A0A077ZCY4_TRITR Loading...

Guanine nucleotide exchange factor DBS

AlphaFold DB , UniProt , Accession A0A077ZCY4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,211 aa.

						>A0A077ZCY4_TRITR|A0A077ZCY4
MVWSSREAIFNSTPTSQRILRADLEESGYQSALTRSQNSQYGTGWLYHDSESIASTSSCDEWDGYMTIDNERIKIREVSDLLVTRYAFISGAKSEQGLPVLTFPDSHVQFSFADYRILVNYLARLQPVEDIFNGFVAIIDRRTDRWSSVKTVLSYLTLFFPGSLRVAYVLKPDGVLQRALEVFVCNNLLELHRYVHPSRLTVDLGGSFCYNHLEWLQHRMEVERLRCSAEGIARTLDEFVQSLKDTELPNDASTTAHILTSQRFDLLKAVRQVDSKPNADQLSPTRLHNVTSVQRTLLQLEDAEKSFDKFWPDHELRLEHCLRLRQFEEDFKKLQANFLNHLDRLRNSNDGRADEQRLYSIEDTDRLIDEYQSYAKKTEEDFEAANALKLRGEQLIETEEKELIGSITPKCQELNRLTAQLDVALRQRAQFLHSARRLQNYISSANQWCATGVDLLTGASMEFESAEQCEAALQRVRTFLKSGDEMCFDLDTSDSLLLLTSYDTKTLLDQVNARLTDVKQLCQNRCFFLKRLLSKTRSSAQSYSPFTESERIGMTLSGTYVPPSKGMQTSSSSPQASDTSEENALPQSIAGGNLWSDMACFDDDGKSRCSSDSLPKRSAFVINELVTTEQSYVDELSSVMDHYVSAIDDPPTGCHLPSAVQAQRDILFGNLAEIHQFHKVHFLPSLLRSSREGGAKEIANAFLEHGDGLRCYVTYCLNKPKSDALLRRHEQECHTFLKTCQQRAGHGLPLGAYLLKPVQRITKYQLLLKVNFNFLHRRCFKKPSFFLQELARSSSLTEGRTDVELALDAILYLLQQANASLNQGYIVGYTVRQKDNNYAQVAYFFFVQGDLSALGPVLMEGSFRVSLSKRNGEKALRMRRGAKLRYRHVFLYSSLLLMCKHRRNSVPNAEERYEVKEELPVRFHNHFAFASQPSAVVQVYSIEQVETVKGKEGRFQVITENRNETLTFSSSPDKVLQFVSKLKQLIERCNSSFGKSMHFHFRKPSELLFLGSSHHHRPISWTSHSSNETGCIRVGERKRHSETDLLSRSVNGVAGGGATSRYPLARSEHNLLRCFESAIHRSRSMDGQNVNKKEVKEVTISCRLHRCHTARICRDFVAKSRDHLSVVSGEAVIILNKRDKTDWTLVKSLRTQREGWVPAGHVQATVVSLDHFLTLLTFHVATMYVSTVAVEDVLVNNGYVASTAAHAIAAG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.3	Very low	30.3	Very low	239 Å²	239	133 Å²	133	100%	1.177	72%	0.717	S	S	*	*				0	55.5	0	-167	-173.3	-72.4	0	0	110.9
2	V	27.1	Very low	30.5	Very low	138 Å²	138	130.2 Å²	130.2	84%	0.836	72%	0.715	S	S	*	*			trans	-145.5	22.6	-170.6	-154.6	0	0	0	0	113.3
3	W	27.6	Very low	31	Very low	159 Å²	159	122.2 Å²	122.2	60%	0.602	67%	0.672	S	S	*	*			trans	-115.2	3.5	-166	-88.4	68	0	0	0	115.8	S5	W3-S5 VanDerWaalsContact C-N 3.34Å; W3-S5 PolarHBondContact O-N 3Å
4	S	30.6	Very low	31.7	Very low	119 Å²	119	119.5 Å²	119.5	83%	0.832	66%	0.663	S	S	*	*	S	Bend	trans	-86.3	23.6	-167.3	-164	0	0	0	0	116
5	S	30.7	Very low	32.1	Very low	119 Å²	119	118.7 Å²	118.7	83%	0.832	66%	0.663	S	S	*	*	S	Bend	trans	-152.7	39.7	-167.2	-49.7	0	0	0	0	115.3	W3	W3-S5 VanDerWaalsContact C-N 3.34Å; W3-S5 PolarHBondContact O-N 3Å
6	R	30.5	Very low	32.4	Very low	98 Å²	98	115.4 Å²	115.4	37%	0.37	65%	0.651	S	S	.	*			trans	-140.2	6.4	-172	-142.2	172.6	165.8	-166.3	-12.6	117.2	F10 K268	R6-F10 HydrophobicContact CG-CE2 4.19Å; R6-K268 PolarHBondContact NH1-O 2.68Å; R6-K268 PolarHBondContact NH2-O 3.41Å
7	E	30.7	Very low	32.8	Very low	179 Å²	179	110.8 Å²	110.8	84%	0.836	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-71.3	-31.5	-176.5	-66.1	174.8	119.3	0	0	113.8	I9	E7-I9 VanDerWaalsContact C-N 3.29Å; E7-I9 PolarHBondContact O-N 2.68Å
8	A	32.3	Very low	33.1	Very low	95 Å²	95	113.4 Å²	113.4	79%	0.785	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-73.4	-6.7	-170.4	0	0	0	0	0	116.4
9	I	33.5	Very low	33.5	Very low	129 Å²	129	112.2 Å²	112.2	66%	0.662	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-110.6	-19.3	-167.5	-61.9	177.1	0	0	0	113.3	E7 N11	E7-I9 VanDerWaalsContact C-N 3.29Å; E7-I9 PolarHBondContact O-N 2.68Å; I9-N11 PolarHBondContact O-N 2.66Å
10	F	33.7	Very low	33.8	Very low	56 Å²	56	108.6 Å²	108.6	25%	0.246	59%	0.593	C	S	.	*	T	Hydrogen-bonded Turn	trans	-91.8	14	-171.8	-81	-76.5	0	0	0	115.6	R6	R6-F10 HydrophobicContact CG-CE2 4.19Å
11	N	31.9	Very low	34.1	Very low	132 Å²	132	108.9 Å²	108.9	71%	0.706	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	0.7	-173.9	-78.9	-21.4	0	0	0	115.3	I9	I9-N11 PolarHBondContact O-N 2.66Å
12	S	33.7	Very low	35	Very low	99 Å²	99	99.3 Å²	99.3	69%	0.692	54%	0.544	S	S	*	.	S	Bend	trans	-116.1	4.7	-167.7	53	0	0	0	0	116.3
13	T	36.2	Very low	35.6	Very low	26 Å²	26	95.4 Å²	95.4	16%	0.16	52%	0.518	C	S	.	.	S	Bend	trans	-116	155.5	-168.2	56.2	0	0	0	0	114.4	Q17 D265	T13-Q17 PolarHBondContact OG1-OE1 3.32Å; T13-D265 WeakPolarHBondContact CG2-OD2 3.47Å
14	P	40.8	Very low	36.4	Very low	85 Å²	85	91.5 Å²	91.5	55%	0.552	51%	0.509	S	S	*	.			trans	-76.4	160.8	-164.3	28.9	-36.3	0	0	0	115.5	S16 Q17	P14-S16 VanDerWaalsContact C-N 3.28Å; P14-S16 PolarHBondContact O-N 2.97Å; P14-Q17 PolarHBondContact O-N 3.29Å
15	T	37.4	Very low	37	Very low	108 Å²	108	90.4 Å²	90.4	66%	0.663	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.4	-38.5	-165.9	-39.3	0	0	0	0	116	Q17 R18 I19	T15-Q17 VanDerWaalsContact C-N 3.25Å; T15-Q17 PolarHBondContact O-N 2.97Å; T15-R18 WeakPolarHBondContact O-CB 3.38Å; T15-R18 PolarHBondContact O-N 3.42Å; T15-I19 PolarHBondContact O-N 3.25Å
16	S	37.3	Very low	37.6	Very low	66 Å²	66	89.2 Å²	89.2	46%	0.462	47%	0.472	S	S	.	.	H	α-helix	trans	-61.1	-28.9	-178.5	-52.9	0	0	0	0	114	P14 R18 I19 L20	P14-S16 VanDerWaalsContact C-N 3.28Å; P14-S16 PolarHBondContact O-N 2.97Å; S16-R18 VanDerWaalsContact C-N 3.34Å; S16-I19 PolarHBondContact O-N 3.32Å; S16-L20 PolarHBondContact O-N 3.23Å
17	Q	40.3	Very low	38.2	Very low	36 Å²	36	85.6 Å²	85.6	17%	0.168	46%	0.461	C	S	.	.	H	α-helix	trans	-72.6	-27.8	174.4	-69.4	-176.8	1.8	0	0	112.3	T13 P14 T15 R21 D265	T13-Q17 PolarHBondContact OG1-OE1 3.32Å; P14-Q17 PolarHBondContact O-N 3.29Å; T15-Q17 VanDerWaalsContact C-N 3.25Å; T15-Q17 PolarHBondContact O-N 2.97Å; Q17-R21 WeakPolarHBondContact O-CB 3.34Å; Q17-R21 PolarHBondContact O-N 2.76Å; Q17-D265 PolarHBondContact NE2-OD2 3.38Å
18	R	37.9	Very low	38.7	Very low	159 Å²	159	78.5 Å²	78.5	60%	0.6	44%	0.436	S	S	*	.	H	α-helix	trans	-71.9	-32.7	174.3	-67.8	-175.1	177.2	174.3	-1	112.1	T15 S16 R21 A22	T15-R18 WeakPolarHBondContact O-CB 3.38Å; T15-R18 PolarHBondContact O-N 3.42Å; S16-R18 VanDerWaalsContact C-N 3.34Å; R18-R21 PolarHBondContact O-N 2.81Å; R18-A22 WeakPolarHBondContact O-CB 3.07Å; R18-A22 PolarHBondContact O-N 3.26Å
19	I	39.8	Very low	38.9	Very low	90 Å²	90	76 Å²	76	46%	0.462	41%	0.406	S	S	.	.	H	α-helix	trans	-64.4	-54.8	175.2	-59.7	172.8	0	0	0	109.9	T15 S16 R21 A22 D23	T15-I19 PolarHBondContact O-N 3.25Å; S16-I19 PolarHBondContact O-N 3.32Å; I19-R21 PolarHBondContact O-N 3.1Å; I19-R21 VanDerWaalsContact O-N 3.11Å; I19-A22 PolarHBondContact O-N 3.36Å; I19-A22 VanDerWaalsContact O-N 3.12Å; I19-D23 WeakPolarHBondContact O-CB 3.38Å; I19-D23 VanDerWaalsContact O-CG 3.31Å; I19-D23 PolarHBondContact O-N 2.83Å
20	L	39.1	Very low	39.2	Very low	40 Å²	40	74.9 Å²	74.9	21%	0.209	40%	0.399	C	S	.	.	H	α-helix	trans	-51.7	-37.7	175.3	-96.2	164.6	0	0	0	113.2	S16 L24 T235 F239	S16-L20 PolarHBondContact O-N 3.23Å; L20-L24 WeakPolarHBondContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CD1 3.43Å; L20-L24 WeakPolarHBondContact O-CG 3.5Å; L20-L24 PolarHBondContact O-N 3.4Å; L20-T235 HydrophobicContact CD2-CG2 3.45Å; L20-T235 VanDerWaalsContact CD2-CG2 3.45Å; L20-T235 HydrophobicContact CG-CG2 3.75Å; L20-F239 HydrophobicContact CD1-CB 4.09Å; L20-F239 HydrophobicContact CD1-CD2 3.81Å; L20-F239 HydrophobicContact CD1-CG 3.83Å
21	R	40.2	Very low	39.6	Very low	115 Å²	115	74.1 Å²	74.1	43%	0.434	40%	0.4	S	S	.	.	H	α-helix	trans	-74.6	-45.1	178.8	-174.2	171	-176.1	152.5	8.4	112.7	Q17 R18 I19 L24 E25	Q17-R21 WeakPolarHBondContact O-CB 3.34Å; Q17-R21 PolarHBondContact O-N 2.76Å; R18-R21 PolarHBondContact O-N 2.81Å; I19-R21 PolarHBondContact O-N 3.1Å; I19-R21 VanDerWaalsContact O-N 3.11Å; R21-L24 PolarHBondContact O-N 2.8Å; R21-E25 HydrophobicContact CG-CG 4.37Å; R21-E25 IonicContact CZ-OE1 2.67Å; R21-E25 IonicContact NE-OE1 3.32Å; R21-E25 PolarHBondContact NE-OE1 3.34Å; R21-E25 IonicContact NE-OE2 2.76Å; R21-E25 PolarHBondContact NE-OE2 2.83Å; R21-E25 IonicContact NH2-OE1 3.63Å; R21-E25 PolarHBondContact NH2-OE1 3.4Å; R21-E25 WeakPolarHBondContact O-CB 3.5Å; R21-E25 WeakPolarHBondContact O-CG 3.29Å; R21-E25 PolarHBondContact O-N 3.41Å
22	A	43.7	Very low	39.8	Very low	37 Å²	37	68.8 Å²	68.8	31%	0.306	38%	0.375	S	S	.	.	H	α-helix	trans	-57.4	-55.9	173.9	0	0	0	0	0	109.7	R18 I19 L24 E25 E26	R18-A22 WeakPolarHBondContact O-CB 3.07Å; R18-A22 PolarHBondContact O-N 3.26Å; I19-A22 PolarHBondContact O-N 3.36Å; I19-A22 VanDerWaalsContact O-N 3.12Å; A22-L24 VanDerWaalsContact C-N 3.25Å; A22-L24 PolarHBondContact O-N 3.39Å; A22-L24 VanDerWaalsContact O-N 3.14Å; A22-E25 PolarHBondContact O-N 2.97Å; A22-E25 VanDerWaalsContact O-N 3.17Å; A22-E26 WeakPolarHBondContact O-CB 3.48Å; A22-E26 VanDerWaalsContact O-CG 3.28Å; A22-E26 WeakPolarHBondContact O-CG 3.36Å; A22-E26 PolarHBondContact O-N 3.26Å
23	D	40.2	Very low	39.8	Very low	57 Å²	57	67.3 Å²	67.3	31%	0.305	36%	0.359	S	S	.	.	H	α-helix	trans	-49	-44.4	176.7	-69.6	3	0	0	0	112.4	I19 S27 T235	I19-D23 WeakPolarHBondContact O-CB 3.38Å; I19-D23 VanDerWaalsContact O-CG 3.31Å; I19-D23 PolarHBondContact O-N 2.83Å; D23-S27 WeakPolarHBondContact O-CB 3.36Å; D23-S27 PolarHBondContact O-N 3.12Å; D23-S27 PolarHBondContact O-OG 3.13Å; D23-T235 WeakPolarHBondContact OD2-CG2 3.33Å; D23-T235 PolarHBondContact OD2-OG1 3.42Å
24	L	44.3	Very low	40	Very low	77 Å²	77	70 Å²	70	40%	0.403	38%	0.375	S	S	.	.	H	α-helix	trans	-70.3	-47.1	-179.5	-90.2	163.6	0	0	0	113.3	L20 R21 A22 S27 I232	L20-L24 WeakPolarHBondContact O-CB 3.27Å; L20-L24 WeakPolarHBondContact O-CD1 3.43Å; L20-L24 WeakPolarHBondContact O-CG 3.5Å; L20-L24 PolarHBondContact O-N 3.4Å; R21-L24 PolarHBondContact O-N 2.8Å; A22-L24 VanDerWaalsContact C-N 3.25Å; A22-L24 PolarHBondContact O-N 3.39Å; A22-L24 VanDerWaalsContact O-N 3.14Å; L24-S27 PolarHBondContact O-OG 3.45Å; L24-I232 HydrophobicContact CD2-CD1 3.7Å; L24-I232 HydrophobicContact CD2-CG1 3.73Å
25	E	43.8	Very low	39.8	Very low	96 Å²	96	72.5 Å²	72.5	45%	0.449	37%	0.373	S	S	.	.	H	α-helix	trans	-69.9	-34.9	179.8	-69.7	174.3	167.9	0	0	111	R21 A22	R21-E25 HydrophobicContact CG-CG 4.37Å; R21-E25 IonicContact CZ-OE1 2.67Å; R21-E25 IonicContact NE-OE1 3.32Å; R21-E25 PolarHBondContact NE-OE1 3.34Å; R21-E25 IonicContact NE-OE2 2.76Å; R21-E25 PolarHBondContact NE-OE2 2.83Å; R21-E25 IonicContact NH2-OE1 3.63Å; R21-E25 PolarHBondContact NH2-OE1 3.4Å; R21-E25 WeakPolarHBondContact O-CB 3.5Å; R21-E25 WeakPolarHBondContact O-CG 3.29Å; R21-E25 PolarHBondContact O-N 3.41Å; A22-E25 PolarHBondContact O-N 2.97Å; A22-E25 VanDerWaalsContact O-N 3.17Å
26	E	41.9	Very low	39.8	Very low	94 Å²	94	71.2 Å²	71.2	44%	0.439	37%	0.368	S	S	.	.	H	α-helix	trans	-71.7	-37.4	174	-76.2	-175.6	178.9	0	0	113.2	A22 G28 W62	A22-E26 WeakPolarHBondContact O-CB 3.48Å; A22-E26 VanDerWaalsContact O-CG 3.28Å; A22-E26 WeakPolarHBondContact O-CG 3.36Å; A22-E26 PolarHBondContact O-N 3.26Å; E26-G28 PolarHBondContact O-N 2.92Å; E26-W62 HydrophobicContact CB-CD2 4.43Å; E26-W62 HydrophobicContact CB-CZ2 3.68Å; E26-W62 HydrophobicContact CG-CZ2 4.36Å; E26-W62 WeakPolarHBondContact OE2-CZ2 3.21Å
27	S	44.5	Very low	39.7	Very low	22 Å²	22	74.4 Å²	74.4	15%	0.154	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-0.4	-173.7	73.3	0	0	0	0	116.3	D23 L24 Y29 S228	D23-S27 WeakPolarHBondContact O-CB 3.36Å; D23-S27 PolarHBondContact O-N 3.12Å; D23-S27 PolarHBondContact O-OG 3.13Å; L24-S27 PolarHBondContact O-OG 3.45Å; S27-Y29 PolarHBondContact O-N 2.84Å; S27-Y29 VanDerWaalsContact O-N 3.1Å; S27-S228 VanDerWaalsContact CB-OG 3.29Å; S27-S228 WeakPolarHBondContact CB-OG 3.42Å; S27-S228 WeakPolarHBondContact O-CB 3.18Å; S27-S228 PolarHBondContact O-OG 3.42Å; S27-S228 PolarHBondContact OG-OG 3.29Å
28	G	39.6	Very low	39.4	Very low	29 Å²	29	78.4 Å²	78.4	30%	0.299	40%	0.399	S	S	.	.	S	Bend	trans	72.4	-0.8	175.6	0	0	0	0	0	115.5	E26 Q30 S31 A32	E26-G28 PolarHBondContact O-N 2.92Å; G28-Q30 VanDerWaalsContact C-N 3.31Å; G28-Q30 PolarHBondContact O-N 2.84Å; G28-S31 WeakPolarHBondContact O-CA 3.29Å; G28-S31 VanDerWaalsContact O-CB 3.32Å; G28-S31 WeakPolarHBondContact O-CB 3.43Å; G28-S31 PolarHBondContact O-N 2.89Å; G28-A32 PolarHBondContact O-N 3.3Å
29	Y	37.7	Very low	39.3	Very low	42 Å²	42	75.3 Å²	75.3	17%	0.165	40%	0.402	C	S	.	.	H	α-helix	trans	-58.2	-40.5	-174.9	-149.7	-106.9	0	0	0	112.5	S27 S31 A32 L33 L225 S228 I232 L300	S27-Y29 PolarHBondContact O-N 2.84Å; S27-Y29 VanDerWaalsContact O-N 3.1Å; Y29-S31 VanDerWaalsContact C-N 3.33Å; Y29-S31 PolarHBondContact O-N 3.24Å; Y29-A32 PolarHBondContact O-N 3.38Å; Y29-L33 HydrophobicContact CD1-CD1 3.66Å; Y29-L33 HydrophobicContact CD1-CG 4.42Å; Y29-L33 HydrophobicContact CE1-CD1 3.87Å; Y29-L33 WeakPolarHBondContact O-CB 3.5Å; Y29-L33 WeakPolarHBondContact O-CG 3.35Å; Y29-L33 PolarHBondContact O-N 3.42Å; Y29-L225 HydrophobicContact CD2-CD1 3.93Å; Y29-L225 HydrophobicContact CE2-CD1 3.35Å; Y29-L225 HydrophobicContact CE2-CG 4.08Å; Y29-S228 WeakPolarHBondContact CD2-OG 3.48Å; Y29-I232 HydrophobicContact CD2-CD1 4.35Å; Y29-I232 HydrophobicContact CG-CD1 4.38Å; Y29-L300 WeakPolarHBondContact OH-CD1 3.45Å
30	Q	38.4	Very low	38.9	Very low	107 Å²	107	79.7 Å²	79.7	50%	0.5	42%	0.42	S	S	.	.	H	α-helix	trans	-63	-36.6	173.4	-73.5	-174	-19.5	0	0	112.7	G28 T34	G28-Q30 VanDerWaalsContact C-N 3.31Å; G28-Q30 PolarHBondContact O-N 2.84Å; Q30-T34 VanDerWaalsContact O-CB 3.27Å; Q30-T34 WeakPolarHBondContact O-CB 3.38Å; Q30-T34 PolarHBondContact O-N 2.95Å; Q30-T34 PolarHBondContact O-OG1 3.38Å
31	S	42.3	Very low	38.5	Very low	40 Å²	40	88 Å²	88	28%	0.28	45%	0.45	S	S	.	.	H	α-helix	trans	-68.9	-45.3	178.6	-166.2	0	0	0	0	111.1	G28 Y29 T34 R35	G28-S31 WeakPolarHBondContact O-CA 3.29Å; G28-S31 VanDerWaalsContact O-CB 3.32Å; G28-S31 WeakPolarHBondContact O-CB 3.43Å; G28-S31 PolarHBondContact O-N 2.89Å; Y29-S31 VanDerWaalsContact C-N 3.33Å; Y29-S31 PolarHBondContact O-N 3.24Å; S31-T34 PolarHBondContact O-N 2.94Å; S31-R35 WeakPolarHBondContact O-CB 3.49Å; S31-R35 VanDerWaalsContact O-CG 3.23Å; S31-R35 WeakPolarHBondContact O-CG 3.47Å; S31-R35 PolarHBondContact O-N 2.98Å
32	A	36	Very low	38	Very low	20 Å²	20	85.6 Å²	85.6	17%	0.165	46%	0.461	C	S	.	.	H	α-helix	trans	-61.6	-46.6	175.9	0	0	0	0	0	112	G28 Y29 R35 S36	G28-A32 PolarHBondContact O-N 3.3Å; Y29-A32 PolarHBondContact O-N 3.38Å; A32-R35 PolarHBondContact O-N 3.45Å; A32-S36 PolarHBondContact O-N 3.21Å
33	L	35.2	Very low	37.1	Very low	68 Å²	68	91.4 Å²	91.4	36%	0.356	49%	0.493	S	S	.	.	H	α-helix	trans	-61.6	-49.4	176.6	-76	168.8	0	0	0	111.7	Y29 R35 S36 Q37	Y29-L33 HydrophobicContact CD1-CD1 3.66Å; Y29-L33 HydrophobicContact CD1-CG 4.42Å; Y29-L33 HydrophobicContact CE1-CD1 3.87Å; Y29-L33 WeakPolarHBondContact O-CB 3.5Å; Y29-L33 WeakPolarHBondContact O-CG 3.35Å; Y29-L33 PolarHBondContact O-N 3.42Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.43Å; L33-S36 PolarHBondContact O-N 2.88Å; L33-S36 VanDerWaalsContact O-N 3.12Å; L33-S36 PolarHBondContact O-OG 3.37Å; L33-Q37 PolarHBondContact O-N 2.98Å; L33-Q37 VanDerWaalsContact O-N 3.09Å
34	T	39.8	Very low	36.4	Very low	81 Å²	81	91.5 Å²	91.5	50%	0.497	51%	0.507	S	S	.	.	H	α-helix	trans	-62.8	-37	-179.4	-53.6	0	0	0	0	112	Q30 S31 N38	Q30-T34 VanDerWaalsContact O-CB 3.27Å; Q30-T34 WeakPolarHBondContact O-CB 3.38Å; Q30-T34 PolarHBondContact O-N 2.95Å; Q30-T34 PolarHBondContact O-OG1 3.38Å; S31-T34 PolarHBondContact O-N 2.94Å; T34-N38 PolarHBondContact O-N 2.92Å
35	R	37.4	Very low	35.7	Very low	139 Å²	139	99.3 Å²	99.3	53%	0.525	53%	0.532	S	S	.	.	H	α-helix	trans	-68	-37.8	174.2	-73.3	172.5	178.2	-159.2	-3.6	112.4	S31 A32 L33	S31-R35 WeakPolarHBondContact O-CB 3.49Å; S31-R35 VanDerWaalsContact O-CG 3.23Å; S31-R35 WeakPolarHBondContact O-CG 3.47Å; S31-R35 PolarHBondContact O-N 2.98Å; A32-R35 PolarHBondContact O-N 3.45Å; L33-R35 VanDerWaalsContact C-N 3.31Å; L33-R35 PolarHBondContact O-N 3.43Å
36	S	35.9	Very low	34.9	Very low	80 Å²	80	101.5 Å²	101.5	56%	0.559	55%	0.546	S	S	*	.	H	α-helix	trans	-67.9	-35.3	177.7	71.8	0	0	0	0	113.7	A32 L33	A32-S36 PolarHBondContact O-N 3.21Å; L33-S36 PolarHBondContact O-N 2.88Å; L33-S36 VanDerWaalsContact O-N 3.12Å; L33-S36 PolarHBondContact O-OG 3.37Å
37	Q	36.2	Very low	34.3	Very low	134 Å²	134	107.1 Å²	107.1	63%	0.626	57%	0.565	S	S	*	*	H	α-helix	trans	-76.6	-25.5	-179.8	-68.5	-175.5	3.1	0	0	113.8	L33	L33-Q37 PolarHBondContact O-N 2.98Å; L33-Q37 VanDerWaalsContact O-N 3.09Å
38	N	34.6	Very low	33.6	Very low	119 Å²	119	114.5 Å²	114.5	64%	0.636	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	5.5	-176.6	-78.3	-13.6	0	0	0	115	T34 Q40	T34-N38 PolarHBondContact O-N 2.92Å; N38-Q40 PolarHBondContact O-N 3.39Å
39	S	33.8	Very low	33.1	Very low	95 Å²	95	119.4 Å²	119.4	66%	0.664	62%	0.616	S	S	*	*			trans	-79.9	63	177.6	-161.1	0	0	0	0	112.3
40	Q	31.5	Very low	32.6	Very low	181 Å²	181	122.6 Å²	122.6	85%	0.846	64%	0.644	S	S	*	*			trans	-93.4	1.8	173	-80.2	-167.2	-14.2	0	0	114.2	N38	N38-Q40 PolarHBondContact O-N 3.39Å
41	Y	32.1	Very low	32.1	Very low	215 Å²	215	126.8 Å²	126.8	84%	0.843	66%	0.664	S	S	*	*			trans	-98.9	126.5	168.2	-55.6	-83.8	0	0	0	108.4
42	G	28.7	Very low	31.4	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	68%	0.681	S	S	*	*			cis	126.9	125.7	11.7	0	0	0	0	0	108.3	G44	G42-G44 PolarHBondContact O-N 3.48Å
43	T	26	Very low	31.2	Very low	158 Å²	158	135.5 Å²	135.5	97%	0.969	71%	0.71	S	S	*	*	S	Bend	trans	-71.8	125.1	-169.2	48.5	0	0	0	0	113.2
44	G	25.1	Very low	30.9	Very low	59 Å²	59	137.4 Å²	137.4	61%	0.608	74%	0.735	S	S	*	*			trans	128.2	138.8	-173.1	0	0	0	0	0	108.6	G42	G42-G44 PolarHBondContact O-N 3.48Å
45	W	29.4	Very low	30.3	Very low	241 Å²	241	138.3 Å²	138.3	91%	0.913	75%	0.745	S	S	*	*			cis	-129.7	138.8	19	-58.4	68.6	0	0	0	108.2
46	L	27.5	Very low	30	Very low	143 Å²	143	137.8 Å²	137.8	75%	0.749	76%	0.757	S	S	*	*				47.3	115.9	75.4	-82.2	173.1	0	0	0	114.6
47	Y	27.9	Very low	29.9	Very low	212 Å²	212	138.4 Å²	138.4	83%	0.831	76%	0.762	S	S	*	*			trans	3.6	112	167.7	-66.1	-96.3	0	0	0	117.9
48	H	30.5	Very low	29.6	Very low	177 Å²	177	137.2 Å²	137.2	82%	0.819	77%	0.768	S	S	*	*				-155.8	168.1	125.9	-107.1	-69	0	0	0	110.9
49	D	29.4	Very low	29.5	Very low	132 Å²	132	135.3 Å²	135.3	71%	0.706	76%	0.763	S	S	*	*			trans	-59.2	164.8	-154.2	-55	-80.9	0	0	0	119
50	S	27.7	Very low	29.7	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	77%	0.766	S	S	*	*	S	Bend	trans	-55.8	169.3	165.5	-56.8	0	0	0	0	113.1
51	E	27.6	Very low	30.5	Very low	196 Å²	196	137.4 Å²	137.4	92%	0.916	77%	0.767	S	S	*	*	S	Bend	trans	74.4	64.2	168.4	-51.2	-176	178.6	0	0	117
52	S	28.2	Very low	31.5	Very low	92 Å²	92	133.3 Å²	133.3	64%	0.643	75%	0.75	S	S	*	*			trans	-153.6	-17.1	166.9	58.6	0	0	0	0	119.1	A54	S52-A54 PolarHBondContact O-N 3.05Å
53	I	30.6	Very low	33.1	Very low	151 Å²	151	132 Å²	132	77%	0.774	73%	0.727	S	S	*	*			trans	-64.6	-6.5	-168.7	-72.1	175.9	0	0	0	115.2	S55	I53-S55 PolarHBondContact O-N 2.91Å
54	A	28.3	Very low	35.1	Very low	107 Å²	107	124.7 Å²	124.7	88%	0.884	68%	0.684	S	S	*	*	S	Bend	trans	-77.2	38.7	178.3	0	0	0	0	0	115.2	S52	S52-A54 PolarHBondContact O-N 3.05Å
55	S	27.7	Very low	37.7	Very low	101 Å²	101	126.3 Å²	126.3	71%	0.706	67%	0.673	S	S	*	*			trans	-165.8	58.9	176.8	51.9	0	0	0	0	117.5	I53	I53-S55 PolarHBondContact O-N 2.91Å
56	T	31.7	Very low	40.2	Very low	128 Å²	128	115.6 Å²	115.6	79%	0.785	63%	0.633	S	S	*	*			trans	-133.2	86.4	164.9	50.9	0	0	0	0	115.3
57	S	32.9	Very low	42.8	Very low	93 Å²	93	112.8 Å²	112.8	65%	0.65	62%	0.622	S	S	*	*			trans	55.9	102.6	141.5	62.9	0	0	0	0	121.1
58	S	30.4	Very low	45.4	Very low	108 Å²	108	102.8 Å²	102.8	76%	0.755	58%	0.583	S	S	*	*	S	Bend		62.9	50.8	126.5	72	0	0	0	0	118.6
59	C	32.3	Very low	47.5	Very low	79 Å²	79	96.6 Å²	96.6	53%	0.534	56%	0.556	S	S	.	*			trans	-154.6	37.6	165.3	-147.9	0	0	0	0	112.4	E61	C59-E61 VanDerWaalsContact C-N 3.33Å; C59-E61 PolarHBondContact O-N 3.25Å
60	D	38.8	Very low	49.6	Very low	137 Å²	137	97.7 Å²	97.7	73%	0.733	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-0.7	-170.1	-70.2	-73.3	0	0	0	115.3
61	E	48.9	Very low	52.2	Low	184 Å²	184	96.7 Å²	96.7	86%	0.86	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-23.5	-167.7	-157.5	154.7	-137.9	0	0	113.9	C59	C59-E61 VanDerWaalsContact C-N 3.33Å; C59-E61 PolarHBondContact O-N 3.25Å
62	W	51.4	Low	54.9	Low	128 Å²	128	95.7 Å²	95.7	49%	0.485	53%	0.533	S	S	.	.			trans	-110.3	86.8	-179.9	-91.9	81.2	0	0	0	113.9	E26	E26-W62 HydrophobicContact CB-CD2 4.43Å; E26-W62 HydrophobicContact CB-CZ2 3.68Å; E26-W62 HydrophobicContact CG-CZ2 4.36Å; E26-W62 WeakPolarHBondContact OE2-CZ2 3.21Å
63	D	63.1	Low	57.6	Low	37 Å²	37	91.8 Å²	91.8	20%	0.198	50%	0.504	C	S	.	.			trans	-97.4	99.5	166.6	-171	18.4	0	0	0	109.4	K74 I75 R76	D63-K74 WeakPolarHBondContact OD2-CB 3.47Å; D63-K74 VanDerWaalsContact OD2-CD 3.32Å; D63-K74 WeakPolarHBondContact OD2-CD 3.36Å; D63-I75 PolarHBondContact OD1-N 2.87Å; D63-R76 VanDerWaalsContact CG-CB 3.5Å; D63-R76 WeakPolarHBondContact OD1-CB 3.32Å; D63-R76 PolarHBondContact OD1-N 3.44Å; D63-R76 WeakPolarHBondContact OD2-CB 3.39Å
64	G	67.4	Low	60.3	Low	6 Å²	6	88.1 Å²	88.1	6%	0.062	48%	0.483	C	S	.	.			trans	-64.5	167.6	-177.6	0	0	0	0	0	113.1	I75	G64-I75 WeakPolarHBondContact O-CG1 3.42Å; G64-I75 PolarHBondContact O-N 3.16Å
65	Y	79.9	Confident	63	Low	93 Å²	93	83.2 Å²	83.2	37%	0.365	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.5	-178.4	-64.9	-94.2	0	0	0	111.3	R72 I73 K74 C227	Y65-R72 HydrophobicContact CD1-CG 3.65Å; Y65-R72 HydrophobicContact CG-CG 3.94Å; Y65-R72 VanDerWaalsContact CG-NE 3.27Å; Y65-I73 CarbonylContact C-O 3.59Å; Y65-I73 WeakPolarHBondContact CA-O 3.46Å; Y65-K74 HydrophobicContact CD1-CG 3.95Å; Y65-K74 HydrophobicContact CE1-CD 4.44Å; Y65-K74 HydrophobicContact CE1-CG 3.59Å; Y65-C227 PolarHBondContact N-SG 3.39Å; Y65-C227 VanDerWaalsContact N-SG 3.42Å; Y65-C227 PolarHBondContact O-SG 3.44Å; Y65-C227 VanDerWaalsContact O-SG 3.37Å
66	M	82.5	Confident	65.7	Low	15 Å²	15	85.1 Å²	85.1	7%	0.074	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	156.9	169.7	67.7	172.4	79.6	0	0	110.9	I68 I73 I75 V78 Y121 E223	M66-I68 HydrophobicContact CG-CD1 4.21Å; M66-I68 HydrophobicContact CG-CG1 4.27Å; M66-I68 HydrophobicContact SD-CD1 3.73Å; M66-I68 HydrophobicContact SD-CG1 4.11Å; M66-I73 PolarHBondContact N-O 3.33Å; M66-I73 PolarHBondContact O-N 3.25Å; M66-I75 HydrophobicContact CE-CB 4.43Å; M66-I75 HydrophobicContact CE-CG1 3.87Å; M66-V78 HydrophobicContact CE-CB 3.98Å; M66-V78 HydrophobicContact CE-CG1 4.13Å; M66-V78 HydrophobicContact CE-CG2 4.03Å; M66-V78 HydrophobicContact SD-CB 4.33Å; M66-V78 HydrophobicContact SD-CG1 4.33Å; M66-V78 HydrophobicContact SD-CG2 3.81Å; M66-Y121 HydrophobicContact CE-CD2 4.26Å; M66-Y121 HydrophobicContact CE-CE2 3.66Å; M66-Y121 HydrophobicContact SD-CD2 3.48Å; M66-Y121 WeakPolarHBondContact SD-CD2 3.43Å; M66-Y121 HydrophobicContact SD-CE2 3.41Å; M66-Y121 WeakPolarHBondContact SD-CE2 3.25Å; M66-E223 HydrophobicContact CE-CB 4.18Å; M66-E223 HydrophobicContact CE-CG 3.78Å
67	T	81.2	Confident	68.4	Low	85 Å²	85	83 Å²	83	52%	0.521	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	110.6	179.2	-52.4	0	0	0	0	111.3	E71 R124	T67-E71 VanDerWaalsContact CA-O 3.32Å; T67-E71 WeakPolarHBondContact CA-O 3.42Å; T67-R124 PolarHBondContact O-NH1 3.47Å
68	I	81.9	Confident	71.1	Confident	2 Å²	2	78.6 Å²	78.6	1%	0.01	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.5	173	-59.8	168.6	0	0	0	107	M66 N70 E71 I73 V78 I117 N120 Y121	M66-I68 HydrophobicContact CG-CD1 4.21Å; M66-I68 HydrophobicContact CG-CG1 4.27Å; M66-I68 HydrophobicContact SD-CD1 3.73Å; M66-I68 HydrophobicContact SD-CG1 4.11Å; I68-N70 PolarHBondContact O-N 2.92Å; I68-E71 PolarHBondContact N-O 2.98Å; I68-E71 WeakPolarHBondContact O-CA 3.24Å; I68-E71 WeakPolarHBondContact O-CB 3.44Å; I68-E71 PolarHBondContact O-N 3.08Å; I68-E71 VanDerWaalsContact O-O 3.09Å; I68-I73 HydrophobicContact CB-CD1 3.97Å; I68-I73 HydrophobicContact CD1-CD1 4.18Å; I68-V78 HydrophobicContact CD1-CG2 3.79Å; I68-I117 HydrophobicContact CD1-CG2 4.04Å; I68-N120 HydrophobicContact CG2-CB 3.72Å; I68-Y121 HydrophobicContact CD1-CD2 4.08Å; I68-Y121 HydrophobicContact CD1-CG 4.47Å
69	D	75.6	Confident	73.9	Confident	47 Å²	47	74.7 Å²	74.7	25%	0.251	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	28.8	-179.4	-58.8	-7.1	0	0	0	116.2	E71 R116 N120 R124	D69-E71 PolarHBondContact O-N 3.46Å; D69-R116 IonicContact OD2-NH1 3.63Å; D69-N120 VanDerWaalsContact OD2-CG 3.28Å; D69-N120 PolarHBondContact OD2-ND2 3.07Å; D69-R124 VanDerWaalsContact N-CZ 3.34Å; D69-R124 IonicContact OD1-CZ 2.93Å; D69-R124 IonicContact OD1-NE 2.7Å; D69-R124 IonicContact OD1-NH2 3.91Å; D69-R124 PolarHBondContact OD1-NH2 3.48Å
70	N	74.5	Confident	76.6	Confident	155 Å²	155	75.2 Å²	75.2	83%	0.829	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	-2.8	-173.1	-42.4	-58.3	0	0	0	114.8	I68	I68-N70 PolarHBondContact O-N 2.92Å
71	E	81	Confident	79.2	Confident	86 Å²	86	69.6 Å²	69.6	40%	0.402	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	150.3	164.2	-68.3	159.4	-127.3	0	0	110.4	T67 I68 D69 I73 R116	T67-E71 VanDerWaalsContact CA-O 3.32Å; T67-E71 WeakPolarHBondContact CA-O 3.42Å; I68-E71 PolarHBondContact N-O 2.98Å; I68-E71 WeakPolarHBondContact O-CA 3.24Å; I68-E71 WeakPolarHBondContact O-CB 3.44Å; I68-E71 PolarHBondContact O-N 3.08Å; I68-E71 VanDerWaalsContact O-O 3.09Å; D69-E71 PolarHBondContact O-N 3.46Å; E71-I73 HydrophobicContact CB-CD1 4.48Å; E71-I73 HydrophobicContact CB-CG1 4.23Å; E71-R116 VanDerWaalsContact CD-NH2 3.27Å; E71-R116 IonicContact OE1-CZ 2.71Å; E71-R116 VanDerWaalsContact OE1-CZ 3.27Å; E71-R116 IonicContact OE1-NH1 3.66Å; E71-R116 PolarHBondContact OE1-NH1 3.07Å; E71-R116 IonicContact OE1-NH2 3.44Å; E71-R116 PolarHBondContact OE1-NH2 2.99Å; E71-R116 IonicContact OE2-CZ 2.78Å; E71-R116 IonicContact OE2-NH1 3.74Å; E71-R116 IonicContact OE2-NH2 3.42Å; E71-R116 PolarHBondContact OE2-NH2 3.37Å
72	R	84.6	Confident	81.2	Confident	176 Å²	176	60.9 Å²	60.9	66%	0.664	28%	0.283	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.5	97.5	-177	178.6	-174.9	159.2	-174.8	-4.1	108.7	Y65	Y65-R72 HydrophobicContact CD1-CG 3.65Å; Y65-R72 HydrophobicContact CG-CG 3.94Å; Y65-R72 VanDerWaalsContact CG-NE 3.27Å
73	I	85.4	Confident	83.1	Confident	10 Å²	10	58.9 Å²	58.9	5%	0.051	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	145.4	-170.4	-52.1	-167.6	0	0	0	109.2	Y65 M66 I68 E71 E77 V78 I117	Y65-I73 CarbonylContact C-O 3.59Å; Y65-I73 WeakPolarHBondContact CA-O 3.46Å; M66-I73 PolarHBondContact N-O 3.33Å; M66-I73 PolarHBondContact O-N 3.25Å; I68-I73 HydrophobicContact CB-CD1 3.97Å; I68-I73 HydrophobicContact CD1-CD1 4.18Å; E71-I73 HydrophobicContact CB-CD1 4.48Å; E71-I73 HydrophobicContact CB-CG1 4.23Å; I73-E77 HydrophobicContact CG2-CB 4.02Å; I73-E77 WeakPolarHBondContact CG2-OE2 3.44Å; I73-V78 HydrophobicContact CG2-CG2 3.87Å; I73-I117 HydrophobicContact CD1-CB 4.41Å; I73-I117 HydrophobicContact CD1-CD1 3.92Å; I73-I117 HydrophobicContact CD1-CG1 3.69Å; I73-I117 HydrophobicContact CD1-CG2 3.93Å; I73-I117 HydrophobicContact CG2-CG2 4.34Å
74	K	86.1	Confident	84.4	Confident	73 Å²	73	59.3 Å²	59.3	32%	0.317	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	152.3	178.9	-60.1	-177.5	-164.5	160.8	0	112.2	D63 Y65 R76 E77 V78	D63-K74 WeakPolarHBondContact OD2-CB 3.47Å; D63-K74 VanDerWaalsContact OD2-CD 3.32Å; D63-K74 WeakPolarHBondContact OD2-CD 3.36Å; Y65-K74 HydrophobicContact CD1-CG 3.95Å; Y65-K74 HydrophobicContact CE1-CD 4.44Å; Y65-K74 HydrophobicContact CE1-CG 3.59Å; K74-R76 VanDerWaalsContact C-N 3.32Å; K74-R76 PolarHBondContact O-N 3.26Å; K74-E77 HydrophobicContact CB-CB 4.29Å; K74-E77 HydrophobicContact CB-CG 3.98Å; K74-E77 VanDerWaalsContact CD-OE1 3.25Å; K74-E77 WeakPolarHBondContact CD-OE1 3.47Å; K74-E77 WeakPolarHBondContact CE-OE1 3.31Å; K74-E77 WeakPolarHBondContact CG-OE1 3.5Å; K74-E77 PolarHBondContact N-OE2 2.74Å; K74-E77 IonicContact NZ-OE1 2.68Å; K74-E77 PolarHBondContact O-N 3.03Å; K74-V78 PolarHBondContact O-N 2.91Å
75	I	84.8	Confident	85.5	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	30%	0.303	C	S	.	.	H	α-helix	trans	-63.6	-39.7	176.4	-69	169.1	0	0	0	110.5	D63 G64 M66 V78 S79 M220 E223 R224 C227	D63-I75 PolarHBondContact OD1-N 2.87Å; G64-I75 WeakPolarHBondContact O-CG1 3.42Å; G64-I75 PolarHBondContact O-N 3.16Å; M66-I75 HydrophobicContact CE-CB 4.43Å; M66-I75 HydrophobicContact CE-CG1 3.87Å; I75-V78 PolarHBondContact O-N 3.27Å; I75-S79 WeakPolarHBondContact O-CB 3.43Å; I75-S79 PolarHBondContact O-N 3.05Å; I75-M220 HydrophobicContact CG2-CB 4.44Å; I75-M220 HydrophobicContact CG2-SD 3.66Å; I75-E223 HydrophobicContact CD1-CB 3.92Å; I75-E223 HydrophobicContact CG1-CB 4.13Å; I75-E223 HydrophobicContact CG2-CB 4.48Å; I75-R224 HydrophobicContact CD1-CG 4.06Å; I75-C227 HydrophobicContact CD1-CB 4.24Å
76	R	85.5	Confident	86	Confident	141 Å²	141	59.6 Å²	59.6	53%	0.532	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-43.3	173.7	-172.2	178.9	-177.4	146.8	3.7	113.6	D63 K74 V78 S79 D80	D63-R76 VanDerWaalsContact CG-CB 3.5Å; D63-R76 WeakPolarHBondContact OD1-CB 3.32Å; D63-R76 PolarHBondContact OD1-N 3.44Å; D63-R76 WeakPolarHBondContact OD2-CB 3.39Å; K74-R76 VanDerWaalsContact C-N 3.32Å; K74-R76 PolarHBondContact O-N 3.26Å; R76-V78 VanDerWaalsContact C-N 3.26Å; R76-V78 PolarHBondContact O-N 3.3Å; R76-S79 CarbonylContact O-C 3.55Å; R76-S79 WeakPolarHBondContact O-CA 3.48Å; R76-S79 WeakPolarHBondContact O-CB 3.36Å; R76-S79 PolarHBondContact O-N 3.33Å; R76-D80 IonicContact NE-OD2 3.62Å; R76-D80 WeakPolarHBondContact O-CB 3.44Å; R76-D80 VanDerWaalsContact O-CG 3.27Å; R76-D80 PolarHBondContact O-N 3.13Å
77	E	87.3	Confident	86.5	Confident	83 Å²	83	58.9 Å²	58.9	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-58.2	-41.7	178.6	-71.3	157.1	-169.8	0	0	110.7	I73 K74 L81	I73-E77 HydrophobicContact CG2-CB 4.02Å; I73-E77 WeakPolarHBondContact CG2-OE2 3.44Å; K74-E77 HydrophobicContact CB-CB 4.29Å; K74-E77 HydrophobicContact CB-CG 3.98Å; K74-E77 VanDerWaalsContact CD-OE1 3.25Å; K74-E77 WeakPolarHBondContact CD-OE1 3.47Å; K74-E77 WeakPolarHBondContact CE-OE1 3.31Å; K74-E77 WeakPolarHBondContact CG-OE1 3.5Å; K74-E77 PolarHBondContact N-OE2 2.74Å; K74-E77 IonicContact NZ-OE1 2.68Å; K74-E77 PolarHBondContact O-N 3.03Å; E77-L81 VanDerWaalsContact O-CG 3.32Å; E77-L81 WeakPolarHBondContact O-CG 3.33Å; E77-L81 PolarHBondContact O-N 3.42Å
78	V	90.1	Very high	87	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-72.1	-36.4	174.1	179.2	0	0	0	0	112.2	M66 I68 I73 K74 I75 R76 L82 I117 Y121	M66-V78 HydrophobicContact CE-CB 3.98Å; M66-V78 HydrophobicContact CE-CG1 4.13Å; M66-V78 HydrophobicContact CE-CG2 4.03Å; M66-V78 HydrophobicContact SD-CB 4.33Å; M66-V78 HydrophobicContact SD-CG1 4.33Å; M66-V78 HydrophobicContact SD-CG2 3.81Å; I68-V78 HydrophobicContact CD1-CG2 3.79Å; I73-V78 HydrophobicContact CG2-CG2 3.87Å; K74-V78 PolarHBondContact O-N 2.91Å; I75-V78 PolarHBondContact O-N 3.27Å; R76-V78 VanDerWaalsContact C-N 3.26Å; R76-V78 PolarHBondContact O-N 3.3Å; V78-L82 HydrophobicContact CG1-CD1 3.88Å; V78-L82 HydrophobicContact CG1-CG 4.43Å; V78-L82 WeakPolarHBondContact O-CD1 3.45Å; V78-L82 VanDerWaalsContact O-CG 3.23Å; V78-L82 WeakPolarHBondContact O-CG 3.03Å; V78-L82 PolarHBondContact O-N 3.37Å; V78-I117 HydrophobicContact CG2-CG2 4Å; V78-Y121 HydrophobicContact CG1-CD1 3.74Å; V78-Y121 HydrophobicContact CG1-CD2 3.75Å; V78-Y121 HydrophobicContact CG1-CE1 3.92Å; V78-Y121 HydrophobicContact CG1-CE2 3.92Å; V78-Y121 HydrophobicContact CG1-CG 3.62Å
79	S	89.5	Confident	87.2	Confident	27 Å²	27	54.9 Å²	54.9	19%	0.189	26%	0.26	C	S	.	.	H	α-helix	trans	-59.8	-49.1	174.1	-173.3	0	0	0	0	111.7	I75 R76 L81 L82 V83	I75-S79 WeakPolarHBondContact O-CB 3.43Å; I75-S79 PolarHBondContact O-N 3.05Å; R76-S79 CarbonylContact O-C 3.55Å; R76-S79 WeakPolarHBondContact O-CA 3.48Å; R76-S79 WeakPolarHBondContact O-CB 3.36Å; R76-S79 PolarHBondContact O-N 3.33Å; S79-L81 VanDerWaalsContact C-N 3.31Å; S79-L81 PolarHBondContact O-N 3.35Å; S79-L82 PolarHBondContact O-N 3.38Å; S79-V83 WeakPolarHBondContact O-CG2 3.46Å; S79-V83 PolarHBondContact O-N 3.1Å
80	D	90.2	Very high	87.7	Confident	89 Å²	89	52.8 Å²	52.8	48%	0.476	25%	0.249	S	C	.	.	H	α-helix	trans	-63.1	-38.2	-177	-67.9	-16.4	0	0	0	110.9	R76	R76-D80 IonicContact NE-OD2 3.62Å; R76-D80 WeakPolarHBondContact O-CB 3.44Å; R76-D80 VanDerWaalsContact O-CG 3.27Å; R76-D80 PolarHBondContact O-N 3.13Å
81	L	91.9	Very high	87.9	Confident	20 Å²	20	47.6 Å²	47.6	11%	0.105	23%	0.232	C	C	.	.	H	α-helix	trans	-63.2	-43.9	170.2	-67.3	175.8	0	0	0	112.4	E77 S79 T84 F110 D114 I117	E77-L81 VanDerWaalsContact O-CG 3.32Å; E77-L81 WeakPolarHBondContact O-CG 3.33Å; E77-L81 PolarHBondContact O-N 3.42Å; S79-L81 VanDerWaalsContact C-N 3.31Å; S79-L81 PolarHBondContact O-N 3.35Å; L81-T84 PolarHBondContact O-OG1 3.36Å; L81-F110 HydrophobicContact CB-CE2 4.42Å; L81-F110 HydrophobicContact CB-CZ 4.38Å; L81-F110 HydrophobicContact CD2-CD2 4.4Å; L81-F110 HydrophobicContact CD2-CE2 3.75Å; L81-F110 HydrophobicContact CD2-CZ 3.82Å; L81-D114 HydrophobicContact CD2-CB 3.57Å; L81-I117 HydrophobicContact CD1-CB 3.83Å; L81-I117 HydrophobicContact CD1-CG2 3.62Å
82	L	91.8	Very high	88.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-41.7	-179.8	-71.1	164	0	0	0	112.3	V78 S79 T84 R85 L118 Y121 L122 H212 W215 L216 M220	V78-L82 HydrophobicContact CG1-CD1 3.88Å; V78-L82 HydrophobicContact CG1-CG 4.43Å; V78-L82 WeakPolarHBondContact O-CD1 3.45Å; V78-L82 VanDerWaalsContact O-CG 3.23Å; V78-L82 WeakPolarHBondContact O-CG 3.03Å; V78-L82 PolarHBondContact O-N 3.37Å; S79-L82 PolarHBondContact O-N 3.38Å; L82-T84 PolarHBondContact O-N 3.16Å; L82-R85 PolarHBondContact O-N 3.03Å; L82-L118 HydrophobicContact CD2-CD1 3.52Å; L82-L118 HydrophobicContact CG-CD1 4.16Å; L82-Y121 HydrophobicContact CD1-CD1 4.1Å; L82-Y121 HydrophobicContact CD1-CE1 3.62Å; L82-Y121 HydrophobicContact CD2-CD1 4.35Å; L82-Y121 HydrophobicContact CD2-CE1 4.44Å; L82-L122 HydrophobicContact CD2-CD2 4.01Å; L82-H212 PolarHBondContact O-CE1 3.42Å; L82-H212 PolarHBondContact O-NE2 3.15Å; L82-W215 HydrophobicContact CD1-CZ3 4.34Å; L82-W215 HydrophobicContact CD2-CH2 4.13Å; L82-W215 HydrophobicContact CD2-CZ3 4.05Å; L82-L216 HydrophobicContact CB-CD1 3.61Å; L82-L216 HydrophobicContact CB-CD2 4.25Å; L82-L216 HydrophobicContact CD1-CD1 3.6Å; L82-L216 HydrophobicContact CG-CD1 4.24Å; L82-M220 HydrophobicContact CD1-CE 3.69Å
83	V	91	Very high	88	Confident	86 Å²	86	38.2 Å²	38.2	52%	0.521	20%	0.195	S	C	.	.	H	α-helix	trans	-48.9	-34.9	179.4	166.2	0	0	0	0	112.4	S79 R85 L216	S79-V83 WeakPolarHBondContact O-CG2 3.46Å; S79-V83 PolarHBondContact O-N 3.1Å; V83-R85 PolarHBondContact O-N 2.93Å; V83-R85 VanDerWaalsContact O-N 3.1Å; V83-L216 HydrophobicContact CB-CD2 4.36Å; V83-L216 HydrophobicContact CG2-CD2 3.51Å
84	T	90.1	Very high	87.8	Confident	47 Å²	47	38.6 Å²	38.6	29%	0.288	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-14.3	179.4	72.8	0	0	0	0	114.5	L81 L82 Y86 F110	L81-T84 PolarHBondContact O-OG1 3.36Å; L82-T84 PolarHBondContact O-N 3.16Å; T84-Y86 PolarHBondContact O-N 3.47Å; T84-Y86 WeakPolarHBondContact OG1-CB 3.36Å; T84-Y86 PolarHBondContact OG1-N 2.88Å; T84-F110 HydrophobicContact CG2-CE1 3.92Å; T84-F110 HydrophobicContact CG2-CZ 4.12Å; T84-F110 VanDerWaalsContact OG1-CZ 3.31Å; T84-F110 WeakPolarHBondContact OG1-CZ 3.27Å
85	R	90.8	Very high	87.5	Confident	94 Å²	94	42.8 Å²	42.8	36%	0.355	22%	0.219	S	C	.	.			trans	55.3	17.2	-173.7	-159.4	-177.3	159.8	174.6	-6.9	113.8	L82 V83 A87 F88 P104 D203	L82-R85 PolarHBondContact O-N 3.03Å; V83-R85 PolarHBondContact O-N 2.93Å; V83-R85 VanDerWaalsContact O-N 3.1Å; R85-A87 PolarHBondContact O-N 3.38Å; R85-A87 VanDerWaalsContact O-N 3.16Å; R85-F88 HydrophobicContact CG-CD1 3.85Å; R85-F88 HydrophobicContact CG-CE1 4.19Å; R85-P104 HydrophobicContact CG-CG 4.2Å; R85-P104 WeakPolarHBondContact O-CD 3.42Å; R85-P104 WeakPolarHBondContact O-CG 3.22Å; R85-D203 IonicContact CZ-OD2 3.57Å; R85-D203 VanDerWaalsContact NH2-CG 3.29Å; R85-D203 IonicContact NH2-OD1 3.61Å; R85-D203 IonicContact NH2-OD2 3.63Å; R85-D203 PolarHBondContact NH2-OD2 2.91Å
86	Y	91.4	Very high	87.2	Confident	10 Å²	10	50.1 Å²	50.1	4%	0.039	25%	0.253	C	S	.	.	S	Bend	trans	-56.8	-35.5	-175	-177.6	-86.9	0	0	0	113.2	T84 F103 V108 F110 Y115 L118 V152	T84-Y86 PolarHBondContact O-N 3.47Å; T84-Y86 WeakPolarHBondContact OG1-CB 3.36Å; T84-Y86 PolarHBondContact OG1-N 2.88Å; Y86-F103 HydrophobicContact CD1-CD1 4.29Å; Y86-F103 HydrophobicContact CE1-CD1 4.02Å; Y86-F103 HydrophobicContact CE1-CE1 4.16Å; Y86-V108 HydrophobicContact CD2-CB 4.29Å; Y86-V108 VanDerWaalsContact CE2-O 3.28Å; Y86-V108 WeakPolarHBondContact CE2-O 3.42Å; Y86-F110 HydrophobicContact CD1-CD2 4.34Å; Y86-F110 HydrophobicContact CD1-CE2 4.41Å; Y86-F110 HydrophobicContact CD2-CD1 4.43Å; Y86-F110 HydrophobicContact CG-CD1 4.48Å; Y86-F110 HydrophobicContact CG-CD2 4.48Å; Y86-F110 HydrophobicContact CG-CE1 4.37Å; Y86-F110 HydrophobicContact CG-CE2 4.39Å; Y86-F110 HydrophobicContact CG-CZ 4.33Å; Y86-Y115 AromaticContact CE1-CD2 3.73Å; Y86-Y115 HydrophobicContact CE1-CD2 3.73Å; Y86-Y115 AromaticContact CE1-CE2 3.69Å; Y86-Y115 HydrophobicContact CE1-CE2 3.69Å; Y86-L118 HydrophobicContact CD1-CD2 4.1Å; Y86-V152 WeakPolarHBondContact OH-CG2 3.12Å
87	A	91.9	Very high	86.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-146.2	150	164.4	0	0	0	0	0	110	R85 L101 T102 F103 L118 L122	R85-A87 PolarHBondContact O-N 3.38Å; R85-A87 VanDerWaalsContact O-N 3.16Å; A87-L101 HydrophobicContact CB-CD1 4.37Å; A87-T102 CarbonylContact C-O 3.54Å; A87-T102 VanDerWaalsContact CA-O 3.29Å; A87-T102 WeakPolarHBondContact CA-O 3.41Å; A87-F103 HydrophobicContact CB-CD1 3.57Å; A87-F103 HydrophobicContact CB-CE1 3.54Å; A87-F103 HydrophobicContact CB-CG 4.15Å; A87-F103 HydrophobicContact CB-CZ 4.1Å; A87-L118 HydrophobicContact CB-CD2 4.03Å; A87-L122 HydrophobicContact CB-CD1 3.87Å
88	F	91	Very high	86.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	157.5	175.6	64.5	-92.1	0	0	0	112.6	R85 T102 P104 T201 Y210	R85-F88 HydrophobicContact CG-CD1 3.85Å; R85-F88 HydrophobicContact CG-CE1 4.19Å; F88-T102 HydrophobicContact CE1-CG2 3.81Å; F88-T102 HydrophobicContact CE2-CG2 4.29Å; F88-T102 HydrophobicContact CZ-CG2 3.61Å; F88-T102 PolarHBondContact N-O 3.33Å; F88-T102 PolarHBondContact O-N 2.92Å; F88-P104 HydrophobicContact CD1-CG 4.13Å; F88-P104 HydrophobicContact CE1-CB 4.08Å; F88-P104 HydrophobicContact CE1-CG 3.73Å; F88-T201 HydrophobicContact CE2-CG2 4.1Å; F88-T201 HydrophobicContact CZ-CG2 4.44Å; F88-Y210 HydrophobicContact CB-CE1 4.39Å; F88-Y210 HydrophobicContact CD1-CE1 4.46Å; F88-Y210 AromaticContact CD2-CD1 3.93Å; F88-Y210 HydrophobicContact CD2-CD1 3.93Å; F88-Y210 AromaticContact CD2-CE1 3.3Å; F88-Y210 HydrophobicContact CD2-CE1 3.3Å; F88-Y210 AromaticContact CD2-CZ 3.7Å; F88-Y210 AromaticContact CE2-CD1 3.69Å; F88-Y210 HydrophobicContact CE2-CD1 3.69Å; F88-Y210 AromaticContact CE2-CE1 3.54Å; F88-Y210 HydrophobicContact CE2-CE1 3.54Å; F88-Y210 AromaticContact CG-CE1 3.82Å; F88-Y210 HydrophobicContact CG-CE1 3.82Å; F88-Y210 HydrophobicContact CZ-CD1 4.32Å; F88-Y210 HydrophobicContact CZ-CE1 4.22Å
89	I	87.8	Confident	86.5	Confident	4 Å²	4	41.3 Å²	41.3	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	116.3	166.2	-63.8	176.8	0	0	0	107.2	G91 L101 L122 Q126 F135	I89-G91 VanDerWaalsContact C-N 3.26Å; I89-G91 PolarHBondContact O-N 3.33Å; I89-L101 HydrophobicContact CD1-CD1 4.46Å; I89-L101 HydrophobicContact CG1-CB 4.45Å; I89-L101 HydrophobicContact CG1-CD1 3.79Å; I89-L122 HydrophobicContact CD1-CB 4.1Å; I89-L122 WeakPolarHBondContact CD1-O 3.37Å; I89-L122 HydrophobicContact CG1-CB 4.43Å; I89-L122 HydrophobicContact CG1-CD2 4.42Å; I89-Q126 HydrophobicContact CD1-CG 4.45Å; I89-F135 HydrophobicContact CD1-CE1 4.07Å
90	S	84.3	Confident	86.4	Confident	3 Å²	3	40.1 Å²	40.1	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	-12.6	-178.8	57	0	0	0	0	114	A92 F208	S90-A92 VanDerWaalsContact C-N 3.32Å; S90-A92 VanDerWaalsContact OG-CB 3.25Å; S90-A92 WeakPolarHBondContact OG-CB 3.43Å; S90-A92 PolarHBondContact OG-N 3.01Å; S90-F208 VanDerWaalsContact O-CE1 3.28Å; S90-F208 WeakPolarHBondContact O-CE1 3.3Å
91	G	80.2	Confident	86.4	Confident	46 Å²	46	36 Å²	36	47%	0.474	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	87.2	-0.6	-164.4	0	0	0	0	0	113.3	I89	I89-G91 VanDerWaalsContact C-N 3.26Å; I89-G91 PolarHBondContact O-N 3.33Å
92	A	83.8	Confident	86.4	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.008	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	144	170.7	0	0	0	0	0	111.6	S90 V100 R199 F208	S90-A92 VanDerWaalsContact C-N 3.32Å; S90-A92 VanDerWaalsContact OG-CB 3.25Å; S90-A92 WeakPolarHBondContact OG-CB 3.43Å; S90-A92 PolarHBondContact OG-N 3.01Å; A92-V100 HydrophobicContact CB-CB 4.33Å; A92-V100 HydrophobicContact CB-CG2 4.35Å; A92-V100 PolarHBondContact O-N 2.73Å; A92-R199 VanDerWaalsContact CB-O 3.23Å; A92-R199 WeakPolarHBondContact CB-O 3.32Å; A92-F208 HydrophobicContact CB-CD2 3.98Å; A92-F208 HydrophobicContact CB-CE2 3.89Å; A92-F208 HydrophobicContact CB-CG 4.33Å; A92-F208 HydrophobicContact CB-CZ 4.17Å
93	K	83.3	Confident	86.5	Confident	64 Å²	64	35.1 Å²	35.1	28%	0.278	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	146	172.3	-73.8	-178	165.2	-156	0	109.8	G97 L98 D130 R199	K93-G97 WeakPolarHBondContact CD-O 3.34Å; K93-G97 WeakPolarHBondContact CG-O 3.38Å; K93-L98 CarbonylContact C-O 3.53Å; K93-L98 VanDerWaalsContact CA-O 3.27Å; K93-L98 WeakPolarHBondContact CA-O 3.21Å; K93-D130 IonicContact NZ-OD1 3.67Å; K93-D130 PolarHBondContact NZ-OD1 2.89Å; K93-D130 IonicContact NZ-OD2 3.76Å; K93-D130 PolarHBondContact NZ-OD2 3.4Å; K93-R199 WeakPolarHBondContact O-CD 3.42Å; K93-R199 WeakPolarHBondContact O-CG 3.46Å; K93-R199 PolarHBondContact O-NE 3.43Å
94	S	81.6	Confident	86.4	Confident	18 Å²	18	31.4 Å²	31.4	13%	0.126	17%	0.169	C	C	.	.			trans	-66.5	174.8	172.3	77.1	0	0	0	0	111.4	Q96 G97 L98	S94-Q96 PolarHBondContact O-N 3.08Å; S94-Q96 PolarHBondContact OG-N 3.4Å; S94-G97 PolarHBondContact O-N 2.92Å; S94-L98 PolarHBondContact N-O 2.89Å; S94-L98 WeakPolarHBondContact OG-CB 3.43Å; S94-L98 PolarHBondContact OG-N 3.46Å
95	E	80.1	Confident	86.3	Confident	160 Å²	160	31.3 Å²	31.3	75%	0.748	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-23.8	173.6	-60.2	-173.2	165.5	0	0	112.8	G97	E95-G97 VanDerWaalsContact C-N 3.28Å; E95-G97 PolarHBondContact O-N 2.91Å
96	Q	78	Confident	86	Confident	158 Å²	158	27.7 Å²	27.7	74%	0.738	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.4	6.2	173.3	-62.7	177.6	-3.3	0	0	113.1	S94 L98	S94-Q96 PolarHBondContact O-N 3.08Å; S94-Q96 PolarHBondContact OG-N 3.4Å; Q96-L98 VanDerWaalsContact C-N 3.25Å; Q96-L98 HydrophobicContact CB-CD1 4.2Å; Q96-L98 HydrophobicContact CB-CG 4.02Å; Q96-L98 PolarHBondContact O-N 3.29Å
97	G	79.5	Confident	85.7	Confident	31 Å²	31	32.5 Å²	32.5	32%	0.32	18%	0.178	S	C	.	.	S	Bend	trans	77.3	2.6	-177.9	0	0	0	0	0	115.2	K93 S94 E95	K93-G97 WeakPolarHBondContact CD-O 3.34Å; K93-G97 WeakPolarHBondContact CG-O 3.38Å; S94-G97 PolarHBondContact O-N 2.92Å; E95-G97 VanDerWaalsContact C-N 3.28Å; E95-G97 PolarHBondContact O-N 2.91Å
98	L	83.2	Confident	85.4	Confident	10 Å²	10	35.4 Å²	35.4	5%	0.052	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-74.8	133.4	-176.9	-54.2	173.8	0	0	0	111	K93 S94 Q96 N133 G134 V136 R165	K93-L98 CarbonylContact C-O 3.53Å; K93-L98 VanDerWaalsContact CA-O 3.27Å; K93-L98 WeakPolarHBondContact CA-O 3.21Å; S94-L98 PolarHBondContact N-O 2.89Å; S94-L98 WeakPolarHBondContact OG-CB 3.43Å; S94-L98 PolarHBondContact OG-N 3.46Å; Q96-L98 VanDerWaalsContact C-N 3.25Å; Q96-L98 HydrophobicContact CB-CD1 4.2Å; Q96-L98 HydrophobicContact CB-CG 4.02Å; Q96-L98 PolarHBondContact O-N 3.29Å; L98-N133 HydrophobicContact CD2-CB 3.79Å; L98-G134 WeakPolarHBondContact CD2-O 3.47Å; L98-V136 HydrophobicContact CB-CG2 4Å; L98-V136 HydrophobicContact CD1-CG2 3.99Å; L98-R165 HydrophobicContact CD1-CB 4.01Å; L98-R165 HydrophobicContact CD1-CG 3.82Å
99	P	86.2	Confident	84.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	138.1	175.4	-24.7	34.6	0	0	0	113.1	Q126 D130 G134 F135 V136	P99-Q126 HydrophobicContact CB-CG 3.91Å; P99-Q126 HydrophobicContact CG-CB 4.41Å; P99-Q126 HydrophobicContact CG-CG 3.78Å; P99-D130 HydrophobicContact CG-CB 4.14Å; P99-G134 WeakPolarHBondContact CD-O 3.45Å; P99-F135 HydrophobicContact CB-CD1 3.84Å; P99-F135 HydrophobicContact CB-CE1 3.92Å; P99-F135 HydrophobicContact CG-CD1 4.47Å; P99-F135 HydrophobicContact CG-CE1 4.34Å; P99-V136 PolarHBondContact O-N 2.88Å
100	V	87.3	Confident	84.9	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	123.8	177.6	-176.2	0	0	0	0	110.3	A92 V136 I138	A92-V100 HydrophobicContact CB-CB 4.33Å; A92-V100 HydrophobicContact CB-CG2 4.35Å; A92-V100 PolarHBondContact O-N 2.73Å; V100-V136 WeakPolarHBondContact CA-O 3.32Å; V100-I138 HydrophobicContact CG1-CD1 3.79Å; V100-I138 HydrophobicContact CG1-CG1 4.12Å
101	L	90.2	Very high	85.1	Confident	2 Å²	2	48 Å²	48	1%	0.01	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.2	172.9	175.4	65.3	0	0	0	109	A87 I89 F103 L122 V136 A137 I138 L156 F160	A87-L101 HydrophobicContact CB-CD1 4.37Å; I89-L101 HydrophobicContact CD1-CD1 4.46Å; I89-L101 HydrophobicContact CG1-CB 4.45Å; I89-L101 HydrophobicContact CG1-CD1 3.79Å; L101-F103 HydrophobicContact CD2-CE2 3.68Å; L101-F103 HydrophobicContact CD2-CZ 4.01Å; L101-F103 HydrophobicContact CG-CD2 4.42Å; L101-F103 HydrophobicContact CG-CE2 3.82Å; L101-F103 HydrophobicContact CG-CZ 4.4Å; L101-L122 HydrophobicContact CD1-CB 4.47Å; L101-L122 HydrophobicContact CD1-CD1 3.86Å; L101-V136 PolarHBondContact N-O 2.93Å; L101-A137 WeakPolarHBondContact O-CA 3.48Å; L101-I138 PolarHBondContact O-N 3.49Å; L101-L156 HydrophobicContact CD2-CD2 4.34Å; L101-F160 HydrophobicContact CD2-CD2 4.34Å; L101-F160 HydrophobicContact CD2-CE2 3.74Å
102	T	91.8	Very high	85.5	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	125.5	-177.7	-59.6	0	0	0	0	110.5	A87 F88 P104 L204	A87-T102 CarbonylContact C-O 3.54Å; A87-T102 VanDerWaalsContact CA-O 3.29Å; A87-T102 WeakPolarHBondContact CA-O 3.41Å; F88-T102 HydrophobicContact CE1-CG2 3.81Å; F88-T102 HydrophobicContact CE2-CG2 4.29Å; F88-T102 HydrophobicContact CZ-CG2 3.61Å; F88-T102 PolarHBondContact N-O 3.33Å; F88-T102 PolarHBondContact O-N 2.92Å; T102-P104 WeakPolarHBondContact O-CD 3.46Å; T102-L204 HydrophobicContact CG2-CD1 3.88Å
103	F	92.2	Very high	85.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	94.3	162.7	-62.7	-98.8	0	0	0	107	Y86 A87 L101 Y115 V119 I138 I139 D140 V152 L156	Y86-F103 HydrophobicContact CD1-CD1 4.29Å; Y86-F103 HydrophobicContact CE1-CD1 4.02Å; Y86-F103 HydrophobicContact CE1-CE1 4.16Å; A87-F103 HydrophobicContact CB-CD1 3.57Å; A87-F103 HydrophobicContact CB-CE1 3.54Å; A87-F103 HydrophobicContact CB-CG 4.15Å; A87-F103 HydrophobicContact CB-CZ 4.1Å; L101-F103 HydrophobicContact CD2-CE2 3.68Å; L101-F103 HydrophobicContact CD2-CZ 4.01Å; L101-F103 HydrophobicContact CG-CD2 4.42Å; L101-F103 HydrophobicContact CG-CE2 3.82Å; L101-F103 HydrophobicContact CG-CZ 4.4Å; F103-Y115 HydrophobicContact CE1-CE2 4Å; F103-Y115 WeakPolarHBondContact CE1-OH 3.37Å; F103-Y115 WeakPolarHBondContact CZ-OH 3.42Å; F103-V119 HydrophobicContact CZ-CG2 4.43Å; F103-I138 PolarHBondContact N-O 2.81Å; F103-I139 HydrophobicContact CB-CG1 4.46Å; F103-I139 HydrophobicContact CD2-CG1 4Å; F103-I139 HydrophobicContact CG-CG1 4.48Å; F103-D140 PolarHBondContact O-N 3.37Å; F103-V152 HydrophobicContact CD1-CG1 3.83Å; F103-V152 HydrophobicContact CD2-CG1 4.14Å; F103-V152 HydrophobicContact CE1-CG1 3.91Å; F103-V152 HydrophobicContact CE2-CG1 4.22Å; F103-V152 HydrophobicContact CG-CG1 3.96Å; F103-V152 HydrophobicContact CZ-CG1 4.11Å; F103-L156 HydrophobicContact CE2-CD1 4.02Å; F103-L156 HydrophobicContact CE2-CD2 4.03Å; F103-L156 HydrophobicContact CE2-CG 4.33Å; F103-L156 HydrophobicContact CZ-CD1 4.33Å; F103-L156 HydrophobicContact CZ-CD2 3.79Å; F103-L156 HydrophobicContact CZ-CG 4.15Å
104	P	90.6	Very high	86.1	Confident	8 Å²	8	52.9 Å²	52.9	5%	0.052	28%	0.279	C	S	.	.			trans	-69.8	164.3	179.4	34.4	-38.7	0	0	0	110.5	R85 F88 T102 S106 R141	R85-P104 HydrophobicContact CG-CG 4.2Å; R85-P104 WeakPolarHBondContact O-CD 3.42Å; R85-P104 WeakPolarHBondContact O-CG 3.22Å; F88-P104 HydrophobicContact CD1-CG 4.13Å; F88-P104 HydrophobicContact CE1-CB 4.08Å; F88-P104 HydrophobicContact CE1-CG 3.73Å; T102-P104 WeakPolarHBondContact O-CD 3.46Å; P104-S106 PolarHBondContact O-N 3.23Å; P104-R141 PolarHBondContact O-NH1 3.05Å
105	D	87.7	Confident	86.5	Confident	45 Å²	45	52 Å²	52	24%	0.241	27%	0.273	C	S	.	.	S	Bend	trans	-60.1	123.5	179.1	-143.1	-20.3	0	0	0	111.1	D140 R141 R142 T143	D105-D140 VanDerWaalsContact CA-O 3.28Å; D105-D140 WeakPolarHBondContact CA-O 3.3Å; D105-D140 PolarHBondContact N-O 2.95Å; D105-R141 WeakPolarHBondContact OD1-CA 3.49Å; D105-R142 WeakPolarHBondContact OD2-CA 3.31Å; D105-R142 WeakPolarHBondContact OD2-CB 3.46Å; D105-R142 PolarHBondContact OD2-N 3.48Å; D105-T143 PolarHBondContact OD1-OG1 3.4Å; D105-T143 PolarHBondContact OD2-N 3.46Å; D105-T143 PolarHBondContact OD2-OG1 2.99Å
106	S	84.3	Confident	87	Confident	17 Å²	17	46.6 Å²	46.6	12%	0.119	25%	0.246	C	C	.	.			trans	-164.6	127.5	-168.3	-179.8	0	0	0	0	111.2	P104 V108	P104-S106 PolarHBondContact O-N 3.23Å; S106-V108 WeakPolarHBondContact OG-CG2 3.39Å; S106-V108 PolarHBondContact OG-N 3.33Å
107	H	83.8	Confident	87.7	Confident	111 Å²	111	40.1 Å²	40.1	51%	0.514	22%	0.216	S	C	.	.			trans	-91.1	5.3	177.1	-56	-63.1	0	0	0	113.5	Q109 T143 D144	H107-Q109 PolarHBondContact O-N 3.28Å; H107-T143 PolarHBondContact CE1-O 3.16Å; H107-T143 PolarHBondContact NE2-OG1 3.38Å; H107-D144 IonicContact CE1-OD1 3.81Å; H107-D144 IonicContact ND1-OD1 3.22Å; H107-D144 PolarHBondContact ND1-OD1 2.99Å; H107-D144 IonicContact ND1-OD2 3.97Å
108	V	85.6	Confident	88.3	Confident	62 Å²	62	38.7 Å²	38.7	38%	0.376	20%	0.201	S	C	.	.	P	Polyproline II helix	trans	-65.2	132.8	178.5	179.4	0	0	0	0	109.6	Y86 S106 F110	Y86-V108 HydrophobicContact CD2-CB 4.29Å; Y86-V108 VanDerWaalsContact CE2-O 3.28Å; Y86-V108 WeakPolarHBondContact CE2-O 3.42Å; S106-V108 WeakPolarHBondContact OG-CG2 3.39Å; S106-V108 PolarHBondContact OG-N 3.33Å; V108-F110 HydrophobicContact CG1-CD1 3.85Å; V108-F110 HydrophobicContact CG1-CE1 3.75Å
109	Q	82.4	Confident	88.5	Confident	187 Å²	187	38.3 Å²	38.3	87%	0.874	20%	0.199	S	C	*	.	P	Polyproline II helix	trans	-103.4	122.1	177.8	-63.1	-174.6	14.1	0	0	109.9	H107	H107-Q109 PolarHBondContact O-N 3.28Å
110	F	86.4	Confident	88.7	Confident	31 Å²	31	38.6 Å²	38.6	14%	0.136	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-99.7	149.6	176.6	-89	24.5	0	0	0	110.8	L81 T84 Y86 V108 D114 L118	L81-F110 HydrophobicContact CB-CE2 4.42Å; L81-F110 HydrophobicContact CB-CZ 4.38Å; L81-F110 HydrophobicContact CD2-CD2 4.4Å; L81-F110 HydrophobicContact CD2-CE2 3.75Å; L81-F110 HydrophobicContact CD2-CZ 3.82Å; T84-F110 HydrophobicContact CG2-CE1 3.92Å; T84-F110 HydrophobicContact CG2-CZ 4.12Å; T84-F110 VanDerWaalsContact OG1-CZ 3.31Å; T84-F110 WeakPolarHBondContact OG1-CZ 3.27Å; Y86-F110 HydrophobicContact CD1-CD2 4.34Å; Y86-F110 HydrophobicContact CD1-CE2 4.41Å; Y86-F110 HydrophobicContact CD2-CD1 4.43Å; Y86-F110 HydrophobicContact CG-CD1 4.48Å; Y86-F110 HydrophobicContact CG-CD2 4.48Å; Y86-F110 HydrophobicContact CG-CE1 4.37Å; Y86-F110 HydrophobicContact CG-CE2 4.39Å; Y86-F110 HydrophobicContact CG-CZ 4.33Å; V108-F110 HydrophobicContact CG1-CD1 3.85Å; V108-F110 HydrophobicContact CG1-CE1 3.75Å; F110-D114 HydrophobicContact CB-CB 4.03Å; F110-D114 HydrophobicContact CD2-CB 3.72Å; F110-D114 HydrophobicContact CE2-CB 4.3Å; F110-D114 HydrophobicContact CG-CB 3.95Å; F110-L118 HydrophobicContact CD2-CD2 4.38Å; F110-L118 HydrophobicContact CE2-CB 4.21Å; F110-L118 HydrophobicContact CE2-CD2 3.56Å; F110-L118 HydrophobicContact CE2-CG 4.48Å; F110-L118 HydrophobicContact CZ-CD2 4.24Å
111	S	89.2	Confident	88.8	Confident	54 Å²	54	38.8 Å²	38.8	38%	0.378	20%	0.202	S	C	.	.	P	Polyproline II helix	trans	-72.4	168.1	165.5	81.4	0	0	0	0	111.5	A113 D114 Y115	S111-A113 PolarHBondContact O-N 2.9Å; S111-A113 PolarHBondContact OG-N 3.3Å; S111-D114 WeakPolarHBondContact CA-OD2 3.48Å; S111-D114 WeakPolarHBondContact CB-OD2 3.23Å; S111-D114 PolarHBondContact N-OD2 3.39Å; S111-D114 PolarHBondContact O-N 2.97Å; S111-D114 PolarHBondContact OG-N 3.35Å; S111-D114 PolarHBondContact OG-OD1 3.5Å; S111-D114 PolarHBondContact OG-OD2 2.89Å; S111-Y115 PolarHBondContact O-N 3.48Å; S111-Y115 VanDerWaalsContact O-N 3.16Å
112	F	87.4	Confident	88.8	Confident	114 Å²	114	38.8 Å²	38.8	50%	0.5	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-29.3	174.5	-170.4	-104.6	0	0	0	112.5	Y155 L158 F159	F112-Y155 HydrophobicContact CD2-CD1 4.47Å; F112-Y155 AromaticContact CD2-CE1 3.9Å; F112-Y155 HydrophobicContact CD2-CE1 3.9Å; F112-Y155 HydrophobicContact CE2-CE1 4.29Å; F112-L158 HydrophobicContact CE2-CD1 4.21Å; F112-F159 HydrophobicContact CD1-CE1 4.46Å; F112-F159 AromaticContact CD1-CZ 3.77Å; F112-F159 HydrophobicContact CD1-CZ 3.77Å; F112-F159 AromaticContact CD2-CE2 3.93Å; F112-F159 HydrophobicContact CD2-CE2 3.93Å; F112-F159 AromaticContact CD2-CZ 3.58Å; F112-F159 HydrophobicContact CD2-CZ 3.58Å; F112-F159 AromaticContact CE1-CE1 3.9Å; F112-F159 HydrophobicContact CE1-CE1 3.9Å; F112-F159 AromaticContact CE1-CZ 3.53Å; F112-F159 HydrophobicContact CE1-CZ 3.53Å; F112-F159 HydrophobicContact CE2-CE1 4.19Å; F112-F159 AromaticContact CE2-CE2 3.84Å; F112-F159 HydrophobicContact CE2-CE2 3.84Å; F112-F159 AromaticContact CE2-CZ 3.33Å; F112-F159 HydrophobicContact CE2-CZ 3.33Å; F112-F159 HydrophobicContact CG-CE2 4.42Å; F112-F159 AromaticContact CG-CZ 3.8Å; F112-F159 HydrophobicContact CG-CZ 3.8Å; F112-F159 AromaticContact CZ-CE1 3.75Å; F112-F159 HydrophobicContact CZ-CE1 3.75Å; F112-F159 HydrophobicContact CZ-CE2 4.25Å; F112-F159 AromaticContact CZ-CZ 3.31Å; F112-F159 HydrophobicContact CZ-CZ 3.31Å; F112-F159 VanDerWaalsContact O-CZ 3.24Å; F112-F159 WeakPolarHBondContact O-CZ 3.02Å
113	A	89.5	Confident	88.4	Confident	45 Å²	45	38.7 Å²	38.7	37%	0.372	20%	0.201	S	C	.	.	H	α-helix	trans	-78.2	-49.7	176.4	0	0	0	0	0	111.5	S111 Y115 R116 I117	S111-A113 PolarHBondContact O-N 2.9Å; S111-A113 PolarHBondContact OG-N 3.3Å; A113-Y115 VanDerWaalsContact C-N 3.3Å; A113-Y115 PolarHBondContact O-N 2.86Å; A113-R116 WeakPolarHBondContact O-CB 3.32Å; A113-R116 PolarHBondContact O-N 2.88Å; A113-R116 VanDerWaalsContact O-N 3.08Å; A113-I117 WeakPolarHBondContact O-CG1 3.47Å; A113-I117 PolarHBondContact O-N 2.94Å
114	D	91.1	Very high	87.9	Confident	54 Å²	54	44.2 Å²	44.2	29%	0.289	22%	0.222	S	C	.	.	H	α-helix	trans	-53.3	-46.7	-179.4	-58.7	-34.1	0	0	0	112.1	L81 F110 S111 I117 L118	L81-D114 HydrophobicContact CD2-CB 3.57Å; F110-D114 HydrophobicContact CB-CB 4.03Å; F110-D114 HydrophobicContact CD2-CB 3.72Å; F110-D114 HydrophobicContact CE2-CB 4.3Å; F110-D114 HydrophobicContact CG-CB 3.95Å; S111-D114 WeakPolarHBondContact CA-OD2 3.48Å; S111-D114 WeakPolarHBondContact CB-OD2 3.23Å; S111-D114 PolarHBondContact N-OD2 3.39Å; S111-D114 PolarHBondContact O-N 2.97Å; S111-D114 PolarHBondContact OG-N 3.35Å; S111-D114 PolarHBondContact OG-OD1 3.5Å; S111-D114 PolarHBondContact OG-OD2 2.89Å; D114-I117 PolarHBondContact O-N 3.32Å; D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 PolarHBondContact O-N 2.96Å
115	Y	90.8	Very high	87.5	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-44.5	179	-172.6	-72.9	0	0	0	111.7	Y86 F103 S111 A113 I117 L118 V119 V152 Y155 L156 F159	Y86-Y115 AromaticContact CE1-CD2 3.73Å; Y86-Y115 HydrophobicContact CE1-CD2 3.73Å; Y86-Y115 AromaticContact CE1-CE2 3.69Å; Y86-Y115 HydrophobicContact CE1-CE2 3.69Å; F103-Y115 HydrophobicContact CE1-CE2 4Å; F103-Y115 WeakPolarHBondContact CE1-OH 3.37Å; F103-Y115 WeakPolarHBondContact CZ-OH 3.42Å; S111-Y115 PolarHBondContact O-N 3.48Å; S111-Y115 VanDerWaalsContact O-N 3.16Å; A113-Y115 VanDerWaalsContact C-N 3.3Å; A113-Y115 PolarHBondContact O-N 2.86Å; Y115-I117 VanDerWaalsContact C-N 3.34Å; Y115-I117 PolarHBondContact O-N 3.4Å; Y115-L118 PolarHBondContact O-N 3.22Å; Y115-V119 HydrophobicContact CD1-CB 4.37Å; Y115-V119 HydrophobicContact CD1-CG2 3.87Å; Y115-V119 HydrophobicContact CE1-CB 4.1Å; Y115-V119 HydrophobicContact CE1-CG2 3.38Å; Y115-V119 WeakPolarHBondContact O-CB 3.25Å; Y115-V119 PolarHBondContact O-N 3.31Å; Y115-V152 PolarHBondContact OH-O 3.47Å; Y115-Y155 HydrophobicContact CD1-CD2 4.12Å; Y115-Y155 HydrophobicContact CD1-CG 4.26Å; Y115-Y155 AromaticContact CD2-CD2 3.62Å; Y115-Y155 HydrophobicContact CD2-CD2 3.62Å; Y115-Y155 HydrophobicContact CD2-CG 4.39Å; Y115-Y155 HydrophobicContact CE1-CG 4.42Å; Y115-Y155 HydrophobicContact CE2-CD2 4.03Å; Y115-Y155 HydrophobicContact CE2-CG 4.49Å; Y115-Y155 AromaticContact CG-CD2 3.65Å; Y115-Y155 HydrophobicContact CG-CD2 3.65Å; Y115-Y155 HydrophobicContact CG-CG 4.26Å; Y115-Y155 VanDerWaalsContact CZ-CB 3.47Å; Y115-L156 WeakPolarHBondContact OH-CG 3.32Å; Y115-L156 PolarHBondContact OH-N 3.2Å; Y115-F159 AromaticContact CD1-CD2 3.61Å; Y115-F159 HydrophobicContact CD1-CD2 3.61Å; Y115-F159 HydrophobicContact CD1-CE2 4.11Å; Y115-F159 HydrophobicContact CE1-CD2 4.09Å
116	R	90.8	Very high	86.8	Confident	46 Å²	46	43 Å²	43	17%	0.174	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-46.1	177.7	-178.8	-174.3	64.3	109.6	-4.4	111	D69 E71 A113 V119 N120 F159	D69-R116 IonicContact OD2-NH1 3.63Å; E71-R116 VanDerWaalsContact CD-NH2 3.27Å; E71-R116 IonicContact OE1-CZ 2.71Å; E71-R116 VanDerWaalsContact OE1-CZ 3.27Å; E71-R116 IonicContact OE1-NH1 3.66Å; E71-R116 PolarHBondContact OE1-NH1 3.07Å; E71-R116 IonicContact OE1-NH2 3.44Å; E71-R116 PolarHBondContact OE1-NH2 2.99Å; E71-R116 IonicContact OE2-CZ 2.78Å; E71-R116 IonicContact OE2-NH1 3.74Å; E71-R116 IonicContact OE2-NH2 3.42Å; E71-R116 PolarHBondContact OE2-NH2 3.37Å; A113-R116 WeakPolarHBondContact O-CB 3.32Å; A113-R116 PolarHBondContact O-N 2.88Å; A113-R116 VanDerWaalsContact O-N 3.08Å; R116-V119 PolarHBondContact O-N 3.35Å; R116-N120 WeakPolarHBondContact O-CB 3.47Å; R116-N120 PolarHBondContact O-N 2.91Å; R116-N120 PolarHBondContact O-ND2 2.97Å; R116-F159 HydrophobicContact CB-CD1 3.76Å; R116-F159 HydrophobicContact CB-CD2 4.21Å; R116-F159 HydrophobicContact CB-CE1 3.71Å; R116-F159 HydrophobicContact CB-CE2 4.16Å; R116-F159 HydrophobicContact CB-CG 3.98Å; R116-F159 HydrophobicContact CB-CZ 3.87Å; R116-F159 HydrophobicContact CG-CD1 3.6Å; R116-F159 HydrophobicContact CG-CE1 3.82Å; R116-F159 HydrophobicContact CG-CG 4.11Å; R116-F159 HydrophobicContact CG-CZ 4.49Å
117	I	91.2	Very high	85.9	Confident	22 Å²	22	43.9 Å²	43.9	11%	0.113	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-51.5	179.5	-64.1	167.1	0	0	0	110.1	I68 I73 V78 L81 A113 D114 Y115 V119 Y121	I68-I117 HydrophobicContact CD1-CG2 4.04Å; I73-I117 HydrophobicContact CD1-CB 4.41Å; I73-I117 HydrophobicContact CD1-CD1 3.92Å; I73-I117 HydrophobicContact CD1-CG1 3.69Å; I73-I117 HydrophobicContact CD1-CG2 3.93Å; I73-I117 HydrophobicContact CG2-CG2 4.34Å; V78-I117 HydrophobicContact CG2-CG2 4Å; L81-I117 HydrophobicContact CD1-CB 3.83Å; L81-I117 HydrophobicContact CD1-CG2 3.62Å; A113-I117 WeakPolarHBondContact O-CG1 3.47Å; A113-I117 PolarHBondContact O-N 2.94Å; D114-I117 PolarHBondContact O-N 3.32Å; Y115-I117 VanDerWaalsContact C-N 3.34Å; Y115-I117 PolarHBondContact O-N 3.4Å; I117-V119 PolarHBondContact O-N 2.88Å; I117-Y121 VanDerWaalsContact O-CB 3.25Å; I117-Y121 WeakPolarHBondContact O-CB 3.38Å; I117-Y121 PolarHBondContact O-N 3.43Å
118	L	91.8	Very high	84.9	Confident	1 Å²	1	43.6 Å²	43.6	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-58	-48.7	178.7	176.1	61.9	0	0	0	112	L82 Y86 A87 F110 D114 Y115 Y121 L122	L82-L118 HydrophobicContact CD2-CD1 3.52Å; L82-L118 HydrophobicContact CG-CD1 4.16Å; Y86-L118 HydrophobicContact CD1-CD2 4.1Å; A87-L118 HydrophobicContact CB-CD2 4.03Å; F110-L118 HydrophobicContact CD2-CD2 4.38Å; F110-L118 HydrophobicContact CE2-CB 4.21Å; F110-L118 HydrophobicContact CE2-CD2 3.56Å; F110-L118 HydrophobicContact CE2-CG 4.48Å; F110-L118 HydrophobicContact CZ-CD2 4.24Å; D114-L118 WeakPolarHBondContact O-CB 3.5Å; D114-L118 PolarHBondContact O-N 2.96Å; Y115-L118 PolarHBondContact O-N 3.22Å; L118-Y121 PolarHBondContact O-N 3.13Å; L118-L122 HydrophobicContact CD1-CD1 3.78Å; L118-L122 HydrophobicContact CD1-CG 4.06Å; L118-L122 HydrophobicContact CG-CD1 4Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.31Å; L118-L122 PolarHBondContact O-N 3.04Å
119	V	89.1	Confident	83.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-70.7	-42	-175.6	164	0	0	0	0	112.4	F103 Y115 R116 I117 L122 A123 F160	F103-V119 HydrophobicContact CZ-CG2 4.43Å; Y115-V119 HydrophobicContact CD1-CB 4.37Å; Y115-V119 HydrophobicContact CD1-CG2 3.87Å; Y115-V119 HydrophobicContact CE1-CB 4.1Å; Y115-V119 HydrophobicContact CE1-CG2 3.38Å; Y115-V119 WeakPolarHBondContact O-CB 3.25Å; Y115-V119 PolarHBondContact O-N 3.31Å; R116-V119 PolarHBondContact O-N 3.35Å; I117-V119 PolarHBondContact O-N 2.88Å; V119-L122 PolarHBondContact O-N 3.33Å; V119-A123 WeakPolarHBondContact O-CB 3.36Å; V119-A123 PolarHBondContact O-N 3.1Å; V119-F160 HydrophobicContact CG1-CB 4.42Å; V119-F160 HydrophobicContact CG1-CD2 3.53Å; V119-F160 HydrophobicContact CG1-CE2 4.2Å; V119-F160 HydrophobicContact CG1-CG 4.42Å
120	N	89	Confident	83.1	Confident	7 Å²	7	40.5 Å²	40.5	4%	0.037	21%	0.208	C	C	.	.	H	α-helix	trans	-67.6	-36.1	175.3	-80.5	-48.5	0	0	0	112	I68 D69 R116 R124 F159 P161	I68-N120 HydrophobicContact CG2-CB 3.72Å; D69-N120 VanDerWaalsContact OD2-CG 3.28Å; D69-N120 PolarHBondContact OD2-ND2 3.07Å; R116-N120 WeakPolarHBondContact O-CB 3.47Å; R116-N120 PolarHBondContact O-N 2.91Å; R116-N120 PolarHBondContact O-ND2 2.97Å; N120-R124 WeakPolarHBondContact O-CB 3.27Å; N120-R124 VanDerWaalsContact O-CD 3.23Å; N120-R124 WeakPolarHBondContact O-CD 3.48Å; N120-R124 WeakPolarHBondContact O-CG 3.28Å; N120-R124 PolarHBondContact O-N 3.06Å; N120-R124 VanDerWaalsContact O-N 3.1Å; N120-F159 PolarHBondContact OD1-O 3.43Å; N120-P161 VanDerWaalsContact OD1-CD 3.3Å; N120-P161 WeakPolarHBondContact OD1-CD 3.28Å; N120-P161 WeakPolarHBondContact OD1-CG 3.27Å
121	Y	90.3	Very high	82	Confident	5 Å²	5	41 Å²	41	2%	0.02	21%	0.211	C	C	.	.	H	α-helix	trans	-60.4	-52.7	171.4	-179.8	-102.6	0	0	0	112	M66 I68 V78 L82 I117 L118 A123 R124 L125 R219 M220 E223	M66-Y121 HydrophobicContact CE-CD2 4.26Å; M66-Y121 HydrophobicContact CE-CE2 3.66Å; M66-Y121 HydrophobicContact SD-CD2 3.48Å; M66-Y121 WeakPolarHBondContact SD-CD2 3.43Å; M66-Y121 HydrophobicContact SD-CE2 3.41Å; M66-Y121 WeakPolarHBondContact SD-CE2 3.25Å; I68-Y121 HydrophobicContact CD1-CD2 4.08Å; I68-Y121 HydrophobicContact CD1-CG 4.47Å; V78-Y121 HydrophobicContact CG1-CD1 3.74Å; V78-Y121 HydrophobicContact CG1-CD2 3.75Å; V78-Y121 HydrophobicContact CG1-CE1 3.92Å; V78-Y121 HydrophobicContact CG1-CE2 3.92Å; V78-Y121 HydrophobicContact CG1-CG 3.62Å; L82-Y121 HydrophobicContact CD1-CD1 4.1Å; L82-Y121 HydrophobicContact CD1-CE1 3.62Å; L82-Y121 HydrophobicContact CD2-CD1 4.35Å; L82-Y121 HydrophobicContact CD2-CE1 4.44Å; I117-Y121 VanDerWaalsContact O-CB 3.25Å; I117-Y121 WeakPolarHBondContact O-CB 3.38Å; I117-Y121 PolarHBondContact O-N 3.43Å; L118-Y121 PolarHBondContact O-N 3.13Å; Y121-A123 PolarHBondContact O-N 3.48Å; Y121-R124 PolarHBondContact O-N 2.89Å; Y121-L125 HydrophobicContact CD1-CD2 4.3Å; Y121-L125 HydrophobicContact CE1-CD1 4.22Å; Y121-L125 HydrophobicContact CE1-CD2 3.84Å; Y121-L125 HydrophobicContact CE1-CG 4.41Å; Y121-L125 HydrophobicContact CE2-CD2 4.17Å; Y121-L125 WeakPolarHBondContact O-CG 3.2Å; Y121-L125 PolarHBondContact O-N 2.91Å; Y121-R219 WeakPolarHBondContact OH-CG 3.48Å; Y121-R219 PolarHBondContact OH-NE 2.71Å; Y121-R219 VanDerWaalsContact OH-NE 3.07Å; Y121-R219 PolarHBondContact OH-NH2 3.49Å; Y121-M220 VanDerWaalsContact OH-CE 3.31Å; Y121-M220 WeakPolarHBondContact OH-CE 3.42Å; Y121-E223 HydrophobicContact CE2-CG 4.36Å
122	L	89.3	Confident	80.9	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-60.1	-43.4	-179.3	-73.1	174.8	0	0	0	112	L82 A87 I89 L101 L118 V119 R124 L125 W215	L82-L122 HydrophobicContact CD2-CD2 4.01Å; A87-L122 HydrophobicContact CB-CD1 3.87Å; I89-L122 HydrophobicContact CD1-CB 4.1Å; I89-L122 WeakPolarHBondContact CD1-O 3.37Å; I89-L122 HydrophobicContact CG1-CB 4.43Å; I89-L122 HydrophobicContact CG1-CD2 4.42Å; L101-L122 HydrophobicContact CD1-CB 4.47Å; L101-L122 HydrophobicContact CD1-CD1 3.86Å; L118-L122 HydrophobicContact CD1-CD1 3.78Å; L118-L122 HydrophobicContact CD1-CG 4.06Å; L118-L122 HydrophobicContact CG-CD1 4Å; L118-L122 WeakPolarHBondContact O-CB 3.33Å; L118-L122 VanDerWaalsContact O-CG 3.31Å; L118-L122 WeakPolarHBondContact O-CG 3.31Å; L118-L122 PolarHBondContact O-N 3.04Å; V119-L122 PolarHBondContact O-N 3.33Å; L122-R124 VanDerWaalsContact C-N 3.32Å; L122-R124 PolarHBondContact O-N 2.98Å; L122-L125 HydrophobicContact CD2-CD1 4.06Å; L122-L125 WeakPolarHBondContact O-CB 3.35Å; L122-L125 WeakPolarHBondContact O-CG 3.35Å; L122-L125 PolarHBondContact O-N 3.13Å; L122-W215 HydrophobicContact CD2-CH2 4.21Å
123	A	83.9	Confident	80.2	Confident	2 Å²	2	44.9 Å²	44.9	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-63	-37.1	177.3	0	0	0	0	0	112.7	V119 Y121 L125 I131 F135 F160 P161	V119-A123 WeakPolarHBondContact O-CB 3.36Å; V119-A123 PolarHBondContact O-N 3.1Å; Y121-A123 PolarHBondContact O-N 3.48Å; A123-L125 PolarHBondContact O-N 2.8Å; A123-I131 WeakPolarHBondContact O-CD1 3.41Å; A123-F135 HydrophobicContact CB-CZ 4.46Å; A123-F160 HydrophobicContact CB-CE2 4.22Å; A123-F160 HydrophobicContact CB-CZ 4.28Å; A123-P161 HydrophobicContact CB-CG 3.44Å; A123-P161 VanDerWaalsContact CB-CG 3.44Å
124	R	82.3	Confident	79.6	Confident	116 Å²	116	42.7 Å²	42.7	44%	0.438	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.5	177.3	-73.4	165.3	-176.5	-108.8	-13.8	114.5	T67 D69 N120 Y121 L122	T67-R124 PolarHBondContact O-NH1 3.47Å; D69-R124 VanDerWaalsContact N-CZ 3.34Å; D69-R124 IonicContact OD1-CZ 2.93Å; D69-R124 IonicContact OD1-NE 2.7Å; D69-R124 IonicContact OD1-NH2 3.91Å; D69-R124 PolarHBondContact OD1-NH2 3.48Å; N120-R124 WeakPolarHBondContact O-CB 3.27Å; N120-R124 VanDerWaalsContact O-CD 3.23Å; N120-R124 WeakPolarHBondContact O-CD 3.48Å; N120-R124 WeakPolarHBondContact O-CG 3.28Å; N120-R124 PolarHBondContact O-N 3.06Å; N120-R124 VanDerWaalsContact O-N 3.1Å; Y121-R124 PolarHBondContact O-N 2.89Å; L122-R124 VanDerWaalsContact C-N 3.32Å; L122-R124 PolarHBondContact O-N 2.98Å
125	L	81.1	Confident	79.4	Confident	14 Å²	14	40.1 Å²	40.1	7%	0.073	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-38.1	-179.3	-59.7	-168.6	0	0	0	112.7	Y121 L122 A123 W215 R219 H288	Y121-L125 HydrophobicContact CD1-CD2 4.3Å; Y121-L125 HydrophobicContact CE1-CD1 4.22Å; Y121-L125 HydrophobicContact CE1-CD2 3.84Å; Y121-L125 HydrophobicContact CE1-CG 4.41Å; Y121-L125 HydrophobicContact CE2-CD2 4.17Å; Y121-L125 WeakPolarHBondContact O-CG 3.2Å; Y121-L125 PolarHBondContact O-N 2.91Å; L122-L125 HydrophobicContact CD2-CD1 4.06Å; L122-L125 WeakPolarHBondContact O-CB 3.35Å; L122-L125 WeakPolarHBondContact O-CG 3.35Å; L122-L125 PolarHBondContact O-N 3.13Å; A123-L125 PolarHBondContact O-N 2.8Å; L125-W215 HydrophobicContact CD1-CH2 4.04Å; L125-W215 HydrophobicContact CD1-CZ2 3.64Å; L125-R219 VanDerWaalsContact CD2-NE 3.25Å; L125-H288 PolarHBondContact O-CE1 3.42Å; L125-H288 PolarHBondContact O-NE2 2.67Å
126	Q	73.2	Confident	79.2	Confident	14 Å²	14	40.5 Å²	40.5	7%	0.065	20%	0.196	C	C	.	.	S	Bend	trans	-68.9	149.8	-173.6	-59.8	-56.9	-75.6	0	0	111.2	I89 P99 V128 D130 I131 F135	I89-Q126 HydrophobicContact CD1-CG 4.45Å; P99-Q126 HydrophobicContact CB-CG 3.91Å; P99-Q126 HydrophobicContact CG-CB 4.41Å; P99-Q126 HydrophobicContact CG-CG 3.78Å; Q126-V128 PolarHBondContact O-N 2.99Å; Q126-D130 HydrophobicContact CB-CB 4.14Å; Q126-I131 HydrophobicContact CB-CG1 3.98Å; Q126-I131 WeakPolarHBondContact O-CD1 3.35Å; Q126-F135 HydrophobicContact CB-CZ 4.34Å; Q126-F135 HydrophobicContact CG-CE1 3.79Å; Q126-F135 HydrophobicContact CG-CZ 3.96Å
127	P	65.8	Low	79.2	Confident	35 Å²	35	38.3 Å²	38.3	23%	0.227	19%	0.188	C	C	.	.			trans	-50.5	143.2	170.3	-24.9	34	0	0	0	110.8	E129 D130 I131	P127-E129 PolarHBondContact O-N 2.92Å; P127-D130 WeakPolarHBondContact CD-OD2 3.47Å; P127-D130 WeakPolarHBondContact O-CB 3.49Å; P127-D130 PolarHBondContact O-N 3.28Å; P127-I131 PolarHBondContact O-N 2.92Å
128	V	62.4	Low	79.2	Confident	104 Å²	104	37.2 Å²	37.2	63%	0.63	18%	0.182	S	C	*	.	H	α-helix	trans	-53.2	-35.8	-176.9	177.4	0	0	0	0	111.8	Q126 I131 F132	Q126-V128 PolarHBondContact O-N 2.99Å; V128-I131 PolarHBondContact O-N 3.3Å; V128-F132 HydrophobicContact CG1-CD2 4.33Å; V128-F132 HydrophobicContact CG1-CE2 3.77Å; V128-F132 WeakPolarHBondContact O-CD2 3.44Å
129	E	64.1	Low	79.2	Confident	159 Å²	159	37.2 Å²	37.2	74%	0.743	18%	0.182	S	C	*	.	H	α-helix	trans	-60.2	-40.4	174.1	-65.9	159.3	-139.7	0	0	113.7	P127 N133	P127-E129 PolarHBondContact O-N 2.92Å; E129-N133 PolarHBondContact O-ND2 3.34Å
130	D	65.5	Low	79.3	Confident	25 Å²	25	37.3 Å²	37.3	13%	0.134	18%	0.183	C	C	.	.	H	α-helix	trans	-73.5	-35.9	178.5	-82.1	-44.9	0	0	0	112.1	K93 P99 Q126 P127 F132 N133 G134	K93-D130 IonicContact NZ-OD1 3.67Å; K93-D130 PolarHBondContact NZ-OD1 2.89Å; K93-D130 IonicContact NZ-OD2 3.76Å; K93-D130 PolarHBondContact NZ-OD2 3.4Å; P99-D130 HydrophobicContact CG-CB 4.14Å; Q126-D130 HydrophobicContact CB-CB 4.14Å; P127-D130 WeakPolarHBondContact CD-OD2 3.47Å; P127-D130 WeakPolarHBondContact O-CB 3.49Å; P127-D130 PolarHBondContact O-N 3.28Å; D130-F132 VanDerWaalsContact C-N 3.27Å; D130-F132 PolarHBondContact O-N 3.02Å; D130-N133 PolarHBondContact O-N 3.01Å; D130-N133 VanDerWaalsContact O-N 3.08Å; D130-G134 PolarHBondContact O-N 3.4Å
131	I	63.4	Low	79.3	Confident	42 Å²	42	37 Å²	37	22%	0.215	18%	0.181	C	C	.	.	H	α-helix	trans	-58.9	-39.3	-178.4	-63.6	175.6	0	0	0	111.1	A123 Q126 P127 V128 N133 G134 F135	A123-I131 WeakPolarHBondContact O-CD1 3.41Å; Q126-I131 HydrophobicContact CB-CG1 3.98Å; Q126-I131 WeakPolarHBondContact O-CD1 3.35Å; P127-I131 PolarHBondContact O-N 2.92Å; V128-I131 PolarHBondContact O-N 3.3Å; I131-N133 VanDerWaalsContact C-N 3.33Å; I131-N133 PolarHBondContact O-N 3.46Å; I131-G134 PolarHBondContact O-N 2.95Å; I131-F135 HydrophobicContact CG1-CZ 4.37Å; I131-F135 HydrophobicContact CG2-CE2 4.4Å
132	F	66.1	Low	79.2	Confident	165 Å²	165	41 Å²	41	72%	0.724	20%	0.196	S	C	*	.	H	α-helix	trans	-69.1	-26	178.2	-74	-65.6	0	0	0	114	V128 D130 G134	V128-F132 HydrophobicContact CG1-CD2 4.33Å; V128-F132 HydrophobicContact CG1-CE2 3.77Å; V128-F132 WeakPolarHBondContact O-CD2 3.44Å; D130-F132 VanDerWaalsContact C-N 3.27Å; D130-F132 PolarHBondContact O-N 3.02Å; F132-G134 VanDerWaalsContact C-N 3.34Å
133	N	72.6	Confident	78.9	Confident	84 Å²	84	46 Å²	46	45%	0.449	23%	0.227	S	C	.	.	H	α-helix	trans	-72.9	-31.1	177.5	-68.1	-41.3	0	0	0	111.7	L98 E129 D130 I131 R165	L98-N133 HydrophobicContact CD2-CB 3.79Å; E129-N133 PolarHBondContact O-ND2 3.34Å; D130-N133 PolarHBondContact O-N 3.01Å; D130-N133 VanDerWaalsContact O-N 3.08Å; I131-N133 VanDerWaalsContact C-N 3.33Å; I131-N133 PolarHBondContact O-N 3.46Å; N133-R165 VanDerWaalsContact O-CZ 3.3Å; N133-R165 PolarHBondContact O-NE 3.21Å; N133-R165 PolarHBondContact O-NH2 3.32Å
134	G	77.7	Confident	79	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	23%	0.233	C	C	.	.			trans	101.7	176.4	177.4	0	0	0	0	0	113.9	L98 P99 D130 I131 F132 S163	L98-G134 WeakPolarHBondContact CD2-O 3.47Å; P99-G134 WeakPolarHBondContact CD-O 3.45Å; D130-G134 PolarHBondContact O-N 3.4Å; I131-G134 PolarHBondContact O-N 2.95Å; F132-G134 VanDerWaalsContact C-N 3.34Å; G134-S163 CarbonylContact C-O 3.57Å; G134-S163 WeakPolarHBondContact CA-O 3.4Å
135	F	86.3	Confident	79	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155	-167.9	-69.3	-109.6	0	0	0	112.5	I89 P99 A123 Q126 I131 F160 S163 L164 R165	I89-F135 HydrophobicContact CD1-CE1 4.07Å; P99-F135 HydrophobicContact CB-CD1 3.84Å; P99-F135 HydrophobicContact CB-CE1 3.92Å; P99-F135 HydrophobicContact CG-CD1 4.47Å; P99-F135 HydrophobicContact CG-CE1 4.34Å; A123-F135 HydrophobicContact CB-CZ 4.46Å; Q126-F135 HydrophobicContact CB-CZ 4.34Å; Q126-F135 HydrophobicContact CG-CE1 3.79Å; Q126-F135 HydrophobicContact CG-CZ 3.96Å; I131-F135 HydrophobicContact CG1-CZ 4.37Å; I131-F135 HydrophobicContact CG2-CE2 4.4Å; F135-F160 HydrophobicContact CB-CE1 4.04Å; F135-F160 HydrophobicContact CB-CZ 3.85Å; F135-F160 AromaticContact CD1-CZ 3.87Å; F135-F160 HydrophobicContact CD1-CZ 3.87Å; F135-F160 AromaticContact CD2-CE1 3.53Å; F135-F160 HydrophobicContact CD2-CE1 3.53Å; F135-F160 AromaticContact CD2-CZ 3.47Å; F135-F160 HydrophobicContact CD2-CZ 3.47Å; F135-F160 VanDerWaalsContact CD2-CZ 3.47Å; F135-F160 HydrophobicContact CE1-CZ 4.24Å; F135-F160 HydrophobicContact CE2-CE1 4.1Å; F135-F160 AromaticContact CE2-CZ 3.88Å; F135-F160 HydrophobicContact CE2-CZ 3.88Å; F135-F160 AromaticContact CG-CE1 3.88Å; F135-F160 HydrophobicContact CG-CE1 3.88Å; F135-F160 AromaticContact CG-CZ 3.47Å; F135-F160 HydrophobicContact CG-CZ 3.47Å; F135-F160 VanDerWaalsContact CG-CZ 3.47Å; F135-F160 HydrophobicContact CZ-CZ 4.24Å; F135-S163 PolarHBondContact N-O 3.49Å; F135-L164 HydrophobicContact CB-CD1 4.17Å; F135-R165 PolarHBondContact O-N 3.02Å
136	V	88.2	Confident	79.2	Confident	7 Å²	7	51.8 Å²	51.8	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.7	169.5	174	0	0	0	0	108.6	L98 P99 V100 L101 V166 Y168	L98-V136 HydrophobicContact CB-CG2 4Å; L98-V136 HydrophobicContact CD1-CG2 3.99Å; P99-V136 PolarHBondContact O-N 2.88Å; V100-V136 WeakPolarHBondContact CA-O 3.32Å; L101-V136 PolarHBondContact N-O 2.93Å; V136-V166 HydrophobicContact CB-CG1 4.43Å; V136-V166 HydrophobicContact CG1-CG1 3.99Å; V136-V166 HydrophobicContact CG2-CG1 4.05Å; V136-Y168 HydrophobicContact CG1-CD2 4.09Å; V136-Y168 HydrophobicContact CG1-CE2 3.94Å
137	A	89.9	Confident	79.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	138.1	172.7	0	0	0	0	0	111.3	L101 L156 L164 V166 A167 Y168	L101-A137 WeakPolarHBondContact O-CA 3.48Å; A137-L156 HydrophobicContact CB-CD1 4.32Å; A137-L164 HydrophobicContact CB-CD1 3.68Å; A137-L164 HydrophobicContact CB-CD2 4.16Å; A137-L164 HydrophobicContact CB-CG 4.44Å; A137-V166 PolarHBondContact N-O 2.74Å; A137-A167 HydrophobicContact CB-CB 4.17Å; A137-A167 WeakPolarHBondContact O-CA 3.49Å; A137-Y168 PolarHBondContact O-N 3.07Å
138	I	91.4	Very high	80.8	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	121.1	165.4	-53.3	179.8	0	0	0	107.3	V100 L101 F103 L191 V195 L200 L204	V100-I138 HydrophobicContact CG1-CD1 3.79Å; V100-I138 HydrophobicContact CG1-CG1 4.12Å; L101-I138 PolarHBondContact O-N 3.49Å; F103-I138 PolarHBondContact N-O 2.81Å; I138-L191 HydrophobicContact CG2-CD1 4.41Å; I138-L191 HydrophobicContact CG2-CD2 4.04Å; I138-V195 HydrophobicContact CD1-CG2 4.37Å; I138-L200 HydrophobicContact CD1-CD2 3.3Å; I138-L204 HydrophobicContact CD1-CD1 4.32Å; I138-L204 HydrophobicContact CG2-CD1 3.93Å; I138-L204 HydrophobicContact CG2-CD2 4.31Å
139	I	91.9	Very high	81.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	106.8	-176.3	-58.9	168.9	0	0	0	107.6	F103 R141 V152 L153 L156 Y168 V169 L170	F103-I139 HydrophobicContact CB-CG1 4.46Å; F103-I139 HydrophobicContact CD2-CG1 4Å; F103-I139 HydrophobicContact CG-CG1 4.48Å; I139-R141 HydrophobicContact CG2-CG 4.12Å; I139-V152 HydrophobicContact CD1-CG1 3.75Å; I139-V152 HydrophobicContact CG1-CG1 4.02Å; I139-V152 HydrophobicContact CG2-CG1 4.28Å; I139-L153 HydrophobicContact CD1-CD2 3.68Å; I139-L153 HydrophobicContact CD1-CG 4.18Å; I139-L156 HydrophobicContact CD1-CD1 4.17Å; I139-Y168 PolarHBondContact N-O 2.98Å; I139-V169 HydrophobicContact CB-CG2 4.11Å; I139-V169 HydrophobicContact CD1-CG2 4.27Å; I139-V169 CarbonylContact O-C 3.53Å; I139-V169 WeakPolarHBondContact O-CA 3.19Å; I139-L170 PolarHBondContact O-N 3.44Å
140	D	91	Very high	82.9	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.016	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	119.6	177.8	-169.6	15.2	0	0	0	110	F103 D105 R142 L170 L204	F103-D140 PolarHBondContact O-N 3.37Å; D105-D140 VanDerWaalsContact CA-O 3.28Å; D105-D140 WeakPolarHBondContact CA-O 3.3Å; D105-D140 PolarHBondContact N-O 2.95Å; D140-R142 WeakPolarHBondContact OD1-CG 3.46Å; D140-R142 IonicContact OD1-CZ 2.75Å; D140-R142 IonicContact OD1-NE 3.2Å; D140-R142 PolarHBondContact OD1-NE 2.9Å; D140-R142 IonicContact OD1-NH2 3.78Å; D140-R142 IonicContact OD2-CZ 2.77Å; D140-R142 IonicContact OD2-NE 3.95Å; D140-R142 PolarHBondContact OD2-NE 3.33Å; D140-R142 IonicContact OD2-NH2 3.78Å; D140-R142 PolarHBondContact OD2-NH2 3.37Å; D140-L170 HydrophobicContact CB-CD1 4.18Å; D140-L170 WeakPolarHBondContact OD1-CB 3.2Å; D140-L170 WeakPolarHBondContact OD1-CD1 3.29Å; D140-L204 HydrophobicContact CB-CD2 4.08Å
141	R	89.1	Confident	84	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.229	C	C	.	.			trans	-145.3	41.7	-179.3	-71	-61.6	-177.2	-94.7	19.4	110.5	P104 D105 I139 D144 S148 V149 L170 P172	P104-R141 PolarHBondContact O-NH1 3.05Å; D105-R141 WeakPolarHBondContact OD1-CA 3.49Å; I139-R141 HydrophobicContact CG2-CG 4.12Å; R141-D144 HydrophobicContact CB-CB 4.27Å; R141-D144 WeakPolarHBondContact CD-OD2 3.24Å; R141-D144 IonicContact NE-OD2 3.44Å; R141-S148 PolarHBondContact NE-OG 3.5Å; R141-V149 HydrophobicContact CB-CG2 3.63Å; R141-V149 HydrophobicContact CG-CG2 3.8Å; R141-L170 CarbonylContact C-O 3.49Å; R141-L170 PolarHBondContact N-O 2.99Å; R141-L170 VanDerWaalsContact N-O 3.1Å; R141-P172 WeakPolarHBondContact O-CD 3.29Å; R141-P172 VanDerWaalsContact O-CG 3.25Å; R141-P172 WeakPolarHBondContact O-CG 3.38Å
142	R	87.1	Confident	85.2	Confident	90 Å²	90	45 Å²	45	34%	0.34	22%	0.219	S	C	.	.	S	Bend	trans	-63.9	-37.6	-178.8	-73	175.1	-77.1	165.3	-7	112.9	D105 D140 L170 D203	D105-R142 WeakPolarHBondContact OD2-CA 3.31Å; D105-R142 WeakPolarHBondContact OD2-CB 3.46Å; D105-R142 PolarHBondContact OD2-N 3.48Å; D140-R142 WeakPolarHBondContact OD1-CG 3.46Å; D140-R142 IonicContact OD1-CZ 2.75Å; D140-R142 IonicContact OD1-NE 3.2Å; D140-R142 PolarHBondContact OD1-NE 2.9Å; D140-R142 IonicContact OD1-NH2 3.78Å; D140-R142 IonicContact OD2-CZ 2.77Å; D140-R142 IonicContact OD2-NE 3.95Å; D140-R142 PolarHBondContact OD2-NE 3.33Å; D140-R142 IonicContact OD2-NH2 3.78Å; D140-R142 PolarHBondContact OD2-NH2 3.37Å; R142-L170 HydrophobicContact CG-CB 3.89Å; R142-D203 PolarHBondContact NH2-O 3.19Å; R142-D203 VanDerWaalsContact NH2-O 3.07Å
143	T	84.5	Confident	86.2	Confident	105 Å²	105	38.4 Å²	38.4	64%	0.644	19%	0.191	S	C	*	.	S	Bend	trans	-96.2	-7.2	179.1	63.8	0	0	0	0	113.9	D105 H107	D105-T143 PolarHBondContact OD1-OG1 3.4Å; D105-T143 PolarHBondContact OD2-N 3.46Å; D105-T143 PolarHBondContact OD2-OG1 2.99Å; H107-T143 PolarHBondContact CE1-O 3.16Å; H107-T143 PolarHBondContact NE2-OG1 3.38Å
144	D	84.9	Confident	86.8	Confident	29 Å²	29	37.1 Å²	37.1	16%	0.155	19%	0.189	C	C	.	.	S	Bend	trans	-101.9	-171.7	-173.6	-160.8	9.3	0	0	0	113.3	H107 R141 S148 P172	H107-D144 IonicContact CE1-OD1 3.81Å; H107-D144 IonicContact ND1-OD1 3.22Å; H107-D144 PolarHBondContact ND1-OD1 2.99Å; H107-D144 IonicContact ND1-OD2 3.97Å; R141-D144 HydrophobicContact CB-CB 4.27Å; R141-D144 WeakPolarHBondContact CD-OD2 3.24Å; R141-D144 IonicContact NE-OD2 3.44Å; D144-S148 WeakPolarHBondContact OD2-CB 3.43Å; D144-S148 PolarHBondContact OD2-OG 2.75Å; D144-P172 VanDerWaalsContact O-CB 3.23Å; D144-P172 WeakPolarHBondContact O-CB 3.49Å; D144-P172 WeakPolarHBondContact O-CG 3.44Å
145	R	83.8	Confident	87.4	Confident	188 Å²	188	39.7 Å²	39.7	71%	0.709	20%	0.199	S	C	*	.			trans	-96.4	149.9	-176.7	-59.5	-179.5	-175.4	-179.4	2	112.1	S147 S148	R145-S147 WeakPolarHBondContact CB-OG 3.37Å; R145-S147 PolarHBondContact O-N 3.31Å; R145-S148 WeakPolarHBondContact O-CA 3.45Å; R145-S148 WeakPolarHBondContact O-CB 3.36Å; R145-S148 PolarHBondContact O-N 3.1Å
146	W	85.1	Confident	87.4	Confident	38 Å²	38	40.1 Å²	40.1	14%	0.144	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-20.7	173.8	-169.8	-129.1	0	0	0	113.7	S148 V149 K150 V169 V175 V184	W146-S148 VanDerWaalsContact C-N 3.35Å; W146-V149 HydrophobicContact CE3-CB 3.9Å; W146-V149 HydrophobicContact CE3-CG1 4.1Å; W146-V149 HydrophobicContact CE3-CG2 3.87Å; W146-V149 HydrophobicContact CH2-CG1 4.24Å; W146-V149 HydrophobicContact CZ3-CB 4.07Å; W146-V149 HydrophobicContact CZ3-CG1 3.75Å; W146-V149 HydrophobicContact CZ3-CG2 4.09Å; W146-K150 VanDerWaalsContact NE1-CE 3.32Å; W146-K150 WeakPolarHBondContact O-CG 3.46Å; W146-K150 PolarHBondContact O-N 3.45Å; W146-V169 HydrophobicContact CZ3-CG1 4.19Å; W146-V175 HydrophobicContact CB-CG2 4.47Å; W146-V175 HydrophobicContact CG-CG1 4.26Å; W146-V184 HydrophobicContact CH2-CG2 4.12Å
147	S	84.3	Confident	87.2	Confident	72 Å²	72	45.8 Å²	45.8	50%	0.503	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-36.6	168.7	50.4	0	0	0	0	113	R145 K150 T151	R145-S147 WeakPolarHBondContact CB-OG 3.37Å; R145-S147 PolarHBondContact O-N 3.31Å; S147-K150 PolarHBondContact O-N 2.92Å; S147-T151 PolarHBondContact O-N 2.8Å; S147-T151 PolarHBondContact O-OG1 3.26Å; S147-T151 VanDerWaalsContact O-OG1 3.11Å
148	S	86.6	Confident	87	Confident	20 Å²	20	50.9 Å²	50.9	14%	0.14	26%	0.262	C	S	.	.	H	α-helix	trans	-64.8	-46	178.4	-166.7	0	0	0	0	111.3	R141 D144 R145 W146 K150 T151 V152	R141-S148 PolarHBondContact NE-OG 3.5Å; D144-S148 WeakPolarHBondContact OD2-CB 3.43Å; D144-S148 PolarHBondContact OD2-OG 2.75Å; R145-S148 WeakPolarHBondContact O-CA 3.45Å; R145-S148 WeakPolarHBondContact O-CB 3.36Å; R145-S148 PolarHBondContact O-N 3.1Å; W146-S148 VanDerWaalsContact C-N 3.35Å; S148-K150 VanDerWaalsContact C-N 3.32Å; S148-K150 PolarHBondContact O-N 2.73Å; S148-T151 WeakPolarHBondContact O-CB 3.25Å; S148-T151 PolarHBondContact O-N 2.68Å; S148-T151 VanDerWaalsContact O-N 3.12Å; S148-V152 WeakPolarHBondContact O-CG2 3.36Å; S148-V152 PolarHBondContact O-N 3.31Å
149	V	87.1	Confident	86.6	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-55.8	-45.9	172.2	179.5	0	0	0	0	111.1	R141 W146 T151 V152 L153 V169	R141-V149 HydrophobicContact CB-CG2 3.63Å; R141-V149 HydrophobicContact CG-CG2 3.8Å; W146-V149 HydrophobicContact CE3-CB 3.9Å; W146-V149 HydrophobicContact CE3-CG1 4.1Å; W146-V149 HydrophobicContact CE3-CG2 3.87Å; W146-V149 HydrophobicContact CH2-CG1 4.24Å; W146-V149 HydrophobicContact CZ3-CB 4.07Å; W146-V149 HydrophobicContact CZ3-CG1 3.75Å; W146-V149 HydrophobicContact CZ3-CG2 4.09Å; V149-T151 PolarHBondContact O-N 3.47Å; V149-V152 PolarHBondContact O-N 2.93Å; V149-L153 HydrophobicContact CG1-CD1 3.86Å; V149-L153 HydrophobicContact CG1-CG 4.43Å; V149-L153 WeakPolarHBondContact O-CB 3.45Å; V149-L153 WeakPolarHBondContact O-CG 3.22Å; V149-L153 PolarHBondContact O-N 3.08Å; V149-V169 HydrophobicContact CG1-CG1 3.88Å; V149-V169 HydrophobicContact CG1-CG2 4.04Å; V149-V169 HydrophobicContact CG2-CG1 4.16Å
150	K	85.3	Confident	86.1	Confident	88 Å²	88	53.3 Å²	53.3	38%	0.383	27%	0.273	S	S	.	.	H	α-helix	trans	-63.3	-38.2	177.1	-71.9	179.9	-177.2	178.2	0	112.5	W146 S147 S148 S154	W146-K150 VanDerWaalsContact NE1-CE 3.32Å; W146-K150 WeakPolarHBondContact O-CG 3.46Å; W146-K150 PolarHBondContact O-N 3.45Å; S147-K150 PolarHBondContact O-N 2.92Å; S148-K150 VanDerWaalsContact C-N 3.32Å; S148-K150 PolarHBondContact O-N 2.73Å; K150-S154 WeakPolarHBondContact O-CB 3.17Å; K150-S154 PolarHBondContact O-N 2.9Å
151	T	87.4	Confident	85.4	Confident	57 Å²	57	56.8 Å²	56.8	35%	0.35	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-49.2	174.5	-59.7	0	0	0	0	111.6	S147 S148 V149 L153 S154 Y155	S147-T151 PolarHBondContact O-N 2.8Å; S147-T151 PolarHBondContact O-OG1 3.26Å; S147-T151 VanDerWaalsContact O-OG1 3.11Å; S148-T151 WeakPolarHBondContact O-CB 3.25Å; S148-T151 PolarHBondContact O-N 2.68Å; S148-T151 VanDerWaalsContact O-N 3.12Å; V149-T151 PolarHBondContact O-N 3.47Å; T151-L153 PolarHBondContact O-N 2.84Å; T151-S154 PolarHBondContact O-N 3.07Å; T151-Y155 HydrophobicContact CG2-CD2 3.74Å; T151-Y155 HydrophobicContact CG2-CE1 4.34Å; T151-Y155 HydrophobicContact CG2-CE2 3.47Å; T151-Y155 VanDerWaalsContact CG2-CE2 3.47Å; T151-Y155 HydrophobicContact CG2-CG 4.31Å; T151-Y155 WeakPolarHBondContact O-CB 3.35Å; T151-Y155 PolarHBondContact O-N 3.03Å
152	V	87.9	Confident	84.5	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.4	-46.6	178.8	175.8	0	0	0	0	111.1	Y86 F103 Y115 I139 S148 V149 Y155 L156	Y86-V152 WeakPolarHBondContact OH-CG2 3.12Å; F103-V152 HydrophobicContact CD1-CG1 3.83Å; F103-V152 HydrophobicContact CD2-CG1 4.14Å; F103-V152 HydrophobicContact CE1-CG1 3.91Å; F103-V152 HydrophobicContact CE2-CG1 4.22Å; F103-V152 HydrophobicContact CG-CG1 3.96Å; F103-V152 HydrophobicContact CZ-CG1 4.11Å; Y115-V152 PolarHBondContact OH-O 3.47Å; I139-V152 HydrophobicContact CD1-CG1 3.75Å; I139-V152 HydrophobicContact CG1-CG1 4.02Å; I139-V152 HydrophobicContact CG2-CG1 4.28Å; S148-V152 WeakPolarHBondContact O-CG2 3.36Å; S148-V152 PolarHBondContact O-N 3.31Å; V149-V152 PolarHBondContact O-N 2.93Å; V152-Y155 PolarHBondContact O-N 2.89Å; V152-L156 HydrophobicContact CG1-CD1 4.26Å; V152-L156 WeakPolarHBondContact O-CB 3.14Å; V152-L156 WeakPolarHBondContact O-CG 3.45Å; V152-L156 PolarHBondContact O-N 3.06Å
153	L	87.4	Confident	83.9	Confident	26 Å²	26	57 Å²	57	14%	0.136	31%	0.314	C	S	.	.	H	α-helix	trans	-64.8	-42.1	178	-69.6	170.6	0	0	0	112.5	I139 V149 T151 T157 A167 V182	I139-L153 HydrophobicContact CD1-CD2 3.68Å; I139-L153 HydrophobicContact CD1-CG 4.18Å; V149-L153 HydrophobicContact CG1-CD1 3.86Å; V149-L153 HydrophobicContact CG1-CG 4.43Å; V149-L153 WeakPolarHBondContact O-CB 3.45Å; V149-L153 WeakPolarHBondContact O-CG 3.22Å; V149-L153 PolarHBondContact O-N 3.08Å; T151-L153 PolarHBondContact O-N 2.84Å; L153-T157 WeakPolarHBondContact O-CB 3.26Å; L153-T157 PolarHBondContact O-N 3.28Å; L153-T157 PolarHBondContact O-OG1 3.49Å; L153-A167 HydrophobicContact CD2-CB 4.31Å; L153-V182 HydrophobicContact CD1-CG2 4.04Å; L153-V182 HydrophobicContact CD2-CG2 4.32Å
154	S	86.5	Confident	83.8	Confident	57 Å²	57	54.8 Å²	54.8	40%	0.399	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-46.5	176.9	-177.7	0	0	0	0	111.4	K150 T151 T157 L158	K150-S154 WeakPolarHBondContact O-CB 3.17Å; K150-S154 PolarHBondContact O-N 2.9Å; T151-S154 PolarHBondContact O-N 3.07Å; S154-T157 WeakPolarHBondContact O-CB 3.32Å; S154-T157 PolarHBondContact O-N 2.85Å; S154-L158 WeakPolarHBondContact O-CG 3.05Å; S154-L158 PolarHBondContact O-N 3.19Å
155	Y	88.7	Confident	83.6	Confident	54 Å²	54	60.7 Å²	60.7	21%	0.212	32%	0.318	C	S	.	.	H	α-helix	trans	-73.6	-33.9	-179.1	-66.9	-8.2	0	0	0	112.8	F112 Y115 T151 V152 T157 L158 F159	F112-Y155 HydrophobicContact CD2-CD1 4.47Å; F112-Y155 AromaticContact CD2-CE1 3.9Å; F112-Y155 HydrophobicContact CD2-CE1 3.9Å; F112-Y155 HydrophobicContact CE2-CE1 4.29Å; Y115-Y155 HydrophobicContact CD1-CD2 4.12Å; Y115-Y155 HydrophobicContact CD1-CG 4.26Å; Y115-Y155 AromaticContact CD2-CD2 3.62Å; Y115-Y155 HydrophobicContact CD2-CD2 3.62Å; Y115-Y155 HydrophobicContact CD2-CG 4.39Å; Y115-Y155 HydrophobicContact CE1-CG 4.42Å; Y115-Y155 HydrophobicContact CE2-CD2 4.03Å; Y115-Y155 HydrophobicContact CE2-CG 4.49Å; Y115-Y155 AromaticContact CG-CD2 3.65Å; Y115-Y155 HydrophobicContact CG-CD2 3.65Å; Y115-Y155 HydrophobicContact CG-CG 4.26Å; Y115-Y155 VanDerWaalsContact CZ-CB 3.47Å; T151-Y155 HydrophobicContact CG2-CD2 3.74Å; T151-Y155 HydrophobicContact CG2-CE1 4.34Å; T151-Y155 HydrophobicContact CG2-CE2 3.47Å; T151-Y155 VanDerWaalsContact CG2-CE2 3.47Å; T151-Y155 HydrophobicContact CG2-CG 4.31Å; T151-Y155 WeakPolarHBondContact O-CB 3.35Å; T151-Y155 PolarHBondContact O-N 3.03Å; V152-Y155 PolarHBondContact O-N 2.89Å; Y155-T157 VanDerWaalsContact C-N 3.3Å; Y155-T157 PolarHBondContact O-N 2.95Å; Y155-L158 HydrophobicContact CD1-CD1 4.36Å; Y155-L158 PolarHBondContact O-N 2.94Å; Y155-F159 HydrophobicContact CD1-CE2 4.43Å; Y155-F159 HydrophobicContact CG-CE2 4.28Å; Y155-F159 WeakPolarHBondContact O-CB 3.39Å; Y155-F159 WeakPolarHBondContact O-CD2 3.44Å; Y155-F159 PolarHBondContact O-N 3.26Å
156	L	86.7	Confident	83.7	Confident	9 Å²	9	53.2 Å²	53.2	5%	0.047	29%	0.293	C	S	.	.	H	α-helix	trans	-56.9	-45.1	166.1	-80.3	175.7	0	0	0	111.1	L101 F103 Y115 A137 I139 V152 L158 F160 L164	L101-L156 HydrophobicContact CD2-CD2 4.34Å; F103-L156 HydrophobicContact CE2-CD1 4.02Å; F103-L156 HydrophobicContact CE2-CD2 4.03Å; F103-L156 HydrophobicContact CE2-CG 4.33Å; F103-L156 HydrophobicContact CZ-CD1 4.33Å; F103-L156 HydrophobicContact CZ-CD2 3.79Å; F103-L156 HydrophobicContact CZ-CG 4.15Å; Y115-L156 WeakPolarHBondContact OH-CG 3.32Å; Y115-L156 PolarHBondContact OH-N 3.2Å; A137-L156 HydrophobicContact CB-CD1 4.32Å; I139-L156 HydrophobicContact CD1-CD1 4.17Å; V152-L156 HydrophobicContact CG1-CD1 4.26Å; V152-L156 WeakPolarHBondContact O-CB 3.14Å; V152-L156 WeakPolarHBondContact O-CG 3.45Å; V152-L156 PolarHBondContact O-N 3.06Å; L156-L158 PolarHBondContact O-N 2.74Å; L156-F160 HydrophobicContact CD2-CB 4.26Å; L156-F160 HydrophobicContact CD2-CD2 3.77Å; L156-F160 HydrophobicContact CD2-CG 4.23Å; L156-F160 WeakPolarHBondContact O-CB 3.44Å; L156-F160 PolarHBondContact O-N 3.11Å; L156-L164 HydrophobicContact CD1-CD2 3.98Å
157	T	84.6	Confident	83.8	Confident	125 Å²	125	52 Å²	52	77%	0.767	29%	0.291	S	S	*	.	H	α-helix	trans	-65.9	-26.7	179.6	-53.3	0	0	0	0	112.9	L153 S154 Y155	L153-T157 WeakPolarHBondContact O-CB 3.26Å; L153-T157 PolarHBondContact O-N 3.28Å; L153-T157 PolarHBondContact O-OG1 3.49Å; S154-T157 WeakPolarHBondContact O-CB 3.32Å; S154-T157 PolarHBondContact O-N 2.85Å; Y155-T157 VanDerWaalsContact C-N 3.3Å; Y155-T157 PolarHBondContact O-N 2.95Å
158	L	85.8	Confident	84	Confident	107 Å²	107	50 Å²	50	56%	0.56	27%	0.273	S	S	*	.	H	α-helix	trans	-91.5	-30.2	-178.2	-74.5	166.2	0	0	0	114.3	F112 S154 Y155 L156	F112-L158 HydrophobicContact CE2-CD1 4.21Å; S154-L158 WeakPolarHBondContact O-CG 3.05Å; S154-L158 PolarHBondContact O-N 3.19Å; Y155-L158 HydrophobicContact CD1-CD1 4.36Å; Y155-L158 PolarHBondContact O-N 2.94Å; L156-L158 PolarHBondContact O-N 2.74Å
159	F	83.2	Confident	84.1	Confident	26 Å²	26	49.1 Å²	49.1	11%	0.114	27%	0.267	C	S	.	.	H	α-helix	trans	-124	-16.1	-167.9	-59.7	-56.8	0	0	0	115.7	F112 Y115 R116 N120 Y155 P161	F112-F159 HydrophobicContact CD1-CE1 4.46Å; F112-F159 AromaticContact CD1-CZ 3.77Å; F112-F159 HydrophobicContact CD1-CZ 3.77Å; F112-F159 AromaticContact CD2-CE2 3.93Å; F112-F159 HydrophobicContact CD2-CE2 3.93Å; F112-F159 AromaticContact CD2-CZ 3.58Å; F112-F159 HydrophobicContact CD2-CZ 3.58Å; F112-F159 AromaticContact CE1-CE1 3.9Å; F112-F159 HydrophobicContact CE1-CE1 3.9Å; F112-F159 AromaticContact CE1-CZ 3.53Å; F112-F159 HydrophobicContact CE1-CZ 3.53Å; F112-F159 HydrophobicContact CE2-CE1 4.19Å; F112-F159 AromaticContact CE2-CE2 3.84Å; F112-F159 HydrophobicContact CE2-CE2 3.84Å; F112-F159 AromaticContact CE2-CZ 3.33Å; F112-F159 HydrophobicContact CE2-CZ 3.33Å; F112-F159 HydrophobicContact CG-CE2 4.42Å; F112-F159 AromaticContact CG-CZ 3.8Å; F112-F159 HydrophobicContact CG-CZ 3.8Å; F112-F159 AromaticContact CZ-CE1 3.75Å; F112-F159 HydrophobicContact CZ-CE1 3.75Å; F112-F159 HydrophobicContact CZ-CE2 4.25Å; F112-F159 AromaticContact CZ-CZ 3.31Å; F112-F159 HydrophobicContact CZ-CZ 3.31Å; F112-F159 VanDerWaalsContact O-CZ 3.24Å; F112-F159 WeakPolarHBondContact O-CZ 3.02Å; Y115-F159 AromaticContact CD1-CD2 3.61Å; Y115-F159 HydrophobicContact CD1-CD2 3.61Å; Y115-F159 HydrophobicContact CD1-CE2 4.11Å; Y115-F159 HydrophobicContact CE1-CD2 4.09Å; R116-F159 HydrophobicContact CB-CD1 3.76Å; R116-F159 HydrophobicContact CB-CD2 4.21Å; R116-F159 HydrophobicContact CB-CE1 3.71Å; R116-F159 HydrophobicContact CB-CE2 4.16Å; R116-F159 HydrophobicContact CB-CG 3.98Å; R116-F159 HydrophobicContact CB-CZ 3.87Å; R116-F159 HydrophobicContact CG-CD1 3.6Å; R116-F159 HydrophobicContact CG-CE1 3.82Å; R116-F159 HydrophobicContact CG-CG 4.11Å; R116-F159 HydrophobicContact CG-CZ 4.49Å; N120-F159 PolarHBondContact OD1-O 3.43Å; Y155-F159 HydrophobicContact CD1-CE2 4.43Å; Y155-F159 HydrophobicContact CG-CE2 4.28Å; Y155-F159 WeakPolarHBondContact O-CB 3.39Å; Y155-F159 WeakPolarHBondContact O-CD2 3.44Å; Y155-F159 PolarHBondContact O-N 3.26Å; F159-P161 WeakPolarHBondContact O-CD 3.26Å
160	F	81.4	Confident	84.2	Confident	25 Å²	25	49.2 Å²	49.2	11%	0.11	27%	0.267	C	S	.	.			trans	-71.9	117.9	-172.6	-162.1	-96	0	0	0	110.7	L101 V119 A123 F135 L156 G162 L164	L101-F160 HydrophobicContact CD2-CD2 4.34Å; L101-F160 HydrophobicContact CD2-CE2 3.74Å; V119-F160 HydrophobicContact CG1-CB 4.42Å; V119-F160 HydrophobicContact CG1-CD2 3.53Å; V119-F160 HydrophobicContact CG1-CE2 4.2Å; V119-F160 HydrophobicContact CG1-CG 4.42Å; A123-F160 HydrophobicContact CB-CE2 4.22Å; A123-F160 HydrophobicContact CB-CZ 4.28Å; F135-F160 HydrophobicContact CB-CE1 4.04Å; F135-F160 HydrophobicContact CB-CZ 3.85Å; F135-F160 AromaticContact CD1-CZ 3.87Å; F135-F160 HydrophobicContact CD1-CZ 3.87Å; F135-F160 AromaticContact CD2-CE1 3.53Å; F135-F160 HydrophobicContact CD2-CE1 3.53Å; F135-F160 AromaticContact CD2-CZ 3.47Å; F135-F160 HydrophobicContact CD2-CZ 3.47Å; F135-F160 VanDerWaalsContact CD2-CZ 3.47Å; F135-F160 HydrophobicContact CE1-CZ 4.24Å; F135-F160 HydrophobicContact CE2-CE1 4.1Å; F135-F160 AromaticContact CE2-CZ 3.88Å; F135-F160 HydrophobicContact CE2-CZ 3.88Å; F135-F160 AromaticContact CG-CE1 3.88Å; F135-F160 HydrophobicContact CG-CE1 3.88Å; F135-F160 AromaticContact CG-CZ 3.47Å; F135-F160 HydrophobicContact CG-CZ 3.47Å; F135-F160 VanDerWaalsContact CG-CZ 3.47Å; F135-F160 HydrophobicContact CZ-CZ 4.24Å; L156-F160 HydrophobicContact CD2-CB 4.26Å; L156-F160 HydrophobicContact CD2-CD2 3.77Å; L156-F160 HydrophobicContact CD2-CG 4.23Å; L156-F160 WeakPolarHBondContact O-CB 3.44Å; L156-F160 PolarHBondContact O-N 3.11Å; F160-G162 VanDerWaalsContact C-N 3.3Å; F160-G162 WeakPolarHBondContact CD1-O 3.49Å; F160-G162 PolarHBondContact O-N 3.04Å; F160-L164 HydrophobicContact CD1-CB 4.46Å
161	P	75.9	Confident	83.9	Confident	77 Å²	77	47.1 Å²	47.1	50%	0.5	26%	0.258	S	S	.	.			trans	-82.6	-4.9	-167.6	34.5	-38.4	0	0	0	114.1	N120 A123 F159	N120-P161 VanDerWaalsContact OD1-CD 3.3Å; N120-P161 WeakPolarHBondContact OD1-CD 3.28Å; N120-P161 WeakPolarHBondContact OD1-CG 3.27Å; A123-P161 HydrophobicContact CB-CG 3.44Å; A123-P161 VanDerWaalsContact CB-CG 3.44Å; F159-P161 WeakPolarHBondContact O-CD 3.26Å
162	G	71.2	Confident	83.5	Confident	22 Å²	22	44.8 Å²	44.8	23%	0.227	24%	0.244	C	C	.	.	S	Bend	trans	-115.6	-177.2	177.9	0	0	0	0	0	112.7	F160 L164	F160-G162 VanDerWaalsContact C-N 3.3Å; F160-G162 WeakPolarHBondContact CD1-O 3.49Å; F160-G162 PolarHBondContact O-N 3.04Å; G162-L164 PolarHBondContact O-N 3.33Å
163	S	74.5	Confident	82.5	Confident	71 Å²	71	51.8 Å²	51.8	50%	0.497	28%	0.281	S	S	.	.			trans	-81.7	112.4	171.5	-59.7	0	0	0	0	110.9	G134 F135 R165	G134-S163 CarbonylContact C-O 3.57Å; G134-S163 WeakPolarHBondContact CA-O 3.4Å; F135-S163 PolarHBondContact N-O 3.49Å; S163-R165 PolarHBondContact O-N 2.87Å
164	L	80.6	Confident	81.2	Confident	59 Å²	59	54.5 Å²	54.5	31%	0.309	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	117	166	-168.8	71.6	0	0	0	108.9	F135 A137 L156 F160 G162 A167	F135-L164 HydrophobicContact CB-CD1 4.17Å; A137-L164 HydrophobicContact CB-CD1 3.68Å; A137-L164 HydrophobicContact CB-CD2 4.16Å; A137-L164 HydrophobicContact CB-CG 4.44Å; L156-L164 HydrophobicContact CD1-CD2 3.98Å; F160-L164 HydrophobicContact CD1-CB 4.46Å; G162-L164 PolarHBondContact O-N 3.33Å; L164-A167 HydrophobicContact CD2-CB 4.3Å
165	R	82.1	Confident	79.7	Confident	154 Å²	154	54.3 Å²	54.3	58%	0.581	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	-37.8	-173.4	-69.7	-69.2	-168.8	169.6	2.1	112.9	L98 N133 F135 S163	L98-R165 HydrophobicContact CD1-CB 4.01Å; L98-R165 HydrophobicContact CD1-CG 3.82Å; N133-R165 VanDerWaalsContact O-CZ 3.3Å; N133-R165 PolarHBondContact O-NE 3.21Å; N133-R165 PolarHBondContact O-NH2 3.32Å; F135-R165 PolarHBondContact O-N 3.02Å; S163-R165 PolarHBondContact O-N 2.87Å
166	V	85.8	Confident	77.7	Confident	30 Å²	30	60.1 Å²	60.1	18%	0.182	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	149.1	177.7	65	0	0	0	0	109.5	V136 A137 Y168 F183	V136-V166 HydrophobicContact CB-CG1 4.43Å; V136-V166 HydrophobicContact CG1-CG1 3.99Å; V136-V166 HydrophobicContact CG2-CG1 4.05Å; A137-V166 PolarHBondContact N-O 2.74Å; V166-Y168 HydrophobicContact CB-CE2 4.43Å; V166-Y168 HydrophobicContact CG1-CD2 4.31Å; V166-Y168 HydrophobicContact CG1-CE2 3.51Å; V166-Y168 HydrophobicContact CG2-CE1 4.02Å; V166-Y168 HydrophobicContact CG2-CE2 4.03Å; V166-F183 HydrophobicContact CG2-CD2 3.59Å; V166-F183 HydrophobicContact CG2-CE2 3.96Å
167	A	87	Confident	76	Confident	12 Å²	12	65 Å²	65	10%	0.099	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	124.4	169.9	0	0	0	0	0	109.6	A137 L153 L164 V182 F183	A137-A167 HydrophobicContact CB-CB 4.17Å; A137-A167 WeakPolarHBondContact O-CA 3.49Å; L153-A167 HydrophobicContact CD2-CB 4.31Å; L164-A167 HydrophobicContact CD2-CB 4.3Å; A167-V182 HydrophobicContact CB-CG1 4.26Å; A167-V182 WeakPolarHBondContact O-CG1 3.16Å; A167-F183 PolarHBondContact O-N 3.36Å
168	Y	89.2	Confident	74	Confident	31 Å²	31	71.4 Å²	71.4	12%	0.122	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	127.1	171.1	-59.7	-73.9	0	0	0	109.2	V136 A137 I139 V166 F183 L191 Y194 V195	V136-Y168 HydrophobicContact CG1-CD2 4.09Å; V136-Y168 HydrophobicContact CG1-CE2 3.94Å; A137-Y168 PolarHBondContact O-N 3.07Å; I139-Y168 PolarHBondContact N-O 2.98Å; V166-Y168 HydrophobicContact CB-CE2 4.43Å; V166-Y168 HydrophobicContact CG1-CD2 4.31Å; V166-Y168 HydrophobicContact CG1-CE2 3.51Å; V166-Y168 HydrophobicContact CG2-CE1 4.02Å; V166-Y168 HydrophobicContact CG2-CE2 4.03Å; Y168-F183 HydrophobicContact CD1-CB 3.61Å; Y168-F183 HydrophobicContact CD1-CG 4.35Å; Y168-F183 HydrophobicContact CE1-CB 3.91Å; Y168-F183 HydrophobicContact CE1-CD2 4.46Å; Y168-F183 HydrophobicContact CE1-CG 4.16Å; Y168-L191 HydrophobicContact CD2-CD1 4.46Å; Y168-L191 HydrophobicContact CG-CD1 4.04Å; Y168-Y194 HydrophobicContact CD1-CD2 4.09Å; Y168-Y194 HydrophobicContact CD1-CG 4.15Å; Y168-Y194 VanDerWaalsContact CE1-CB 3.41Å; Y168-Y194 HydrophobicContact CE1-CD1 4.08Å; Y168-Y194 AromaticContact CE1-CD2 3.94Å; Y168-Y194 HydrophobicContact CE1-CD2 3.94Å; Y168-Y194 AromaticContact CE1-CG 3.56Å; Y168-Y194 HydrophobicContact CE1-CG 3.56Å; Y168-V195 HydrophobicContact CD2-CG2 4Å; Y168-V195 HydrophobicContact CE2-CG2 3.85Å
169	V	88.6	Confident	71.6	Confident	1 Å²	1	69.7 Å²	69.7	1%	0.006	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.2	-179.4	171.5	0	0	0	0	109.7	I139 W146 V149 V182 F183 V184 C185	I139-V169 HydrophobicContact CB-CG2 4.11Å; I139-V169 HydrophobicContact CD1-CG2 4.27Å; I139-V169 CarbonylContact O-C 3.53Å; I139-V169 WeakPolarHBondContact O-CA 3.19Å; W146-V169 HydrophobicContact CZ3-CG1 4.19Å; V149-V169 HydrophobicContact CG1-CG1 3.88Å; V149-V169 HydrophobicContact CG1-CG2 4.04Å; V149-V169 HydrophobicContact CG2-CG1 4.16Å; V169-V182 HydrophobicContact CB-CG1 4.26Å; V169-V182 HydrophobicContact CG2-CG1 3.47Å; V169-V182 VanDerWaalsContact CG2-CG1 3.47Å; V169-F183 PolarHBondContact N-O 3.05Å; V169-V184 CarbonylContact O-C 3.59Å; V169-V184 WeakPolarHBondContact O-CA 3.41Å; V169-C185 PolarHBondContact O-N 2.9Å
170	L	88.3	Confident	69.5	Low	2 Å²	2	74 Å²	74	1%	0.01	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	109.2	162.1	-66.4	161.3	0	0	0	107.4	I139 D140 R141 R142 C185 L188 L191 L204	I139-L170 PolarHBondContact O-N 3.44Å; D140-L170 HydrophobicContact CB-CD1 4.18Å; D140-L170 WeakPolarHBondContact OD1-CB 3.2Å; D140-L170 WeakPolarHBondContact OD1-CD1 3.29Å; R141-L170 CarbonylContact C-O 3.49Å; R141-L170 PolarHBondContact N-O 2.99Å; R141-L170 VanDerWaalsContact N-O 3.1Å; R142-L170 HydrophobicContact CG-CB 3.89Å; L170-C185 HydrophobicContact CD2-CB 3.92Å; L170-L188 HydrophobicContact CD1-CD2 3.59Å; L170-L188 HydrophobicContact CD2-CD2 4.14Å; L170-L191 HydrophobicContact CD1-CD2 3.97Å; L170-L191 HydrophobicContact CD2-CB 4.22Å; L170-L191 HydrophobicContact CG-CD2 4.37Å; L170-L204 HydrophobicContact CD1-CD2 3.7Å
171	K	79.5	Confident	68	Low	45 Å²	45	82.4 Å²	82.4	20%	0.196	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-75	159.4	-171.7	65.3	175.2	-160.9	-170.1	0	113.2	V184 C185 N186	K171-V184 HydrophobicContact CB-CG1 3.73Å; K171-V184 HydrophobicContact CD-CG1 3.91Å; K171-V184 HydrophobicContact CG-CG1 4.08Å; K171-C185 PolarHBondContact N-O 2.75Å; K171-N186 WeakPolarHBondContact CE-OD1 3.29Å; K171-N186 PolarHBondContact NZ-OD1 3.31Å
172	P	78.5	Confident	67.2	Low	8 Å²	8	80.5 Å²	80.5	5%	0.052	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-62.1	151.9	157.1	-14.4	26.1	0	0	0	112.2	R141 D144	R141-P172 WeakPolarHBondContact O-CD 3.29Å; R141-P172 VanDerWaalsContact O-CG 3.25Å; R141-P172 WeakPolarHBondContact O-CG 3.38Å; D144-P172 VanDerWaalsContact O-CB 3.23Å; D144-P172 WeakPolarHBondContact O-CB 3.49Å; D144-P172 WeakPolarHBondContact O-CG 3.44Å
173	D	67.8	Low	67.1	Low	146 Å²	146	84.6 Å²	84.6	78%	0.781	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	157.3	169.2	-89.6	-43.1	0	0	0	113.2	V175	D173-V175 PolarHBondContact O-N 3.18Å
174	G	60.3	Low	67.2	Low	84 Å²	84	83.7 Å²	83.7	87%	0.866	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	-5.2	172	0	0	0	0	0	117.4
175	V	53.7	Low	67.1	Low	53 Å²	53	80.9 Å²	80.9	32%	0.321	42%	0.419	S	S	.	.			trans	-101.7	119.1	-177	-175.3	0	0	0	0	113.1	W146 D173 Q177	W146-V175 HydrophobicContact CB-CG2 4.47Å; W146-V175 HydrophobicContact CG-CG1 4.26Å; D173-V175 PolarHBondContact O-N 3.18Å; V175-Q177 HydrophobicContact CG1-CB 4.18Å
176	L	47.5	Very low	66.9	Low	175 Å²	175	77.6 Å²	77.6	92%	0.916	41%	0.413	S	S	*	.			trans	-109.3	96.6	165	-81	169.8	0	0	0	109.9
177	Q	51.3	Low	66.7	Low	113 Å²	113	80 Å²	80	53%	0.528	42%	0.424	S	S	.	.			trans	-135.9	98	173.9	-154.1	170.5	62	0	0	110.8	V175 A179	V175-Q177 HydrophobicContact CG1-CB 4.18Å; Q177-A179 PolarHBondContact O-N 3.46Å
178	R	41	Very low	66.7	Low	258 Å²	258	81.5 Å²	81.5	97%	0.974	43%	0.43	S	S	*	.			trans	-77.6	78.7	177.8	-74.6	-177.4	174.3	168.6	-2.2	111.5
179	A	35.7	Very low	66.5	Low	71 Å²	71	85.9 Å²	85.9	59%	0.587	46%	0.455	S	S	*	.			trans	-164.4	102.8	164	0	0	0	0	0	111.2	Q177	Q177-A179 PolarHBondContact O-N 3.46Å
180	L	39.3	Very low	66.4	Low	116 Å²	116	87.8 Å²	87.8	61%	0.607	46%	0.464	S	S	*	.			trans	163	146.5	154	-92.6	161.1	0	0	0	109.2	V182	L180-V182 VanDerWaalsContact C-N 3.26Å; L180-V182 HydrophobicContact CB-CG2 4.31Å; L180-V182 PolarHBondContact O-N 3.15Å
181	E	49.3	Very low	66.3	Low	203 Å²	203	87.7 Å²	87.7	95%	0.949	46%	0.464	S	S	*	.	S	Bend	trans	-82.5	65.2	180	-63.8	-175.5	137.6	0	0	111.6
182	V	60.3	Low	66.8	Low	36 Å²	36	88 Å²	88	22%	0.218	47%	0.466	C	S	.	.	S	Bend	trans	-135.3	139.5	-176.3	-176.8	0	0	0	0	109.7	L153 A167 V169 L180 V184	L153-V182 HydrophobicContact CD1-CG2 4.04Å; L153-V182 HydrophobicContact CD2-CG2 4.32Å; A167-V182 HydrophobicContact CB-CG1 4.26Å; A167-V182 WeakPolarHBondContact O-CG1 3.16Å; V169-V182 HydrophobicContact CB-CG1 4.26Å; V169-V182 HydrophobicContact CG2-CG1 3.47Å; V169-V182 VanDerWaalsContact CG2-CG1 3.47Å; L180-V182 VanDerWaalsContact C-N 3.26Å; L180-V182 HydrophobicContact CB-CG2 4.31Å; L180-V182 PolarHBondContact O-N 3.15Å; V182-V184 PolarHBondContact O-N 3Å
183	F	69.2	Low	67.1	Low	108 Å²	108	96.6 Å²	96.6	47%	0.474	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	85.1	-178.5	-72.2	-86.9	0	0	0	110.7	V166 A167 Y168 V169 C185	V166-F183 HydrophobicContact CG2-CD2 3.59Å; V166-F183 HydrophobicContact CG2-CE2 3.96Å; A167-F183 PolarHBondContact O-N 3.36Å; Y168-F183 HydrophobicContact CD1-CB 3.61Å; Y168-F183 HydrophobicContact CD1-CG 4.35Å; Y168-F183 HydrophobicContact CE1-CB 3.91Å; Y168-F183 HydrophobicContact CE1-CD2 4.46Å; Y168-F183 HydrophobicContact CE1-CG 4.16Å; V169-F183 PolarHBondContact N-O 3.05Å; F183-C185 PolarHBondContact O-N 2.97Å
184	V	75.5	Confident	67.8	Low	53 Å²	53	94.6 Å²	94.6	32%	0.321	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	103.5	178.2	-175.4	0	0	0	0	110.2	W146 V169 K171 V182	W146-V184 HydrophobicContact CH2-CG2 4.12Å; V169-V184 CarbonylContact O-C 3.59Å; V169-V184 WeakPolarHBondContact O-CA 3.41Å; K171-V184 HydrophobicContact CB-CG1 3.73Å; K171-V184 HydrophobicContact CD-CG1 3.91Å; K171-V184 HydrophobicContact CG-CG1 4.08Å; V182-V184 PolarHBondContact O-N 3Å
185	C	79.7	Confident	69	Low	0 Å²	0	91 Å²	91	0%	0	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	131.7	173.4	-60.6	0	0	0	0	109.8	V169 L170 K171 F183 E190 L191	V169-C185 PolarHBondContact O-N 2.9Å; L170-C185 HydrophobicContact CD2-CB 3.92Å; K171-C185 PolarHBondContact N-O 2.75Å; F183-C185 PolarHBondContact O-N 2.97Å; C185-E190 HydrophobicContact CB-CB 4.23Å; C185-E190 HydrophobicContact CB-CG 4.24Å; C185-L191 HydrophobicContact CB-CB 4.41Å
186	N	77	Confident	70.6	Confident	85 Å²	85	93.3 Å²	93.3	46%	0.455	45%	0.447	S	S	.	.	S	Bend	trans	-83.1	-16.9	-178.7	-61.4	-85	0	0	0	112.8	K171 E190	K171-N186 WeakPolarHBondContact CE-OD1 3.29Å; K171-N186 PolarHBondContact NZ-OD1 3.31Å; N186-E190 WeakPolarHBondContact CB-OE2 3.35Å; N186-E190 PolarHBondContact N-OE2 3.01Å; N186-E190 PolarHBondContact ND2-OE2 2.72Å
187	N	81.8	Confident	72.5	Confident	81 Å²	81	86.8 Å²	86.8	43%	0.433	42%	0.416	S	S	.	.	S	Bend	trans	-163.3	173.3	176.1	55.6	62.5	0	0	0	110.6	L189 E190 L191	N187-L189 VanDerWaalsContact C-N 3.29Å; N187-L189 PolarHBondContact O-N 2.86Å; N187-L189 WeakPolarHBondContact OD1-CA 3.47Å; N187-L189 WeakPolarHBondContact OD1-CB 3.14Å; N187-L189 PolarHBondContact OD1-N 3.39Å; N187-E190 PolarHBondContact O-N 3.11Å; N187-E190 PolarHBondContact OD1-N 2.85Å; N187-L191 PolarHBondContact O-N 3.25Å
188	L	86.5	Confident	74.1	Confident	43 Å²	43	83.7 Å²	83.7	23%	0.225	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-36	177.6	-66.1	-179.7	0	0	0	113.1	L170 E190 L191 H192	L170-L188 HydrophobicContact CD1-CD2 3.59Å; L170-L188 HydrophobicContact CD2-CD2 4.14Å; L188-E190 PolarHBondContact O-N 2.92Å; L188-L191 WeakPolarHBondContact O-CB 3.41Å; L188-L191 PolarHBondContact O-N 3.33Å; L188-L191 VanDerWaalsContact O-N 3.12Å; L188-H192 PolarHBondContact O-CD2 3.45Å; L188-H192 PolarHBondContact O-N 3.22Å
189	L	86	Confident	76.3	Confident	123 Å²	123	76.3 Å²	76.3	64%	0.644	38%	0.379	S	S	*	.	H	α-helix	trans	-64.8	-25.9	-179.7	-150.8	90.2	0	0	0	112.3	N187	N187-L189 VanDerWaalsContact C-N 3.29Å; N187-L189 PolarHBondContact O-N 2.86Å; N187-L189 WeakPolarHBondContact OD1-CA 3.47Å; N187-L189 WeakPolarHBondContact OD1-CB 3.14Å; N187-L189 PolarHBondContact OD1-N 3.39Å
190	E	85.6	Confident	78.7	Confident	40 Å²	40	73 Å²	73	19%	0.187	35%	0.351	C	S	.	.	H	α-helix	trans	-79.2	-39.9	172.5	-172.8	164.8	-152.7	0	0	111.8	C185 N186 N187 L188 H192 R193 Y194	C185-E190 HydrophobicContact CB-CB 4.23Å; C185-E190 HydrophobicContact CB-CG 4.24Å; N186-E190 WeakPolarHBondContact CB-OE2 3.35Å; N186-E190 PolarHBondContact N-OE2 3.01Å; N186-E190 PolarHBondContact ND2-OE2 2.72Å; N187-E190 PolarHBondContact O-N 3.11Å; N187-E190 PolarHBondContact OD1-N 2.85Å; L188-E190 PolarHBondContact O-N 2.92Å; E190-H192 VanDerWaalsContact C-N 3.28Å; E190-H192 PolarHBondContact O-N 3.35Å; E190-R193 WeakPolarHBondContact O-CB 3.29Å; E190-R193 PolarHBondContact O-N 3.45Å; E190-R193 VanDerWaalsContact O-N 3.16Å; E190-Y194 HydrophobicContact CG-CE2 4.09Å; E190-Y194 WeakPolarHBondContact O-CD2 3.48Å
191	L	87.8	Confident	81	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-40	171.2	176.1	63.7	0	0	0	111.6	I138 Y168 L170 C185 N187 L188 R193 Y194 V195 L200 L204	I138-L191 HydrophobicContact CG2-CD1 4.41Å; I138-L191 HydrophobicContact CG2-CD2 4.04Å; Y168-L191 HydrophobicContact CD2-CD1 4.46Å; Y168-L191 HydrophobicContact CG-CD1 4.04Å; L170-L191 HydrophobicContact CD1-CD2 3.97Å; L170-L191 HydrophobicContact CD2-CB 4.22Å; L170-L191 HydrophobicContact CG-CD2 4.37Å; C185-L191 HydrophobicContact CB-CB 4.41Å; N187-L191 PolarHBondContact O-N 3.25Å; L188-L191 WeakPolarHBondContact O-CB 3.41Å; L188-L191 PolarHBondContact O-N 3.33Å; L188-L191 VanDerWaalsContact O-N 3.12Å; L191-R193 PolarHBondContact O-N 3Å; L191-R193 VanDerWaalsContact O-N 3.13Å; L191-Y194 PolarHBondContact O-N 2.61Å; L191-V195 HydrophobicContact CD1-CG2 4.25Å; L191-V195 PolarHBondContact O-N 2.89Å; L191-L200 HydrophobicContact CD2-CD1 4.12Å; L191-L200 HydrophobicContact CD2-CD2 4.48Å; L191-L200 HydrophobicContact CG-CD1 4.21Å; L191-L204 HydrophobicContact CD2-CD2 4.36Å
192	H	89.3	Confident	82.8	Confident	52 Å²	52	63.2 Å²	63.2	24%	0.241	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.3	178.8	-66.5	-177.3	0	0	0	113.9	L188 E190 P197 L200 L204 G205	L188-H192 PolarHBondContact O-CD2 3.45Å; L188-H192 PolarHBondContact O-N 3.22Å; E190-H192 VanDerWaalsContact C-N 3.28Å; E190-H192 PolarHBondContact O-N 3.35Å; H192-P197 HydrophobicContact CB-CG 4.26Å; H192-L200 VanDerWaalsContact CD2-CD1 3.45Å; H192-L200 WeakPolarHBondContact CD2-CD1 3.37Å; H192-L204 PolarHBondContact NE2-O 3.21Å; H192-G205 PolarHBondContact CE1-O 3.23Å
193	R	84.7	Confident	84	Confident	187 Å²	187	63.9 Å²	63.9	71%	0.706	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-18	170.9	-63.6	173.3	178.4	-177.2	-3.7	113.4	E190 L191	E190-R193 WeakPolarHBondContact O-CB 3.29Å; E190-R193 PolarHBondContact O-N 3.45Å; E190-R193 VanDerWaalsContact O-N 3.16Å; L191-R193 PolarHBondContact O-N 3Å; L191-R193 VanDerWaalsContact O-N 3.13Å
194	Y	83.2	Confident	84.9	Confident	105 Å²	105	58.8 Å²	58.8	41%	0.412	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-27.3	-178	-56.3	-69	0	0	0	113.1	Y168 E190 L191	Y168-Y194 HydrophobicContact CD1-CD2 4.09Å; Y168-Y194 HydrophobicContact CD1-CG 4.15Å; Y168-Y194 VanDerWaalsContact CE1-CB 3.41Å; Y168-Y194 HydrophobicContact CE1-CD1 4.08Å; Y168-Y194 AromaticContact CE1-CD2 3.94Å; Y168-Y194 HydrophobicContact CE1-CD2 3.94Å; Y168-Y194 AromaticContact CE1-CG 3.56Å; Y168-Y194 HydrophobicContact CE1-CG 3.56Å; E190-Y194 HydrophobicContact CG-CE2 4.09Å; E190-Y194 WeakPolarHBondContact O-CD2 3.48Å; L191-Y194 PolarHBondContact O-N 2.61Å
195	V	84.8	Confident	85.3	Confident	8 Å²	8	58 Å²	58	5%	0.048	29%	0.293	C	S	.	.	S	Bend	trans	-133.8	115.3	176.6	-171.2	0	0	0	0	109.3	I138 Y168 L191 R199 L200	I138-V195 HydrophobicContact CD1-CG2 4.37Å; Y168-V195 HydrophobicContact CD2-CG2 4Å; Y168-V195 HydrophobicContact CE2-CG2 3.85Å; L191-V195 HydrophobicContact CD1-CG2 4.25Å; L191-V195 PolarHBondContact O-N 2.89Å; V195-R199 HydrophobicContact CG1-CB 4.09Å; V195-L200 HydrophobicContact CB-CD1 4.42Å; V195-L200 HydrophobicContact CB-CD2 4Å; V195-L200 HydrophobicContact CB-CG 4.31Å; V195-L200 HydrophobicContact CG1-CD2 3.57Å; V195-L200 HydrophobicContact CG1-CG 3.91Å
196	H	86.6	Confident	85.6	Confident	101 Å²	101	58.7 Å²	58.7	47%	0.468	30%	0.3	S	S	.	.			trans	-58.6	135.2	-178	-174	-95.9	0	0	0	112	S198 R199	H196-S198 PolarHBondContact CE1-OG 2.97Å; H196-S198 PolarHBondContact ND1-N 2.98Å; H196-S198 PolarHBondContact ND1-OG 3.43Å; H196-S198 PolarHBondContact O-N 3.05Å; H196-R199 WeakPolarHBondContact O-CB 3.35Å; H196-R199 PolarHBondContact O-N 2.99Å
197	P	87.3	Confident	86.1	Confident	38 Å²	38	58.4 Å²	58.4	25%	0.247	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-54.1	-27.9	-173.9	-31.4	37	0	0	0	116.3	H192 R199 L200 G206 S207	H192-P197 HydrophobicContact CB-CG 4.26Å; P197-R199 PolarHBondContact O-N 2.79Å; P197-L200 PolarHBondContact O-N 2.85Å; P197-L200 VanDerWaalsContact O-N 3.1Å; P197-G206 CarbonylContact O-C 3.54Å; P197-G206 WeakPolarHBondContact O-CA 3.24Å; P197-S207 PolarHBondContact O-N 3.16Å
198	S	86.5	Confident	86.2	Confident	49 Å²	49	56.4 Å²	56.4	34%	0.343	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-71.2	-4.7	174.9	68.7	0	0	0	0	115	H196 S207	H196-S198 PolarHBondContact CE1-OG 2.97Å; H196-S198 PolarHBondContact ND1-N 2.98Å; H196-S198 PolarHBondContact ND1-OG 3.43Å; H196-S198 PolarHBondContact O-N 3.05Å; S198-S207 WeakPolarHBondContact CA-OG 3.48Å
199	R	85.6	Confident	85.9	Confident	102 Å²	102	59.7 Å²	59.7	39%	0.385	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-105	-4.2	170.9	-53	-53.7	-164	174.4	6	112.8	A92 K93 V195 H196 P197	A92-R199 VanDerWaalsContact CB-O 3.23Å; A92-R199 WeakPolarHBondContact CB-O 3.32Å; K93-R199 WeakPolarHBondContact O-CD 3.42Å; K93-R199 WeakPolarHBondContact O-CG 3.46Å; K93-R199 PolarHBondContact O-NE 3.43Å; V195-R199 HydrophobicContact CG1-CB 4.09Å; H196-R199 WeakPolarHBondContact O-CB 3.35Å; H196-R199 PolarHBondContact O-N 2.99Å; P197-R199 PolarHBondContact O-N 2.79Å
200	L	86.7	Confident	85.8	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.01	29%	0.293	C	S	.	.	S	Bend	trans	-103.2	145.2	-179.3	-64	179.7	0	0	0	110.4	I138 L191 H192 V195 P197 L204 G206 S207 F208	I138-L200 HydrophobicContact CD1-CD2 3.3Å; L191-L200 HydrophobicContact CD2-CD1 4.12Å; L191-L200 HydrophobicContact CD2-CD2 4.48Å; L191-L200 HydrophobicContact CG-CD1 4.21Å; H192-L200 VanDerWaalsContact CD2-CD1 3.45Å; H192-L200 WeakPolarHBondContact CD2-CD1 3.37Å; V195-L200 HydrophobicContact CB-CD1 4.42Å; V195-L200 HydrophobicContact CB-CD2 4Å; V195-L200 HydrophobicContact CB-CG 4.31Å; V195-L200 HydrophobicContact CG1-CD2 3.57Å; V195-L200 HydrophobicContact CG1-CG 3.91Å; P197-L200 PolarHBondContact O-N 2.85Å; P197-L200 VanDerWaalsContact O-N 3.1Å; L200-L204 HydrophobicContact CB-CB 4.17Å; L200-L204 HydrophobicContact CD1-CB 4.5Å; L200-L204 HydrophobicContact CD2-CD1 4.15Å; L200-G206 CarbonylContact O-C 3.57Å; L200-G206 VanDerWaalsContact O-CA 3.28Å; L200-G206 WeakPolarHBondContact O-CA 3.39Å; L200-S207 PolarHBondContact O-N 3.1Å; L200-F208 WeakPolarHBondContact O-CB 3.33Å; L200-F208 PolarHBondContact O-N 3.42Å
201	T	88.5	Confident	85.8	Confident	4 Å²	4	57.7 Å²	57.7	3%	0.025	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-77.3	164.2	172.6	48.2	0	0	0	0	111.1	F88 D203 L204 G206 F208 Y210	F88-T201 HydrophobicContact CE2-CG2 4.1Å; F88-T201 HydrophobicContact CZ-CG2 4.44Å; T201-D203 VanDerWaalsContact C-N 3.28Å; T201-D203 WeakPolarHBondContact CB-OD1 3.25Å; T201-D203 PolarHBondContact O-N 2.78Å; T201-D203 PolarHBondContact OG1-OD1 2.52Å; T201-L204 WeakPolarHBondContact O-CA 3.45Å; T201-L204 PolarHBondContact O-N 2.95Å; T201-G206 PolarHBondContact O-N 2.98Å; T201-G206 VanDerWaalsContact O-N 3.08Å; T201-F208 HydrophobicContact CG2-CD1 4.31Å; T201-Y210 HydrophobicContact CG2-CD1 4.24Å; T201-Y210 HydrophobicContact CG2-CG 4.23Å
202	V	86.8	Confident	85.8	Confident	110 Å²	110	58.7 Å²	58.7	67%	0.667	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-62.4	-32	-168.9	-176.4	0	0	0	0	113.2	L204 G205	V202-L204 PolarHBondContact O-N 2.9Å; V202-G205 PolarHBondContact O-N 2.87Å
203	D	84.8	Confident	85.6	Confident	50 Å²	50	60.7 Å²	60.7	27%	0.267	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-61.4	-24.7	172.7	48.4	-21.9	0	0	0	114.1	R85 R142 T201	R85-D203 IonicContact CZ-OD2 3.57Å; R85-D203 VanDerWaalsContact NH2-CG 3.29Å; R85-D203 IonicContact NH2-OD1 3.61Å; R85-D203 IonicContact NH2-OD2 3.63Å; R85-D203 PolarHBondContact NH2-OD2 2.91Å; R142-D203 PolarHBondContact NH2-O 3.19Å; R142-D203 VanDerWaalsContact NH2-O 3.07Å; T201-D203 VanDerWaalsContact C-N 3.28Å; T201-D203 WeakPolarHBondContact CB-OD1 3.25Å; T201-D203 PolarHBondContact O-N 2.78Å; T201-D203 PolarHBondContact OG1-OD1 2.52Å
204	L	88.4	Confident	85.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-99.7	16.1	174.2	-61.9	172.5	0	0	0	112.4	T102 I138 D140 L170 L191 H192 L200 T201 V202 G206	T102-L204 HydrophobicContact CG2-CD1 3.88Å; I138-L204 HydrophobicContact CD1-CD1 4.32Å; I138-L204 HydrophobicContact CG2-CD1 3.93Å; I138-L204 HydrophobicContact CG2-CD2 4.31Å; D140-L204 HydrophobicContact CB-CD2 4.08Å; L170-L204 HydrophobicContact CD1-CD2 3.7Å; L191-L204 HydrophobicContact CD2-CD2 4.36Å; H192-L204 PolarHBondContact NE2-O 3.21Å; L200-L204 HydrophobicContact CB-CB 4.17Å; L200-L204 HydrophobicContact CD1-CB 4.5Å; L200-L204 HydrophobicContact CD2-CD1 4.15Å; T201-L204 WeakPolarHBondContact O-CA 3.45Å; T201-L204 PolarHBondContact O-N 2.95Å; V202-L204 PolarHBondContact O-N 2.9Å; L204-G206 VanDerWaalsContact C-N 3.28Å; L204-G206 PolarHBondContact O-N 2.85Å
205	G	83.9	Confident	85.5	Confident	38 Å²	38	50.7 Å²	50.7	39%	0.392	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	23.1	-178	0	0	0	0	0	113.9	H192 V202	H192-G205 PolarHBondContact CE1-O 3.23Å; V202-G205 PolarHBondContact O-N 2.87Å
206	G	86.3	Confident	85.6	Confident	13 Å²	13	50.6 Å²	50.6	13%	0.134	29%	0.287	C	S	.	.			trans	-99.6	-179.6	179.1	0	0	0	0	0	114.9	P197 L200 T201 L204	P197-G206 CarbonylContact O-C 3.54Å; P197-G206 WeakPolarHBondContact O-CA 3.24Å; L200-G206 CarbonylContact O-C 3.57Å; L200-G206 VanDerWaalsContact O-CA 3.28Å; L200-G206 WeakPolarHBondContact O-CA 3.39Å; T201-G206 PolarHBondContact O-N 2.98Å; T201-G206 VanDerWaalsContact O-N 3.08Å; L204-G206 VanDerWaalsContact C-N 3.28Å; L204-G206 PolarHBondContact O-N 2.85Å
207	S	86.1	Confident	85.3	Confident	80 Å²	80	51.4 Å²	51.4	56%	0.559	29%	0.291	S	S	*	.			trans	-117.9	10.7	-179	56.7	0	0	0	0	114.3	P197 S198 L200 C209	P197-S207 PolarHBondContact O-N 3.16Å; S198-S207 WeakPolarHBondContact CA-OG 3.48Å; L200-S207 PolarHBondContact O-N 3.1Å; S207-C209 PolarHBondContact O-N 3.04Å
208	F	84.1	Confident	84.9	Confident	38 Å²	38	53 Å²	53	17%	0.167	29%	0.294	C	S	.	.	B	Isolated β-bridge	trans	-74.8	111.3	173.9	-167.2	-82	0	0	0	110.7	S90 A92 L200 T201 Y210	S90-F208 VanDerWaalsContact O-CE1 3.28Å; S90-F208 WeakPolarHBondContact O-CE1 3.3Å; A92-F208 HydrophobicContact CB-CD2 3.98Å; A92-F208 HydrophobicContact CB-CE2 3.89Å; A92-F208 HydrophobicContact CB-CG 4.33Å; A92-F208 HydrophobicContact CB-CZ 4.17Å; L200-F208 WeakPolarHBondContact O-CB 3.33Å; L200-F208 PolarHBondContact O-N 3.42Å; T201-F208 HydrophobicContact CG2-CD1 4.31Å; F208-Y210 PolarHBondContact O-N 2.92Å; F208-Y210 VanDerWaalsContact O-N 3.13Å
209	C	80.4	Confident	84.8	Confident	113 Å²	113	51.2 Å²	51.2	76%	0.764	28%	0.28	S	S	*	.			trans	-69	105.7	179.7	-57.7	0	0	0	0	111.5	S207	S207-C209 PolarHBondContact O-N 3.04Å
210	Y	84.7	Confident	84.7	Confident	35 Å²	35	46.9 Å²	46.9	14%	0.137	26%	0.264	C	S	.	.			trans	-131.4	117.7	177.1	178.2	-111.2	0	0	0	110.9	F88 T201 F208 H212 W215	F88-Y210 HydrophobicContact CB-CE1 4.39Å; F88-Y210 HydrophobicContact CD1-CE1 4.46Å; F88-Y210 AromaticContact CD2-CD1 3.93Å; F88-Y210 HydrophobicContact CD2-CD1 3.93Å; F88-Y210 AromaticContact CD2-CE1 3.3Å; F88-Y210 HydrophobicContact CD2-CE1 3.3Å; F88-Y210 AromaticContact CD2-CZ 3.7Å; F88-Y210 AromaticContact CE2-CD1 3.69Å; F88-Y210 HydrophobicContact CE2-CD1 3.69Å; F88-Y210 AromaticContact CE2-CE1 3.54Å; F88-Y210 HydrophobicContact CE2-CE1 3.54Å; F88-Y210 AromaticContact CG-CE1 3.82Å; F88-Y210 HydrophobicContact CG-CE1 3.82Å; F88-Y210 HydrophobicContact CZ-CD1 4.32Å; F88-Y210 HydrophobicContact CZ-CE1 4.22Å; T201-Y210 HydrophobicContact CG2-CD1 4.24Å; T201-Y210 HydrophobicContact CG2-CG 4.23Å; F208-Y210 PolarHBondContact O-N 2.92Å; F208-Y210 VanDerWaalsContact O-N 3.13Å; Y210-H212 HydrophobicContact CD1-CB 4.45Å; Y210-H212 HydrophobicContact CE1-CB 3.71Å; Y210-H212 AromaticContact CE1-ND1 3.84Å; Y210-H212 AromaticContact CZ-ND1 3.75Å; Y210-H212 PolarHBondContact OH-ND1 2.87Å; Y210-W215 HydrophobicContact CE2-CB 3.74Å; Y210-W215 AromaticContact CE2-CD1 3.94Å; Y210-W215 HydrophobicContact CE2-CD2 4.28Å; Y210-W215 AromaticContact CE2-CG 3.7Å; Y210-W215 HydrophobicContact CE2-CG 3.7Å
211	N	84.9	Confident	83.9	Confident	86 Å²	86	49.6 Å²	49.6	46%	0.46	28%	0.277	S	S	.	.			trans	-102.7	111.8	167.8	179.3	-9.4	0	0	0	108.4	L213 E214 W215	N211-L213 PolarHBondContact OD1-N 2.8Å; N211-L213 VanDerWaalsContact OD1-N 3.13Å; N211-E214 HydrophobicContact CB-CB 3.92Å; N211-E214 WeakPolarHBondContact ND2-CB 3.39Å; N211-E214 PolarHBondContact OD1-N 2.92Å; N211-W215 VanDerWaalsContact O-CB 3.27Å; N211-W215 WeakPolarHBondContact O-CB 3.29Å; N211-W215 PolarHBondContact O-N 3.33Å
212	H	88	Confident	83.3	Confident	21 Å²	21	49.9 Å²	49.9	10%	0.097	28%	0.279	C	S	.	.	H	α-helix	trans	-66.3	-38.4	-175.8	-176.6	59.8	0	0	0	113	L82 Y210 W215 L216	L82-H212 PolarHBondContact O-CE1 3.42Å; L82-H212 PolarHBondContact O-NE2 3.15Å; Y210-H212 HydrophobicContact CD1-CB 4.45Å; Y210-H212 HydrophobicContact CE1-CB 3.71Å; Y210-H212 AromaticContact CE1-ND1 3.84Å; Y210-H212 AromaticContact CZ-ND1 3.75Å; Y210-H212 PolarHBondContact OH-ND1 2.87Å; H212-W215 PolarHBondContact O-N 3.18Å; H212-L216 VanDerWaalsContact O-CB 3.31Å; H212-L216 WeakPolarHBondContact O-CB 3.33Å; H212-L216 PolarHBondContact O-N 2.9Å
213	L	85.5	Confident	83.1	Confident	95 Å²	95	45.3 Å²	45.3	50%	0.497	25%	0.25	S	S	.	.	H	α-helix	trans	-72.6	-43.3	-178.5	-174.8	63.1	0	0	0	111.4	N211 W215 L216 Q217	N211-L213 PolarHBondContact OD1-N 2.8Å; N211-L213 VanDerWaalsContact OD1-N 3.13Å; L213-W215 VanDerWaalsContact C-N 3.35Å; L213-L216 PolarHBondContact O-N 3.44Å; L213-Q217 WeakPolarHBondContact O-CB 3.04Å; L213-Q217 WeakPolarHBondContact O-CG 3.44Å; L213-Q217 PolarHBondContact O-N 3.06Å
214	E	81.2	Confident	82.5	Confident	69 Å²	69	47.7 Å²	47.7	32%	0.322	26%	0.255	S	S	.	.	H	α-helix	trans	-61.8	-43.4	173	-179	-170.5	173.7	0	0	111.2	N211 L216 H218	N211-E214 HydrophobicContact CB-CB 3.92Å; N211-E214 WeakPolarHBondContact ND2-CB 3.39Å; N211-E214 PolarHBondContact OD1-N 2.92Å; E214-L216 VanDerWaalsContact C-N 3.35Å; E214-H218 VanDerWaalsContact CG-CE1 3.45Å; E214-H218 WeakPolarHBondContact CG-CE1 3.22Å; E214-H218 PolarHBondContact O-N 3.08Å; E214-H218 PolarHBondContact O-ND1 3.37Å; E214-H218 IonicContact OE1-CE1 3.32Å
215	W	85.2	Confident	81.7	Confident	12 Å²	12	48.8 Å²	48.8	5%	0.045	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-45.9	175.7	174.9	89.9	0	0	0	111.2	L82 L122 L125 Y210 N211 H212 L213 R219	L82-W215 HydrophobicContact CD1-CZ3 4.34Å; L82-W215 HydrophobicContact CD2-CH2 4.13Å; L82-W215 HydrophobicContact CD2-CZ3 4.05Å; L122-W215 HydrophobicContact CD2-CH2 4.21Å; L125-W215 HydrophobicContact CD1-CH2 4.04Å; L125-W215 HydrophobicContact CD1-CZ2 3.64Å; Y210-W215 HydrophobicContact CE2-CB 3.74Å; Y210-W215 AromaticContact CE2-CD1 3.94Å; Y210-W215 HydrophobicContact CE2-CD2 4.28Å; Y210-W215 AromaticContact CE2-CG 3.7Å; Y210-W215 HydrophobicContact CE2-CG 3.7Å; N211-W215 VanDerWaalsContact O-CB 3.27Å; N211-W215 WeakPolarHBondContact O-CB 3.29Å; N211-W215 PolarHBondContact O-N 3.33Å; H212-W215 PolarHBondContact O-N 3.18Å; L213-W215 VanDerWaalsContact C-N 3.35Å; W215-R219 HydrophobicContact CH2-CG 4.14Å; W215-R219 HydrophobicContact CZ2-CG 4.15Å; W215-R219 WeakPolarHBondContact O-CB 3.43Å; W215-R219 PolarHBondContact O-N 3.39Å
216	L	86.1	Confident	81.2	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-64.3	-47.3	-178.8	179	57.8	0	0	0	112.1	L82 V83 H212 L213 E214 H218 R219 M220	L82-L216 HydrophobicContact CB-CD1 3.61Å; L82-L216 HydrophobicContact CB-CD2 4.25Å; L82-L216 HydrophobicContact CD1-CD1 3.6Å; L82-L216 HydrophobicContact CG-CD1 4.24Å; V83-L216 HydrophobicContact CB-CD2 4.36Å; V83-L216 HydrophobicContact CG2-CD2 3.51Å; H212-L216 VanDerWaalsContact O-CB 3.31Å; H212-L216 WeakPolarHBondContact O-CB 3.33Å; H212-L216 PolarHBondContact O-N 2.9Å; L213-L216 PolarHBondContact O-N 3.44Å; E214-L216 VanDerWaalsContact C-N 3.35Å; L216-H218 PolarHBondContact O-N 3.08Å; L216-R219 PolarHBondContact O-N 3.36Å; L216-R219 VanDerWaalsContact O-N 3.1Å; L216-M220 HydrophobicContact CD1-CE 4Å; L216-M220 HydrophobicContact CD1-CG 3.84Å; L216-M220 HydrophobicContact CD1-SD 4.3Å; L216-M220 HydrophobicContact CG-CG 4.4Å; L216-M220 WeakPolarHBondContact O-CG 3.42Å; L216-M220 PolarHBondContact O-N 2.76Å
217	Q	80.3	Confident	80.5	Confident	118 Å²	118	53.1 Å²	53.1	55%	0.551	27%	0.267	S	S	*	.	H	α-helix	trans	-55.9	-52.9	177.7	-75	172.8	-14.9	0	0	111.3	L213 R219 M220 E221	L213-Q217 WeakPolarHBondContact O-CB 3.04Å; L213-Q217 WeakPolarHBondContact O-CG 3.44Å; L213-Q217 PolarHBondContact O-N 3.06Å; Q217-R219 VanDerWaalsContact C-N 3.3Å; Q217-R219 PolarHBondContact O-N 3.15Å; Q217-M220 PolarHBondContact O-N 3.37Å; Q217-E221 PolarHBondContact O-N 2.94Å
218	H	78.1	Confident	79.5	Confident	71 Å²	71	49.6 Å²	49.6	33%	0.329	24%	0.242	S	C	.	.	H	α-helix	trans	-61.9	-37.5	175.6	-66.4	111.8	0	0	0	112.2	E214 L216 E221 V222 N289	E214-H218 VanDerWaalsContact CG-CE1 3.45Å; E214-H218 WeakPolarHBondContact CG-CE1 3.22Å; E214-H218 PolarHBondContact O-N 3.08Å; E214-H218 PolarHBondContact O-ND1 3.37Å; E214-H218 IonicContact OE1-CE1 3.32Å; L216-H218 PolarHBondContact O-N 3.08Å; H218-E221 PolarHBondContact O-N 3.23Å; H218-V222 WeakPolarHBondContact O-CG2 3.43Å; H218-V222 PolarHBondContact O-N 3.34Å; H218-V222 VanDerWaalsContact O-N 3.1Å; H218-N289 WeakPolarHBondContact CB-ND2 3.46Å
219	R	84.3	Confident	78.7	Confident	13 Å²	13	48 Å²	48	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-39	-177.4	-175.9	68.1	-162.2	95.9	-0.8	112.4	Y121 L125 W215 L216 Q217 V222 E223	Y121-R219 WeakPolarHBondContact OH-CG 3.48Å; Y121-R219 PolarHBondContact OH-NE 2.71Å; Y121-R219 VanDerWaalsContact OH-NE 3.07Å; Y121-R219 PolarHBondContact OH-NH2 3.49Å; L125-R219 VanDerWaalsContact CD2-NE 3.25Å; W215-R219 HydrophobicContact CH2-CG 4.14Å; W215-R219 HydrophobicContact CZ2-CG 4.15Å; W215-R219 WeakPolarHBondContact O-CB 3.43Å; W215-R219 PolarHBondContact O-N 3.39Å; L216-R219 PolarHBondContact O-N 3.36Å; L216-R219 VanDerWaalsContact O-N 3.1Å; Q217-R219 VanDerWaalsContact C-N 3.3Å; Q217-R219 PolarHBondContact O-N 3.15Å; R219-V222 PolarHBondContact O-N 3.02Å; R219-E223 IonicContact CZ-OE1 3.99Å; R219-E223 IonicContact NH1-OE1 3.04Å; R219-E223 PolarHBondContact NH1-OE1 2.93Å; R219-E223 IonicContact NH2-OE1 3.81Å; R219-E223 PolarHBondContact NH2-OE1 3.46Å; R219-E223 IonicContact NH2-OE2 2.69Å; R219-E223 PolarHBondContact O-N 3.18Å
220	M	83.7	Confident	78.3	Confident	10 Å²	10	45.7 Å²	45.7	5%	0.049	21%	0.213	C	C	.	.	H	α-helix	trans	-70.8	-39.3	177.3	-66	-59.3	97.8	0	0	112.1	I75 L82 Y121 L216 Q217 V222 E223 R224	I75-M220 HydrophobicContact CG2-CB 4.44Å; I75-M220 HydrophobicContact CG2-SD 3.66Å; L82-M220 HydrophobicContact CD1-CE 3.69Å; Y121-M220 VanDerWaalsContact OH-CE 3.31Å; Y121-M220 WeakPolarHBondContact OH-CE 3.42Å; L216-M220 HydrophobicContact CD1-CE 4Å; L216-M220 HydrophobicContact CD1-CG 3.84Å; L216-M220 HydrophobicContact CD1-SD 4.3Å; L216-M220 HydrophobicContact CG-CG 4.4Å; L216-M220 WeakPolarHBondContact O-CG 3.42Å; L216-M220 PolarHBondContact O-N 2.76Å; Q217-M220 PolarHBondContact O-N 3.37Å; M220-V222 VanDerWaalsContact C-N 3.29Å; M220-V222 PolarHBondContact O-N 3.38Å; M220-E223 PolarHBondContact O-N 2.94Å; M220-R224 WeakPolarHBondContact O-CG 3.34Å; M220-R224 PolarHBondContact O-N 3.31Å
221	E	70.5	Confident	77.3	Confident	59 Å²	59	44.9 Å²	44.9	28%	0.276	22%	0.216	S	C	.	.	H	α-helix	trans	-63.5	-34.2	173	-67.1	-59.7	119.4	0	0	112.2	Q217 H218 R224 L225	Q217-E221 PolarHBondContact O-N 2.94Å; H218-E221 PolarHBondContact O-N 3.23Å; E221-R224 PolarHBondContact O-N 3.5Å; E221-R224 WeakPolarHBondContact OE1-CD 3.48Å; E221-R224 IonicContact OE1-CZ 3.58Å; E221-R224 IonicContact OE1-NE 2.91Å; E221-R224 IonicContact OE1-NH1 3.79Å; E221-R224 PolarHBondContact OE1-NH1 3.3Å; E221-L225 WeakPolarHBondContact O-CB 3.45Å; E221-L225 PolarHBondContact O-N 3.41Å
222	V	75.7	Confident	76.3	Confident	11 Å²	11	42.8 Å²	42.8	7%	0.067	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-39.4	172.1	172.3	0	0	0	0	112.3	H218 R219 M220 R226 N289 V293	H218-V222 WeakPolarHBondContact O-CG2 3.43Å; H218-V222 PolarHBondContact O-N 3.34Å; H218-V222 VanDerWaalsContact O-N 3.1Å; R219-V222 PolarHBondContact O-N 3.02Å; M220-V222 VanDerWaalsContact C-N 3.29Å; M220-V222 PolarHBondContact O-N 3.38Å; V222-R226 WeakPolarHBondContact O-CB 3.35Å; V222-R226 PolarHBondContact O-N 3Å; V222-N289 HydrophobicContact CG2-CB 3.89Å; V222-V293 HydrophobicContact CG2-CG2 3.98Å
223	E	82.4	Confident	75.4	Confident	13 Å²	13	42.9 Å²	42.9	6%	0.061	21%	0.208	C	C	.	.	H	α-helix	trans	-69.3	-36.2	174.5	-68.7	-55.8	93.1	0	0	112.4	M66 I75 Y121 R219 M220 R226 C227	M66-E223 HydrophobicContact CE-CB 4.18Å; M66-E223 HydrophobicContact CE-CG 3.78Å; I75-E223 HydrophobicContact CD1-CB 3.92Å; I75-E223 HydrophobicContact CG1-CB 4.13Å; I75-E223 HydrophobicContact CG2-CB 4.48Å; Y121-E223 HydrophobicContact CE2-CG 4.36Å; R219-E223 IonicContact CZ-OE1 3.99Å; R219-E223 IonicContact NH1-OE1 3.04Å; R219-E223 PolarHBondContact NH1-OE1 2.93Å; R219-E223 IonicContact NH2-OE1 3.81Å; R219-E223 PolarHBondContact NH2-OE1 3.46Å; R219-E223 IonicContact NH2-OE2 2.69Å; R219-E223 PolarHBondContact O-N 3.18Å; M220-E223 PolarHBondContact O-N 2.94Å; E223-R226 PolarHBondContact O-N 3.34Å; E223-C227 VanDerWaalsContact O-CB 3.31Å; E223-C227 WeakPolarHBondContact O-CB 3.38Å; E223-C227 PolarHBondContact O-N 3.36Å
224	R	72.6	Confident	74.7	Confident	100 Å²	100	44.6 Å²	44.6	38%	0.377	21%	0.208	S	C	.	.	H	α-helix	trans	-61.1	-49.9	173.1	-75.6	172.5	163.1	162.7	-2.8	111.2	I75 M220 E221 R226 C227 S228	I75-R224 HydrophobicContact CD1-CG 4.06Å; M220-R224 WeakPolarHBondContact O-CG 3.34Å; M220-R224 PolarHBondContact O-N 3.31Å; E221-R224 PolarHBondContact O-N 3.5Å; E221-R224 WeakPolarHBondContact OE1-CD 3.48Å; E221-R224 IonicContact OE1-CZ 3.58Å; E221-R224 IonicContact OE1-NE 2.91Å; E221-R224 IonicContact OE1-NH1 3.79Å; E221-R224 PolarHBondContact OE1-NH1 3.3Å; R224-R226 VanDerWaalsContact C-N 3.29Å; R224-R226 PolarHBondContact O-N 2.98Å; R224-C227 PolarHBondContact O-N 2.99Å; R224-S228 WeakPolarHBondContact O-CB 3.13Å; R224-S228 PolarHBondContact O-N 2.97Å
225	L	71.8	Confident	74	Confident	24 Å²	24	42.2 Å²	42.2	13%	0.126	20%	0.198	C	C	.	.	H	α-helix	trans	-56.3	-44.6	175.7	-171.1	81.7	0	0	0	111.4	Y29 E221 A229 V293	Y29-L225 HydrophobicContact CD2-CD1 3.93Å; Y29-L225 HydrophobicContact CE2-CD1 3.35Å; Y29-L225 HydrophobicContact CE2-CG 4.08Å; E221-L225 WeakPolarHBondContact O-CB 3.45Å; E221-L225 PolarHBondContact O-N 3.41Å; L225-A229 VanDerWaalsContact O-CB 3.32Å; L225-A229 WeakPolarHBondContact O-CB 3.39Å; L225-A229 PolarHBondContact O-N 3.37Å; L225-V293 HydrophobicContact CD2-CB 4.27Å; L225-V293 HydrophobicContact CD2-CG1 3.88Å; L225-V293 HydrophobicContact CD2-CG2 3.85Å
226	R	74.2	Confident	73.3	Confident	109 Å²	109	42.6 Å²	42.6	41%	0.411	20%	0.201	S	C	.	.	H	α-helix	trans	-64.9	-48.7	178.5	-176.8	-177.4	171.5	-166.7	-8	112.4	V222 E223 R224 S228 A229 E230	V222-R226 WeakPolarHBondContact O-CB 3.35Å; V222-R226 PolarHBondContact O-N 3Å; E223-R226 PolarHBondContact O-N 3.34Å; R224-R226 VanDerWaalsContact C-N 3.29Å; R224-R226 PolarHBondContact O-N 2.98Å; R226-S228 VanDerWaalsContact C-N 3.31Å; R226-S228 PolarHBondContact O-N 2.92Å; R226-A229 PolarHBondContact O-N 3.14Å; R226-E230 HydrophobicContact CG-CG 4.45Å; R226-E230 IonicContact CZ-OE1 3.63Å; R226-E230 IonicContact NE-OE1 2.67Å; R226-E230 PolarHBondContact NE-OE1 3.03Å; R226-E230 IonicContact NH2-OE1 2.75Å; R226-E230 PolarHBondContact NH2-OE1 2.99Å; R226-E230 WeakPolarHBondContact O-CB 3.41Å; R226-E230 WeakPolarHBondContact O-CG 3.48Å; R226-E230 PolarHBondContact O-N 3.23Å
227	C	70.5	Confident	72.6	Confident	33 Å²	33	47.1 Å²	47.1	22%	0.223	23%	0.226	C	C	.	.	H	α-helix	trans	-59.5	-42.4	178.6	-179.9	0	0	0	0	111.4	Y65 I75 E223 R224 G231	Y65-C227 PolarHBondContact N-SG 3.39Å; Y65-C227 VanDerWaalsContact N-SG 3.42Å; Y65-C227 PolarHBondContact O-SG 3.44Å; Y65-C227 VanDerWaalsContact O-SG 3.37Å; I75-C227 HydrophobicContact CD1-CB 4.24Å; E223-C227 VanDerWaalsContact O-CB 3.31Å; E223-C227 WeakPolarHBondContact O-CB 3.38Å; E223-C227 PolarHBondContact O-N 3.36Å; R224-C227 PolarHBondContact O-N 2.99Å; C227-G231 PolarHBondContact O-N 3.05Å
228	S	65.2	Low	72	Confident	6 Å²	6	47.3 Å²	47.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-47.2	175.4	172.6	0	0	0	0	111.8	S27 Y29 R224 R226 E230 G231 I232	S27-S228 VanDerWaalsContact CB-OG 3.29Å; S27-S228 WeakPolarHBondContact CB-OG 3.42Å; S27-S228 WeakPolarHBondContact O-CB 3.18Å; S27-S228 PolarHBondContact O-OG 3.42Å; S27-S228 PolarHBondContact OG-OG 3.29Å; Y29-S228 WeakPolarHBondContact CD2-OG 3.48Å; R224-S228 WeakPolarHBondContact O-CB 3.13Å; R224-S228 PolarHBondContact O-N 2.97Å; R226-S228 VanDerWaalsContact C-N 3.31Å; R226-S228 PolarHBondContact O-N 2.92Å; S228-E230 PolarHBondContact O-N 3.47Å; S228-G231 CarbonylContact O-C 3.6Å; S228-G231 VanDerWaalsContact O-CA 3.25Å; S228-G231 WeakPolarHBondContact O-CA 3.46Å; S228-G231 PolarHBondContact O-N 3.29Å; S228-I232 WeakPolarHBondContact O-CG1 3.36Å; S228-I232 PolarHBondContact O-N 2.79Å
229	A	68.1	Low	71.6	Confident	3 Å²	3	45 Å²	45	3%	0.025	22%	0.215	C	C	.	.	H	α-helix	trans	-63.7	-41.2	178.7	0	0	0	0	0	113.4	L225 R226 G231 I232 A233 T296 L300	L225-A229 VanDerWaalsContact O-CB 3.32Å; L225-A229 WeakPolarHBondContact O-CB 3.39Å; L225-A229 PolarHBondContact O-N 3.37Å; R226-A229 PolarHBondContact O-N 3.14Å; A229-G231 PolarHBondContact O-N 3.44Å; A229-I232 PolarHBondContact O-N 3.08Å; A229-A233 WeakPolarHBondContact O-CB 3.47Å; A229-A233 PolarHBondContact O-N 3.18Å; A229-T296 HydrophobicContact CB-CG2 3.3Å; A229-L300 HydrophobicContact CB-CD1 3.82Å; A229-L300 HydrophobicContact CB-CD2 4.15Å; A229-L300 HydrophobicContact CB-CG 4.01Å
230	E	70.5	Confident	71.2	Confident	65 Å²	65	44.5 Å²	44.5	30%	0.304	21%	0.214	S	C	.	.	H	α-helix	trans	-65.8	-21.9	171.3	-71.4	-176.4	-171.2	0	0	112.1	R226 S228 R234	R226-E230 HydrophobicContact CG-CG 4.45Å; R226-E230 IonicContact CZ-OE1 3.63Å; R226-E230 IonicContact NE-OE1 2.67Å; R226-E230 PolarHBondContact NE-OE1 3.03Å; R226-E230 IonicContact NH2-OE1 2.75Å; R226-E230 PolarHBondContact NH2-OE1 2.99Å; R226-E230 WeakPolarHBondContact O-CB 3.41Å; R226-E230 WeakPolarHBondContact O-CG 3.48Å; R226-E230 PolarHBondContact O-N 3.23Å; S228-E230 PolarHBondContact O-N 3.47Å; E230-R234 WeakPolarHBondContact O-CB 3.5Å; E230-R234 PolarHBondContact O-NH2 3.42Å
231	G	64.6	Low	70.8	Confident	18 Å²	18	48.1 Å²	48.1	19%	0.186	23%	0.231	C	C	.	.	H	α-helix	trans	-70.6	-61.1	166.5	0	0	0	0	0	112.4	C227 S228 A229 A233 R234 T235	C227-G231 PolarHBondContact O-N 3.05Å; S228-G231 CarbonylContact O-C 3.6Å; S228-G231 VanDerWaalsContact O-CA 3.25Å; S228-G231 WeakPolarHBondContact O-CA 3.46Å; S228-G231 PolarHBondContact O-N 3.29Å; A229-G231 PolarHBondContact O-N 3.44Å; G231-A233 VanDerWaalsContact C-N 3.3Å; G231-A233 PolarHBondContact O-N 3.04Å; G231-R234 WeakPolarHBondContact O-CA 3.4Å; G231-R234 WeakPolarHBondContact O-CB 3.17Å; G231-R234 PolarHBondContact O-N 3.35Å; G231-T235 PolarHBondContact O-N 3.48Å; G231-T235 PolarHBondContact O-OG1 3.38Å
232	I	64.1	Low	70.8	Confident	42 Å²	42	47.6 Å²	47.6	22%	0.215	23%	0.233	C	C	.	.	H	α-helix	trans	-54.3	-44.8	-177.3	-64.3	165.4	0	0	0	111.5	L24 Y29 S228 A229 R234 T235 L236 L300	L24-I232 HydrophobicContact CD2-CD1 3.7Å; L24-I232 HydrophobicContact CD2-CG1 3.73Å; Y29-I232 HydrophobicContact CD2-CD1 4.35Å; Y29-I232 HydrophobicContact CG-CD1 4.38Å; S228-I232 WeakPolarHBondContact O-CG1 3.36Å; S228-I232 PolarHBondContact O-N 2.79Å; A229-I232 PolarHBondContact O-N 3.08Å; I232-R234 VanDerWaalsContact C-N 3.31Å; I232-R234 PolarHBondContact O-N 3.38Å; I232-T235 PolarHBondContact O-N 2.99Å; I232-L236 WeakPolarHBondContact O-CB 3.46Å; I232-L236 PolarHBondContact O-N 3.48Å; I232-L300 HydrophobicContact CB-CD2 4.06Å; I232-L300 HydrophobicContact CG2-CD2 3.96Å
233	A	68.3	Low	70.7	Confident	23 Å²	23	47.1 Å²	47.1	19%	0.19	23%	0.231	C	C	.	.	H	α-helix	trans	-61.8	-38.5	177	0	0	0	0	0	112.4	A229 G231 D237 L300 A303	A229-A233 WeakPolarHBondContact O-CB 3.47Å; A229-A233 PolarHBondContact O-N 3.18Å; G231-A233 VanDerWaalsContact C-N 3.3Å; G231-A233 PolarHBondContact O-N 3.04Å; A233-D237 PolarHBondContact O-N 3.11Å; A233-L300 HydrophobicContact CB-CD2 4.47Å; A233-A303 HydrophobicContact CB-CB 4.36Å
234	R	71.7	Confident	70.5	Confident	132 Å²	132	50.7 Å²	50.7	50%	0.498	25%	0.246	S	C	.	.	H	α-helix	trans	-69.1	-47.4	177.5	-169.5	-170.2	-50.3	101.5	11.7	111.6	E230 G231 I232 L236 D237 E238	E230-R234 WeakPolarHBondContact O-CB 3.5Å; E230-R234 PolarHBondContact O-NH2 3.42Å; G231-R234 WeakPolarHBondContact O-CA 3.4Å; G231-R234 WeakPolarHBondContact O-CB 3.17Å; G231-R234 PolarHBondContact O-N 3.35Å; I232-R234 VanDerWaalsContact C-N 3.31Å; I232-R234 PolarHBondContact O-N 3.38Å; R234-L236 PolarHBondContact O-N 3Å; R234-D237 PolarHBondContact O-N 3.41Å; R234-D237 VanDerWaalsContact O-N 3.17Å; R234-E238 WeakPolarHBondContact CD-OE1 3.28Å; R234-E238 HydrophobicContact CG-CG 4.49Å; R234-E238 WeakPolarHBondContact CG-OE1 3.27Å; R234-E238 WeakPolarHBondContact O-CB 3.1Å; R234-E238 WeakPolarHBondContact O-CG 3.47Å; R234-E238 PolarHBondContact O-N 2.87Å
235	T	65.6	Low	70.5	Confident	18 Å²	18	51.2 Å²	51.2	11%	0.11	26%	0.256	C	S	.	.	H	α-helix	trans	-64.4	-31.1	178.2	-43.5	0	0	0	0	111	L20 D23 G231 I232 F239	L20-T235 HydrophobicContact CD2-CG2 3.45Å; L20-T235 VanDerWaalsContact CD2-CG2 3.45Å; L20-T235 HydrophobicContact CG-CG2 3.75Å; D23-T235 WeakPolarHBondContact OD2-CG2 3.33Å; D23-T235 PolarHBondContact OD2-OG1 3.42Å; G231-T235 PolarHBondContact O-N 3.48Å; G231-T235 PolarHBondContact O-OG1 3.38Å; I232-T235 PolarHBondContact O-N 2.99Å; T235-F239 WeakPolarHBondContact O-CB 3.47Å; T235-F239 PolarHBondContact O-N 3.48Å
236	L	70.3	Confident	70.4	Confident	21 Å²	21	51.6 Å²	51.6	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-43.3	171.6	-175.9	59.8	0	0	0	112.8	I232 R234 F239 V240 A303 F307	I232-L236 WeakPolarHBondContact O-CB 3.46Å; I232-L236 PolarHBondContact O-N 3.48Å; R234-L236 PolarHBondContact O-N 3Å; L236-F239 PolarHBondContact O-N 3.44Å; L236-V240 HydrophobicContact CD1-CG2 4.45Å; L236-V240 WeakPolarHBondContact O-CB 3.4Å; L236-V240 WeakPolarHBondContact O-CG2 3.14Å; L236-V240 PolarHBondContact O-N 2.68Å; L236-A303 HydrophobicContact CD2-CB 4.09Å; L236-F307 HydrophobicContact CD1-CB 4.34Å; L236-F307 HydrophobicContact CD1-CD2 3.9Å; L236-F307 HydrophobicContact CD1-CG 4.31Å; L236-F307 HydrophobicContact CD2-CB 4.41Å
237	D	71.5	Confident	69.9	Low	101 Å²	101	51 Å²	51	54%	0.54	26%	0.262	S	S	.	.	H	α-helix	trans	-64.7	-43.6	175.5	-103.1	-20.3	0	0	0	112	A233 R234 F239 V240 Q241	A233-D237 PolarHBondContact O-N 3.11Å; R234-D237 PolarHBondContact O-N 3.41Å; R234-D237 VanDerWaalsContact O-N 3.17Å; D237-F239 VanDerWaalsContact C-N 3.33Å; D237-F239 PolarHBondContact O-N 2.96Å; D237-V240 PolarHBondContact O-N 3.48Å; D237-Q241 WeakPolarHBondContact O-CB 3.4Å; D237-Q241 PolarHBondContact O-N 3.16Å
238	E	68.9	Low	69.8	Low	121 Å²	121	51.5 Å²	51.5	57%	0.565	26%	0.262	S	S	*	.	H	α-helix	trans	-62.2	-40.6	174.2	-72.3	178.4	-161.2	0	0	111.3	R234 Q241 S242	R234-E238 WeakPolarHBondContact CD-OE1 3.28Å; R234-E238 HydrophobicContact CG-CG 4.49Å; R234-E238 WeakPolarHBondContact CG-OE1 3.27Å; R234-E238 WeakPolarHBondContact O-CB 3.1Å; R234-E238 WeakPolarHBondContact O-CG 3.47Å; R234-E238 PolarHBondContact O-N 2.87Å; E238-Q241 PolarHBondContact O-N 3.44Å; E238-S242 PolarHBondContact O-N 2.89Å
239	F	70.1	Confident	69.8	Low	22 Å²	22	51.3 Å²	51.3	10%	0.096	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-45.8	174.8	179.3	-100.5	0	0	0	112.5	L20 T235 L236 D237 Q241 S242 L243 L266 F307	L20-F239 HydrophobicContact CD1-CB 4.09Å; L20-F239 HydrophobicContact CD1-CD2 3.81Å; L20-F239 HydrophobicContact CD1-CG 3.83Å; T235-F239 WeakPolarHBondContact O-CB 3.47Å; T235-F239 PolarHBondContact O-N 3.48Å; L236-F239 PolarHBondContact O-N 3.44Å; D237-F239 VanDerWaalsContact C-N 3.33Å; D237-F239 PolarHBondContact O-N 2.96Å; F239-Q241 VanDerWaalsContact C-N 3.26Å; F239-Q241 PolarHBondContact O-N 3.25Å; F239-S242 WeakPolarHBondContact O-CA 3.33Å; F239-S242 WeakPolarHBondContact O-CB 3.41Å; F239-S242 PolarHBondContact O-N 2.82Å; F239-S242 VanDerWaalsContact O-N 3.07Å; F239-S242 PolarHBondContact O-OG 2.65Å; F239-L243 HydrophobicContact CD1-CD1 4.34Å; F239-L243 HydrophobicContact CD1-CG 4.49Å; F239-L243 HydrophobicContact CE1-CD1 3.45Å; F239-L243 VanDerWaalsContact CE1-CD1 3.45Å; F239-L243 HydrophobicContact CE1-CD2 4.32Å; F239-L243 HydrophobicContact CE1-CG 3.74Å; F239-L243 HydrophobicContact CE2-CD2 4.4Å; F239-L243 HydrophobicContact CE2-CG 4.38Å; F239-L243 HydrophobicContact CZ-CD1 3.76Å; F239-L243 HydrophobicContact CZ-CD2 3.75Å; F239-L243 HydrophobicContact CZ-CG 3.65Å; F239-L243 PolarHBondContact O-N 3.47Å; F239-L266 HydrophobicContact CD1-CD2 4.35Å; F239-L266 HydrophobicContact CE1-CD1 3.91Å; F239-L266 HydrophobicContact CE1-CD2 3.41Å; F239-L266 VanDerWaalsContact CE1-CD2 3.41Å; F239-L266 HydrophobicContact CE1-CG 4.3Å; F239-L266 HydrophobicContact CE2-CD2 4.16Å; F239-L266 HydrophobicContact CZ-CD1 3.58Å; F239-L266 HydrophobicContact CZ-CD2 3.32Å; F239-L266 HydrophobicContact CZ-CG 4.09Å; F239-F307 HydrophobicContact CD1-CE2 4.43Å; F239-F307 HydrophobicContact CE1-CE2 4.16Å
240	V	74.3	Confident	69.8	Low	3 Å²	3	54.1 Å²	54.1	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-60	-37.3	174.2	164.3	0	0	0	0	111.2	L236 D237 L243 K244 F307 F310	L236-V240 HydrophobicContact CD1-CG2 4.45Å; L236-V240 WeakPolarHBondContact O-CB 3.4Å; L236-V240 WeakPolarHBondContact O-CG2 3.14Å; L236-V240 PolarHBondContact O-N 2.68Å; D237-V240 PolarHBondContact O-N 3.48Å; V240-L243 PolarHBondContact O-N 3.15Å; V240-K244 HydrophobicContact CG1-CD 4.21Å; V240-K244 VanDerWaalsContact CG1-CE 3.42Å; V240-K244 WeakPolarHBondContact O-CG 3.46Å; V240-K244 PolarHBondContact O-N 3.37Å; V240-K244 VanDerWaalsContact O-N 3.11Å; V240-F307 HydrophobicContact CG2-CB 4.49Å; V240-F307 HydrophobicContact CG2-CD2 3.65Å; V240-F307 HydrophobicContact CG2-CE2 4.44Å; V240-F310 HydrophobicContact CG1-CD1 4.09Å; V240-F310 HydrophobicContact CG1-CE1 4.37Å; V240-F310 HydrophobicContact CG1-CG 4.35Å; V240-F310 HydrophobicContact CG2-CD1 4.5Å
241	Q	76.1	Confident	70	Confident	87 Å²	87	53.2 Å²	53.2	41%	0.407	27%	0.272	S	S	.	.	H	α-helix	trans	-66.3	-40.3	173.7	-171.7	56.5	33.1	0	0	111.6	D237 E238 F239 L243 K244 D245	D237-Q241 WeakPolarHBondContact O-CB 3.4Å; D237-Q241 PolarHBondContact O-N 3.16Å; E238-Q241 PolarHBondContact O-N 3.44Å; F239-Q241 VanDerWaalsContact C-N 3.26Å; F239-Q241 PolarHBondContact O-N 3.25Å; Q241-L243 VanDerWaalsContact C-N 3.31Å; Q241-L243 PolarHBondContact O-N 3.41Å; Q241-K244 PolarHBondContact O-N 2.88Å; Q241-D245 PolarHBondContact NE2-OD1 2.9Å; Q241-D245 VanDerWaalsContact NE2-OD1 3.15Å; Q241-D245 PolarHBondContact NE2-OD2 2.85Å; Q241-D245 WeakPolarHBondContact O-CB 3.41Å; Q241-D245 PolarHBondContact O-N 3.42Å
242	S	71.4	Confident	70.6	Confident	47 Å²	47	52.9 Å²	52.9	33%	0.329	27%	0.267	S	S	.	.	H	α-helix	trans	-60.7	-37.1	174.4	84.5	0	0	0	0	113.1	E238 F239 T246	E238-S242 PolarHBondContact O-N 2.89Å; F239-S242 WeakPolarHBondContact O-CA 3.33Å; F239-S242 WeakPolarHBondContact O-CB 3.41Å; F239-S242 PolarHBondContact O-N 2.82Å; F239-S242 VanDerWaalsContact O-N 3.07Å; F239-S242 PolarHBondContact O-OG 2.65Å; S242-T246 PolarHBondContact O-N 2.87Å; S242-T246 PolarHBondContact O-OG1 2.92Å
243	L	73.6	Confident	71.2	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-67.4	-42.7	174	-71.1	-173.8	0	0	0	112.3	F239 V240 Q241 D245 T246 L266 F307 F310 W311 H314	F239-L243 HydrophobicContact CD1-CD1 4.34Å; F239-L243 HydrophobicContact CD1-CG 4.49Å; F239-L243 HydrophobicContact CE1-CD1 3.45Å; F239-L243 VanDerWaalsContact CE1-CD1 3.45Å; F239-L243 HydrophobicContact CE1-CD2 4.32Å; F239-L243 HydrophobicContact CE1-CG 3.74Å; F239-L243 HydrophobicContact CE2-CD2 4.4Å; F239-L243 HydrophobicContact CE2-CG 4.38Å; F239-L243 HydrophobicContact CZ-CD1 3.76Å; F239-L243 HydrophobicContact CZ-CD2 3.75Å; F239-L243 HydrophobicContact CZ-CG 3.65Å; F239-L243 PolarHBondContact O-N 3.47Å; V240-L243 PolarHBondContact O-N 3.15Å; Q241-L243 VanDerWaalsContact C-N 3.31Å; Q241-L243 PolarHBondContact O-N 3.41Å; L243-D245 PolarHBondContact O-N 2.89Å; L243-T246 WeakPolarHBondContact O-CB 3.37Å; L243-T246 PolarHBondContact O-N 3.14Å; L243-T246 PolarHBondContact O-OG1 3.32Å; L243-L266 HydrophobicContact CD1-CD1 4.46Å; L243-F307 HydrophobicContact CD1-CE2 4.44Å; L243-F310 HydrophobicContact CB-CE1 3.78Å; L243-F310 HydrophobicContact CB-CZ 3.99Å; L243-F310 HydrophobicContact CD1-CE1 3.91Å; L243-W311 HydrophobicContact CD1-CE3 4.49Å; L243-W311 HydrophobicContact CD1-CZ3 4.03Å; L243-H314 PolarHBondContact O-CE1 3.44Å; L243-H314 VanDerWaalsContact O-CE1 3.26Å
244	K	77.4	Confident	71.5	Confident	87 Å²	87	56.2 Å²	56.2	38%	0.378	29%	0.292	S	S	.	.	H	α-helix	trans	-59.4	-47.1	176.3	-71.9	164.4	-175	165.4	0	111.3	V240 Q241 T246 F310 R317	V240-K244 HydrophobicContact CG1-CD 4.21Å; V240-K244 VanDerWaalsContact CG1-CE 3.42Å; V240-K244 WeakPolarHBondContact O-CG 3.46Å; V240-K244 PolarHBondContact O-N 3.37Å; V240-K244 VanDerWaalsContact O-N 3.11Å; Q241-K244 PolarHBondContact O-N 2.88Å; K244-T246 VanDerWaalsContact C-N 3.29Å; K244-T246 PolarHBondContact O-N 2.97Å; K244-F310 HydrophobicContact CD-CE2 4.3Å; K244-F310 HydrophobicContact CG-CD2 4.4Å; K244-F310 HydrophobicContact CG-CE2 3.51Å; K244-F310 HydrophobicContact CG-CZ 3.64Å; K244-R317 PolarHBondContact O-NH1 3.01Å; K244-R317 VanDerWaalsContact O-NH1 3.09Å
245	D	73.2	Confident	71.7	Confident	111 Å²	111	50 Å²	50	59%	0.594	27%	0.268	S	S	*	.	H	α-helix	trans	-80.6	-2.4	-177.5	-68.3	-20.4	0	0	0	114	Q241 L243 E247	Q241-D245 PolarHBondContact NE2-OD1 2.9Å; Q241-D245 VanDerWaalsContact NE2-OD1 3.15Å; Q241-D245 PolarHBondContact NE2-OD2 2.85Å; Q241-D245 WeakPolarHBondContact O-CB 3.41Å; Q241-D245 PolarHBondContact O-N 3.42Å; L243-D245 PolarHBondContact O-N 2.89Å; D245-E247 PolarHBondContact O-N 3.37Å
246	T	68.6	Low	72.1	Confident	33 Å²	33	50.7 Å²	50.7	20%	0.202	28%	0.276	C	S	.	.			trans	-59.8	111.5	174.3	-66.3	0	0	0	0	110.4	S242 L243 K244 L248 R317	S242-T246 PolarHBondContact O-N 2.87Å; S242-T246 PolarHBondContact O-OG1 2.92Å; L243-T246 WeakPolarHBondContact O-CB 3.37Å; L243-T246 PolarHBondContact O-N 3.14Å; L243-T246 PolarHBondContact O-OG1 3.32Å; K244-T246 VanDerWaalsContact C-N 3.29Å; K244-T246 PolarHBondContact O-N 2.97Å; T246-L248 PolarHBondContact O-N 3.5Å; T246-R317 PolarHBondContact O-NH2 3.34Å
247	E	64.5	Low	72.4	Confident	96 Å²	96	55.5 Å²	55.5	45%	0.449	30%	0.298	S	S	.	.			trans	-71.1	115.7	172.3	-71	-172.4	-125	0	0	109.4	D245 R903	D245-E247 PolarHBondContact O-N 3.37Å; E247-R903 WeakPolarHBondContact OE1-CD 3.4Å; E247-R903 IonicContact OE1-CZ 3.74Å; E247-R903 IonicContact OE1-NE 3.64Å; E247-R903 IonicContact OE1-NH1 2.68Å; E247-R903 PolarHBondContact OE1-NH1 3.27Å
248	L	67.2	Low	72.4	Confident	44 Å²	44	52.4 Å²	52.4	23%	0.23	28%	0.281	C	S	.	.			trans	-65.8	128.8	-174.9	-64.4	163.8	0	0	0	111.4	T246 R317 L318 C321	T246-L248 PolarHBondContact O-N 3.5Å; L248-R317 HydrophobicContact CD1-CG 4.01Å; L248-L318 HydrophobicContact CD2-CD2 3.54Å; L248-L318 HydrophobicContact CD2-CG 4.21Å; L248-C321 HydrophobicContact CB-CB 4.43Å; L248-C321 HydrophobicContact CD1-CB 4.09Å; L248-C321 HydrophobicContact CD2-CB 4.36Å
249	P	65.6	Low	72.5	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.013	26%	0.258	C	S	.	.			trans	-54.3	147.4	-173.2	-28.8	35.4	0	0	0	115	D251 T254 I258 R325 S905	P249-D251 WeakPolarHBondContact CB-OD1 3.41Å; P249-D251 PolarHBondContact O-N 2.91Å; P249-T254 HydrophobicContact CB-CG2 4.16Å; P249-T254 HydrophobicContact CG-CG2 3.81Å; P249-I258 HydrophobicContact CG-CD1 3.5Å; P249-R325 WeakPolarHBondContact O-CD 3.44Å; P249-R325 PolarHBondContact O-NH1 3.5Å; P249-S905 WeakPolarHBondContact CB-OG 3.22Å
250	N	69.1	Low	72.5	Confident	61 Å²	61	50.1 Å²	50.1	33%	0.326	28%	0.276	S	S	.	.	S	Bend	trans	-82.5	6.6	178.6	-66.3	-73.9	0	0	0	113.1	R325 R902 R903	N250-R325 VanDerWaalsContact O-CD 3.29Å; N250-R325 WeakPolarHBondContact O-CD 3.38Å; N250-R902 PolarHBondContact OD1-NH1 3.43Å; N250-R903 PolarHBondContact ND2-O 2.93Å
251	D	74	Confident	72.1	Confident	47 Å²	47	50.9 Å²	50.9	25%	0.251	28%	0.282	S	S	.	.	S	Bend	trans	-132.8	157.2	-178.7	67.1	-72.1	0	0	0	112.3	P249 S253 T254 T255 S905	P249-D251 WeakPolarHBondContact CB-OD1 3.41Å; P249-D251 PolarHBondContact O-N 2.91Å; D251-S253 PolarHBondContact OD2-N 3.27Å; D251-T254 VanDerWaalsContact CG-OG1 3.31Å; D251-T254 WeakPolarHBondContact OD1-CB 3.4Å; D251-T254 PolarHBondContact OD1-OG1 3.02Å; D251-T254 WeakPolarHBondContact OD2-CB 3.41Å; D251-T254 PolarHBondContact OD2-N 2.96Å; D251-T254 PolarHBondContact OD2-OG1 3.15Å; D251-T255 PolarHBondContact O-N 3.43Å; D251-T255 PolarHBondContact O-OG1 3.25Å; D251-S905 PolarHBondContact OD1-OG 3.18Å; D251-S905 VanDerWaalsContact OD1-OG 3.11Å
252	A	76.8	Confident	71.7	Confident	10 Å²	10	48 Å²	48	8%	0.083	27%	0.269	C	S	.	.	H	α-helix	trans	-74.3	-40.6	-177.1	0	0	0	0	0	112.8	T255 A256 L322 R325 Q326	A252-T255 PolarHBondContact O-N 2.91Å; A252-A256 PolarHBondContact O-N 3.18Å; A252-L322 HydrophobicContact CB-CD1 4.16Å; A252-L322 VanDerWaalsContact O-CD1 3.23Å; A252-L322 WeakPolarHBondContact O-CD1 3.32Å; A252-R325 HydrophobicContact CB-CB 4.03Å; A252-Q326 HydrophobicContact CB-CG 3.84Å
253	S	77.8	Confident	71.5	Confident	95 Å²	95	51.1 Å²	51.1	66%	0.664	27%	0.273	S	S	*	.	H	α-helix	trans	-59.9	-52.3	-176.1	-173.1	0	0	0	0	112.1	D251 T255 A256 H257	D251-S253 PolarHBondContact OD2-N 3.27Å; S253-T255 VanDerWaalsContact C-N 3.32Å; S253-T255 PolarHBondContact O-N 2.61Å; S253-A256 WeakPolarHBondContact O-CB 3.33Å; S253-A256 PolarHBondContact O-N 3.03Å; S253-H257 PolarHBondContact O-N 2.9Å
254	T	75	Confident	70.6	Confident	41 Å²	41	58.7 Å²	58.7	25%	0.252	31%	0.306	S	S	.	.	H	α-helix	trans	-68.9	-32.5	-179.8	-44.4	0	0	0	0	111.5	P249 D251 A256 H257 I258	P249-T254 HydrophobicContact CB-CG2 4.16Å; P249-T254 HydrophobicContact CG-CG2 3.81Å; D251-T254 VanDerWaalsContact CG-OG1 3.31Å; D251-T254 WeakPolarHBondContact OD1-CB 3.4Å; D251-T254 PolarHBondContact OD1-OG1 3.02Å; D251-T254 WeakPolarHBondContact OD2-CB 3.41Å; D251-T254 PolarHBondContact OD2-N 2.96Å; D251-T254 PolarHBondContact OD2-OG1 3.15Å; T254-A256 VanDerWaalsContact C-N 3.34Å; T254-H257 PolarHBondContact O-N 3.49Å; T254-I258 HydrophobicContact CG2-CD1 4.49Å; T254-I258 WeakPolarHBondContact O-CG1 3.48Å; T254-I258 PolarHBondContact O-N 3.04Å
255	T	74.3	Confident	69.6	Low	0 Å²	0	56 Å²	56	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-40.7	173.6	-51.9	0	0	0	0	111.1	D251 A252 S253 L259 C321 L322	D251-T255 PolarHBondContact O-N 3.43Å; D251-T255 PolarHBondContact O-OG1 3.25Å; A252-T255 PolarHBondContact O-N 2.91Å; S253-T255 VanDerWaalsContact C-N 3.32Å; S253-T255 PolarHBondContact O-N 2.61Å; T255-L259 PolarHBondContact O-N 3.13Å; T255-L259 VanDerWaalsContact O-N 3.09Å; T255-C321 HydrophobicContact CG2-CB 3.97Å; T255-L322 HydrophobicContact CG2-CB 3.91Å
256	A	75.6	Confident	68.8	Low	34 Å²	34	51 Å²	51	28%	0.281	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-42.3	174.4	0	0	0	0	0	112.2	A252 S253 T254 I258 L259 T260 L322	A252-A256 PolarHBondContact O-N 3.18Å; S253-A256 WeakPolarHBondContact O-CB 3.33Å; S253-A256 PolarHBondContact O-N 3.03Å; T254-A256 VanDerWaalsContact C-N 3.34Å; A256-I258 PolarHBondContact O-N 3.33Å; A256-L259 PolarHBondContact O-N 3.5Å; A256-T260 PolarHBondContact O-N 3.06Å; A256-T260 PolarHBondContact O-OG1 2.66Å; A256-L322 HydrophobicContact CB-CD1 3.96Å; A256-L322 HydrophobicContact CB-CD2 4.05Å
257	H	76.1	Confident	68	Low	122 Å²	122	52.1 Å²	52.1	57%	0.565	27%	0.273	S	S	*	.	H	α-helix	trans	-64	-37.1	177.3	-168.9	-43	0	0	0	112.7	S253 T254 T260 S261	S253-H257 PolarHBondContact O-N 2.9Å; T254-H257 PolarHBondContact O-N 3.49Å; H257-T260 WeakPolarHBondContact CA-OG1 3.38Å; H257-T260 PolarHBondContact O-OG1 3.45Å; H257-T260 VanDerWaalsContact O-OG1 3.13Å; H257-S261 PolarHBondContact O-N 2.84Å; H257-S261 VanDerWaalsContact O-N 3.15Å
258	I	70.5	Confident	67.4	Low	35 Å²	35	54 Å²	54	18%	0.179	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-46.1	173.2	-70	179.2	0	0	0	109.9	P249 T254 A256 T260 Q262 L318	P249-I258 HydrophobicContact CG-CD1 3.5Å; T254-I258 HydrophobicContact CG2-CD1 4.49Å; T254-I258 WeakPolarHBondContact O-CG1 3.48Å; T254-I258 PolarHBondContact O-N 3.04Å; A256-I258 PolarHBondContact O-N 3.33Å; I258-T260 PolarHBondContact O-N 3.49Å; I258-Q262 HydrophobicContact CG2-CG 4.14Å; I258-Q262 WeakPolarHBondContact O-CB 3.32Å; I258-Q262 VanDerWaalsContact O-CG 3.26Å; I258-Q262 WeakPolarHBondContact O-CG 3.47Å; I258-Q262 PolarHBondContact O-N 2.92Å; I258-L318 HydrophobicContact CB-CD2 4.37Å; I258-L318 HydrophobicContact CG2-CD1 4.24Å; I258-L318 HydrophobicContact CG2-CD2 3.65Å
259	L	71.1	Confident	66.5	Low	18 Å²	18	54.8 Å²	54.8	9%	0.094	29%	0.293	C	S	.	.	H	α-helix	trans	-59.8	-41.5	178.3	-177.3	69.6	0	0	0	112.4	T255 A256 R263 E315 L318 E319 L322	T255-L259 PolarHBondContact O-N 3.13Å; T255-L259 VanDerWaalsContact O-N 3.09Å; A256-L259 PolarHBondContact O-N 3.5Å; L259-R263 HydrophobicContact CD1-CG 4.35Å; L259-R263 VanDerWaalsContact O-CB 3.28Å; L259-R263 WeakPolarHBondContact O-CB 3.29Å; L259-R263 VanDerWaalsContact O-CG 3.24Å; L259-R263 WeakPolarHBondContact O-CG 3.38Å; L259-R263 PolarHBondContact O-N 3.12Å; L259-E315 HydrophobicContact CD1-CG 4.11Å; L259-L318 HydrophobicContact CD1-CB 3.79Å; L259-L318 HydrophobicContact CD1-CD1 4.37Å; L259-E319 HydrophobicContact CD1-CG 4.21Å; L259-E319 HydrophobicContact CD2-CG 3.9Å; L259-L322 HydrophobicContact CD2-CD2 4.39Å
260	T	71.2	Confident	65.6	Low	77 Å²	77	57.7 Å²	57.7	47%	0.472	31%	0.311	S	S	.	.	H	α-helix	trans	-71.1	-49.7	-179.1	52.1	0	0	0	0	113	A256 H257 I258 R263 F264	A256-T260 PolarHBondContact O-N 3.06Å; A256-T260 PolarHBondContact O-OG1 2.66Å; H257-T260 WeakPolarHBondContact CA-OG1 3.38Å; H257-T260 PolarHBondContact O-OG1 3.45Å; H257-T260 VanDerWaalsContact O-OG1 3.13Å; I258-T260 PolarHBondContact O-N 3.49Å; T260-R263 PolarHBondContact O-N 2.88Å; T260-F264 PolarHBondContact O-N 3.42Å
261	S	66.1	Low	64.5	Low	20 Å²	20	60.3 Å²	60.3	14%	0.14	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-46.5	177	169.3	0	0	0	0	110.9	H257 R263 F264 D265	H257-S261 PolarHBondContact O-N 2.84Å; H257-S261 VanDerWaalsContact O-N 3.15Å; S261-R263 PolarHBondContact O-N 2.98Å; S261-F264 PolarHBondContact O-N 3.12Å; S261-D265 WeakPolarHBondContact CA-OD2 3.4Å; S261-D265 WeakPolarHBondContact CB-OD2 3.4Å; S261-D265 WeakPolarHBondContact O-CB 3.42Å; S261-D265 VanDerWaalsContact O-CG 3.23Å; S261-D265 PolarHBondContact O-N 3.34Å; S261-D265 PolarHBondContact OG-OD2 2.8Å
262	Q	67.6	Low	62.9	Low	27 Å²	27	63.3 Å²	63.3	13%	0.126	33%	0.328	C	S	.	.	H	α-helix	trans	-62.8	-40.7	179.7	-68.5	-170	0.4	0	0	111.7	I258 L266 W311 H314	I258-Q262 HydrophobicContact CG2-CG 4.14Å; I258-Q262 WeakPolarHBondContact O-CB 3.32Å; I258-Q262 VanDerWaalsContact O-CG 3.26Å; I258-Q262 WeakPolarHBondContact O-CG 3.47Å; I258-Q262 PolarHBondContact O-N 2.92Å; Q262-L266 HydrophobicContact CB-CD1 4.16Å; Q262-L266 HydrophobicContact CG-CD1 4.24Å; Q262-W311 HydrophobicContact CB-CH2 3.92Å; Q262-W311 WeakPolarHBondContact O-CH2 3.49Å; Q262-H314 PolarHBondContact OE1-NE2 2.97Å
263	R	65.7	Low	60.8	Low	112 Å²	112	69.4 Å²	69.4	42%	0.423	36%	0.364	S	S	.	.	H	α-helix	trans	-65.1	-38.9	175.2	-78.1	174	64.8	123.9	12	114.3	L259 T260 S261 E315 E319	L259-R263 HydrophobicContact CD1-CG 4.35Å; L259-R263 VanDerWaalsContact O-CB 3.28Å; L259-R263 WeakPolarHBondContact O-CB 3.29Å; L259-R263 VanDerWaalsContact O-CG 3.24Å; L259-R263 WeakPolarHBondContact O-CG 3.38Å; L259-R263 PolarHBondContact O-N 3.12Å; T260-R263 PolarHBondContact O-N 2.88Å; S261-R263 PolarHBondContact O-N 2.98Å; R263-E315 WeakPolarHBondContact CD-OE1 3.13Å; R263-E315 HydrophobicContact CG-CG 4.37Å; R263-E315 IonicContact CZ-OE1 3.61Å; R263-E315 IonicContact NE-OE1 2.73Å; R263-E315 PolarHBondContact NE-OE1 3.39Å; R263-E315 IonicContact NH1-OE1 3.17Å; R263-E315 PolarHBondContact NH1-OE1 2.79Å; R263-E315 IonicContact NH2-OE1 3.39Å; R263-E319 IonicContact NH1-OE1 3.91Å
264	F	55.5	Low	58.7	Low	161 Å²	161	71.2 Å²	71.2	71%	0.706	37%	0.366	S	S	*	.	H	α-helix	trans	-87.2	-36.7	-173.7	-91.8	-90	0	0	0	114.5	T260 S261	T260-F264 PolarHBondContact O-N 3.42Å; S261-F264 PolarHBondContact O-N 3.12Å
265	D	56.1	Low	56.8	Low	29 Å²	29	74.8 Å²	74.8	16%	0.155	39%	0.393	C	S	.	.	H	α-helix	trans	-86.3	-41.4	-168.2	-56.4	-37.1	0	0	0	112.4	T13 Q17 S261 A269	T13-D265 WeakPolarHBondContact CG2-OD2 3.47Å; Q17-D265 PolarHBondContact NE2-OD2 3.38Å; S261-D265 WeakPolarHBondContact CA-OD2 3.4Å; S261-D265 WeakPolarHBondContact CB-OD2 3.4Å; S261-D265 WeakPolarHBondContact O-CB 3.42Å; S261-D265 VanDerWaalsContact O-CG 3.23Å; S261-D265 PolarHBondContact O-N 3.34Å; S261-D265 PolarHBondContact OG-OD2 2.8Å; D265-A269 VanDerWaalsContact O-CB 3.32Å; D265-A269 WeakPolarHBondContact O-CB 3.38Å; D265-A269 PolarHBondContact O-N 3.45Å
266	L	55.5	Low	54.9	Low	8 Å²	8	81.6 Å²	81.6	4%	0.042	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-52.2	-166.9	-73.5	161.8	0	0	0	113.7	F239 L243 Q262 K268 A269 V270 W311	F239-L266 HydrophobicContact CD1-CD2 4.35Å; F239-L266 HydrophobicContact CE1-CD1 3.91Å; F239-L266 HydrophobicContact CE1-CD2 3.41Å; F239-L266 VanDerWaalsContact CE1-CD2 3.41Å; F239-L266 HydrophobicContact CE1-CG 4.3Å; F239-L266 HydrophobicContact CE2-CD2 4.16Å; F239-L266 HydrophobicContact CZ-CD1 3.58Å; F239-L266 HydrophobicContact CZ-CD2 3.32Å; F239-L266 HydrophobicContact CZ-CG 4.09Å; L243-L266 HydrophobicContact CD1-CD1 4.46Å; Q262-L266 HydrophobicContact CB-CD1 4.16Å; Q262-L266 HydrophobicContact CG-CD1 4.24Å; L266-K268 PolarHBondContact O-N 3.05Å; L266-A269 PolarHBondContact O-N 3.23Å; L266-A269 VanDerWaalsContact O-N 3.09Å; L266-V270 PolarHBondContact O-N 2.83Å; L266-W311 HydrophobicContact CB-CH2 4.32Å; L266-W311 HydrophobicContact CB-CZ3 4.33Å; L266-W311 HydrophobicContact CD1-CH2 3.82Å; L266-W311 HydrophobicContact CD1-CZ3 3.69Å
267	L	52.4	Low	53	Low	55 Å²	55	85.6 Å²	85.6	29%	0.288	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-13.8	-179.9	-68.1	170.1	0	0	0	113.2	F307 W311	L267-F307 HydrophobicContact CD2-CE1 4.38Å; L267-W311 HydrophobicContact CD1-CZ2 4.48Å
268	K	52.8	Low	51.5	Low	137 Å²	137	86 Å²	86	60%	0.596	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	10	-178.6	-148.4	179.9	178.5	176.9	0	113.9	R6 L266	R6-K268 PolarHBondContact NH1-O 2.68Å; R6-K268 PolarHBondContact NH2-O 3.41Å; L266-K268 PolarHBondContact O-N 3.05Å
269	A	47.1	Very low	50.3	Low	60 Å²	60	86.9 Å²	86.9	50%	0.496	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-43.8	171.1	0	0	0	0	0	111.7	D265 L266	D265-A269 VanDerWaalsContact O-CB 3.32Å; D265-A269 WeakPolarHBondContact O-CB 3.38Å; D265-A269 PolarHBondContact O-N 3.45Å; L266-A269 PolarHBondContact O-N 3.23Å; L266-A269 VanDerWaalsContact O-N 3.09Å
270	V	47.1	Very low	49.2	Very low	63 Å²	63	93.1 Å²	93.1	38%	0.382	50%	0.498	S	S	.	.	S	Bend	trans	-73.7	-35.5	-177.2	-179.3	0	0	0	0	112.7	L266 Q272	L266-V270 PolarHBondContact O-N 2.83Å; V270-Q272 PolarHBondContact O-N 3.2Å
271	R	47	Very low	48	Very low	115 Å²	115	97.6 Å²	97.6	43%	0.434	51%	0.514	S	S	.	.			trans	-92.8	101.1	-171	-68.9	177.8	175.5	170.4	-3.2	113.1	D308	R271-D308 IonicContact CZ-OD1 3.41Å; R271-D308 IonicContact CZ-OD2 2.72Å; R271-D308 IonicContact NE-OD1 3.41Å; R271-D308 IonicContact NH2-OD1 2.71Å; R271-D308 PolarHBondContact NH2-OD1 3.29Å; R271-D308 IonicContact NH2-OD2 3.95Å; R271-D308 PolarHBondContact NH2-OD2 3.02Å
272	Q	39.8	Very low	47	Very low	111 Å²	111	100.1 Å²	100.1	52%	0.519	53%	0.525	S	S	.	.			trans	-130.4	129	153.9	-67.8	-169.4	45.6	0	0	109.1	V270	V270-Q272 PolarHBondContact O-N 3.2Å
273	V	32.5	Very low	45.9	Very low	138 Å²	138	101.1 Å²	101.1	84%	0.836	54%	0.535	S	S	*	.			trans	-107.5	114.1	-172.9	178.2	0	0	0	0	108.9
274	D	33.1	Very low	45	Very low	132 Å²	132	101.1 Å²	101.1	71%	0.706	55%	0.55	S	S	*	.			trans	-111.6	153.1	170.3	-88.7	-44.2	0	0	0	111.2
275	S	36	Very low	44.9	Very low	116 Å²	116	95.5 Å²	95.5	81%	0.811	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-84	139.3	-168.4	51.6	0	0	0	0	114
276	K	34.5	Very low	44.8	Very low	143 Å²	143	98.8 Å²	98.8	62%	0.622	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-77.9	123	-176.2	-157.5	168.3	-168.1	162.5	0	110.6
277	P	35.3	Very low	44.8	Very low	118 Å²	118	103.5 Å²	103.5	77%	0.766	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-74.8	149.4	179.7	29.4	-34.5	0	0	0	112.7
278	N	43.9	Very low	45.1	Very low	130 Å²	130	103.1 Å²	103.1	70%	0.695	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-73.2	147.2	178.9	-77.3	-17.2	0	0	0	112.6
279	A	45.1	Very low	45.6	Very low	54 Å²	54	97.2 Å²	97.2	45%	0.446	54%	0.535	S	S	.	.	S	Bend	trans	-78.7	-22.5	-171.8	0	0	0	0	0	114.7	Q281	A279-Q281 PolarHBondContact O-N 3.01Å
280	D	49.5	Very low	46.4	Very low	150 Å²	150	95.7 Å²	95.7	80%	0.802	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	7.4	-159.5	-47.4	-53.3	0	0	0	115.5
281	Q	46	Very low	47.4	Very low	171 Å²	171	95.1 Å²	95.1	80%	0.799	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.1	14.1	-174.3	-61.3	-174.2	-6.3	0	0	113.6	A279	A279-Q281 PolarHBondContact O-N 3.01Å
282	L	45.2	Very low	48.3	Very low	72 Å²	72	90.6 Å²	90.6	38%	0.377	50%	0.502	S	S	.	.			trans	-123.1	125.5	-162	-58.4	171.7	0	0	0	111.2	R286 V290	L282-R286 HydrophobicContact CB-CB 4.04Å; L282-V290 HydrophobicContact CB-CG2 4.47Å; L282-V290 HydrophobicContact CD1-CG2 3.47Å; L282-V290 VanDerWaalsContact CD1-CG2 3.47Å
283	S	44.4	Very low	49.6	Very low	49 Å²	49	87.3 Å²	87.3	34%	0.343	49%	0.49	S	S	.	.			trans	-64	161.9	-176.4	63.6	0	0	0	0	112.9	T285 R286 L287	S283-T285 PolarHBondContact O-N 3.27Å; S283-T285 VanDerWaalsContact O-N 3.12Å; S283-R286 WeakPolarHBondContact O-CA 3.32Å; S283-R286 WeakPolarHBondContact O-CB 3.36Å; S283-R286 PolarHBondContact O-N 2.82Å; S283-R286 WeakPolarHBondContact OG-CG 3.34Å; S283-L287 PolarHBondContact O-N 2.86Å
284	P	46.1	Very low	51.3	Low	111 Å²	111	85 Å²	85	72%	0.721	47%	0.47	S	S	*	.	H	α-helix	trans	-54.6	-35.1	-178.8	-28.4	36.4	0	0	0	114.2	R286 L287	P284-R286 VanDerWaalsContact C-N 3.32Å; P284-R286 PolarHBondContact O-N 3.31Å; P284-L287 WeakPolarHBondContact O-CB 3.28Å; P284-L287 PolarHBondContact O-N 3.38Å
285	T	52.7	Low	53.1	Low	43 Å²	43	84 Å²	84	26%	0.264	46%	0.456	S	S	.	.	H	α-helix	trans	-65.8	-33.6	174.5	-37.8	0	0	0	0	112.4	S283	S283-T285 PolarHBondContact O-N 3.27Å; S283-T285 VanDerWaalsContact O-N 3.12Å
286	R	54.4	Low	54.7	Low	98 Å²	98	78.8 Å²	78.8	37%	0.37	42%	0.419	S	S	.	.	H	α-helix	trans	-75.7	-33	174.8	-66.4	177.7	179.9	-170.7	-4	112.1	L282 S283 P284 H288 N289 V290	L282-R286 HydrophobicContact CB-CB 4.04Å; S283-R286 WeakPolarHBondContact O-CA 3.32Å; S283-R286 WeakPolarHBondContact O-CB 3.36Å; S283-R286 PolarHBondContact O-N 2.82Å; S283-R286 WeakPolarHBondContact OG-CG 3.34Å; P284-R286 VanDerWaalsContact C-N 3.32Å; P284-R286 PolarHBondContact O-N 3.31Å; R286-H288 VanDerWaalsContact C-N 3.26Å; R286-H288 PolarHBondContact O-N 2.96Å; R286-N289 WeakPolarHBondContact O-CA 3.45Å; R286-N289 WeakPolarHBondContact O-CB 3.42Å; R286-N289 PolarHBondContact O-N 2.88Å; R286-V290 WeakPolarHBondContact O-CG2 3.28Å; R286-V290 PolarHBondContact O-N 2.8Å
287	L	55.6	Low	56.4	Low	108 Å²	108	75 Å²	75	57%	0.565	41%	0.406	S	S	*	.	H	α-helix	trans	-52.6	-42.1	-177.9	-175.6	65.5	0	0	0	112.8	S283 P284 N289 V290 T291	S283-L287 PolarHBondContact O-N 2.86Å; P284-L287 WeakPolarHBondContact O-CB 3.28Å; P284-L287 PolarHBondContact O-N 3.38Å; L287-N289 PolarHBondContact O-N 2.99Å; L287-V290 WeakPolarHBondContact O-CB 3.29Å; L287-V290 PolarHBondContact O-N 3.33Å; L287-T291 PolarHBondContact O-N 3.06Å; L287-T291 PolarHBondContact O-OG1 3.45Å; L287-T291 VanDerWaalsContact O-OG1 3.05Å
288	H	58.4	Low	58.3	Low	47 Å²	47	73.4 Å²	73.4	22%	0.218	39%	0.39	C	S	.	.	H	α-helix	trans	-61.2	-43.3	177	-174.4	82	0	0	0	112.8	L125 R286 S292	L125-H288 PolarHBondContact O-CE1 3.42Å; L125-H288 PolarHBondContact O-NE2 2.67Å; R286-H288 VanDerWaalsContact C-N 3.26Å; R286-H288 PolarHBondContact O-N 2.96Å; H288-S292 PolarHBondContact O-N 3.16Å
289	N	64.3	Low	59.6	Low	13 Å²	13	72 Å²	72	7%	0.07	38%	0.38	C	S	.	.	H	α-helix	trans	-68.5	-39.7	176	-73.5	-15.2	0	0	0	111.2	H218 V222 R286 L287 T291 S292 V293	H218-N289 WeakPolarHBondContact CB-ND2 3.46Å; V222-N289 HydrophobicContact CG2-CB 3.89Å; R286-N289 WeakPolarHBondContact O-CA 3.45Å; R286-N289 WeakPolarHBondContact O-CB 3.42Å; R286-N289 PolarHBondContact O-N 2.88Å; L287-N289 PolarHBondContact O-N 2.99Å; N289-T291 PolarHBondContact O-N 3.18Å; N289-S292 PolarHBondContact O-N 2.94Å; N289-V293 WeakPolarHBondContact O-CG2 3.46Å; N289-V293 PolarHBondContact O-N 3.04Å
290	V	63.8	Low	60.8	Low	27 Å²	27	71.1 Å²	71.1	16%	0.164	37%	0.367	C	S	.	.	H	α-helix	trans	-58.6	-45.9	175	171.6	0	0	0	0	111.4	L282 R286 L287 S292 V293 Q294	L282-V290 HydrophobicContact CB-CG2 4.47Å; L282-V290 HydrophobicContact CD1-CG2 3.47Å; L282-V290 VanDerWaalsContact CD1-CG2 3.47Å; R286-V290 WeakPolarHBondContact O-CG2 3.28Å; R286-V290 PolarHBondContact O-N 2.8Å; L287-V290 WeakPolarHBondContact O-CB 3.29Å; L287-V290 PolarHBondContact O-N 3.33Å; V290-S292 VanDerWaalsContact C-N 3.28Å; V290-S292 PolarHBondContact O-N 3.23Å; V290-V293 PolarHBondContact O-N 3.25Å; V290-Q294 HydrophobicContact CG1-CG 4.27Å; V290-Q294 WeakPolarHBondContact O-CB 3.46Å; V290-Q294 VanDerWaalsContact O-CG 3.29Å; V290-Q294 WeakPolarHBondContact O-CG 3.2Å; V290-Q294 PolarHBondContact O-N 3.48Å
291	T	66.9	Low	61.9	Low	52 Å²	52	67.6 Å²	67.6	32%	0.319	35%	0.346	S	S	.	.	H	α-helix	trans	-61.6	-37.9	177.4	-48.8	0	0	0	0	111.7	L287 N289 Q294 R295	L287-T291 PolarHBondContact O-N 3.06Å; L287-T291 PolarHBondContact O-OG1 3.45Å; L287-T291 VanDerWaalsContact O-OG1 3.05Å; N289-T291 PolarHBondContact O-N 3.18Å; T291-Q294 PolarHBondContact O-N 3.08Å; T291-R295 WeakPolarHBondContact O-CG 3.48Å; T291-R295 PolarHBondContact O-N 3.29Å; T291-R295 VanDerWaalsContact O-N 3.12Å
292	S	67.2	Low	63.3	Low	20 Å²	20	64.1 Å²	64.1	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-68.1	-44.5	175.8	-67	0	0	0	0	112.4	H288 N289 V290 Q294 R295 T296	H288-S292 PolarHBondContact O-N 3.16Å; N289-S292 PolarHBondContact O-N 2.94Å; V290-S292 VanDerWaalsContact C-N 3.28Å; V290-S292 PolarHBondContact O-N 3.23Å; S292-Q294 VanDerWaalsContact C-N 3.34Å; S292-Q294 PolarHBondContact O-N 3.07Å; S292-R295 PolarHBondContact O-N 2.99Å; S292-R295 PolarHBondContact OG-NH1 3.03Å; S292-T296 PolarHBondContact O-N 3.43Å; S292-T296 PolarHBondContact O-OG1 3.14Å; S292-T296 VanDerWaalsContact O-OG1 3.05Å
293	V	66.7	Low	64.5	Low	42 Å²	42	61.6 Å²	61.6	26%	0.255	32%	0.322	S	S	.	.	H	α-helix	trans	-58.8	-43.4	172.7	171.7	0	0	0	0	111.6	V222 L225 N289 V290 R295 T296 L297	V222-V293 HydrophobicContact CG2-CG2 3.98Å; L225-V293 HydrophobicContact CD2-CB 4.27Å; L225-V293 HydrophobicContact CD2-CG1 3.88Å; L225-V293 HydrophobicContact CD2-CG2 3.85Å; N289-V293 WeakPolarHBondContact O-CG2 3.46Å; N289-V293 PolarHBondContact O-N 3.04Å; V290-V293 PolarHBondContact O-N 3.25Å; V293-R295 PolarHBondContact O-N 3.24Å; V293-T296 WeakPolarHBondContact O-CB 3.46Å; V293-T296 PolarHBondContact O-N 3.42Å; V293-L297 HydrophobicContact CG1-CD1 3.97Å; V293-L297 HydrophobicContact CG1-CG 4.36Å; V293-L297 WeakPolarHBondContact O-CG 3.3Å; V293-L297 PolarHBondContact O-N 2.92Å
294	Q	68.9	Low	65.7	Low	88 Å²	88	62.7 Å²	62.7	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-41.8	178.2	-76.3	174	-10.3	0	0	112.4	V290 T291 S292 L297 L298	V290-Q294 HydrophobicContact CG1-CG 4.27Å; V290-Q294 WeakPolarHBondContact O-CB 3.46Å; V290-Q294 VanDerWaalsContact O-CG 3.29Å; V290-Q294 WeakPolarHBondContact O-CG 3.2Å; V290-Q294 PolarHBondContact O-N 3.48Å; T291-Q294 PolarHBondContact O-N 3.08Å; S292-Q294 VanDerWaalsContact C-N 3.34Å; S292-Q294 PolarHBondContact O-N 3.07Å; Q294-L297 PolarHBondContact O-N 2.96Å; Q294-L298 WeakPolarHBondContact O-CG 3.5Å; Q294-L298 PolarHBondContact O-N 2.86Å; Q294-L298 VanDerWaalsContact O-N 3.13Å
295	R	71.1	Confident	67.1	Low	113 Å²	113	62.1 Å²	62.1	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-44.5	173.5	-67.4	-173.3	-145.4	101.9	-4.6	111.5	T291 S292 V293 L297 L298 Q299	T291-R295 WeakPolarHBondContact O-CG 3.48Å; T291-R295 PolarHBondContact O-N 3.29Å; T291-R295 VanDerWaalsContact O-N 3.12Å; S292-R295 PolarHBondContact O-N 2.99Å; S292-R295 PolarHBondContact OG-NH1 3.03Å; V293-R295 PolarHBondContact O-N 3.24Å; R295-L297 VanDerWaalsContact C-N 3.35Å; R295-L297 PolarHBondContact O-N 3.42Å; R295-L298 PolarHBondContact O-N 2.89Å; R295-Q299 WeakPolarHBondContact O-CG 3.39Å; R295-Q299 PolarHBondContact O-N 3.31Å
296	T	68.8	Low	68.3	Low	6 Å²	6	63 Å²	63	4%	0.037	32%	0.316	C	S	.	.	H	α-helix	trans	-60.3	-41.7	178.4	-58	0	0	0	0	112.4	A229 S292 V293 Q299 L300	A229-T296 HydrophobicContact CB-CG2 3.3Å; S292-T296 PolarHBondContact O-N 3.43Å; S292-T296 PolarHBondContact O-OG1 3.14Å; S292-T296 VanDerWaalsContact O-OG1 3.05Å; V293-T296 WeakPolarHBondContact O-CB 3.46Å; V293-T296 PolarHBondContact O-N 3.42Å; T296-Q299 PolarHBondContact O-N 3Å; T296-L300 PolarHBondContact O-N 3.38Å
297	L	70	Confident	69.4	Low	63 Å²	63	58.5 Å²	58.5	33%	0.33	30%	0.299	S	S	.	.	H	α-helix	trans	-67.2	-38.8	176.7	-69.5	172.1	0	0	0	112.6	V293 Q294 R295 Q299 L300 E301	V293-L297 HydrophobicContact CG1-CD1 3.97Å; V293-L297 HydrophobicContact CG1-CG 4.36Å; V293-L297 WeakPolarHBondContact O-CG 3.3Å; V293-L297 PolarHBondContact O-N 2.92Å; Q294-L297 PolarHBondContact O-N 2.96Å; R295-L297 VanDerWaalsContact C-N 3.35Å; R295-L297 PolarHBondContact O-N 3.42Å; L297-Q299 VanDerWaalsContact C-N 3.3Å; L297-Q299 PolarHBondContact O-N 3.23Å; L297-L300 PolarHBondContact O-N 3.38Å; L297-E301 PolarHBondContact O-N 2.96Å
298	L	74.6	Confident	70.3	Confident	85 Å²	85	56.3 Å²	56.3	45%	0.445	29%	0.288	S	S	.	.	H	α-helix	trans	-62.7	-35.8	176	-73	167.2	0	0	0	112.4	Q294 R295 L300 E301 D302	Q294-L298 WeakPolarHBondContact O-CG 3.5Å; Q294-L298 PolarHBondContact O-N 2.86Å; Q294-L298 VanDerWaalsContact O-N 3.13Å; R295-L298 PolarHBondContact O-N 2.89Å; L298-L300 VanDerWaalsContact C-N 3.33Å; L298-L300 PolarHBondContact O-N 3.49Å; L298-E301 PolarHBondContact O-N 2.87Å; L298-D302 PolarHBondContact O-N 3.4Å
299	Q	72.7	Confident	71.5	Confident	101 Å²	101	62.7 Å²	62.7	47%	0.472	32%	0.315	S	S	.	.	H	α-helix	trans	-64.7	-35.6	176.3	-68.5	174	-71.1	0	0	112.6	R295 T296 L297 A303	R295-Q299 WeakPolarHBondContact O-CG 3.39Å; R295-Q299 PolarHBondContact O-N 3.31Å; T296-Q299 PolarHBondContact O-N 3Å; L297-Q299 VanDerWaalsContact C-N 3.3Å; L297-Q299 PolarHBondContact O-N 3.23Å; Q299-A303 PolarHBondContact O-N 3.31Å
300	L	70.2	Confident	72.4	Confident	35 Å²	35	63.8 Å²	63.8	18%	0.183	32%	0.319	C	S	.	.	H	α-helix	trans	-71.2	-41.7	173.1	-68.7	171.6	0	0	0	111.6	Y29 A229 I232 A233 T296 L297 L298 D302 A303 E304	Y29-L300 WeakPolarHBondContact OH-CD1 3.45Å; A229-L300 HydrophobicContact CB-CD1 3.82Å; A229-L300 HydrophobicContact CB-CD2 4.15Å; A229-L300 HydrophobicContact CB-CG 4.01Å; I232-L300 HydrophobicContact CB-CD2 4.06Å; I232-L300 HydrophobicContact CG2-CD2 3.96Å; A233-L300 HydrophobicContact CB-CD2 4.47Å; T296-L300 PolarHBondContact O-N 3.38Å; L297-L300 PolarHBondContact O-N 3.38Å; L298-L300 VanDerWaalsContact C-N 3.33Å; L298-L300 PolarHBondContact O-N 3.49Å; L300-D302 VanDerWaalsContact C-N 3.3Å; L300-D302 PolarHBondContact O-N 3.01Å; L300-A303 PolarHBondContact O-N 3.12Å; L300-A303 VanDerWaalsContact O-N 3.16Å; L300-E304 PolarHBondContact O-N 3.47Å
301	E	71.4	Confident	73.3	Confident	75 Å²	75	63.2 Å²	63.2	35%	0.35	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-37.4	178.4	-153.3	-165.2	114.2	0	0	112.1	L297 L298 K305	L297-E301 PolarHBondContact O-N 2.96Å; L298-E301 PolarHBondContact O-N 2.87Å; E301-K305 WeakPolarHBondContact O-CD 3.36Å; E301-K305 WeakPolarHBondContact O-CE 3.33Å; E301-K305 VanDerWaalsContact O-CG 3.25Å; E301-K305 WeakPolarHBondContact O-CG 3.38Å; E301-K305 PolarHBondContact O-N 3.48Å; E301-K305 WeakPolarHBondContact OE1-CE 3.38Å; E301-K305 IonicContact OE1-NZ 3.12Å; E301-K305 PolarHBondContact OE1-NZ 3.47Å
302	D	76.5	Confident	73.9	Confident	98 Å²	98	64.3 Å²	64.3	52%	0.524	32%	0.322	S	S	.	.	H	α-helix	trans	-75.6	-30.1	176	-74.6	-12.9	0	0	0	113.1	L298 L300 K305 S306	L298-D302 PolarHBondContact O-N 3.4Å; L300-D302 VanDerWaalsContact C-N 3.3Å; L300-D302 PolarHBondContact O-N 3.01Å; D302-K305 IonicContact OD1-NZ 3.1Å; D302-K305 PolarHBondContact OD1-NZ 2.91Å; D302-S306 PolarHBondContact O-N 3.33Å; D302-S306 VanDerWaalsContact O-N 3.12Å
303	A	69.7	Low	74.6	Confident	19 Å²	19	69.1 Å²	69.1	16%	0.157	35%	0.346	C	S	.	.	H	α-helix	trans	-68.5	-41.3	172.5	0	0	0	0	0	111.8	A233 L236 Q299 L300 S306 F307	A233-A303 HydrophobicContact CB-CB 4.36Å; L236-A303 HydrophobicContact CD2-CB 4.09Å; Q299-A303 PolarHBondContact O-N 3.31Å; L300-A303 PolarHBondContact O-N 3.12Å; L300-A303 VanDerWaalsContact O-N 3.16Å; A303-S306 VanDerWaalsContact O-CB 3.31Å; A303-S306 WeakPolarHBondContact O-CB 3.25Å; A303-S306 PolarHBondContact O-N 3.02Å; A303-F307 PolarHBondContact O-N 3.44Å
304	E	69.5	Low	75.2	Confident	72 Å²	72	67.2 Å²	67.2	34%	0.336	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-47.5	174	-174	178.2	-161.3	0	0	111.5	L300 S306 F307 D308	L300-E304 PolarHBondContact O-N 3.47Å; E304-S306 PolarHBondContact O-N 2.94Å; E304-F307 WeakPolarHBondContact O-CB 3.43Å; E304-F307 PolarHBondContact O-N 3.02Å; E304-F307 VanDerWaalsContact O-N 3.09Å; E304-D308 PolarHBondContact O-N 3.35Å
305	K	76.5	Confident	75.8	Confident	99 Å²	99	64.8 Å²	64.8	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-59.5	-32.4	175.8	-68.4	164.6	-155.9	155.4	0	113	E301 D302 K309	E301-K305 WeakPolarHBondContact O-CD 3.36Å; E301-K305 WeakPolarHBondContact O-CE 3.33Å; E301-K305 VanDerWaalsContact O-CG 3.25Å; E301-K305 WeakPolarHBondContact O-CG 3.38Å; E301-K305 PolarHBondContact O-N 3.48Å; E301-K305 WeakPolarHBondContact OE1-CE 3.38Å; E301-K305 IonicContact OE1-NZ 3.12Å; E301-K305 PolarHBondContact OE1-NZ 3.47Å; D302-K305 IonicContact OD1-NZ 3.1Å; D302-K305 PolarHBondContact OD1-NZ 2.91Å; K305-K309 WeakPolarHBondContact O-CB 3.47Å; K305-K309 PolarHBondContact O-N 3.21Å
306	S	78.1	Confident	76.3	Confident	61 Å²	61	63.5 Å²	63.5	43%	0.427	33%	0.325	S	S	.	.	H	α-helix	trans	-65.6	-43.5	175.4	-168.3	0	0	0	0	111.4	D302 A303 E304 F310	D302-S306 PolarHBondContact O-N 3.33Å; D302-S306 VanDerWaalsContact O-N 3.12Å; A303-S306 VanDerWaalsContact O-CB 3.31Å; A303-S306 WeakPolarHBondContact O-CB 3.25Å; A303-S306 PolarHBondContact O-N 3.02Å; E304-S306 PolarHBondContact O-N 2.94Å; S306-F310 PolarHBondContact O-N 3.16Å
307	F	77.3	Confident	76.8	Confident	4 Å²	4	67.9 Å²	67.9	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-65	-50.8	174.8	179	-89.7	0	0	0	112.2	L236 F239 V240 L243 L267 A303 E304 K309 F310 W311	L236-F307 HydrophobicContact CD1-CB 4.34Å; L236-F307 HydrophobicContact CD1-CD2 3.9Å; L236-F307 HydrophobicContact CD1-CG 4.31Å; L236-F307 HydrophobicContact CD2-CB 4.41Å; F239-F307 HydrophobicContact CD1-CE2 4.43Å; F239-F307 HydrophobicContact CE1-CE2 4.16Å; V240-F307 HydrophobicContact CG2-CB 4.49Å; V240-F307 HydrophobicContact CG2-CD2 3.65Å; V240-F307 HydrophobicContact CG2-CE2 4.44Å; L243-F307 HydrophobicContact CD1-CE2 4.44Å; L267-F307 HydrophobicContact CD2-CE1 4.38Å; A303-F307 PolarHBondContact O-N 3.44Å; E304-F307 WeakPolarHBondContact O-CB 3.43Å; E304-F307 PolarHBondContact O-N 3.02Å; E304-F307 VanDerWaalsContact O-N 3.09Å; F307-K309 PolarHBondContact O-N 2.87Å; F307-F310 PolarHBondContact O-N 2.96Å; F307-W311 HydrophobicContact CE1-CB 4.42Å; F307-W311 HydrophobicContact CE1-CD2 4.48Å; F307-W311 HydrophobicContact CE1-CE3 4.07Å; F307-W311 HydrophobicContact CE2-CE3 4.12Å; F307-W311 HydrophobicContact CZ-CD2 4.26Å; F307-W311 AromaticContact CZ-CE3 3.44Å; F307-W311 HydrophobicContact CZ-CE3 3.44Å; F307-W311 VanDerWaalsContact CZ-CE3 3.44Å; F307-W311 AromaticContact CZ-CZ3 3.91Å; F307-W311 HydrophobicContact CZ-CZ3 3.91Å; F307-W311 PolarHBondContact O-N 3.47Å
308	D	74.4	Confident	77.1	Confident	63 Å²	63	65 Å²	65	34%	0.337	33%	0.325	S	S	.	.	H	α-helix	trans	-59.8	-32.3	-177.7	-98.5	17.4	0	0	0	112.8	R271 E304 P312	R271-D308 IonicContact CZ-OD1 3.41Å; R271-D308 IonicContact CZ-OD2 2.72Å; R271-D308 IonicContact NE-OD1 3.41Å; R271-D308 IonicContact NH2-OD1 2.71Å; R271-D308 PolarHBondContact NH2-OD1 3.29Å; R271-D308 IonicContact NH2-OD2 3.95Å; R271-D308 PolarHBondContact NH2-OD2 3.02Å; E304-D308 PolarHBondContact O-N 3.35Å; D308-P312 WeakPolarHBondContact O-CD 3.42Å
309	K	83.4	Confident	77.5	Confident	180 Å²	180	63.5 Å²	63.5	78%	0.783	32%	0.316	S	S	*	.	H	α-helix	trans	-75	-28.6	174.4	-173.3	175.1	-179.7	179.2	0	113.5	K305 F307	K305-K309 WeakPolarHBondContact O-CB 3.47Å; K305-K309 PolarHBondContact O-N 3.21Å; F307-K309 PolarHBondContact O-N 2.87Å
310	F	82.9	Confident	77.9	Confident	36 Å²	36	60.2 Å²	60.2	16%	0.158	30%	0.3	C	S	.	.	H	α-helix	trans	-81.8	-33.6	179.5	166.3	-107.1	0	0	0	112.7	V240 L243 K244 S306 F307 D313 H314	V240-F310 HydrophobicContact CG1-CD1 4.09Å; V240-F310 HydrophobicContact CG1-CE1 4.37Å; V240-F310 HydrophobicContact CG1-CG 4.35Å; V240-F310 HydrophobicContact CG2-CD1 4.5Å; L243-F310 HydrophobicContact CB-CE1 3.78Å; L243-F310 HydrophobicContact CB-CZ 3.99Å; L243-F310 HydrophobicContact CD1-CE1 3.91Å; K244-F310 HydrophobicContact CD-CE2 4.3Å; K244-F310 HydrophobicContact CG-CD2 4.4Å; K244-F310 HydrophobicContact CG-CE2 3.51Å; K244-F310 HydrophobicContact CG-CZ 3.64Å; S306-F310 PolarHBondContact O-N 3.16Å; F307-F310 PolarHBondContact O-N 2.96Å; F310-D313 PolarHBondContact O-N 3.1Å; F310-H314 HydrophobicContact CE1-CB 3.99Å; F310-H314 HydrophobicContact CE2-CB 4.13Å; F310-H314 HydrophobicContact CZ-CB 3.7Å; F310-H314 AromaticContact CZ-CG 3.84Å; F310-H314 AromaticContact CZ-ND1 3.87Å; F310-H314 PolarHBondContact O-N 3.4Å
311	W	81.6	Confident	78.5	Confident	15 Å²	15	59 Å²	59	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-54.3	-49.4	-170.2	-175.6	-94.3	0	0	0	115.6	L243 Q262 L266 L267 F307 D313 H314 E315	L243-W311 HydrophobicContact CD1-CE3 4.49Å; L243-W311 HydrophobicContact CD1-CZ3 4.03Å; Q262-W311 HydrophobicContact CB-CH2 3.92Å; Q262-W311 WeakPolarHBondContact O-CH2 3.49Å; L266-W311 HydrophobicContact CB-CH2 4.32Å; L266-W311 HydrophobicContact CB-CZ3 4.33Å; L266-W311 HydrophobicContact CD1-CH2 3.82Å; L266-W311 HydrophobicContact CD1-CZ3 3.69Å; L267-W311 HydrophobicContact CD1-CZ2 4.48Å; F307-W311 HydrophobicContact CE1-CB 4.42Å; F307-W311 HydrophobicContact CE1-CD2 4.48Å; F307-W311 HydrophobicContact CE1-CE3 4.07Å; F307-W311 HydrophobicContact CE2-CE3 4.12Å; F307-W311 HydrophobicContact CZ-CD2 4.26Å; F307-W311 AromaticContact CZ-CE3 3.44Å; F307-W311 HydrophobicContact CZ-CE3 3.44Å; F307-W311 VanDerWaalsContact CZ-CE3 3.44Å; F307-W311 AromaticContact CZ-CZ3 3.91Å; F307-W311 HydrophobicContact CZ-CZ3 3.91Å; F307-W311 PolarHBondContact O-N 3.47Å; W311-D313 PolarHBondContact O-N 3.44Å; W311-H314 PolarHBondContact O-N 3.32Å; W311-H314 VanDerWaalsContact O-N 3.14Å; W311-E315 PolarHBondContact NE1-OE2 2.88Å; W311-E315 PolarHBondContact O-N 2.96Å
312	P	80.7	Confident	79.1	Confident	75 Å²	75	56.8 Å²	56.8	49%	0.487	29%	0.285	S	S	.	.	H	α-helix	trans	-65.1	-37.4	-172.8	-22	35.1	0	0	0	113.5	D308 H314 L316	D308-P312 WeakPolarHBondContact O-CD 3.42Å; P312-H314 VanDerWaalsContact C-N 3.27Å; P312-H314 PolarHBondContact O-N 2.79Å; P312-L316 VanDerWaalsContact O-CB 3.28Å; P312-L316 WeakPolarHBondContact O-CB 3.5Å; P312-L316 PolarHBondContact O-N 3.05Å
313	D	81	Confident	79.5	Confident	121 Å²	121	56.3 Å²	56.3	65%	0.647	28%	0.276	S	S	*	.	H	α-helix	trans	-64.5	-33.8	177.2	-74.7	-10.2	0	0	0	111.6	F310 W311 R317	F310-D313 PolarHBondContact O-N 3.1Å; W311-D313 PolarHBondContact O-N 3.44Å; D313-R317 VanDerWaalsContact O-CB 3.28Å; D313-R317 WeakPolarHBondContact O-CB 3.47Å; D313-R317 PolarHBondContact O-N 3.22Å
314	H	80.9	Confident	80.3	Confident	2 Å²	2	56.2 Å²	56.2	1%	0.009	27%	0.273	C	S	.	.	H	α-helix	trans	-78.6	-41.3	179.4	-178.6	76.8	0	0	0	112.6	L243 Q262 F310 W311 P312 R317 L318	L243-H314 PolarHBondContact O-CE1 3.44Å; L243-H314 VanDerWaalsContact O-CE1 3.26Å; Q262-H314 PolarHBondContact OE1-NE2 2.97Å; F310-H314 HydrophobicContact CE1-CB 3.99Å; F310-H314 HydrophobicContact CE2-CB 4.13Å; F310-H314 HydrophobicContact CZ-CB 3.7Å; F310-H314 AromaticContact CZ-CG 3.84Å; F310-H314 AromaticContact CZ-ND1 3.87Å; F310-H314 PolarHBondContact O-N 3.4Å; W311-H314 PolarHBondContact O-N 3.32Å; W311-H314 VanDerWaalsContact O-N 3.14Å; P312-H314 VanDerWaalsContact C-N 3.27Å; P312-H314 PolarHBondContact O-N 2.79Å; H314-R317 PolarHBondContact O-N 2.91Å; H314-L318 PolarHBondContact O-N 3.24Å; H314-L318 VanDerWaalsContact O-N 3.12Å
315	E	79.5	Confident	81.1	Confident	37 Å²	37	54.5 Å²	54.5	17%	0.173	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-45.6	173.7	-173	173.2	165.3	0	0	111.2	L259 R263 W311 R317 L318 E319	L259-E315 HydrophobicContact CD1-CG 4.11Å; R263-E315 WeakPolarHBondContact CD-OE1 3.13Å; R263-E315 HydrophobicContact CG-CG 4.37Å; R263-E315 IonicContact CZ-OE1 3.61Å; R263-E315 IonicContact NE-OE1 2.73Å; R263-E315 PolarHBondContact NE-OE1 3.39Å; R263-E315 IonicContact NH1-OE1 3.17Å; R263-E315 PolarHBondContact NH1-OE1 2.79Å; R263-E315 IonicContact NH2-OE1 3.39Å; W311-E315 PolarHBondContact NE1-OE2 2.88Å; W311-E315 PolarHBondContact O-N 2.96Å; E315-R317 PolarHBondContact O-N 3.41Å; E315-L318 WeakPolarHBondContact O-CB 3.35Å; E315-L318 PolarHBondContact O-N 3.37Å; E315-L318 VanDerWaalsContact O-N 3.17Å; E315-E319 PolarHBondContact O-N 3.15Å; E315-E319 VanDerWaalsContact O-N 3.1Å
316	L	81.6	Confident	81.7	Confident	87 Å²	87	53.1 Å²	53.1	46%	0.455	26%	0.259	S	S	.	.	H	α-helix	trans	-60.1	-45.1	176.2	-171.4	67.9	0	0	0	111.9	P312 L318 E319 H320	P312-L316 VanDerWaalsContact O-CB 3.28Å; P312-L316 WeakPolarHBondContact O-CB 3.5Å; P312-L316 PolarHBondContact O-N 3.05Å; L316-L318 VanDerWaalsContact C-N 3.26Å; L316-L318 PolarHBondContact O-N 3.41Å; L316-E319 PolarHBondContact O-N 2.83Å; L316-H320 VanDerWaalsContact CD1-NE2 3.26Å; L316-H320 WeakPolarHBondContact CD1-NE2 3.44Å; L316-H320 VanDerWaalsContact CG-CE1 3.47Å; L316-H320 WeakPolarHBondContact CG-CE1 3.47Å; L316-H320 PolarHBondContact O-CD2 3.42Å; L316-H320 PolarHBondContact O-N 2.77Å
317	R	80.1	Confident	82.3	Confident	98 Å²	98	50.3 Å²	50.3	37%	0.37	24%	0.239	S	C	.	.	H	α-helix	trans	-58	-34.4	175.7	173.7	-176.6	173.9	-147.7	-5	112.9	K244 T246 L248 D313 H314 E315 C321	K244-R317 PolarHBondContact O-NH1 3.01Å; K244-R317 VanDerWaalsContact O-NH1 3.09Å; T246-R317 PolarHBondContact O-NH2 3.34Å; L248-R317 HydrophobicContact CD1-CG 4.01Å; D313-R317 VanDerWaalsContact O-CB 3.28Å; D313-R317 WeakPolarHBondContact O-CB 3.47Å; D313-R317 PolarHBondContact O-N 3.22Å; H314-R317 PolarHBondContact O-N 2.91Å; E315-R317 PolarHBondContact O-N 3.41Å; R317-C321 PolarHBondContact O-N 2.82Å
318	L	76.9	Confident	82.9	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-72.9	-46.4	175.9	-79.7	162.2	0	0	0	112.3	L248 I258 L259 H314 E315 L316 H320 C321 L322	L248-L318 HydrophobicContact CD2-CD2 3.54Å; L248-L318 HydrophobicContact CD2-CG 4.21Å; I258-L318 HydrophobicContact CB-CD2 4.37Å; I258-L318 HydrophobicContact CG2-CD1 4.24Å; I258-L318 HydrophobicContact CG2-CD2 3.65Å; L259-L318 HydrophobicContact CD1-CB 3.79Å; L259-L318 HydrophobicContact CD1-CD1 4.37Å; H314-L318 PolarHBondContact O-N 3.24Å; H314-L318 VanDerWaalsContact O-N 3.12Å; E315-L318 WeakPolarHBondContact O-CB 3.35Å; E315-L318 PolarHBondContact O-N 3.37Å; E315-L318 VanDerWaalsContact O-N 3.17Å; L316-L318 VanDerWaalsContact C-N 3.26Å; L316-L318 PolarHBondContact O-N 3.41Å; L318-H320 VanDerWaalsContact C-N 3.31Å; L318-H320 PolarHBondContact O-N 3.14Å; L318-C321 WeakPolarHBondContact O-CB 3.26Å; L318-C321 PolarHBondContact O-N 2.87Å; L318-L322 PolarHBondContact O-N 3.48Å
319	E	82	Confident	83.7	Confident	53 Å²	53	52.5 Å²	52.5	25%	0.248	25%	0.247	C	C	.	.	H	α-helix	trans	-58.3	-43.4	176.7	-74.2	-158.9	-172.6	0	0	112.4	L259 R263 E315 L316 C321 L322 R323	L259-E319 HydrophobicContact CD1-CG 4.21Å; L259-E319 HydrophobicContact CD2-CG 3.9Å; R263-E319 IonicContact NH1-OE1 3.91Å; E315-E319 PolarHBondContact O-N 3.15Å; E315-E319 VanDerWaalsContact O-N 3.1Å; L316-E319 PolarHBondContact O-N 2.83Å; E319-C321 VanDerWaalsContact C-N 3.33Å; E319-C321 PolarHBondContact O-N 3.02Å; E319-L322 WeakPolarHBondContact O-CB 3.38Å; E319-L322 PolarHBondContact O-N 2.8Å; E319-L322 VanDerWaalsContact O-N 3.16Å; E319-R323 WeakPolarHBondContact O-CG 3.29Å; E319-R323 PolarHBondContact O-N 3Å; E319-R323 IonicContact OE2-CZ 3.48Å; E319-R323 IonicContact OE2-NH2 3.58Å; E319-R323 PolarHBondContact OE2-NH2 3.42Å
320	H	81.6	Confident	84.1	Confident	32 Å²	32	46.3 Å²	46.3	15%	0.148	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-37.7	-179.9	-63.6	-176	0	0	0	111.8	L316 L318 L324 E400	L316-H320 VanDerWaalsContact CD1-NE2 3.26Å; L316-H320 WeakPolarHBondContact CD1-NE2 3.44Å; L316-H320 VanDerWaalsContact CG-CE1 3.47Å; L316-H320 WeakPolarHBondContact CG-CE1 3.47Å; L316-H320 PolarHBondContact O-CD2 3.42Å; L316-H320 PolarHBondContact O-N 2.77Å; L318-H320 VanDerWaalsContact C-N 3.31Å; L318-H320 PolarHBondContact O-N 3.14Å; H320-L324 PolarHBondContact O-N 3.32Å; H320-L324 VanDerWaalsContact O-N 3.08Å; H320-E400 WeakPolarHBondContact CB-OE1 3.37Å; H320-E400 WeakPolarHBondContact CB-OE2 3.34Å; H320-E400 IonicContact CD2-OE1 3.64Å; H320-E400 VanDerWaalsContact CE1-CD 3.44Å; H320-E400 IonicContact CE1-OE1 2.78Å; H320-E400 PolarHBondContact CE1-OE1 2.76Å; H320-E400 IonicContact CE1-OE2 2.78Å; H320-E400 VanDerWaalsContact CG-CD 3.4Å; H320-E400 IonicContact CG-OE1 2.74Å; H320-E400 IonicContact CG-OE2 3.71Å; H320-E400 VanDerWaalsContact CG-OE2 3.32Å; H320-E400 IonicContact ND1-OE1 3.21Å; H320-E400 PolarHBondContact ND1-OE1 2.86Å; H320-E400 VanDerWaalsContact ND1-OE1 3.12Å; H320-E400 IonicContact ND1-OE2 2.72Å; H320-E400 PolarHBondContact ND1-OE2 2.64Å; H320-E400 IonicContact NE2-OE1 2.74Å
321	C	82.1	Confident	84.7	Confident	11 Å²	11	45.2 Å²	45.2	7%	0.074	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-42.9	171.1	-170.9	0	0	0	0	111.9	L248 T255 R317 L318 E319 R323 L324 R325	L248-C321 HydrophobicContact CB-CB 4.43Å; L248-C321 HydrophobicContact CD1-CB 4.09Å; L248-C321 HydrophobicContact CD2-CB 4.36Å; T255-C321 HydrophobicContact CG2-CB 3.97Å; R317-C321 PolarHBondContact O-N 2.82Å; L318-C321 WeakPolarHBondContact O-CB 3.26Å; L318-C321 PolarHBondContact O-N 2.87Å; E319-C321 VanDerWaalsContact C-N 3.33Å; E319-C321 PolarHBondContact O-N 3.02Å; C321-R323 PolarHBondContact O-N 2.77Å; C321-L324 PolarHBondContact O-N 2.86Å; C321-R325 WeakPolarHBondContact O-CB 3.36Å; C321-R325 VanDerWaalsContact O-CG 3.24Å; C321-R325 WeakPolarHBondContact O-CG 3.37Å; C321-R325 PolarHBondContact O-N 2.85Å; C321-R325 PolarHBondContact SG-NH1 2.95Å; C321-R325 VanDerWaalsContact SG-NH1 3.42Å
322	L	84.1	Confident	85.2	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.141	24%	0.241	C	C	.	.	H	α-helix	trans	-60.4	-46.4	178.3	178	57.7	0	0	0	111.5	A252 T255 A256 L259 L318 E319 L324 R325 Q326	A252-L322 HydrophobicContact CB-CD1 4.16Å; A252-L322 VanDerWaalsContact O-CD1 3.23Å; A252-L322 WeakPolarHBondContact O-CD1 3.32Å; T255-L322 HydrophobicContact CG2-CB 3.91Å; A256-L322 HydrophobicContact CB-CD1 3.96Å; A256-L322 HydrophobicContact CB-CD2 4.05Å; L259-L322 HydrophobicContact CD2-CD2 4.39Å; L318-L322 PolarHBondContact O-N 3.48Å; E319-L322 WeakPolarHBondContact O-CB 3.38Å; E319-L322 PolarHBondContact O-N 2.8Å; E319-L322 VanDerWaalsContact O-N 3.16Å; L322-L324 VanDerWaalsContact C-N 3.35Å; L322-L324 PolarHBondContact O-N 3.21Å; L322-R325 PolarHBondContact O-N 2.93Å; L322-Q326 HydrophobicContact CD1-CG 4.31Å; L322-Q326 WeakPolarHBondContact O-CG 3.29Å; L322-Q326 PolarHBondContact O-N 3.35Å
323	R	85.2	Confident	85.8	Confident	89 Å²	89	52 Å²	52	34%	0.336	24%	0.24	S	C	.	.	H	α-helix	trans	-59.6	-43.4	176.9	-65.8	172.3	-161.7	-179.8	7.7	111.8	E319 C321 F327 L395	E319-R323 WeakPolarHBondContact O-CG 3.29Å; E319-R323 PolarHBondContact O-N 3Å; E319-R323 IonicContact OE2-CZ 3.48Å; E319-R323 IonicContact OE2-NH2 3.58Å; E319-R323 PolarHBondContact OE2-NH2 3.42Å; C321-R323 PolarHBondContact O-N 2.77Å; R323-F327 PolarHBondContact O-N 3.34Å; R323-L395 HydrophobicContact CB-CD2 3.97Å
324	L	86.2	Confident	86.4	Confident	17 Å²	17	47 Å²	47	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-48.7	174.2	178.4	62.2	0	0	0	111.9	H320 C321 L322 Q326 F327 E328 L403 I407	H320-L324 PolarHBondContact O-N 3.32Å; H320-L324 VanDerWaalsContact O-N 3.08Å; C321-L324 PolarHBondContact O-N 2.86Å; L322-L324 VanDerWaalsContact C-N 3.35Å; L322-L324 PolarHBondContact O-N 3.21Å; L324-Q326 VanDerWaalsContact C-N 3.32Å; L324-Q326 PolarHBondContact O-N 2.7Å; L324-F327 PolarHBondContact O-N 2.75Å; L324-E328 HydrophobicContact CD1-CG 3.96Å; L324-E328 HydrophobicContact CG-CG 4.18Å; L324-E328 WeakPolarHBondContact O-CG 3.22Å; L324-E328 PolarHBondContact O-N 2.63Å; L324-L403 HydrophobicContact CB-CD2 3.79Å; L324-L403 HydrophobicContact CD1-CD2 4.27Å; L324-L403 HydrophobicContact CD2-CD2 3.84Å; L324-L403 HydrophobicContact CG-CD2 4.16Å; L324-I407 HydrophobicContact CD1-CD1 4.26Å; L324-I407 HydrophobicContact CD1-CG1 3.88Å
325	R	86.1	Confident	87.1	Confident	36 Å²	36	49.6 Å²	49.6	14%	0.136	23%	0.225	C	C	.	.	H	α-helix	trans	-61.5	-39.7	-176	-73	-68.4	111.7	79	4.5	112.4	P249 N250 A252 C321 L322 E328 E329	P249-R325 WeakPolarHBondContact O-CD 3.44Å; P249-R325 PolarHBondContact O-NH1 3.5Å; N250-R325 VanDerWaalsContact O-CD 3.29Å; N250-R325 WeakPolarHBondContact O-CD 3.38Å; A252-R325 HydrophobicContact CB-CB 4.03Å; C321-R325 WeakPolarHBondContact O-CB 3.36Å; C321-R325 VanDerWaalsContact O-CG 3.24Å; C321-R325 WeakPolarHBondContact O-CG 3.37Å; C321-R325 PolarHBondContact O-N 2.85Å; C321-R325 PolarHBondContact SG-NH1 2.95Å; C321-R325 VanDerWaalsContact SG-NH1 3.42Å; L322-R325 PolarHBondContact O-N 2.93Å; R325-E328 IonicContact CZ-OE2 2.71Å; R325-E328 IonicContact NE-OE2 2.72Å; R325-E328 PolarHBondContact NE-OE2 3.13Å; R325-E328 IonicContact NH2-OE2 2.69Å; R325-E328 PolarHBondContact NH2-OE2 3.45Å; R325-E328 PolarHBondContact O-N 3.05Å; R325-E329 PolarHBondContact O-N 3.28Å
326	Q	89.2	Confident	87.8	Confident	70 Å²	70	50 Å²	50	33%	0.327	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-49.5	173.1	-69.6	173.6	-3.6	0	0	111.4	A252 L322 L324 E328 E329 D330	A252-Q326 HydrophobicContact CB-CG 3.84Å; L322-Q326 HydrophobicContact CD1-CG 4.31Å; L322-Q326 WeakPolarHBondContact O-CG 3.29Å; L322-Q326 PolarHBondContact O-N 3.35Å; L324-Q326 VanDerWaalsContact C-N 3.32Å; L324-Q326 PolarHBondContact O-N 2.7Å; Q326-E328 VanDerWaalsContact C-N 3.28Å; Q326-E328 PolarHBondContact O-N 2.74Å; Q326-E329 WeakPolarHBondContact O-CB 3.37Å; Q326-E329 PolarHBondContact O-N 3.27Å; Q326-D330 PolarHBondContact O-N 3.4Å
327	F	91.8	Very high	88.4	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.009	23%	0.229	C	C	.	.	H	α-helix	trans	-59.4	-37.3	175.3	176.8	-87.5	0	0	0	112.7	R323 L324 E329 F331 L388 L395 I407 K410	R323-F327 PolarHBondContact O-N 3.34Å; L324-F327 PolarHBondContact O-N 2.75Å; F327-E329 VanDerWaalsContact C-N 3.28Å; F327-E329 PolarHBondContact O-N 2.99Å; F327-F331 VanDerWaalsContact O-CB 3.29Å; F327-F331 WeakPolarHBondContact O-CB 3.26Å; F327-F331 PolarHBondContact O-N 3.41Å; F327-F331 VanDerWaalsContact O-N 3.1Å; F327-L388 HydrophobicContact CD2-CD1 3.43Å; F327-L388 VanDerWaalsContact CD2-CD1 3.43Å; F327-L388 HydrophobicContact CD2-CG 4.09Å; F327-L388 HydrophobicContact CE2-CD1 3.7Å; F327-L388 HydrophobicContact CE2-CG 3.81Å; F327-L388 WeakPolarHBondContact CE2-O 3.39Å; F327-L388 HydrophobicContact CG-CD1 4.3Å; F327-L395 HydrophobicContact CB-CD1 4.21Å; F327-L395 HydrophobicContact CD2-CD1 4.46Å; F327-I407 HydrophobicContact CD1-CG1 3.99Å; F327-I407 HydrophobicContact CD1-CG2 4.44Å; F327-I407 HydrophobicContact CE1-CB 4.11Å; F327-I407 HydrophobicContact CE1-CG1 4.01Å; F327-I407 HydrophobicContact CE1-CG2 3.81Å; F327-I407 HydrophobicContact CE2-CG2 4.16Å; F327-I407 HydrophobicContact CZ-CB 4.47Å; F327-I407 HydrophobicContact CZ-CG2 3.67Å; F327-K410 HydrophobicContact CD1-CD 4.49Å; F327-K410 HydrophobicContact CE1-CB 3.92Å; F327-K410 HydrophobicContact CE1-CD 3.98Å; F327-K410 HydrophobicContact CZ-CB 4.26Å
328	E	90	Very high	89	Confident	31 Å²	31	44.1 Å²	44.1	15%	0.145	21%	0.211	C	C	.	.	H	α-helix	trans	-71.1	-19	175.4	-67.6	-169.2	131	0	0	113.9	L324 R325 Q326 K332 S406 K410	L324-E328 HydrophobicContact CD1-CG 3.96Å; L324-E328 HydrophobicContact CG-CG 4.18Å; L324-E328 WeakPolarHBondContact O-CG 3.22Å; L324-E328 PolarHBondContact O-N 2.63Å; R325-E328 IonicContact CZ-OE2 2.71Å; R325-E328 IonicContact NE-OE2 2.72Å; R325-E328 PolarHBondContact NE-OE2 3.13Å; R325-E328 IonicContact NH2-OE2 2.69Å; R325-E328 PolarHBondContact NH2-OE2 3.45Å; R325-E328 PolarHBondContact O-N 3.05Å; Q326-E328 VanDerWaalsContact C-N 3.28Å; Q326-E328 PolarHBondContact O-N 2.74Å; E328-K332 VanDerWaalsContact O-CD 3.29Å; E328-K332 WeakPolarHBondContact O-CD 3.28Å; E328-K332 WeakPolarHBondContact O-CE 3.3Å; E328-K332 VanDerWaalsContact O-CG 3.26Å; E328-K332 WeakPolarHBondContact O-CG 3.46Å; E328-S406 PolarHBondContact OE1-OG 2.93Å; E328-K410 IonicContact OE1-NZ 2.65Å; E328-K410 PolarHBondContact OE1-NZ 3.34Å
329	E	90	Very high	89.8	Confident	82 Å²	82	48.1 Å²	48.1	38%	0.383	23%	0.232	S	C	.	.	H	α-helix	trans	-86.3	-49.3	175	-165.4	-172.4	130	0	0	111.2	R325 Q326 F327 F331 K332 K333	R325-E329 PolarHBondContact O-N 3.28Å; Q326-E329 WeakPolarHBondContact O-CB 3.37Å; Q326-E329 PolarHBondContact O-N 3.27Å; F327-E329 VanDerWaalsContact C-N 3.28Å; F327-E329 PolarHBondContact O-N 2.99Å; E329-F331 VanDerWaalsContact C-N 3.28Å; E329-F331 PolarHBondContact O-N 3.35Å; E329-K332 PolarHBondContact O-N 3.13Å; E329-K332 VanDerWaalsContact O-N 3.08Å; E329-K333 PolarHBondContact O-N 3.37Å; E329-K333 VanDerWaalsContact O-N 3.16Å; E329-K333 VanDerWaalsContact OE1-CE 3.28Å; E329-K333 WeakPolarHBondContact OE1-CE 3.06Å; E329-K333 IonicContact OE1-NZ 3.57Å; E329-K333 PolarHBondContact OE1-NZ 2.96Å
330	D	93.1	Very high	90.3	Very high	49 Å²	49	50.8 Å²	50.8	26%	0.262	25%	0.248	S	C	.	.	H	α-helix	trans	-57.4	-42.5	176.6	-61.8	-23.9	0	0	0	111.1	Q326 K332 K333 L334 L388 R391	Q326-D330 PolarHBondContact O-N 3.4Å; D330-K332 VanDerWaalsContact C-N 3.34Å; D330-K332 PolarHBondContact O-N 2.97Å; D330-K333 PolarHBondContact O-N 3.1Å; D330-L334 PolarHBondContact O-N 3.05Å; D330-L334 VanDerWaalsContact O-N 3.14Å; D330-L388 HydrophobicContact CB-CD1 3.72Å; D330-L388 HydrophobicContact CB-CD2 3.88Å; D330-L388 HydrophobicContact CB-CG 4.44Å; D330-R391 IonicContact OD2-NH1 3.01Å; D330-R391 PolarHBondContact OD2-NH1 2.84Å
331	F	94.5	Very high	90.8	Very high	13 Å²	13	50.7 Å²	50.7	6%	0.057	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-40.3	175.7	171.5	-95.3	0	0	0	112.8	F327 E329 Q335 L388 K410 E413 L414	F327-F331 VanDerWaalsContact O-CB 3.29Å; F327-F331 WeakPolarHBondContact O-CB 3.26Å; F327-F331 PolarHBondContact O-N 3.41Å; F327-F331 VanDerWaalsContact O-N 3.1Å; E329-F331 VanDerWaalsContact C-N 3.28Å; E329-F331 PolarHBondContact O-N 3.35Å; F331-Q335 HydrophobicContact CE1-CB 4.3Å; F331-Q335 VanDerWaalsContact CE1-OE1 3.32Å; F331-Q335 HydrophobicContact CZ-CB 4.33Å; F331-Q335 VanDerWaalsContact O-CB 3.22Å; F331-Q335 WeakPolarHBondContact O-CB 3.44Å; F331-Q335 PolarHBondContact O-N 2.92Å; F331-L388 HydrophobicContact CB-CD2 3.99Å; F331-K410 HydrophobicContact CB-CD 4.16Å; F331-K410 HydrophobicContact CD1-CB 4.41Å; F331-K410 HydrophobicContact CD1-CD 3.64Å; F331-K410 HydrophobicContact CD1-CG 4.08Å; F331-K410 HydrophobicContact CD2-CB 3.67Å; F331-K410 HydrophobicContact CD2-CD 4.29Å; F331-K410 HydrophobicContact CD2-CG 4.23Å; F331-K410 HydrophobicContact CE1-CB 4.47Å; F331-K410 HydrophobicContact CE1-CD 4.08Å; F331-K410 HydrophobicContact CE1-CG 4.06Å; F331-K410 HydrophobicContact CE2-CB 3.73Å; F331-K410 HydrophobicContact CE2-CG 4.22Å; F331-K410 VanDerWaalsContact CE2-O 3.29Å; F331-K410 WeakPolarHBondContact CE2-O 3.26Å; F331-K410 HydrophobicContact CG-CB 4.01Å; F331-K410 HydrophobicContact CG-CD 3.74Å; F331-K410 HydrophobicContact CG-CG 4.15Å; F331-K410 HydrophobicContact CZ-CB 4.14Å; F331-K410 HydrophobicContact CZ-CG 4.13Å; F331-E413 HydrophobicContact CE2-CB 4.33Å; F331-E413 HydrophobicContact CE2-CG 4.28Å; F331-E413 HydrophobicContact CZ-CB 4.23Å; F331-E413 HydrophobicContact CZ-CG 3.89Å; F331-L414 HydrophobicContact CD2-CB 4.45Å; F331-L414 HydrophobicContact CE2-CB 4.23Å
332	K	92.8	Very high	91.2	Very high	129 Å²	129	51.8 Å²	51.8	56%	0.561	25%	0.253	S	S	*	.	H	α-helix	trans	-67.9	-40.3	-179.8	-73.2	167.2	-171.8	168.8	0	111.7	E328 E329 D330 Q335 A336	E328-K332 VanDerWaalsContact O-CD 3.29Å; E328-K332 WeakPolarHBondContact O-CD 3.28Å; E328-K332 WeakPolarHBondContact O-CE 3.3Å; E328-K332 VanDerWaalsContact O-CG 3.26Å; E328-K332 WeakPolarHBondContact O-CG 3.46Å; E329-K332 PolarHBondContact O-N 3.13Å; E329-K332 VanDerWaalsContact O-N 3.08Å; D330-K332 VanDerWaalsContact C-N 3.34Å; D330-K332 PolarHBondContact O-N 2.97Å; K332-Q335 PolarHBondContact O-N 3.14Å; K332-A336 WeakPolarHBondContact O-CB 3.48Å; K332-A336 PolarHBondContact O-N 2.84Å
333	K	93.1	Very high	91.4	Very high	105 Å²	105	53.5 Å²	53.5	46%	0.457	26%	0.262	S	S	.	.	H	α-helix	trans	-58.7	-53.2	176.5	-67.1	168.1	-174.2	160	0	110	E329 D330 A336 N337	E329-K333 PolarHBondContact O-N 3.37Å; E329-K333 VanDerWaalsContact O-N 3.16Å; E329-K333 VanDerWaalsContact OE1-CE 3.28Å; E329-K333 WeakPolarHBondContact OE1-CE 3.06Å; E329-K333 IonicContact OE1-NZ 3.57Å; E329-K333 PolarHBondContact OE1-NZ 2.96Å; D330-K333 PolarHBondContact O-N 3.1Å; K333-A336 PolarHBondContact O-N 3.07Å; K333-N337 PolarHBondContact O-N 3.31Å; K333-N337 PolarHBondContact O-OD1 3.15Å
334	L	94.5	Very high	91.5	Very high	15 Å²	15	56.2 Å²	56.2	8%	0.079	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-42.6	177.9	-64.1	176.5	0	0	0	112.5	D330 A336 N337 F338 D381 A384 A385 L388 L414	D330-L334 PolarHBondContact O-N 3.05Å; D330-L334 VanDerWaalsContact O-N 3.14Å; L334-A336 VanDerWaalsContact C-N 3.27Å; L334-A336 PolarHBondContact O-N 3.49Å; L334-N337 PolarHBondContact O-N 2.87Å; L334-N337 VanDerWaalsContact O-N 3.15Å; L334-F338 HydrophobicContact CB-CD2 4.49Å; L334-F338 WeakPolarHBondContact O-CD2 3.47Å; L334-F338 PolarHBondContact O-N 2.95Å; L334-D381 VanDerWaalsContact CD2-OD1 3.22Å; L334-D381 WeakPolarHBondContact CD2-OD1 3.44Å; L334-A384 HydrophobicContact CD1-CB 4.28Å; L334-A384 HydrophobicContact CD2-CB 3.73Å; L334-A385 HydrophobicContact CD1-CB 4.36Å; L334-L388 HydrophobicContact CD1-CB 4.15Å; L334-L388 HydrophobicContact CD1-CD2 3.83Å; L334-L414 HydrophobicContact CB-CD1 4.2Å; L334-L414 HydrophobicContact CD1-CD2 4.42Å
335	Q	95.3	Very high	91.5	Very high	56 Å²	56	55.6 Å²	55.6	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-40.3	176.6	-179.1	170.1	52.1	0	0	111.8	F331 K332 L339 L417	F331-Q335 HydrophobicContact CE1-CB 4.3Å; F331-Q335 VanDerWaalsContact CE1-OE1 3.32Å; F331-Q335 HydrophobicContact CZ-CB 4.33Å; F331-Q335 VanDerWaalsContact O-CB 3.22Å; F331-Q335 WeakPolarHBondContact O-CB 3.44Å; F331-Q335 PolarHBondContact O-N 2.92Å; K332-Q335 PolarHBondContact O-N 3.14Å; Q335-L339 HydrophobicContact CG-CD1 3.99Å; Q335-L339 WeakPolarHBondContact O-CB 3.46Å; Q335-L339 WeakPolarHBondContact O-CD1 3.11Å; Q335-L339 WeakPolarHBondContact O-CG 3.49Å; Q335-L339 PolarHBondContact O-N 3.44Å; Q335-L339 VanDerWaalsContact O-N 3.14Å; Q335-L417 HydrophobicContact CB-CD1 4.39Å; Q335-L417 HydrophobicContact CG-CD1 3.98Å
336	A	93.2	Very high	91.1	Very high	47 Å²	47	61.1 Å²	61.1	39%	0.388	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-46.6	174.2	0	0	0	0	0	111.9	K332 K333 L334 L339 N340	K332-A336 WeakPolarHBondContact O-CB 3.48Å; K332-A336 PolarHBondContact O-N 2.84Å; K333-A336 PolarHBondContact O-N 3.07Å; L334-A336 VanDerWaalsContact C-N 3.27Å; L334-A336 PolarHBondContact O-N 3.49Å; A336-L339 PolarHBondContact O-N 3.29Å; A336-N340 WeakPolarHBondContact O-CB 3.38Å; A336-N340 PolarHBondContact O-N 2.99Å; A336-N340 PolarHBondContact O-ND2 3.46Å
337	N	93.7	Very high	90.2	Very high	61 Å²	61	61.4 Å²	61.4	33%	0.326	29%	0.294	S	S	.	.	H	α-helix	trans	-58.7	-53.4	177.9	-68.9	0.8	0	0	0	111.8	K333 L334 L339 N340 H341 D381	K333-N337 PolarHBondContact O-N 3.31Å; K333-N337 PolarHBondContact O-OD1 3.15Å; L334-N337 PolarHBondContact O-N 2.87Å; L334-N337 VanDerWaalsContact O-N 3.15Å; N337-L339 VanDerWaalsContact C-N 3.29Å; N337-L339 PolarHBondContact O-N 3.34Å; N337-N340 PolarHBondContact O-N 2.91Å; N337-N340 VanDerWaalsContact O-N 3.13Å; N337-H341 PolarHBondContact O-CD2 2.65Å; N337-H341 PolarHBondContact O-N 3.32Å; N337-D381 WeakPolarHBondContact CB-OD1 3.39Å; N337-D381 WeakPolarHBondContact CB-OD2 3.25Å; N337-D381 PolarHBondContact ND2-OD1 3.03Å; N337-D381 PolarHBondContact ND2-OD2 3.16Å
338	F	94.2	Very high	88.9	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-38.5	178.8	-86.5	-91.3	0	0	0	112.6	L334 H341 L342 D381 F382 A385 L414 L417 L421	L334-F338 HydrophobicContact CB-CD2 4.49Å; L334-F338 WeakPolarHBondContact O-CD2 3.47Å; L334-F338 PolarHBondContact O-N 2.95Å; F338-H341 PolarHBondContact O-N 2.88Å; F338-L342 WeakPolarHBondContact O-CB 3.22Å; F338-L342 VanDerWaalsContact O-CG 3.28Å; F338-L342 WeakPolarHBondContact O-CG 3.46Å; F338-L342 PolarHBondContact O-N 2.75Å; F338-D381 HydrophobicContact CD2-CB 4.49Å; F338-D381 HydrophobicContact CE2-CB 3.87Å; F338-D381 WeakPolarHBondContact CE2-O 3.48Å; F338-D381 HydrophobicContact CZ-CB 4.25Å; F338-F382 HydrophobicContact CE1-CE1 4.37Å; F338-F382 HydrophobicContact CE1-CZ 4.44Å; F338-A385 HydrophobicContact CE2-CB 3.83Å; F338-A385 HydrophobicContact CZ-CB 3.98Å; F338-L414 HydrophobicContact CD2-CD1 4.44Å; F338-L414 HydrophobicContact CE2-CD1 4.41Å; F338-L417 HydrophobicContact CB-CB 4.03Å; F338-L417 HydrophobicContact CB-CD1 4.38Å; F338-L417 HydrophobicContact CD1-CB 4.12Å; F338-L417 HydrophobicContact CG-CB 4.14Å; F338-L421 HydrophobicContact CD1-CB 3.9Å; F338-L421 HydrophobicContact CD1-CD2 3.58Å; F338-L421 HydrophobicContact CD1-CG 4.39Å; F338-L421 HydrophobicContact CE1-CB 4.07Å; F338-L421 HydrophobicContact CE1-CD2 3.6Å; F338-L421 HydrophobicContact CE1-CG 4.46Å; F338-L421 HydrophobicContact CG-CD2 4.47Å
339	L	92.6	Very high	87.3	Confident	85 Å²	85	65 Å²	65	45%	0.445	32%	0.317	S	S	.	.	H	α-helix	trans	-69.2	-41.1	175.7	-71.6	171.8	0	0	0	112.3	Q335 A336 N337 H341 L342 D343 L417	Q335-L339 HydrophobicContact CG-CD1 3.99Å; Q335-L339 WeakPolarHBondContact O-CB 3.46Å; Q335-L339 WeakPolarHBondContact O-CD1 3.11Å; Q335-L339 WeakPolarHBondContact O-CG 3.49Å; Q335-L339 PolarHBondContact O-N 3.44Å; Q335-L339 VanDerWaalsContact O-N 3.14Å; A336-L339 PolarHBondContact O-N 3.29Å; N337-L339 VanDerWaalsContact C-N 3.29Å; N337-L339 PolarHBondContact O-N 3.34Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 PolarHBondContact O-N 3.49Å; L339-L342 PolarHBondContact O-N 3.14Å; L339-D343 PolarHBondContact O-N 3.35Å; L339-L417 HydrophobicContact CD2-CD2 4.01Å; L339-L417 HydrophobicContact CG-CD2 4.42Å
340	N	92.4	Very high	85.5	Confident	110 Å²	110	66.6 Å²	66.6	59%	0.588	33%	0.328	S	S	*	.	H	α-helix	trans	-62.8	-37.8	174.4	-69.7	-24.1	0	0	0	111.9	A336 N337 R344	A336-N340 WeakPolarHBondContact O-CB 3.38Å; A336-N340 PolarHBondContact O-N 2.99Å; A336-N340 PolarHBondContact O-ND2 3.46Å; N337-N340 PolarHBondContact O-N 2.91Å; N337-N340 VanDerWaalsContact O-N 3.13Å; N340-R344 WeakPolarHBondContact O-CB 3.45Å; N340-R344 PolarHBondContact O-N 3.02Å
341	H	92.8	Very high	83.5	Confident	30 Å²	30	65.1 Å²	65.1	14%	0.139	33%	0.325	C	S	.	.	H	α-helix	trans	-67.6	-42.2	175.5	-75.8	-65.6	0	0	0	112.5	N337 F338 L339 L345 Y374 T378 D381 L421	N337-H341 PolarHBondContact O-CD2 2.65Å; N337-H341 PolarHBondContact O-N 3.32Å; F338-H341 PolarHBondContact O-N 2.88Å; L339-H341 VanDerWaalsContact C-N 3.31Å; L339-H341 PolarHBondContact O-N 3.49Å; H341-L345 WeakPolarHBondContact O-CB 3.49Å; H341-L345 WeakPolarHBondContact O-CG 3.39Å; H341-L345 PolarHBondContact O-N 2.87Å; H341-Y374 WeakPolarHBondContact CA-OH 3.47Å; H341-Y374 AromaticContact CE1-CE2 3.93Å; H341-Y374 AromaticContact ND1-CE2 3.59Å; H341-Y374 AromaticContact ND1-CZ 3.35Å; H341-Y374 PolarHBondContact ND1-OH 3.25Å; H341-Y374 PolarHBondContact O-OH 3.39Å; H341-T378 WeakPolarHBondContact ND1-CG2 3.45Å; H341-D381 IonicContact CD2-OD2 3.97Å; H341-D381 IonicContact NE2-OD2 3.89Å; H341-D381 PolarHBondContact NE2-OD2 3.08Å; H341-L421 HydrophobicContact CB-CD1 3.78Å; H341-L421 HydrophobicContact CB-CD2 3.97Å
342	L	91.4	Very high	81.5	Confident	34 Å²	34	74.4 Å²	74.4	18%	0.178	36%	0.359	C	S	.	.	H	α-helix	trans	-64.4	-42.2	174.9	-74.5	167.9	0	0	0	112.4	F338 L339 L345 R346 L417 Q420 L421 A424	F338-L342 WeakPolarHBondContact O-CB 3.22Å; F338-L342 VanDerWaalsContact O-CG 3.28Å; F338-L342 WeakPolarHBondContact O-CG 3.46Å; F338-L342 PolarHBondContact O-N 2.75Å; L339-L342 PolarHBondContact O-N 3.14Å; L342-L345 PolarHBondContact O-N 3.24Å; L342-R346 WeakPolarHBondContact O-CB 3.28Å; L342-R346 PolarHBondContact O-N 2.81Å; L342-L417 HydrophobicContact CD1-CD2 4.1Å; L342-Q420 HydrophobicContact CD1-CB 4.22Å; L342-Q420 HydrophobicContact CD2-CB 4.13Å; L342-L421 HydrophobicContact CD2-CB 4.4Å; L342-L421 HydrophobicContact CD2-CD1 4.39Å; L342-A424 HydrophobicContact CD2-CB 4.05Å
343	D	88.1	Confident	79.6	Confident	63 Å²	63	71.4 Å²	71.4	34%	0.337	36%	0.359	S	S	.	.	H	α-helix	trans	-67.1	-44	177.6	-167.6	64.7	0	0	0	111.9	L339 L345 R346 N347	L339-D343 PolarHBondContact O-N 3.35Å; D343-L345 VanDerWaalsContact C-N 3.34Å; D343-L345 PolarHBondContact O-N 3.13Å; D343-R346 WeakPolarHBondContact O-CB 3.29Å; D343-R346 PolarHBondContact O-N 3.32Å; D343-R346 VanDerWaalsContact O-N 3.16Å; D343-R346 IonicContact OD1-CZ 3.75Å; D343-R346 IonicContact OD1-NE 3.89Å; D343-R346 PolarHBondContact OD1-NE 3.04Å; D343-R346 IonicContact OD1-NH2 2.93Å; D343-R346 PolarHBondContact OD1-NH2 3.38Å; D343-N347 WeakPolarHBondContact O-CB 3.44Å; D343-N347 PolarHBondContact O-N 2.82Å; D343-N347 PolarHBondContact O-ND2 3.4Å; D343-N347 PolarHBondContact O-OD1 2.87Å; D343-N347 PolarHBondContact OD2-ND2 3.17Å
344	R	86.8	Confident	77.8	Confident	145 Å²	145	67 Å²	67	55%	0.547	34%	0.34	S	S	.	.	H	α-helix	trans	-59.5	-43.2	175.1	177.7	167.7	170.8	175.6	0	112.2	N340 N347 S348	N340-R344 WeakPolarHBondContact O-CB 3.45Å; N340-R344 PolarHBondContact O-N 3.02Å; R344-N347 PolarHBondContact O-N 3.27Å; R344-S348 PolarHBondContact O-N 3.31Å; R344-S348 PolarHBondContact O-OG 2.88Å
345	L	85.5	Confident	75.8	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-66	-37.1	175.7	-75	168.7	0	0	0	112.3	H341 L342 D343 N349 Y374 L421 A424 L425 R428	H341-L345 WeakPolarHBondContact O-CB 3.49Å; H341-L345 WeakPolarHBondContact O-CG 3.39Å; H341-L345 PolarHBondContact O-N 2.87Å; L342-L345 PolarHBondContact O-N 3.24Å; D343-L345 VanDerWaalsContact C-N 3.34Å; D343-L345 PolarHBondContact O-N 3.13Å; L345-N349 WeakPolarHBondContact O-CB 3.37Å; L345-N349 PolarHBondContact O-N 2.91Å; L345-N349 VanDerWaalsContact O-N 3.1Å; L345-N349 PolarHBondContact O-ND2 2.96Å; L345-N349 PolarHBondContact O-OD1 3.48Å; L345-Y374 HydrophobicContact CD1-CE1 4.5Å; L345-Y374 HydrophobicContact CD2-CD1 4.5Å; L345-Y374 HydrophobicContact CD2-CE1 3.91Å; L345-Y374 HydrophobicContact CG-CE1 4.02Å; L345-L421 HydrophobicContact CD1-CD1 3.53Å; L345-A424 HydrophobicContact CB-CB 4.49Å; L345-A424 HydrophobicContact CD1-CB 3.83Å; L345-L425 HydrophobicContact CD1-CD2 3.85Å; L345-L425 HydrophobicContact CD1-CG 3.99Å; L345-L425 HydrophobicContact CD2-CD2 4.32Å; L345-R428 HydrophobicContact CD2-CB 4.12Å; L345-R428 HydrophobicContact CD2-CG 4.13Å
346	R	79.2	Confident	74	Confident	151 Å²	151	73.3 Å²	73.3	57%	0.57	37%	0.369	S	S	*	.	H	α-helix	trans	-62	-49.8	173	178.8	175.6	66.3	159.4	0.4	111.6	L342 D343 S348 N349 D350	L342-R346 WeakPolarHBondContact O-CB 3.28Å; L342-R346 PolarHBondContact O-N 2.81Å; D343-R346 WeakPolarHBondContact O-CB 3.29Å; D343-R346 PolarHBondContact O-N 3.32Å; D343-R346 VanDerWaalsContact O-N 3.16Å; D343-R346 IonicContact OD1-CZ 3.75Å; D343-R346 IonicContact OD1-NE 3.89Å; D343-R346 PolarHBondContact OD1-NE 3.04Å; D343-R346 IonicContact OD1-NH2 2.93Å; D343-R346 PolarHBondContact OD1-NH2 3.38Å; R346-S348 VanDerWaalsContact C-N 3.27Å; R346-S348 PolarHBondContact O-N 3.15Å; R346-N349 CarbonylContact O-C 3.41Å; R346-N349 WeakPolarHBondContact O-CA 3.24Å; R346-N349 WeakPolarHBondContact O-CB 3.24Å; R346-N349 PolarHBondContact O-N 3Å; R346-D350 PolarHBondContact O-N 3.41Å
347	N	69.6	Low	72.5	Confident	76 Å²	76	76.5 Å²	76.5	41%	0.406	37%	0.371	S	S	.	.	H	α-helix	trans	-68.9	-27.3	-176.3	-56.5	-17.6	0	0	0	111.9	D343 R344	D343-N347 WeakPolarHBondContact O-CB 3.44Å; D343-N347 PolarHBondContact O-N 2.82Å; D343-N347 PolarHBondContact O-ND2 3.4Å; D343-N347 PolarHBondContact O-OD1 2.87Å; D343-N347 PolarHBondContact OD2-ND2 3.17Å; R344-N347 PolarHBondContact O-N 3.27Å
348	S	63.9	Low	71.4	Confident	39 Å²	39	74.6 Å²	74.6	27%	0.273	36%	0.361	S	S	.	.	H	α-helix	trans	-73.9	-21.8	166.8	-70.6	0	0	0	0	113.6	R344 R346 R428	R344-S348 PolarHBondContact O-N 3.31Å; R344-S348 PolarHBondContact O-OG 2.88Å; R346-S348 VanDerWaalsContact C-N 3.27Å; R346-S348 PolarHBondContact O-N 3.15Å; S348-R428 PolarHBondContact O-NH1 2.96Å
349	N	57.4	Low	70.2	Confident	69 Å²	69	82.5 Å²	82.5	37%	0.369	39%	0.392	S	S	.	.	H	α-helix	trans	-89.6	-6.1	178.3	-71.6	-9.5	0	0	0	113.7	L345 R346 G351 R428	L345-N349 WeakPolarHBondContact O-CB 3.37Å; L345-N349 PolarHBondContact O-N 2.91Å; L345-N349 VanDerWaalsContact O-N 3.1Å; L345-N349 PolarHBondContact O-ND2 2.96Å; L345-N349 PolarHBondContact O-OD1 3.48Å; R346-N349 CarbonylContact O-C 3.41Å; R346-N349 WeakPolarHBondContact O-CA 3.24Å; R346-N349 WeakPolarHBondContact O-CB 3.24Å; R346-N349 PolarHBondContact O-N 3Å; N349-G351 PolarHBondContact O-N 2.81Å; N349-R428 WeakPolarHBondContact OD1-CD 3.45Å
350	D	51.2	Low	69.3	Low	117 Å²	117	79.7 Å²	79.7	63%	0.626	38%	0.38	S	S	*	.	S	Bend	trans	-72.3	19.2	176.8	-87.7	-16.8	0	0	0	114.3	R346 R352	R346-D350 PolarHBondContact O-N 3.41Å; D350-R352 VanDerWaalsContact C-N 3.3Å; D350-R352 PolarHBondContact O-N 2.91Å
351	G	51.2	Low	68.9	Low	18 Å²	18	76.3 Å²	76.3	19%	0.186	36%	0.361	C	S	.	.	S	Bend	trans	70.5	-69.7	170.1	0	0	0	0	0	114.9	N349 A353 D354 E355	N349-G351 PolarHBondContact O-N 2.81Å; G351-A353 PolarHBondContact O-N 3.32Å; G351-D354 PolarHBondContact O-N 3.32Å; G351-E355 WeakPolarHBondContact O-CG 3.49Å; G351-E355 PolarHBondContact O-N 3.1Å
352	R	51.9	Low	68.6	Low	207 Å²	207	80.6 Å²	80.6	78%	0.781	38%	0.381	S	S	*	.	H	α-helix	trans	-56.1	-27.1	-160.4	-67	178.9	170.6	-174.3	-3.8	116	D350 E355	D350-R352 VanDerWaalsContact C-N 3.3Å; D350-R352 PolarHBondContact O-N 2.91Å; R352-E355 WeakPolarHBondContact CA-OE2 3.23Å; R352-E355 PolarHBondContact N-OE2 3.29Å
353	A	52.9	Low	68.2	Low	67 Å²	67	81.3 Å²	81.3	55%	0.554	39%	0.385	S	S	*	.	H	α-helix	trans	-83	-33	179.3	0	0	0	0	0	113.1	G351	G351-A353 PolarHBondContact O-N 3.32Å
354	D	55.4	Low	68	Low	13 Å²	13	78.3 Å²	78.3	7%	0.07	37%	0.369	C	S	.	.	H	α-helix	trans	-93.9	-24.2	178.3	-76.7	-33.2	0	0	0	112.2	G351 Q356 R357 L358 R428	G351-D354 PolarHBondContact O-N 3.32Å; D354-Q356 PolarHBondContact O-N 3.44Å; D354-R357 CarbonylContact O-C 3.6Å; D354-R357 WeakPolarHBondContact O-CA 3.5Å; D354-R357 WeakPolarHBondContact O-CB 3.48Å; D354-R357 PolarHBondContact O-N 2.58Å; D354-L358 VanDerWaalsContact O-CG 3.29Å; D354-L358 WeakPolarHBondContact O-CG 3.26Å; D354-L358 PolarHBondContact O-N 2.98Å; D354-L358 VanDerWaalsContact O-N 3.11Å; D354-R428 IonicContact OD1-NH2 2.68Å; D354-R428 IonicContact OD2-CZ 3.48Å; D354-R428 IonicContact OD2-NH1 3.68Å; D354-R428 PolarHBondContact OD2-NH1 3.28Å; D354-R428 IonicContact OD2-NH2 2.65Å; D354-R428 PolarHBondContact OD2-NH2 3.05Å
355	E	53.4	Low	68.1	Low	63 Å²	63	73.1 Å²	73.1	29%	0.294	35%	0.352	S	S	.	.	H	α-helix	trans	-56.9	-35.7	169	-74.2	171.9	150.5	0	0	111.4	G351 R352 R357 L358 S501	G351-E355 WeakPolarHBondContact O-CG 3.49Å; G351-E355 PolarHBondContact O-N 3.1Å; R352-E355 WeakPolarHBondContact CA-OE2 3.23Å; R352-E355 PolarHBondContact N-OE2 3.29Å; E355-R357 PolarHBondContact O-N 3.42Å; E355-L358 PolarHBondContact O-N 3.11Å; E355-S501 WeakPolarHBondContact OE1-CB 2.83Å; E355-S501 PolarHBondContact OE1-OG 3.42Å
356	Q	56.9	Low	68.2	Low	139 Å²	139	80.2 Å²	80.2	65%	0.65	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	2.6	172	-65.1	-176.1	2.9	0	0	114.5	D354 Y359	D354-Q356 PolarHBondContact O-N 3.44Å; Q356-Y359 WeakPolarHBondContact O-CE2 3.33Å
357	R	62.1	Low	68.5	Low	114 Å²	114	73.2 Å²	73.2	43%	0.43	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124	-0.4	177.8	-67.7	175.5	150.2	-141.3	-10.2	112.8	D354 E355 D363 L367 E370	D354-R357 CarbonylContact O-C 3.6Å; D354-R357 WeakPolarHBondContact O-CA 3.5Å; D354-R357 WeakPolarHBondContact O-CB 3.48Å; D354-R357 PolarHBondContact O-N 2.58Å; E355-R357 PolarHBondContact O-N 3.42Å; R357-D363 WeakPolarHBondContact O-CB 3.36Å; R357-L367 HydrophobicContact CB-CD1 3.85Å; R357-L367 HydrophobicContact CB-CG 4.47Å; R357-E370 IonicContact NH1-OE1 2.7Å; R357-E370 PolarHBondContact NH1-OE1 3.04Å; R357-E370 IonicContact NH1-OE2 3.29Å; R357-E370 PolarHBondContact NH1-OE2 2.86Å
358	L	70.5	Confident	69.5	Low	22 Å²	22	70.7 Å²	70.7	12%	0.115	34%	0.339	C	S	.	.			trans	-104.7	33.7	-175.7	-73.6	170.1	0	0	0	112.9	D354 E355 T364 L367 F431 A435 Q439	D354-L358 VanDerWaalsContact O-CG 3.29Å; D354-L358 WeakPolarHBondContact O-CG 3.26Å; D354-L358 PolarHBondContact O-N 2.98Å; D354-L358 VanDerWaalsContact O-N 3.11Å; E355-L358 PolarHBondContact O-N 3.11Å; L358-T364 HydrophobicContact CD2-CG2 3.93Å; L358-L367 HydrophobicContact CD2-CD1 3.67Å; L358-L367 HydrophobicContact CG-CD1 3.98Å; L358-F431 HydrophobicContact CD1-CE1 4.1Å; L358-F431 HydrophobicContact CD1-CZ 4.16Å; L358-A435 HydrophobicContact CD1-CB 4.37Å; L358-A435 HydrophobicContact CD2-CB 3.93Å; L358-Q439 PolarHBondContact O-NE2 2.89Å
359	Y	68.6	Low	70.8	Confident	166 Å²	166	73.7 Å²	73.7	65%	0.651	35%	0.352	S	S	*	.	S	Bend	trans	-82.6	-20	-177.9	-62.6	-55.8	0	0	0	115	Q356	Q356-Y359 WeakPolarHBondContact O-CE2 3.33Å
360	S	73.6	Confident	72.3	Confident	26 Å²	26	75.4 Å²	75.4	18%	0.182	36%	0.357	C	S	.	.	S	Bend	trans	-139.7	168.5	-173.9	74.1	0	0	0	0	112.1	E362 D363 T364	S360-E362 VanDerWaalsContact C-N 3.35Å; S360-E362 PolarHBondContact OG-N 3.04Å; S360-D363 WeakPolarHBondContact OG-CB 3.14Å; S360-D363 PolarHBondContact OG-N 3.1Å; S360-D363 PolarHBondContact OG-OD2 3.37Å; S360-T364 WeakPolarHBondContact O-CB 3.41Å; S360-T364 PolarHBondContact O-N 3.4Å; S360-T364 PolarHBondContact O-OG1 2.97Å
361	I	84.3	Confident	74.2	Confident	38 Å²	38	71.6 Å²	71.6	20%	0.195	33%	0.334	C	S	.	.	H	α-helix	trans	-68.9	-41.3	172	-64	168.6	0	0	0	108.9	D363 T364 D365 Q439 N440	I361-D363 PolarHBondContact O-N 3.26Å; I361-T364 PolarHBondContact O-N 2.76Å; I361-D365 WeakPolarHBondContact O-CB 3.17Å; I361-D365 PolarHBondContact O-N 2.89Å; I361-Q439 HydrophobicContact CG1-CB 3.88Å; I361-N440 WeakPolarHBondContact CD1-OD1 3.48Å
362	E	86	Confident	76.1	Confident	121 Å²	121	76.2 Å²	76.2	57%	0.565	35%	0.351	S	S	*	.	H	α-helix	trans	-61.2	-41.4	-179.5	-64.9	81.6	173.4	0	0	112.7	S360 R366	S360-E362 VanDerWaalsContact C-N 3.35Å; S360-E362 PolarHBondContact OG-N 3.04Å; E362-R366 VanDerWaalsContact O-CG 3.25Å; E362-R366 WeakPolarHBondContact O-CG 3.13Å; E362-R366 PolarHBondContact O-N 3.18Å
363	D	83.3	Confident	78	Confident	48 Å²	48	69.5 Å²	69.5	26%	0.257	34%	0.336	S	S	.	.	H	α-helix	trans	-76	-33	177.2	-62.1	-55.4	0	0	0	112.3	R357 S360 I361 D365 R366 L367	R357-D363 WeakPolarHBondContact O-CB 3.36Å; S360-D363 WeakPolarHBondContact OG-CB 3.14Å; S360-D363 PolarHBondContact OG-N 3.1Å; S360-D363 PolarHBondContact OG-OD2 3.37Å; I361-D363 PolarHBondContact O-N 3.26Å; D363-D365 VanDerWaalsContact C-N 3.32Å; D363-R366 PolarHBondContact O-N 3.36Å; D363-R366 IonicContact OD1-CZ 2.75Å; D363-R366 IonicContact OD1-NH1 3.19Å; D363-R366 PolarHBondContact OD1-NH1 3.3Å; D363-L367 WeakPolarHBondContact O-CG 3.13Å; D363-L367 PolarHBondContact O-N 3.3Å
364	T	83.4	Confident	79.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65	-38.6	171.3	-53.4	0	0	0	0	111.2	L358 S360 I361 L367 I368 A435 R436	L358-T364 HydrophobicContact CD2-CG2 3.93Å; S360-T364 WeakPolarHBondContact O-CB 3.41Å; S360-T364 PolarHBondContact O-N 3.4Å; S360-T364 PolarHBondContact O-OG1 2.97Å; I361-T364 PolarHBondContact O-N 2.76Å; T364-L367 PolarHBondContact O-N 2.92Å; T364-I368 HydrophobicContact CG2-CD1 4.32Å; T364-I368 WeakPolarHBondContact O-CG1 3.28Å; T364-I368 PolarHBondContact O-N 2.97Å; T364-A435 HydrophobicContact CG2-CB 4.15Å; T364-R436 HydrophobicContact CG2-CB 3.86Å; T364-R436 HydrophobicContact CG2-CG 4.46Å
365	D	89.8	Confident	81.5	Confident	37 Å²	37	67.9 Å²	67.9	20%	0.198	32%	0.32	C	S	.	.	H	α-helix	trans	-70.1	-40.2	176.8	-74.4	-8.6	0	0	0	111.7	I361 D363 L367 I368 D369 R436	I361-D365 WeakPolarHBondContact O-CB 3.17Å; I361-D365 PolarHBondContact O-N 2.89Å; D363-D365 VanDerWaalsContact C-N 3.32Å; D365-L367 VanDerWaalsContact C-N 3.31Å; D365-L367 PolarHBondContact O-N 3.36Å; D365-I368 WeakPolarHBondContact O-CB 3.48Å; D365-I368 PolarHBondContact O-N 3.07Å; D365-I368 VanDerWaalsContact O-N 3.11Å; D365-D369 PolarHBondContact O-N 3.41Å; D365-R436 VanDerWaalsContact CG-CZ 3.48Å; D365-R436 VanDerWaalsContact OD1-CD 3.25Å; D365-R436 WeakPolarHBondContact OD1-CD 3.37Å; D365-R436 IonicContact OD1-CZ 2.88Å; D365-R436 IonicContact OD1-NE 2.75Å; D365-R436 PolarHBondContact OD1-NE 3.44Å; D365-R436 IonicContact OD1-NH1 3.59Å; D365-R436 IonicContact OD1-NH2 3.07Å; D365-R436 PolarHBondContact OD1-NH2 3.32Å; D365-R436 VanDerWaalsContact OD1-NH2 3.07Å; D365-R436 IonicContact OD2-CZ 3.39Å; D365-R436 IonicContact OD2-NE 3.65Å; D365-R436 IonicContact OD2-NH2 2.68Å; D365-R436 PolarHBondContact OD2-NH2 2.63Å
366	R	88.3	Confident	83.3	Confident	153 Å²	153	72 Å²	72	58%	0.577	34%	0.337	S	S	*	.	H	α-helix	trans	-56.2	-43.7	169.2	-72.5	165.4	-175.6	161.4	0.8	112.1	E362 D363 I368 D369 E370	E362-R366 VanDerWaalsContact O-CG 3.25Å; E362-R366 WeakPolarHBondContact O-CG 3.13Å; E362-R366 PolarHBondContact O-N 3.18Å; D363-R366 PolarHBondContact O-N 3.36Å; D363-R366 IonicContact OD1-CZ 2.75Å; D363-R366 IonicContact OD1-NH1 3.19Å; D363-R366 PolarHBondContact OD1-NH1 3.3Å; R366-I368 VanDerWaalsContact C-N 3.32Å; R366-I368 PolarHBondContact O-N 3.05Å; R366-D369 PolarHBondContact O-N 2.85Å; R366-E370 WeakPolarHBondContact O-CB 3.42Å; R366-E370 WeakPolarHBondContact O-CG 3.19Å; R366-E370 PolarHBondContact O-N 3.34Å
367	L	85.5	Confident	84.9	Confident	5 Å²	5	71.3 Å²	71.3	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-65.7	-32.9	176.3	-79.5	172.8	0	0	0	112.9	R357 L358 D363 T364 D365 Y371 L432	R357-L367 HydrophobicContact CB-CD1 3.85Å; R357-L367 HydrophobicContact CB-CG 4.47Å; L358-L367 HydrophobicContact CD2-CD1 3.67Å; L358-L367 HydrophobicContact CG-CD1 3.98Å; D363-L367 WeakPolarHBondContact O-CG 3.13Å; D363-L367 PolarHBondContact O-N 3.3Å; T364-L367 PolarHBondContact O-N 2.92Å; D365-L367 VanDerWaalsContact C-N 3.31Å; D365-L367 PolarHBondContact O-N 3.36Å; L367-Y371 VanDerWaalsContact O-CB 3.29Å; L367-Y371 WeakPolarHBondContact O-CB 3.2Å; L367-Y371 PolarHBondContact O-N 2.97Å; L367-L432 HydrophobicContact CB-CD2 3.98Å
368	I	89.2	Confident	86.3	Confident	22 Å²	22	66 Å²	66	11%	0.113	31%	0.312	C	S	.	.	H	α-helix	trans	-68.4	-41.9	173.5	-74.6	165.4	0	0	0	110.8	T364 D365 R366 Y371 Q372 L432 R436	T364-I368 HydrophobicContact CG2-CD1 4.32Å; T364-I368 WeakPolarHBondContact O-CG1 3.28Å; T364-I368 PolarHBondContact O-N 2.97Å; D365-I368 WeakPolarHBondContact O-CB 3.48Å; D365-I368 PolarHBondContact O-N 3.07Å; D365-I368 VanDerWaalsContact O-N 3.11Å; R366-I368 VanDerWaalsContact C-N 3.32Å; R366-I368 PolarHBondContact O-N 3.05Å; I368-Y371 PolarHBondContact O-N 3.35Å; I368-Q372 VanDerWaalsContact CG2-NE2 3.26Å; I368-Q372 WeakPolarHBondContact O-CG 3.28Å; I368-Q372 PolarHBondContact O-N 3.34Å; I368-L432 HydrophobicContact CG1-CB 3.84Å; I368-L432 HydrophobicContact CG1-CD1 4.43Å; I368-R436 HydrophobicContact CD1-CB 4.07Å; I368-R436 HydrophobicContact CD1-CG 4.39Å
369	D	91.6	Very high	87.3	Confident	102 Å²	102	70.3 Å²	70.3	55%	0.545	33%	0.332	S	S	.	.	H	α-helix	trans	-69.2	-41.7	176.8	-70.6	-14.6	0	0	0	112	D365 R366 Y371 Q372 S373	D365-D369 PolarHBondContact O-N 3.41Å; R366-D369 PolarHBondContact O-N 2.85Å; D369-Y371 VanDerWaalsContact C-N 3.29Å; D369-Y371 PolarHBondContact O-N 2.8Å; D369-Q372 PolarHBondContact O-N 3.35Å; D369-S373 VanDerWaalsContact O-CB 3.29Å; D369-S373 WeakPolarHBondContact O-CB 3.26Å; D369-S373 PolarHBondContact O-N 3.5Å
370	E	89.3	Confident	88.4	Confident	105 Å²	105	69.1 Å²	69.1	49%	0.491	33%	0.332	S	S	.	.	H	α-helix	trans	-56.1	-44.5	170	-79.5	-173.4	-169.1	0	0	110.8	R357 R366 Y374	R357-E370 IonicContact NH1-OE1 2.7Å; R357-E370 PolarHBondContact NH1-OE1 3.04Å; R357-E370 IonicContact NH1-OE2 3.29Å; R357-E370 PolarHBondContact NH1-OE2 2.86Å; R366-E370 WeakPolarHBondContact O-CB 3.42Å; R366-E370 WeakPolarHBondContact O-CG 3.19Å; R366-E370 PolarHBondContact O-N 3.34Å; E370-Y374 WeakPolarHBondContact O-CB 3.18Å; E370-Y374 PolarHBondContact O-N 3.12Å
371	Y	90.5	Very high	89.4	Confident	37 Å²	37	68.7 Å²	68.7	15%	0.145	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-44.8	177.3	168	-97.6	0	0	0	112.9	L367 I368 D369 S373 Y374 A375 L425 R428 A429 L432	L367-Y371 VanDerWaalsContact O-CB 3.29Å; L367-Y371 WeakPolarHBondContact O-CB 3.2Å; L367-Y371 PolarHBondContact O-N 2.97Å; I368-Y371 PolarHBondContact O-N 3.35Å; D369-Y371 VanDerWaalsContact C-N 3.29Å; D369-Y371 PolarHBondContact O-N 2.8Å; Y371-S373 PolarHBondContact O-N 2.71Å; Y371-Y374 PolarHBondContact O-N 3.18Å; Y371-A375 HydrophobicContact CE1-CB 4.37Å; Y371-A375 HydrophobicContact CE2-CB 4.38Å; Y371-A375 WeakPolarHBondContact O-CB 3.5Å; Y371-A375 PolarHBondContact O-N 2.86Å; Y371-L425 HydrophobicContact CE2-CD2 3.95Å; Y371-L425 PolarHBondContact OH-O 2.75Å; Y371-R428 HydrophobicContact CD2-CB 4.24Å; Y371-R428 HydrophobicContact CD2-CG 3.5Å; Y371-R428 HydrophobicContact CE2-CB 3.91Å; Y371-R428 HydrophobicContact CE2-CG 3.71Å; Y371-R428 HydrophobicContact CG-CG 4.37Å; Y371-A429 HydrophobicContact CE1-CB 3.75Å; Y371-L432 VanDerWaalsContact CB-CD1 3.49Å; Y371-L432 HydrophobicContact CD1-CD1 4.3Å; Y371-L432 HydrophobicContact CD2-CD1 4.42Å; Y371-L432 HydrophobicContact CG-CD1 3.79Å
372	Q	92.4	Very high	89.8	Confident	115 Å²	115	68.8 Å²	68.8	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-43.5	178	-74.4	179.6	49	0	0	111.5	I368 D369 Y374 A375 K376	I368-Q372 VanDerWaalsContact CG2-NE2 3.26Å; I368-Q372 WeakPolarHBondContact O-CG 3.28Å; I368-Q372 PolarHBondContact O-N 3.34Å; D369-Q372 PolarHBondContact O-N 3.35Å; Q372-Y374 VanDerWaalsContact C-N 3.27Å; Q372-Y374 PolarHBondContact O-N 3.39Å; Q372-A375 PolarHBondContact O-N 3.29Å; Q372-K376 PolarHBondContact O-N 3.33Å
373	S	90.8	Very high	90.2	Very high	66 Å²	66	69.6 Å²	69.6	46%	0.462	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-34.3	174.6	-174.7	0	0	0	0	112.6	D369 Y371 K377	D369-S373 VanDerWaalsContact O-CB 3.29Å; D369-S373 WeakPolarHBondContact O-CB 3.26Å; D369-S373 PolarHBondContact O-N 3.5Å; Y371-S373 PolarHBondContact O-N 2.71Å; S373-K377 WeakPolarHBondContact O-CG 3.36Å
374	Y	91.1	Very high	90.8	Very high	21 Å²	21	69.3 Å²	69.3	8%	0.082	34%	0.335	C	S	.	.	H	α-helix	trans	-76.8	-43.7	175.4	178.2	-108.3	0	0	0	113.1	H341 L345 E370 Y371 Q372 K376 K377 T378	H341-Y374 WeakPolarHBondContact CA-OH 3.47Å; H341-Y374 AromaticContact CE1-CE2 3.93Å; H341-Y374 AromaticContact ND1-CE2 3.59Å; H341-Y374 AromaticContact ND1-CZ 3.35Å; H341-Y374 PolarHBondContact ND1-OH 3.25Å; H341-Y374 PolarHBondContact O-OH 3.39Å; L345-Y374 HydrophobicContact CD1-CE1 4.5Å; L345-Y374 HydrophobicContact CD2-CD1 4.5Å; L345-Y374 HydrophobicContact CD2-CE1 3.91Å; L345-Y374 HydrophobicContact CG-CE1 4.02Å; E370-Y374 WeakPolarHBondContact O-CB 3.18Å; E370-Y374 PolarHBondContact O-N 3.12Å; Y371-Y374 PolarHBondContact O-N 3.18Å; Q372-Y374 VanDerWaalsContact C-N 3.27Å; Q372-Y374 PolarHBondContact O-N 3.39Å; Y374-K376 VanDerWaalsContact C-N 3.32Å; Y374-K376 PolarHBondContact O-N 3.45Å; Y374-K377 WeakPolarHBondContact O-CB 3.47Å; Y374-K377 PolarHBondContact O-N 3Å; Y374-T378 HydrophobicContact CE1-CG2 4.48Å; Y374-T378 PolarHBondContact O-N 3.48Å
375	A	91.2	Very high	91.3	Very high	25 Å²	25	69.3 Å²	69.3	21%	0.207	34%	0.335	C	S	.	.	H	α-helix	trans	-60	-42.5	177.5	0	0	0	0	0	111.2	Y371 Q372 K377 T378 E379 L425	Y371-A375 HydrophobicContact CE1-CB 4.37Å; Y371-A375 HydrophobicContact CE2-CB 4.38Å; Y371-A375 WeakPolarHBondContact O-CB 3.5Å; Y371-A375 PolarHBondContact O-N 2.86Å; Q372-A375 PolarHBondContact O-N 3.29Å; A375-K377 VanDerWaalsContact C-N 3.26Å; A375-K377 PolarHBondContact O-N 3.44Å; A375-T378 PolarHBondContact O-N 3.08Å; A375-T378 PolarHBondContact O-OG1 3.27Å; A375-E379 PolarHBondContact O-N 3.31Å; A375-L425 HydrophobicContact CB-CD2 4.31Å
376	K	91.1	Very high	91.5	Very high	150 Å²	150	71.7 Å²	71.7	65%	0.652	35%	0.348	S	S	*	.	H	α-helix	trans	-58.5	-35.6	173.4	-173	173.4	-178.3	178.5	0	113	Q372 Y374 T378 E379	Q372-K376 PolarHBondContact O-N 3.33Å; Y374-K376 VanDerWaalsContact C-N 3.32Å; Y374-K376 PolarHBondContact O-N 3.45Å; K376-T378 VanDerWaalsContact C-N 3.32Å; K376-T378 PolarHBondContact O-N 3.1Å; K376-E379 WeakPolarHBondContact O-CB 3.36Å; K376-E379 PolarHBondContact O-N 2.74Å
377	K	89.7	Confident	91.8	Very high	125 Å²	125	67.4 Å²	67.4	54%	0.543	35%	0.345	S	S	.	.	H	α-helix	trans	-70.1	-27.5	176.5	-69.8	169.5	-175.4	177	0	113	S373 Y374 A375 E379	S373-K377 WeakPolarHBondContact O-CG 3.36Å; Y374-K377 WeakPolarHBondContact O-CB 3.47Å; Y374-K377 PolarHBondContact O-N 3Å; A375-K377 VanDerWaalsContact C-N 3.26Å; A375-K377 PolarHBondContact O-N 3.44Å; K377-E379 PolarHBondContact O-N 3.05Å
378	T	91.7	Very high	92.2	Very high	3 Å²	3	67.5 Å²	67.5	2%	0.018	35%	0.346	C	S	.	.	H	α-helix	trans	-70.8	-21.5	173.3	63.9	0	0	0	0	112.9	H341 Y374 A375 K376 E380 D381 F382 L421 L425	H341-T378 WeakPolarHBondContact ND1-CG2 3.45Å; Y374-T378 HydrophobicContact CE1-CG2 4.48Å; Y374-T378 PolarHBondContact O-N 3.48Å; A375-T378 PolarHBondContact O-N 3.08Å; A375-T378 PolarHBondContact O-OG1 3.27Å; K376-T378 VanDerWaalsContact C-N 3.32Å; K376-T378 PolarHBondContact O-N 3.1Å; T378-E380 VanDerWaalsContact C-N 3.29Å; T378-E380 PolarHBondContact O-N 3.25Å; T378-D381 PolarHBondContact O-N 2.97Å; T378-D381 VanDerWaalsContact O-N 3.12Å; T378-F382 WeakPolarHBondContact O-CD2 3.14Å; T378-F382 PolarHBondContact O-N 3.35Å; T378-L421 HydrophobicContact CG2-CD2 4.3Å; T378-L425 WeakPolarHBondContact OG1-CD1 3.5Å
379	E	91.8	Very high	92.4	Very high	111 Å²	111	67.1 Å²	67.1	52%	0.519	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-37.8	-178.2	-161	162.9	-148.1	0	0	111.9	A375 K376 K377 D381 F382 E383	A375-E379 PolarHBondContact O-N 3.31Å; K376-E379 WeakPolarHBondContact O-CB 3.36Å; K376-E379 PolarHBondContact O-N 2.74Å; K377-E379 PolarHBondContact O-N 3.05Å; E379-D381 PolarHBondContact O-N 3.02Å; E379-F382 WeakPolarHBondContact O-CB 3.47Å; E379-F382 PolarHBondContact O-N 2.98Å; E379-F382 VanDerWaalsContact O-N 3.12Å; E379-E383 PolarHBondContact O-N 2.76Å
380	E	92	Very high	92.4	Very high	142 Å²	142	66.8 Å²	66.8	66%	0.664	34%	0.341	S	S	*	.	H	α-helix	trans	-59.6	-41.7	175	-62.8	174.5	-156.7	0	0	112.1	T378 E383 A384	T378-E380 VanDerWaalsContact C-N 3.29Å; T378-E380 PolarHBondContact O-N 3.25Å; E380-E383 PolarHBondContact O-N 2.81Å; E380-A384 WeakPolarHBondContact O-CB 3.47Å; E380-A384 PolarHBondContact O-N 3.13Å
381	D	93.6	Very high	92.5	Very high	17 Å²	17	65.3 Å²	65.3	9%	0.091	33%	0.331	C	S	.	.	H	α-helix	trans	-71.5	-32.1	174.7	-86.4	-54.9	0	0	0	112.5	L334 N337 F338 H341 T378 E379 A385	L334-D381 VanDerWaalsContact CD2-OD1 3.22Å; L334-D381 WeakPolarHBondContact CD2-OD1 3.44Å; N337-D381 WeakPolarHBondContact CB-OD1 3.39Å; N337-D381 WeakPolarHBondContact CB-OD2 3.25Å; N337-D381 PolarHBondContact ND2-OD1 3.03Å; N337-D381 PolarHBondContact ND2-OD2 3.16Å; F338-D381 HydrophobicContact CD2-CB 4.49Å; F338-D381 HydrophobicContact CE2-CB 3.87Å; F338-D381 WeakPolarHBondContact CE2-O 3.48Å; F338-D381 HydrophobicContact CZ-CB 4.25Å; H341-D381 IonicContact CD2-OD2 3.97Å; H341-D381 IonicContact NE2-OD2 3.89Å; H341-D381 PolarHBondContact NE2-OD2 3.08Å; T378-D381 PolarHBondContact O-N 2.97Å; T378-D381 VanDerWaalsContact O-N 3.12Å; E379-D381 PolarHBondContact O-N 3.02Å; D381-A385 WeakPolarHBondContact O-CB 3.21Å; D381-A385 PolarHBondContact O-N 3.21Å
382	F	94.3	Very high	92.5	Very high	39 Å²	39	63.6 Å²	63.6	17%	0.171	32%	0.324	C	S	.	.	H	α-helix	trans	-65.5	-43.8	172	-83.1	-82	0	0	0	111.7	F338 T378 E379 A385 N386 T418 L421 D422 L425	F338-F382 HydrophobicContact CE1-CE1 4.37Å; F338-F382 HydrophobicContact CE1-CZ 4.44Å; T378-F382 WeakPolarHBondContact O-CD2 3.14Å; T378-F382 PolarHBondContact O-N 3.35Å; E379-F382 WeakPolarHBondContact O-CB 3.47Å; E379-F382 PolarHBondContact O-N 2.98Å; E379-F382 VanDerWaalsContact O-N 3.12Å; F382-A385 PolarHBondContact O-N 2.67Å; F382-N386 VanDerWaalsContact O-CG 3.28Å; F382-N386 PolarHBondContact O-N 2.61Å; F382-N386 VanDerWaalsContact O-N 3.13Å; F382-N386 PolarHBondContact O-ND2 3.22Å; F382-T418 HydrophobicContact CD1-CG2 3.7Å; F382-T418 HydrophobicContact CE1-CG2 3.61Å; F382-L421 HydrophobicContact CE2-CD2 3.85Å; F382-L421 HydrophobicContact CE2-CG 4.05Å; F382-L421 HydrophobicContact CZ-CB 4.07Å; F382-L421 HydrophobicContact CZ-CD2 4.11Å; F382-L421 HydrophobicContact CZ-CG 3.98Å; F382-D422 HydrophobicContact CE1-CB 4.43Å; F382-D422 HydrophobicContact CZ-CB 4.29Å; F382-L425 HydrophobicContact CE2-CD1 3.91Å; F382-L425 HydrophobicContact CZ-CD1 4.33Å
383	E	94.3	Very high	92.3	Very high	138 Å²	138	63 Å²	63	65%	0.645	32%	0.321	S	S	*	.	H	α-helix	trans	-63.7	-50.7	175.4	-71	-167.1	160.8	0	0	111.4	E379 E380 A385 N386 A387	E379-E383 PolarHBondContact O-N 2.76Å; E380-E383 PolarHBondContact O-N 2.81Å; E383-A385 VanDerWaalsContact C-N 3.28Å; E383-A385 PolarHBondContact O-N 3.37Å; E383-N386 PolarHBondContact O-N 2.92Å; E383-A387 PolarHBondContact O-N 3.46Å
384	A	94.7	Very high	92.1	Very high	43 Å²	43	64.8 Å²	64.8	36%	0.355	32%	0.323	S	S	.	.	H	α-helix	trans	-60.2	-37.5	178.1	0	0	0	0	0	112.3	L334 E380 N386 A387 L388	L334-A384 HydrophobicContact CD1-CB 4.28Å; L334-A384 HydrophobicContact CD2-CB 3.73Å; E380-A384 WeakPolarHBondContact O-CB 3.47Å; E380-A384 PolarHBondContact O-N 3.13Å; A384-N386 VanDerWaalsContact C-N 3.33Å; A384-N386 PolarHBondContact O-N 2.98Å; A384-A387 PolarHBondContact O-N 3.28Å; A384-L388 WeakPolarHBondContact O-CB 3.34Å; A384-L388 PolarHBondContact O-N 3.12Å
385	A	94.6	Very high	91.9	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-64.3	-35.6	173.6	0	0	0	0	0	113.1	L334 F338 D381 F382 E383 K389 L414	L334-A385 HydrophobicContact CD1-CB 4.36Å; F338-A385 HydrophobicContact CE2-CB 3.83Å; F338-A385 HydrophobicContact CZ-CB 3.98Å; D381-A385 WeakPolarHBondContact O-CB 3.21Å; D381-A385 PolarHBondContact O-N 3.21Å; F382-A385 PolarHBondContact O-N 2.67Å; E383-A385 VanDerWaalsContact C-N 3.28Å; E383-A385 PolarHBondContact O-N 3.37Å; A385-K389 WeakPolarHBondContact O-CD 3.26Å; A385-K389 VanDerWaalsContact O-CE 3.28Å; A385-K389 WeakPolarHBondContact O-CE 3.46Å; A385-K389 WeakPolarHBondContact O-CG 3.44Å; A385-K389 PolarHBondContact O-N 2.79Å; A385-K389 VanDerWaalsContact O-N 3.12Å; A385-L414 HydrophobicContact CB-CD1 3.89Å; A385-L414 HydrophobicContact CB-CD2 4.11Å; A385-L414 HydrophobicContact CB-CG 3.99Å
386	N	93.7	Very high	91.6	Very high	86 Å²	86	65.7 Å²	65.7	46%	0.46	33%	0.325	S	S	.	.	H	α-helix	trans	-76.7	-39	177.8	-67.1	-26.4	0	0	0	112	F382 E383 A384 L388 K389 L390	F382-N386 VanDerWaalsContact O-CG 3.28Å; F382-N386 PolarHBondContact O-N 2.61Å; F382-N386 VanDerWaalsContact O-N 3.13Å; F382-N386 PolarHBondContact O-ND2 3.22Å; E383-N386 PolarHBondContact O-N 2.92Å; A384-N386 VanDerWaalsContact C-N 3.33Å; A384-N386 PolarHBondContact O-N 2.98Å; N386-L388 VanDerWaalsContact C-N 3.34Å; N386-L388 PolarHBondContact O-N 2.62Å; N386-K389 PolarHBondContact O-N 2.79Å; N386-K389 PolarHBondContact OD1-NZ 3.05Å; N386-L390 PolarHBondContact O-N 3.36Å; N386-L390 VanDerWaalsContact O-N 3.14Å
387	A	94.9	Very high	91.1	Very high	63 Å²	63	66 Å²	66	52%	0.521	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-42.9	171.3	0	0	0	0	0	112	E383 A384 L390 R391	E383-A387 PolarHBondContact O-N 3.46Å; A384-A387 PolarHBondContact O-N 3.28Å; A387-L390 PolarHBondContact O-N 2.85Å; A387-R391 PolarHBondContact O-N 3.12Å
388	L	94.4	Very high	90.3	Very high	8 Å²	8	63.4 Å²	63.4	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-68.1	-36.1	177.7	-172.9	62.5	0	0	0	112.6	F327 D330 F331 L334 A384 N386 R391 G392 L414	F327-L388 HydrophobicContact CD2-CD1 3.43Å; F327-L388 VanDerWaalsContact CD2-CD1 3.43Å; F327-L388 HydrophobicContact CD2-CG 4.09Å; F327-L388 HydrophobicContact CE2-CD1 3.7Å; F327-L388 HydrophobicContact CE2-CG 3.81Å; F327-L388 WeakPolarHBondContact CE2-O 3.39Å; F327-L388 HydrophobicContact CG-CD1 4.3Å; D330-L388 HydrophobicContact CB-CD1 3.72Å; D330-L388 HydrophobicContact CB-CD2 3.88Å; D330-L388 HydrophobicContact CB-CG 4.44Å; F331-L388 HydrophobicContact CB-CD2 3.99Å; L334-L388 HydrophobicContact CD1-CB 4.15Å; L334-L388 HydrophobicContact CD1-CD2 3.83Å; A384-L388 WeakPolarHBondContact O-CB 3.34Å; A384-L388 PolarHBondContact O-N 3.12Å; N386-L388 VanDerWaalsContact C-N 3.34Å; N386-L388 PolarHBondContact O-N 2.62Å; L388-R391 PolarHBondContact O-N 2.76Å; L388-G392 PolarHBondContact O-N 2.74Å; L388-L414 HydrophobicContact CB-CD2 4.31Å; L388-L414 HydrophobicContact CD2-CD2 4.08Å; L388-L414 HydrophobicContact CG-CD2 4.45Å
389	K	92.2	Very high	88.7	Confident	13 Å²	13	70 Å²	70	6%	0.057	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-49.6	173.5	-71.5	159.9	-156.3	174.1	0	111.1	A385 N386 R391 G392 E393 L414 N415 T418	A385-K389 WeakPolarHBondContact O-CD 3.26Å; A385-K389 VanDerWaalsContact O-CE 3.28Å; A385-K389 WeakPolarHBondContact O-CE 3.46Å; A385-K389 WeakPolarHBondContact O-CG 3.44Å; A385-K389 PolarHBondContact O-N 2.79Å; A385-K389 VanDerWaalsContact O-N 3.12Å; N386-K389 PolarHBondContact O-N 2.79Å; N386-K389 PolarHBondContact OD1-NZ 3.05Å; K389-R391 VanDerWaalsContact C-N 3.35Å; K389-R391 PolarHBondContact O-N 3.06Å; K389-G392 CarbonylContact O-C 3.56Å; K389-G392 WeakPolarHBondContact O-CA 3.26Å; K389-G392 PolarHBondContact O-N 2.8Å; K389-E393 WeakPolarHBondContact O-CG 3.35Å; K389-E393 PolarHBondContact O-N 3.35Å; K389-L414 HydrophobicContact CG-CD2 4.2Å; K389-N415 VanDerWaalsContact CD-OD1 3.27Å; K389-N415 WeakPolarHBondContact CD-OD1 3.36Å; K389-N415 WeakPolarHBondContact CE-OD1 3.35Å; K389-N415 PolarHBondContact NZ-OD1 2.96Å; K389-T418 PolarHBondContact NZ-OG1 3Å
390	L	92.5	Very high	87.3	Confident	95 Å²	95	66.2 Å²	66.2	50%	0.497	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-42.1	178.3	-177.1	64.8	0	0	0	111.9	N386 A387 G392 E393 Q394	N386-L390 PolarHBondContact O-N 3.36Å; N386-L390 VanDerWaalsContact O-N 3.14Å; A387-L390 PolarHBondContact O-N 2.85Å; L390-G392 VanDerWaalsContact C-N 3.29Å; L390-G392 PolarHBondContact O-N 3.02Å; L390-E393 PolarHBondContact O-N 2.91Å; L390-Q394 WeakPolarHBondContact O-CG 3.37Å; L390-Q394 PolarHBondContact O-N 2.85Å
391	R	91.2	Very high	86	Confident	75 Å²	75	65.6 Å²	65.6	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-59.7	-39.6	172.5	-172.9	-177.2	-174	-168.7	3.8	111.9	D330 A387 L388 K389 L395	D330-R391 IonicContact OD2-NH1 3.01Å; D330-R391 PolarHBondContact OD2-NH1 2.84Å; A387-R391 PolarHBondContact O-N 3.12Å; L388-R391 PolarHBondContact O-N 2.76Å; K389-R391 VanDerWaalsContact C-N 3.35Å; K389-R391 PolarHBondContact O-N 3.06Å; R391-L395 HydrophobicContact CG-CD1 4.39Å; R391-L395 VanDerWaalsContact O-CG 3.3Å; R391-L395 WeakPolarHBondContact O-CG 3.21Å; R391-L395 PolarHBondContact O-N 3.36Å; R391-L395 VanDerWaalsContact O-N 3.13Å
392	G	90.1	Very high	84.5	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-66.7	-38.8	175.4	0	0	0	0	0	113.1	L388 K389 L390 L395 I396 I407	L388-G392 PolarHBondContact O-N 2.74Å; K389-G392 CarbonylContact O-C 3.56Å; K389-G392 WeakPolarHBondContact O-CA 3.26Å; K389-G392 PolarHBondContact O-N 2.8Å; L390-G392 VanDerWaalsContact C-N 3.29Å; L390-G392 PolarHBondContact O-N 3.02Å; G392-L395 PolarHBondContact O-N 3.46Å; G392-I396 WeakPolarHBondContact O-CD1 3.36Å; G392-I396 WeakPolarHBondContact O-CG1 3.46Å; G392-I396 PolarHBondContact O-N 3.3Å; G392-I396 VanDerWaalsContact O-N 3.1Å; G392-I407 WeakPolarHBondContact O-CG2 3.13Å
393	E	87.8	Confident	83.4	Confident	102 Å²	102	69.7 Å²	69.7	48%	0.477	35%	0.351	S	S	.	.	H	α-helix	trans	-65.4	-45.3	176.1	-71.6	166.4	166.4	0	0	111	K389 L390 L395 I396 E397	K389-E393 WeakPolarHBondContact O-CG 3.35Å; K389-E393 PolarHBondContact O-N 3.35Å; L390-E393 PolarHBondContact O-N 2.91Å; E393-L395 VanDerWaalsContact C-N 3.32Å; E393-L395 PolarHBondContact O-N 3.17Å; E393-I396 WeakPolarHBondContact O-CA 3.42Å; E393-I396 WeakPolarHBondContact O-CB 3.25Å; E393-I396 PolarHBondContact O-N 3.05Å; E393-E397 WeakPolarHBondContact O-CG 3.32Å; E393-E397 PolarHBondContact O-N 3.23Å
394	Q	87.7	Confident	82.7	Confident	105 Å²	105	65.9 Å²	65.9	49%	0.491	33%	0.334	S	S	.	.	H	α-helix	trans	-58.6	-39.7	173.4	-69.6	168.7	-3.9	0	0	112.9	L390 I396 E397 T398	L390-Q394 WeakPolarHBondContact O-CG 3.37Å; L390-Q394 PolarHBondContact O-N 2.85Å; Q394-I396 PolarHBondContact O-N 3.27Å; Q394-E397 PolarHBondContact O-N 3.29Å; Q394-T398 PolarHBondContact O-N 2.87Å
395	L	85.6	Confident	82	Confident	16 Å²	16	66.8 Å²	66.8	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-74.3	-10.8	175.4	-69.6	171.3	0	0	0	114	R323 F327 R391 G392 E393 T398 I407	R323-L395 HydrophobicContact CB-CD2 3.97Å; F327-L395 HydrophobicContact CB-CD1 4.21Å; F327-L395 HydrophobicContact CD2-CD1 4.46Å; R391-L395 HydrophobicContact CG-CD1 4.39Å; R391-L395 VanDerWaalsContact O-CG 3.3Å; R391-L395 WeakPolarHBondContact O-CG 3.21Å; R391-L395 PolarHBondContact O-N 3.36Å; R391-L395 VanDerWaalsContact O-N 3.13Å; G392-L395 PolarHBondContact O-N 3.46Å; E393-L395 VanDerWaalsContact C-N 3.32Å; E393-L395 PolarHBondContact O-N 3.17Å; L395-T398 PolarHBondContact O-OG1 3.04Å; L395-I407 HydrophobicContact CB-CD1 3.51Å; L395-I407 HydrophobicContact CD1-CD1 4.04Å; L395-I407 HydrophobicContact CG-CD1 4.41Å
396	I	85	Confident	81.5	Confident	48 Å²	48	68.3 Å²	68.3	25%	0.246	36%	0.359	C	S	.	.	H	α-helix	trans	-89.1	-33.9	169.2	-73.3	163.3	0	0	0	110.2	G392 E393 Q394 T398 I404 I407 T408	G392-I396 WeakPolarHBondContact O-CD1 3.36Å; G392-I396 WeakPolarHBondContact O-CG1 3.46Å; G392-I396 PolarHBondContact O-N 3.3Å; G392-I396 VanDerWaalsContact O-N 3.1Å; E393-I396 WeakPolarHBondContact O-CA 3.42Å; E393-I396 WeakPolarHBondContact O-CB 3.25Å; E393-I396 PolarHBondContact O-N 3.05Å; Q394-I396 PolarHBondContact O-N 3.27Å; I396-T398 VanDerWaalsContact C-N 3.34Å; I396-T398 PolarHBondContact O-N 3.47Å; I396-I404 HydrophobicContact CB-CG1 4.4Å; I396-I404 HydrophobicContact CG1-CG1 4.24Å; I396-I404 HydrophobicContact CG1-CG2 4.45Å; I396-I404 HydrophobicContact CG2-CD1 4.41Å; I396-I404 HydrophobicContact CG2-CG1 4.13Å; I396-I404 HydrophobicContact CG2-CG2 4.43Å; I396-I407 HydrophobicContact CD1-CB 4.34Å; I396-I407 HydrophobicContact CD1-CG2 3.81Å; I396-I407 HydrophobicContact CG1-CB 4.3Å; I396-I407 HydrophobicContact CG1-CG2 4.02Å; I396-T408 WeakPolarHBondContact CD1-OG1 3.32Å
397	E	81.6	Confident	81.3	Confident	156 Å²	156	64.2 Å²	64.2	73%	0.729	34%	0.337	S	S	*	.	H	α-helix	trans	-69.1	-25.6	177.3	-71.9	-178.1	159.3	0	0	113.6	E393 Q394 E399	E393-E397 WeakPolarHBondContact O-CG 3.32Å; E393-E397 PolarHBondContact O-N 3.23Å; Q394-E397 PolarHBondContact O-N 3.29Å; E397-E399 PolarHBondContact O-N 2.9Å
398	T	72.2	Confident	81.1	Confident	72 Å²	72	63.4 Å²	63.4	44%	0.442	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	25.9	176	50.9	0	0	0	0	114.9	Q394 L395 I396 E400	Q394-T398 PolarHBondContact O-N 2.87Å; L395-T398 PolarHBondContact O-OG1 3.04Å; I396-T398 VanDerWaalsContact C-N 3.34Å; I396-T398 PolarHBondContact O-N 3.47Å; T398-E400 PolarHBondContact O-N 3.1Å
399	E	58.7	Low	80.9	Confident	140 Å²	140	66.1 Å²	66.1	65%	0.654	34%	0.343	S	S	*	.			trans	58.1	0.8	172.2	-85.3	-100.3	164.9	0	0	117.3	E397 K401	E397-E399 PolarHBondContact O-N 2.9Å; E399-K401 PolarHBondContact O-N 3.39Å; E399-K401 PolarHBondContact O-NZ 3.41Å; E399-K401 IonicContact OE2-NZ 3.39Å; E399-K401 PolarHBondContact OE2-NZ 3.19Å
400	E	63	Low	80.9	Confident	33 Å²	33	67.2 Å²	67.2	15%	0.154	35%	0.348	C	S	.	.			trans	-73.6	89.3	-176.1	-73.6	-155.5	-98.1	0	0	113.5	H320 T398 E402 L403 I404	H320-E400 WeakPolarHBondContact CB-OE1 3.37Å; H320-E400 WeakPolarHBondContact CB-OE2 3.34Å; H320-E400 IonicContact CD2-OE1 3.64Å; H320-E400 VanDerWaalsContact CE1-CD 3.44Å; H320-E400 IonicContact CE1-OE1 2.78Å; H320-E400 PolarHBondContact CE1-OE1 2.76Å; H320-E400 IonicContact CE1-OE2 2.78Å; H320-E400 VanDerWaalsContact CG-CD 3.4Å; H320-E400 IonicContact CG-OE1 2.74Å; H320-E400 IonicContact CG-OE2 3.71Å; H320-E400 VanDerWaalsContact CG-OE2 3.32Å; H320-E400 IonicContact ND1-OE1 3.21Å; H320-E400 PolarHBondContact ND1-OE1 2.86Å; H320-E400 VanDerWaalsContact ND1-OE1 3.12Å; H320-E400 IonicContact ND1-OE2 2.72Å; H320-E400 PolarHBondContact ND1-OE2 2.64Å; H320-E400 IonicContact NE2-OE1 2.74Å; T398-E400 PolarHBondContact O-N 3.1Å; E400-E402 PolarHBondContact O-N 3.17Å; E400-L403 HydrophobicContact CB-CB 4.09Å; E400-L403 HydrophobicContact CB-CD1 4.09Å; E400-L403 HydrophobicContact CB-CG 3.76Å; E400-L403 HydrophobicContact CG-CD1 4.45Å; E400-L403 HydrophobicContact CG-CG 4.45Å; E400-L403 PolarHBondContact O-N 3.16Å; E400-L403 WeakPolarHBondContact OE1-CD1 3.47Å; E400-I404 WeakPolarHBondContact O-CG1 3.34Å; E400-I404 PolarHBondContact O-N 2.98Å
401	K	63.2	Low	80.9	Confident	129 Å²	129	63.3 Å²	63.3	56%	0.561	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-19	178.8	-63.9	150.5	-166.3	77.4	0	114.2	E399	E399-K401 PolarHBondContact O-N 3.39Å; E399-K401 PolarHBondContact O-NZ 3.41Å; E399-K401 IonicContact OE2-NZ 3.39Å; E399-K401 PolarHBondContact OE2-NZ 3.19Å
402	E	63.8	Low	81	Confident	135 Å²	135	65.7 Å²	65.7	63%	0.631	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-40	172.1	-66	-72.7	107.1	0	0	112.5	E400 K883	E400-E402 PolarHBondContact O-N 3.17Å; E402-K883 IonicContact OE1-NZ 2.75Å; E402-K883 PolarHBondContact OE1-NZ 2.97Å; E402-K883 IonicContact OE2-NZ 2.76Å; E402-K883 PolarHBondContact OE2-NZ 3.41Å
403	L	71.1	Confident	81.1	Confident	7 Å²	7	68.1 Å²	68.1	4%	0.037	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-42.3	-174.9	-63.6	-163.8	0	0	0	113	L324 E400 G405 S406 I407	L324-L403 HydrophobicContact CB-CD2 3.79Å; L324-L403 HydrophobicContact CD1-CD2 4.27Å; L324-L403 HydrophobicContact CD2-CD2 3.84Å; L324-L403 HydrophobicContact CG-CD2 4.16Å; E400-L403 HydrophobicContact CB-CB 4.09Å; E400-L403 HydrophobicContact CB-CD1 4.09Å; E400-L403 HydrophobicContact CB-CG 3.76Å; E400-L403 HydrophobicContact CG-CD1 4.45Å; E400-L403 HydrophobicContact CG-CG 4.45Å; E400-L403 PolarHBondContact O-N 3.16Å; E400-L403 WeakPolarHBondContact OE1-CD1 3.47Å; L403-G405 PolarHBondContact O-N 3.13Å; L403-G405 VanDerWaalsContact O-N 3.12Å; L403-S406 PolarHBondContact O-N 2.96Å; L403-I407 HydrophobicContact CB-CD1 3.96Å; L403-I407 HydrophobicContact CD1-CD1 4.39Å; L403-I407 WeakPolarHBondContact O-CG1 3.5Å; L403-I407 PolarHBondContact O-N 2.93Å
404	I	78.7	Confident	81.4	Confident	57 Å²	57	63.4 Å²	63.4	29%	0.292	33%	0.332	S	S	.	.	H	α-helix	trans	-49.8	-45.1	-173.8	-59.2	173	0	0	0	111.4	I396 E400 S406 I407 T408	I396-I404 HydrophobicContact CB-CG1 4.4Å; I396-I404 HydrophobicContact CG1-CG1 4.24Å; I396-I404 HydrophobicContact CG1-CG2 4.45Å; I396-I404 HydrophobicContact CG2-CD1 4.41Å; I396-I404 HydrophobicContact CG2-CG1 4.13Å; I396-I404 HydrophobicContact CG2-CG2 4.43Å; E400-I404 WeakPolarHBondContact O-CG1 3.34Å; E400-I404 PolarHBondContact O-N 2.98Å; I404-S406 PolarHBondContact O-N 3.5Å; I404-I407 PolarHBondContact O-N 3.31Å; I404-T408 WeakPolarHBondContact O-CB 3.43Å; I404-T408 PolarHBondContact O-N 3.5Å; I404-T408 PolarHBondContact O-OG1 3.03Å; I404-T408 VanDerWaalsContact O-OG1 3.07Å
405	G	80.5	Confident	81.7	Confident	63 Å²	63	62.1 Å²	62.1	65%	0.649	33%	0.329	S	S	*	.	H	α-helix	trans	-66	-16.2	-179.5	0	0	0	0	0	115.6	L403	L403-G405 PolarHBondContact O-N 3.13Å; L403-G405 VanDerWaalsContact O-N 3.12Å
406	S	84.7	Confident	82.1	Confident	32 Å²	32	66.1 Å²	66.1	22%	0.224	34%	0.343	C	S	.	.	H	α-helix	trans	-101.9	-28.8	174.9	-161.5	0	0	0	0	112.9	E328 L403 I404 K410	E328-S406 PolarHBondContact OE1-OG 2.93Å; L403-S406 PolarHBondContact O-N 2.96Å; I404-S406 PolarHBondContact O-N 3.5Å; S406-K410 WeakPolarHBondContact O-CG 3.35Å; S406-K410 PolarHBondContact O-NZ 3.24Å; S406-K410 PolarHBondContact OG-NZ 3.36Å
407	I	88.9	Confident	82.5	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-85.2	-52.1	-175.3	-64.3	-178.1	0	0	0	111.5	L324 F327 G392 L395 I396 L403 I404 K410 C411	L324-I407 HydrophobicContact CD1-CD1 4.26Å; L324-I407 HydrophobicContact CD1-CG1 3.88Å; F327-I407 HydrophobicContact CD1-CG1 3.99Å; F327-I407 HydrophobicContact CD1-CG2 4.44Å; F327-I407 HydrophobicContact CE1-CB 4.11Å; F327-I407 HydrophobicContact CE1-CG1 4.01Å; F327-I407 HydrophobicContact CE1-CG2 3.81Å; F327-I407 HydrophobicContact CE2-CG2 4.16Å; F327-I407 HydrophobicContact CZ-CB 4.47Å; F327-I407 HydrophobicContact CZ-CG2 3.67Å; G392-I407 WeakPolarHBondContact O-CG2 3.13Å; L395-I407 HydrophobicContact CB-CD1 3.51Å; L395-I407 HydrophobicContact CD1-CD1 4.04Å; L395-I407 HydrophobicContact CG-CD1 4.41Å; I396-I407 HydrophobicContact CD1-CB 4.34Å; I396-I407 HydrophobicContact CD1-CG2 3.81Å; I396-I407 HydrophobicContact CG1-CB 4.3Å; I396-I407 HydrophobicContact CG1-CG2 4.02Å; L403-I407 HydrophobicContact CB-CD1 3.96Å; L403-I407 HydrophobicContact CD1-CD1 4.39Å; L403-I407 WeakPolarHBondContact O-CG1 3.5Å; L403-I407 PolarHBondContact O-N 2.93Å; I404-I407 PolarHBondContact O-N 3.31Å; I407-K410 WeakPolarHBondContact O-CB 3.32Å; I407-K410 PolarHBondContact O-N 2.85Å; I407-C411 PolarHBondContact O-N 2.93Å; I407-C411 VanDerWaalsContact O-N 3.07Å
408	T	89.3	Confident	83.1	Confident	45 Å²	45	57.4 Å²	57.4	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-50.5	-47.9	-177.3	-54.1	0	0	0	0	114.7	I396 I404 K410 C411 Q412	I396-T408 WeakPolarHBondContact CD1-OG1 3.32Å; I404-T408 WeakPolarHBondContact O-CB 3.43Å; I404-T408 PolarHBondContact O-N 3.5Å; I404-T408 PolarHBondContact O-OG1 3.03Å; I404-T408 VanDerWaalsContact O-OG1 3.07Å; T408-K410 VanDerWaalsContact C-N 3.28Å; T408-K410 PolarHBondContact O-N 3.47Å; T408-C411 PolarHBondContact O-N 2.91Å; T408-Q412 WeakPolarHBondContact O-CG 3.41Å; T408-Q412 PolarHBondContact O-N 2.81Å
409	P	90.8	Very high	84.2	Confident	66 Å²	66	56.7 Å²	56.7	43%	0.429	30%	0.304	S	S	.	.	H	α-helix	trans	-66.7	-27.4	179.2	26.4	-35.1	0	0	0	113.2	E413	P409-E413 WeakPolarHBondContact O-CB 3.29Å; P409-E413 PolarHBondContact O-N 3.42Å
410	K	92.8	Very high	85.9	Confident	35 Å²	35	54.3 Å²	54.3	15%	0.152	29%	0.293	C	S	.	.	H	α-helix	trans	-73.1	-41.6	175.5	-65.8	-169.6	-168.5	87	0	111.4	F327 E328 F331 S406 I407 T408 Q412 E413 L414	F327-K410 HydrophobicContact CD1-CD 4.49Å; F327-K410 HydrophobicContact CE1-CB 3.92Å; F327-K410 HydrophobicContact CE1-CD 3.98Å; F327-K410 HydrophobicContact CZ-CB 4.26Å; E328-K410 IonicContact OE1-NZ 2.65Å; E328-K410 PolarHBondContact OE1-NZ 3.34Å; F331-K410 HydrophobicContact CB-CD 4.16Å; F331-K410 HydrophobicContact CD1-CB 4.41Å; F331-K410 HydrophobicContact CD1-CD 3.64Å; F331-K410 HydrophobicContact CD1-CG 4.08Å; F331-K410 HydrophobicContact CD2-CB 3.67Å; F331-K410 HydrophobicContact CD2-CD 4.29Å; F331-K410 HydrophobicContact CD2-CG 4.23Å; F331-K410 HydrophobicContact CE1-CB 4.47Å; F331-K410 HydrophobicContact CE1-CD 4.08Å; F331-K410 HydrophobicContact CE1-CG 4.06Å; F331-K410 HydrophobicContact CE2-CB 3.73Å; F331-K410 HydrophobicContact CE2-CG 4.22Å; F331-K410 VanDerWaalsContact CE2-O 3.29Å; F331-K410 WeakPolarHBondContact CE2-O 3.26Å; F331-K410 HydrophobicContact CG-CB 4.01Å; F331-K410 HydrophobicContact CG-CD 3.74Å; F331-K410 HydrophobicContact CG-CG 4.15Å; F331-K410 HydrophobicContact CZ-CB 4.14Å; F331-K410 HydrophobicContact CZ-CG 4.13Å; S406-K410 WeakPolarHBondContact O-CG 3.35Å; S406-K410 PolarHBondContact O-NZ 3.24Å; S406-K410 PolarHBondContact OG-NZ 3.36Å; I407-K410 WeakPolarHBondContact O-CB 3.32Å; I407-K410 PolarHBondContact O-N 2.85Å; T408-K410 VanDerWaalsContact C-N 3.28Å; T408-K410 PolarHBondContact O-N 3.47Å; K410-Q412 VanDerWaalsContact C-N 3.29Å; K410-Q412 PolarHBondContact O-N 2.88Å; K410-E413 PolarHBondContact O-N 3.02Å; K410-L414 VanDerWaalsContact O-CB 3.28Å; K410-L414 WeakPolarHBondContact O-CB 3.29Å; K410-L414 PolarHBondContact O-N 3.08Å
411	C	93.3	Very high	87.3	Confident	13 Å²	13	52.8 Å²	52.8	9%	0.088	29%	0.286	C	S	.	.	H	α-helix	trans	-60.7	-38.6	171.9	-61	0	0	0	0	112	I407 T408 N415	I407-C411 PolarHBondContact O-N 2.93Å; I407-C411 VanDerWaalsContact O-N 3.07Å; T408-C411 PolarHBondContact O-N 2.91Å; C411-N415 WeakPolarHBondContact O-CB 3.36Å; C411-N415 PolarHBondContact O-N 2.89Å; C411-N415 PolarHBondContact O-ND2 2.94Å
412	Q	92.8	Very high	88.8	Confident	126 Å²	126	49.3 Å²	49.3	59%	0.589	27%	0.273	S	S	*	.	H	α-helix	trans	-66.7	-45.8	175.5	-72	173	-8.5	0	0	112.5	T408 K410 N415 R416	T408-Q412 WeakPolarHBondContact O-CG 3.41Å; T408-Q412 PolarHBondContact O-N 2.81Å; K410-Q412 VanDerWaalsContact C-N 3.29Å; K410-Q412 PolarHBondContact O-N 2.88Å; Q412-N415 PolarHBondContact O-N 3.43Å; Q412-R416 PolarHBondContact O-N 3.36Å
413	E	92.4	Very high	90.1	Very high	51 Å²	51	46.3 Å²	46.3	24%	0.238	26%	0.264	C	S	.	.	H	α-helix	trans	-64.1	-40.6	176.6	175.2	60	-175	0	0	112.1	F331 P409 K410 N415 R416 L417	F331-E413 HydrophobicContact CE2-CB 4.33Å; F331-E413 HydrophobicContact CE2-CG 4.28Å; F331-E413 HydrophobicContact CZ-CB 4.23Å; F331-E413 HydrophobicContact CZ-CG 3.89Å; P409-E413 WeakPolarHBondContact O-CB 3.29Å; P409-E413 PolarHBondContact O-N 3.42Å; K410-E413 PolarHBondContact O-N 3.02Å; E413-N415 PolarHBondContact O-N 3.31Å; E413-R416 WeakPolarHBondContact O-CB 3.31Å; E413-R416 PolarHBondContact O-N 2.94Å; E413-R416 VanDerWaalsContact O-N 3.13Å; E413-R416 IonicContact OE1-CZ 2.68Å; E413-R416 IonicContact OE1-NE 3.18Å; E413-R416 IonicContact OE1-NH2 2.63Å; E413-R416 PolarHBondContact OE1-NH2 3.36Å; E413-R416 IonicContact OE2-CZ 2.8Å; E413-R416 IonicContact OE2-NE 3.37Å; E413-R416 PolarHBondContact OE2-NE 2.59Å; E413-R416 IonicContact OE2-NH2 2.71Å; E413-R416 PolarHBondContact OE2-NH2 3.35Å; E413-L417 HydrophobicContact CG-CD1 4.3Å; E413-L417 WeakPolarHBondContact O-CG 3.42Å; E413-L417 PolarHBondContact O-N 3.02Å
414	L	93.5	Very high	90.9	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.01	27%	0.268	C	S	.	.	H	α-helix	trans	-64	-41.5	176.1	-170.8	56.2	0	0	0	111.2	F331 L334 F338 A385 L388 K389 K410 R416 L417 T418	F331-L414 HydrophobicContact CD2-CB 4.45Å; F331-L414 HydrophobicContact CE2-CB 4.23Å; L334-L414 HydrophobicContact CB-CD1 4.2Å; L334-L414 HydrophobicContact CD1-CD2 4.42Å; F338-L414 HydrophobicContact CD2-CD1 4.44Å; F338-L414 HydrophobicContact CE2-CD1 4.41Å; A385-L414 HydrophobicContact CB-CD1 3.89Å; A385-L414 HydrophobicContact CB-CD2 4.11Å; A385-L414 HydrophobicContact CB-CG 3.99Å; L388-L414 HydrophobicContact CB-CD2 4.31Å; L388-L414 HydrophobicContact CD2-CD2 4.08Å; L388-L414 HydrophobicContact CG-CD2 4.45Å; K389-L414 HydrophobicContact CG-CD2 4.2Å; K410-L414 VanDerWaalsContact O-CB 3.28Å; K410-L414 WeakPolarHBondContact O-CB 3.29Å; K410-L414 PolarHBondContact O-N 3.08Å; L414-R416 VanDerWaalsContact C-N 3.33Å; L414-R416 PolarHBondContact O-N 3.3Å; L414-L417 PolarHBondContact O-N 3.06Å; L414-T418 WeakPolarHBondContact O-CB 3.49Å; L414-T418 PolarHBondContact O-N 3.15Å; L414-T418 PolarHBondContact O-OG1 3.47Å
415	N	93.8	Very high	91.5	Very high	78 Å²	78	44.7 Å²	44.7	42%	0.417	26%	0.258	S	S	.	.	H	α-helix	trans	-61.4	-37.4	171	-83.9	-37	0	0	0	113.2	K389 C411 Q412 E413 A419	K389-N415 VanDerWaalsContact CD-OD1 3.27Å; K389-N415 WeakPolarHBondContact CD-OD1 3.36Å; K389-N415 WeakPolarHBondContact CE-OD1 3.35Å; K389-N415 PolarHBondContact NZ-OD1 2.96Å; C411-N415 WeakPolarHBondContact O-CB 3.36Å; C411-N415 PolarHBondContact O-N 2.89Å; C411-N415 PolarHBondContact O-ND2 2.94Å; Q412-N415 PolarHBondContact O-N 3.43Å; E413-N415 PolarHBondContact O-N 3.31Å; N415-A419 PolarHBondContact O-N 3.47Å
416	R	94.6	Very high	92	Very high	100 Å²	100	49 Å²	49	38%	0.377	25%	0.254	S	S	.	.	H	α-helix	trans	-63.8	-43.4	175.2	-168.5	-167.6	66.8	69.2	6	111.6	Q412 E413 L414 A419 Q420	Q412-R416 PolarHBondContact O-N 3.36Å; E413-R416 WeakPolarHBondContact O-CB 3.31Å; E413-R416 PolarHBondContact O-N 2.94Å; E413-R416 VanDerWaalsContact O-N 3.13Å; E413-R416 IonicContact OE1-CZ 2.68Å; E413-R416 IonicContact OE1-NE 3.18Å; E413-R416 IonicContact OE1-NH2 2.63Å; E413-R416 PolarHBondContact OE1-NH2 3.36Å; E413-R416 IonicContact OE2-CZ 2.8Å; E413-R416 IonicContact OE2-NE 3.37Å; E413-R416 PolarHBondContact OE2-NE 2.59Å; E413-R416 IonicContact OE2-NH2 2.71Å; E413-R416 PolarHBondContact OE2-NH2 3.35Å; L414-R416 VanDerWaalsContact C-N 3.33Å; L414-R416 PolarHBondContact O-N 3.3Å; R416-A419 PolarHBondContact O-N 2.89Å; R416-Q420 WeakPolarHBondContact O-CG 3.32Å; R416-Q420 PolarHBondContact O-N 3.14Å; R416-Q420 VanDerWaalsContact O-N 3.08Å
417	L	94	Very high	92	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-67.7	-43.5	177	-70.3	168.5	0	0	0	112	Q335 F338 L339 L342 E413 L414 A419 Q420 L421	Q335-L417 HydrophobicContact CB-CD1 4.39Å; Q335-L417 HydrophobicContact CG-CD1 3.98Å; F338-L417 HydrophobicContact CB-CB 4.03Å; F338-L417 HydrophobicContact CB-CD1 4.38Å; F338-L417 HydrophobicContact CD1-CB 4.12Å; F338-L417 HydrophobicContact CG-CB 4.14Å; L339-L417 HydrophobicContact CD2-CD2 4.01Å; L339-L417 HydrophobicContact CG-CD2 4.42Å; L342-L417 HydrophobicContact CD1-CD2 4.1Å; E413-L417 HydrophobicContact CG-CD1 4.3Å; E413-L417 WeakPolarHBondContact O-CG 3.42Å; E413-L417 PolarHBondContact O-N 3.02Å; L414-L417 PolarHBondContact O-N 3.06Å; L417-A419 VanDerWaalsContact C-N 3.32Å; L417-A419 PolarHBondContact O-N 3.48Å; L417-Q420 PolarHBondContact O-N 3.41Å; L417-L421 PolarHBondContact O-N 3.37Å
418	T	94.2	Very high	91.8	Very high	22 Å²	22	53.1 Å²	53.1	14%	0.135	27%	0.27	C	S	.	.	H	α-helix	trans	-51	-50.9	171.6	-58.8	0	0	0	0	111.1	F382 K389 L414 L421 D422	F382-T418 HydrophobicContact CD1-CG2 3.7Å; F382-T418 HydrophobicContact CE1-CG2 3.61Å; K389-T418 PolarHBondContact NZ-OG1 3Å; L414-T418 WeakPolarHBondContact O-CB 3.49Å; L414-T418 PolarHBondContact O-N 3.15Å; L414-T418 PolarHBondContact O-OG1 3.47Å; T418-L421 PolarHBondContact O-N 3.25Å; T418-D422 PolarHBondContact O-N 3.31Å
419	A	94.6	Very high	91.8	Very high	57 Å²	57	52.6 Å²	52.6	47%	0.471	27%	0.27	S	S	.	.	H	α-helix	trans	-69.2	-33.6	-178.3	0	0	0	0	0	113.6	N415 R416 L417 V423	N415-A419 PolarHBondContact O-N 3.47Å; R416-A419 PolarHBondContact O-N 2.89Å; L417-A419 VanDerWaalsContact C-N 3.32Å; L417-A419 PolarHBondContact O-N 3.48Å; A419-V423 WeakPolarHBondContact O-CG2 3.35Å; A419-V423 PolarHBondContact O-N 3.14Å
420	Q	93.3	Very high	91.4	Very high	90 Å²	90	54 Å²	54	42%	0.421	27%	0.271	S	S	.	.	H	α-helix	trans	-70.4	-39.8	176.4	-77.6	-172.4	-26.2	0	0	112.6	L342 R416 L417 V423 A424	L342-Q420 HydrophobicContact CD1-CB 4.22Å; L342-Q420 HydrophobicContact CD2-CB 4.13Å; R416-Q420 WeakPolarHBondContact O-CG 3.32Å; R416-Q420 PolarHBondContact O-N 3.14Å; R416-Q420 VanDerWaalsContact O-N 3.08Å; L417-Q420 PolarHBondContact O-N 3.41Å; Q420-V423 PolarHBondContact O-N 2.99Å; Q420-A424 WeakPolarHBondContact O-CB 3.5Å; Q420-A424 PolarHBondContact O-N 2.73Å
421	L	93.2	Very high	90.8	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.4	-40.5	179.1	-177	56.9	0	0	0	111.6	F338 H341 L342 L345 T378 F382 L417 T418 V423 A424 L425	F338-L421 HydrophobicContact CD1-CB 3.9Å; F338-L421 HydrophobicContact CD1-CD2 3.58Å; F338-L421 HydrophobicContact CD1-CG 4.39Å; F338-L421 HydrophobicContact CE1-CB 4.07Å; F338-L421 HydrophobicContact CE1-CD2 3.6Å; F338-L421 HydrophobicContact CE1-CG 4.46Å; F338-L421 HydrophobicContact CG-CD2 4.47Å; H341-L421 HydrophobicContact CB-CD1 3.78Å; H341-L421 HydrophobicContact CB-CD2 3.97Å; L342-L421 HydrophobicContact CD2-CB 4.4Å; L342-L421 HydrophobicContact CD2-CD1 4.39Å; L345-L421 HydrophobicContact CD1-CD1 3.53Å; T378-L421 HydrophobicContact CG2-CD2 4.3Å; F382-L421 HydrophobicContact CE2-CD2 3.85Å; F382-L421 HydrophobicContact CE2-CG 4.05Å; F382-L421 HydrophobicContact CZ-CB 4.07Å; F382-L421 HydrophobicContact CZ-CD2 4.11Å; F382-L421 HydrophobicContact CZ-CG 3.98Å; L417-L421 PolarHBondContact O-N 3.37Å; T418-L421 PolarHBondContact O-N 3.25Å; L421-V423 PolarHBondContact O-N 3.12Å; L421-A424 PolarHBondContact O-N 2.77Å; L421-L425 HydrophobicContact CD1-CD1 4.21Å; L421-L425 HydrophobicContact CD1-CG 4.12Å; L421-L425 HydrophobicContact CG-CD1 3.95Å; L421-L425 HydrophobicContact CG-CG 4.36Å; L421-L425 WeakPolarHBondContact O-CB 3.42Å; L421-L425 VanDerWaalsContact O-CG 3.29Å; L421-L425 WeakPolarHBondContact O-CG 3.12Å; L421-L425 PolarHBondContact O-N 3.42Å
422	D	94	Very high	90.3	Very high	56 Å²	56	53.7 Å²	53.7	30%	0.299	27%	0.268	S	S	.	.	H	α-helix	trans	-56.5	-46	173.4	172.5	82.8	0	0	0	112.2	F382 T418 R426	F382-D422 HydrophobicContact CE1-CB 4.43Å; F382-D422 HydrophobicContact CZ-CB 4.29Å; T418-D422 PolarHBondContact O-N 3.31Å; D422-R426 VanDerWaalsContact O-CG 3.26Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 2.95Å; D422-R426 IonicContact OD1-CZ 3.3Å; D422-R426 VanDerWaalsContact OD1-CZ 3.3Å; D422-R426 IonicContact OD1-NE 3.06Å; D422-R426 PolarHBondContact OD1-NE 2.68Å; D422-R426 IonicContact OD1-NH2 2.71Å; D422-R426 PolarHBondContact OD1-NH2 2.78Å; D422-R426 IonicContact OD2-CZ 3.47Å; D422-R426 IonicContact OD2-NE 2.76Å; D422-R426 PolarHBondContact OD2-NE 3.23Å; D422-R426 IonicContact OD2-NH2 3.66Å; D422-R426 PolarHBondContact OD2-NH2 2.99Å
423	V	91.1	Very high	89.9	Confident	73 Å²	73	53.4 Å²	53.4	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-44.2	176.7	171.7	0	0	0	0	111.8	A419 Q420 L421 L425 R426 Q427	A419-V423 WeakPolarHBondContact O-CG2 3.35Å; A419-V423 PolarHBondContact O-N 3.14Å; Q420-V423 PolarHBondContact O-N 2.99Å; L421-V423 PolarHBondContact O-N 3.12Å; V423-L425 PolarHBondContact O-N 2.77Å; V423-R426 PolarHBondContact O-N 3.41Å; V423-Q427 HydrophobicContact CG1-CG 4.45Å; V423-Q427 WeakPolarHBondContact O-CG 3.33Å; V423-Q427 PolarHBondContact O-N 3.11Å
424	A	89.5	Confident	89.3	Confident	14 Å²	14	51.7 Å²	51.7	12%	0.116	26%	0.261	C	S	.	.	H	α-helix	trans	-64.6	-39.5	179.9	0	0	0	0	0	112.6	L342 L345 Q420 L421 R428	L342-A424 HydrophobicContact CD2-CB 4.05Å; L345-A424 HydrophobicContact CB-CB 4.49Å; L345-A424 HydrophobicContact CD1-CB 3.83Å; Q420-A424 WeakPolarHBondContact O-CB 3.5Å; Q420-A424 PolarHBondContact O-N 2.73Å; L421-A424 PolarHBondContact O-N 2.77Å; A424-R428 PolarHBondContact O-N 3.33Å
425	L	91.4	Very high	88.6	Confident	16 Å²	16	51.8 Å²	51.8	8%	0.084	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-48.4	173.6	-72.9	167.9	0	0	0	111.2	L345 Y371 A375 T378 F382 L421 V423 Q427 R428 A429	L345-L425 HydrophobicContact CD1-CD2 3.85Å; L345-L425 HydrophobicContact CD1-CG 3.99Å; L345-L425 HydrophobicContact CD2-CD2 4.32Å; Y371-L425 HydrophobicContact CE2-CD2 3.95Å; Y371-L425 PolarHBondContact OH-O 2.75Å; A375-L425 HydrophobicContact CB-CD2 4.31Å; T378-L425 WeakPolarHBondContact OG1-CD1 3.5Å; F382-L425 HydrophobicContact CE2-CD1 3.91Å; F382-L425 HydrophobicContact CZ-CD1 4.33Å; L421-L425 HydrophobicContact CD1-CD1 4.21Å; L421-L425 HydrophobicContact CD1-CG 4.12Å; L421-L425 HydrophobicContact CG-CD1 3.95Å; L421-L425 HydrophobicContact CG-CG 4.36Å; L421-L425 WeakPolarHBondContact O-CB 3.42Å; L421-L425 VanDerWaalsContact O-CG 3.29Å; L421-L425 WeakPolarHBondContact O-CG 3.12Å; L421-L425 PolarHBondContact O-N 3.42Å; V423-L425 PolarHBondContact O-N 2.77Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 3.04Å; L425-R428 PolarHBondContact O-N 3.23Å; L425-A429 PolarHBondContact O-N 3.09Å
426	R	89.8	Confident	88.2	Confident	152 Å²	152	52.7 Å²	52.7	57%	0.574	26%	0.259	S	S	*	.	H	α-helix	trans	-57.1	-45.5	176.5	-71.7	172.5	-162	-92.3	-7.6	112	D422 V423 R428 A429 Q430	D422-R426 VanDerWaalsContact O-CG 3.26Å; D422-R426 WeakPolarHBondContact O-CG 3.47Å; D422-R426 PolarHBondContact O-N 2.95Å; D422-R426 IonicContact OD1-CZ 3.3Å; D422-R426 VanDerWaalsContact OD1-CZ 3.3Å; D422-R426 IonicContact OD1-NE 3.06Å; D422-R426 PolarHBondContact OD1-NE 2.68Å; D422-R426 IonicContact OD1-NH2 2.71Å; D422-R426 PolarHBondContact OD1-NH2 2.78Å; D422-R426 IonicContact OD2-CZ 3.47Å; D422-R426 IonicContact OD2-NE 2.76Å; D422-R426 PolarHBondContact OD2-NE 3.23Å; D422-R426 IonicContact OD2-NH2 3.66Å; D422-R426 PolarHBondContact OD2-NH2 2.99Å; V423-R426 PolarHBondContact O-N 3.41Å; R426-R428 PolarHBondContact O-N 2.93Å; R426-A429 PolarHBondContact O-N 3.35Å; R426-Q430 WeakPolarHBondContact O-CB 3.32Å; R426-Q430 VanDerWaalsContact O-CG 3.28Å; R426-Q430 WeakPolarHBondContact O-CG 3.17Å; R426-Q430 PolarHBondContact O-N 3.42Å; R426-Q430 PolarHBondContact O-OE1 2.95Å
427	Q	84.7	Confident	87.7	Confident	106 Å²	106	52.8 Å²	52.8	50%	0.495	26%	0.259	S	S	.	.	H	α-helix	trans	-60.7	-43.7	177	-74.7	174.1	-22.6	0	0	111.9	V423 L425 Q430 F431	V423-Q427 HydrophobicContact CG1-CG 4.45Å; V423-Q427 WeakPolarHBondContact O-CG 3.33Å; V423-Q427 PolarHBondContact O-N 3.11Å; L425-Q427 VanDerWaalsContact C-N 3.34Å; L425-Q427 PolarHBondContact O-N 3.04Å; Q427-Q430 PolarHBondContact O-N 3.15Å; Q427-F431 WeakPolarHBondContact O-CB 3.4Å; Q427-F431 PolarHBondContact O-N 3.25Å
428	R	85.7	Confident	87	Confident	13 Å²	13	53.4 Å²	53.4	5%	0.049	26%	0.262	C	S	.	.	H	α-helix	trans	-64	-40.7	176.8	-178.4	61.1	-177.9	-161.3	-1.9	112.3	L345 S348 N349 D354 Y371 A424 L425 R426 F431 L432	L345-R428 HydrophobicContact CD2-CB 4.12Å; L345-R428 HydrophobicContact CD2-CG 4.13Å; S348-R428 PolarHBondContact O-NH1 2.96Å; N349-R428 WeakPolarHBondContact OD1-CD 3.45Å; D354-R428 IonicContact OD1-NH2 2.68Å; D354-R428 IonicContact OD2-CZ 3.48Å; D354-R428 IonicContact OD2-NH1 3.68Å; D354-R428 PolarHBondContact OD2-NH1 3.28Å; D354-R428 IonicContact OD2-NH2 2.65Å; D354-R428 PolarHBondContact OD2-NH2 3.05Å; Y371-R428 HydrophobicContact CD2-CB 4.24Å; Y371-R428 HydrophobicContact CD2-CG 3.5Å; Y371-R428 HydrophobicContact CE2-CB 3.91Å; Y371-R428 HydrophobicContact CE2-CG 3.71Å; Y371-R428 HydrophobicContact CG-CG 4.37Å; A424-R428 PolarHBondContact O-N 3.33Å; L425-R428 PolarHBondContact O-N 3.23Å; R426-R428 PolarHBondContact O-N 2.93Å; R428-F431 PolarHBondContact O-N 3.19Å; R428-L432 HydrophobicContact CG-CD1 4.32Å; R428-L432 WeakPolarHBondContact O-CG 3.37Å; R428-L432 PolarHBondContact O-N 3Å; R428-L432 VanDerWaalsContact O-N 3.08Å
429	A	87.7	Confident	86.5	Confident	35 Å²	35	53.6 Å²	53.6	29%	0.289	26%	0.262	S	S	.	.	H	α-helix	trans	-62.8	-43.3	174.2	0	0	0	0	0	112.3	Y371 L425 R426 L432 H433	Y371-A429 HydrophobicContact CE1-CB 3.75Å; L425-A429 PolarHBondContact O-N 3.09Å; R426-A429 PolarHBondContact O-N 3.35Å; A429-L432 PolarHBondContact O-N 3.37Å; A429-H433 VanDerWaalsContact O-CB 3.32Å; A429-H433 WeakPolarHBondContact O-CB 3.45Å; A429-H433 PolarHBondContact O-N 3.39Å
430	Q	83.4	Confident	86.2	Confident	96 Å²	96	54.1 Å²	54.1	45%	0.449	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-40.8	177.5	-73.2	169.7	-47.5	0	0	112.3	R426 Q427 S434	R426-Q430 WeakPolarHBondContact O-CB 3.32Å; R426-Q430 VanDerWaalsContact O-CG 3.28Å; R426-Q430 WeakPolarHBondContact O-CG 3.17Å; R426-Q430 PolarHBondContact O-N 3.42Å; R426-Q430 PolarHBondContact O-OE1 2.95Å; Q427-Q430 PolarHBondContact O-N 3.15Å; Q430-S434 VanDerWaalsContact O-CB 3.3Å; Q430-S434 WeakPolarHBondContact O-CB 3.48Å; Q430-S434 PolarHBondContact O-N 3.33Å; Q430-S434 PolarHBondContact O-OG 3.49Å
431	F	80.3	Confident	85.8	Confident	38 Å²	38	50.9 Å²	50.9	17%	0.167	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-54.2	174.3	176.1	-96.7	0	0	0	111.5	L358 Q427 R428 H433 S434 A435 L498	L358-F431 HydrophobicContact CD1-CE1 4.1Å; L358-F431 HydrophobicContact CD1-CZ 4.16Å; Q427-F431 WeakPolarHBondContact O-CB 3.4Å; Q427-F431 PolarHBondContact O-N 3.25Å; R428-F431 PolarHBondContact O-N 3.19Å; F431-H433 PolarHBondContact O-N 3.49Å; F431-S434 WeakPolarHBondContact O-CB 3.37Å; F431-S434 PolarHBondContact O-N 3.32Å; F431-S434 VanDerWaalsContact O-N 3.07Å; F431-A435 PolarHBondContact O-N 3.46Å; F431-L498 HydrophobicContact CD2-CG 4.19Å; F431-L498 HydrophobicContact CE2-CD2 3.79Å; F431-L498 HydrophobicContact CE2-CG 3.78Å; F431-L498 HydrophobicContact CZ-CD2 3.93Å; F431-L498 HydrophobicContact CZ-CG 4.42Å
432	L	82.7	Confident	85.4	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	25%	0.245	C	C	.	.	H	α-helix	trans	-63	-40.1	-178.7	-69.3	174.3	0	0	0	112.6	L367 I368 Y371 R428 A429 S434 A435 R436	L367-L432 HydrophobicContact CB-CD2 3.98Å; I368-L432 HydrophobicContact CG1-CB 3.84Å; I368-L432 HydrophobicContact CG1-CD1 4.43Å; Y371-L432 VanDerWaalsContact CB-CD1 3.49Å; Y371-L432 HydrophobicContact CD1-CD1 4.3Å; Y371-L432 HydrophobicContact CD2-CD1 4.42Å; Y371-L432 HydrophobicContact CG-CD1 3.79Å; R428-L432 HydrophobicContact CG-CD1 4.32Å; R428-L432 WeakPolarHBondContact O-CG 3.37Å; R428-L432 PolarHBondContact O-N 3Å; R428-L432 VanDerWaalsContact O-N 3.08Å; A429-L432 PolarHBondContact O-N 3.37Å; L432-S434 VanDerWaalsContact C-N 3.3Å; L432-S434 PolarHBondContact O-N 3.35Å; L432-A435 PolarHBondContact O-N 3.31Å; L432-R436 PolarHBondContact O-N 2.89Å
433	H	84.7	Confident	85.1	Confident	121 Å²	121	51.9 Å²	51.9	56%	0.56	25%	0.251	S	S	*	.	H	α-helix	trans	-65	-34.6	174.1	-172.1	-70.4	0	0	0	112.2	A429 F431 R437	A429-H433 VanDerWaalsContact O-CB 3.32Å; A429-H433 WeakPolarHBondContact O-CB 3.45Å; A429-H433 PolarHBondContact O-N 3.39Å; F431-H433 PolarHBondContact O-N 3.49Å; H433-R437 WeakPolarHBondContact O-CG 3.47Å; H433-R437 PolarHBondContact O-N 3.18Å
434	S	78.4	Confident	85	Confident	15 Å²	15	51.1 Å²	51.1	11%	0.105	25%	0.249	C	C	.	.	H	α-helix	trans	-71.8	-36.8	175.7	-59.6	0	0	0	0	112	Q430 F431 L432 R437 L438	Q430-S434 VanDerWaalsContact O-CB 3.3Å; Q430-S434 WeakPolarHBondContact O-CB 3.48Å; Q430-S434 PolarHBondContact O-N 3.33Å; Q430-S434 PolarHBondContact O-OG 3.49Å; F431-S434 WeakPolarHBondContact O-CB 3.37Å; F431-S434 PolarHBondContact O-N 3.32Å; F431-S434 VanDerWaalsContact O-N 3.07Å; L432-S434 VanDerWaalsContact C-N 3.3Å; L432-S434 PolarHBondContact O-N 3.35Å; S434-R437 WeakPolarHBondContact O-CB 3.36Å; S434-R437 PolarHBondContact O-N 2.91Å; S434-L438 PolarHBondContact O-N 2.93Å
435	A	79.4	Confident	84.9	Confident	3 Å²	3	50.4 Å²	50.4	3%	0.025	24%	0.243	C	C	.	.	H	α-helix	trans	-63.1	-42.6	172.8	0	0	0	0	0	111.2	L358 T364 F431 L432 R437 L438 Q439 L498	L358-A435 HydrophobicContact CD1-CB 4.37Å; L358-A435 HydrophobicContact CD2-CB 3.93Å; T364-A435 HydrophobicContact CG2-CB 4.15Å; F431-A435 PolarHBondContact O-N 3.46Å; L432-A435 PolarHBondContact O-N 3.31Å; A435-R437 PolarHBondContact O-N 3.23Å; A435-L438 WeakPolarHBondContact O-CB 3.2Å; A435-L438 PolarHBondContact O-N 3.12Å; A435-Q439 PolarHBondContact O-N 3.24Å; A435-L498 HydrophobicContact CB-CD1 4.21Å; A435-L498 HydrophobicContact CB-CD2 3.94Å
436	R	85.3	Confident	84.8	Confident	97 Å²	97	52.1 Å²	52.1	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-63.6	-40.9	174.9	-166	-177.1	-172	169.3	14.1	112.3	T364 D365 I368 L432 L438 Q439 N440	T364-R436 HydrophobicContact CG2-CB 3.86Å; T364-R436 HydrophobicContact CG2-CG 4.46Å; D365-R436 VanDerWaalsContact CG-CZ 3.48Å; D365-R436 VanDerWaalsContact OD1-CD 3.25Å; D365-R436 WeakPolarHBondContact OD1-CD 3.37Å; D365-R436 IonicContact OD1-CZ 2.88Å; D365-R436 IonicContact OD1-NE 2.75Å; D365-R436 PolarHBondContact OD1-NE 3.44Å; D365-R436 IonicContact OD1-NH1 3.59Å; D365-R436 IonicContact OD1-NH2 3.07Å; D365-R436 PolarHBondContact OD1-NH2 3.32Å; D365-R436 VanDerWaalsContact OD1-NH2 3.07Å; D365-R436 IonicContact OD2-CZ 3.39Å; D365-R436 IonicContact OD2-NE 3.65Å; D365-R436 IonicContact OD2-NH2 2.68Å; D365-R436 PolarHBondContact OD2-NH2 2.63Å; I368-R436 HydrophobicContact CD1-CB 4.07Å; I368-R436 HydrophobicContact CD1-CG 4.39Å; L432-R436 PolarHBondContact O-N 2.89Å; R436-L438 VanDerWaalsContact C-N 3.32Å; R436-L438 PolarHBondContact O-N 3.44Å; R436-Q439 PolarHBondContact O-N 3.42Å; R436-N440 WeakPolarHBondContact O-CB 3.41Å; R436-N440 VanDerWaalsContact O-CG 3.23Å; R436-N440 PolarHBondContact O-N 3.14Å; R436-N440 PolarHBondContact O-ND2 3.26Å
437	R	84.5	Confident	84.9	Confident	102 Å²	102	50.7 Å²	50.7	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-58.3	-43.8	172.2	-78.1	179.5	65.9	-147.9	-4.4	111.6	H433 S434 A435 Y441 F488	H433-R437 WeakPolarHBondContact O-CG 3.47Å; H433-R437 PolarHBondContact O-N 3.18Å; S434-R437 WeakPolarHBondContact O-CB 3.36Å; S434-R437 PolarHBondContact O-N 2.91Å; A435-R437 PolarHBondContact O-N 3.23Å; R437-Y441 PolarHBondContact O-N 2.77Å; R437-F488 HydrophobicContact CB-CE2 4.33Å
438	L	80.3	Confident	85.3	Confident	13 Å²	13	46.3 Å²	46.3	7%	0.068	23%	0.231	C	C	.	.	H	α-helix	trans	-65	-47.1	178.7	177.3	58.4	0	0	0	112	S434 A435 R436 Y441 I442 F488 T504 L508	S434-L438 PolarHBondContact O-N 2.93Å; A435-L438 WeakPolarHBondContact O-CB 3.2Å; A435-L438 PolarHBondContact O-N 3.12Å; R436-L438 VanDerWaalsContact C-N 3.32Å; R436-L438 PolarHBondContact O-N 3.44Å; L438-Y441 WeakPolarHBondContact O-CB 3.48Å; L438-Y441 PolarHBondContact O-N 2.76Å; L438-Y441 VanDerWaalsContact O-N 3.16Å; L438-I442 HydrophobicContact CD1-CD1 3.88Å; L438-I442 HydrophobicContact CD1-CG1 4.19Å; L438-I442 HydrophobicContact CG-CD1 3.9Å; L438-I442 WeakPolarHBondContact O-CG1 3.33Å; L438-I442 PolarHBondContact O-N 2.94Å; L438-F488 HydrophobicContact CB-CE2 4.48Å; L438-F488 HydrophobicContact CB-CZ 3.96Å; L438-F488 HydrophobicContact CD1-CD1 4.5Å; L438-F488 HydrophobicContact CD1-CE1 4Å; L438-F488 HydrophobicContact CD1-CZ 4.01Å; L438-T504 HydrophobicContact CD2-CG2 3.63Å; L438-L508 HydrophobicContact CD1-CD1 3.83Å; L438-L508 HydrophobicContact CD1-CD2 3.75Å; L438-L508 HydrophobicContact CD1-CG 3.9Å
439	Q	83.6	Confident	85.5	Confident	27 Å²	27	45.9 Å²	45.9	13%	0.126	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-39.7	177.8	-77.6	-64.5	-4	0	0	112.7	L358 I361 A435 R436 Y441 I442 S443	L358-Q439 PolarHBondContact O-NE2 2.89Å; I361-Q439 HydrophobicContact CG1-CB 3.88Å; A435-Q439 PolarHBondContact O-N 3.24Å; R436-Q439 PolarHBondContact O-N 3.42Å; Q439-Y441 VanDerWaalsContact C-N 3.29Å; Q439-Y441 PolarHBondContact O-N 2.7Å; Q439-I442 PolarHBondContact O-N 3.32Å; Q439-S443 WeakPolarHBondContact O-CB 3.43Å; Q439-S443 PolarHBondContact O-N 3.09Å
440	N	86.5	Confident	85.7	Confident	68 Å²	68	46.2 Å²	46.2	36%	0.364	23%	0.233	S	C	.	.	H	α-helix	trans	-60.2	-38.2	171.8	-74.5	-13.4	0	0	0	112.1	I361 R436 S444	I361-N440 WeakPolarHBondContact CD1-OD1 3.48Å; R436-N440 WeakPolarHBondContact O-CB 3.41Å; R436-N440 VanDerWaalsContact O-CG 3.23Å; R436-N440 PolarHBondContact O-N 3.14Å; R436-N440 PolarHBondContact O-ND2 3.26Å; N440-S444 VanDerWaalsContact O-CB 3.27Å; N440-S444 WeakPolarHBondContact O-CB 3.29Å; N440-S444 PolarHBondContact O-N 3.21Å; N440-S444 PolarHBondContact O-OG 2.93Å
441	Y	86.3	Confident	86	Confident	21 Å²	21	44.4 Å²	44.4	8%	0.082	23%	0.229	C	C	.	.	H	α-helix	trans	-67.9	-48.2	174.6	173.4	-104.3	0	0	0	112.2	R437 L438 Q439 S443 S444 A445 F488 L508 V511 N512 L515	R437-Y441 PolarHBondContact O-N 2.77Å; L438-Y441 WeakPolarHBondContact O-CB 3.48Å; L438-Y441 PolarHBondContact O-N 2.76Å; L438-Y441 VanDerWaalsContact O-N 3.16Å; Q439-Y441 VanDerWaalsContact C-N 3.29Å; Q439-Y441 PolarHBondContact O-N 2.7Å; Y441-S443 VanDerWaalsContact C-N 3.3Å; Y441-S443 PolarHBondContact O-N 2.73Å; Y441-S444 PolarHBondContact O-N 2.75Å; Y441-A445 HydrophobicContact CE2-CB 4.44Å; Y441-A445 VanDerWaalsContact O-CB 3.25Å; Y441-A445 WeakPolarHBondContact O-CB 3.36Å; Y441-A445 PolarHBondContact O-N 3.09Å; Y441-F488 VanDerWaalsContact CB-CD2 3.49Å; Y441-F488 HydrophobicContact CD1-CB 3.68Å; Y441-F488 AromaticContact CD1-CD2 3.95Å; Y441-F488 HydrophobicContact CD1-CD2 3.95Å; Y441-F488 AromaticContact CD1-CG 3.91Å; Y441-F488 HydrophobicContact CD1-CG 3.91Å; Y441-F488 HydrophobicContact CD2-CB 3.83Å; Y441-F488 HydrophobicContact CD2-CD2 4.09Å; Y441-F488 HydrophobicContact CD2-CG 4.4Å; Y441-F488 HydrophobicContact CE1-CB 3.61Å; Y441-F488 HydrophobicContact CE1-CG 4.31Å; Y441-F488 HydrophobicContact CE2-CB 3.77Å; Y441-F488 HydrophobicContact CG-CB 3.77Å; Y441-F488 AromaticContact CG-CD2 3.57Å; Y441-F488 HydrophobicContact CG-CD2 3.57Å; Y441-F488 HydrophobicContact CG-CE2 4.45Å; Y441-F488 AromaticContact CG-CG 3.95Å; Y441-F488 HydrophobicContact CG-CG 3.95Å; Y441-L508 HydrophobicContact CD1-CD2 4.27Å; Y441-L508 HydrophobicContact CE1-CD2 4.1Å; Y441-V511 HydrophobicContact CE1-CG1 4.17Å; Y441-N512 PolarHBondContact OH-OD1 2.8Å; Y441-L515 VanDerWaalsContact OH-CD1 3.22Å; Y441-L515 WeakPolarHBondContact OH-CD1 3.49Å
442	I	83.9	Confident	86.5	Confident	16 Å²	16	42.6 Å²	42.6	8%	0.082	22%	0.221	C	C	.	.	H	α-helix	trans	-58.3	-44.1	179.1	-69	166.9	0	0	0	110.5	L438 Q439 N446 L507 V511	L438-I442 HydrophobicContact CD1-CD1 3.88Å; L438-I442 HydrophobicContact CD1-CG1 4.19Å; L438-I442 HydrophobicContact CG-CD1 3.9Å; L438-I442 WeakPolarHBondContact O-CG1 3.33Å; L438-I442 PolarHBondContact O-N 2.94Å; Q439-I442 PolarHBondContact O-N 3.32Å; I442-N446 WeakPolarHBondContact O-CB 3.39Å; I442-N446 PolarHBondContact O-N 3.26Å; I442-N446 PolarHBondContact O-ND2 3.32Å; I442-L507 HydrophobicContact CD1-CD2 3.95Å; I442-L507 HydrophobicContact CD1-CG 4.37Å; I442-V511 HydrophobicContact CG2-CG2 4.37Å
443	S	87.5	Confident	86.8	Confident	61 Å²	61	45.7 Å²	45.7	43%	0.427	24%	0.239	S	C	.	.	H	α-helix	trans	-61.8	-50.2	174.6	-175.3	0	0	0	0	111.9	Q439 Y441 A445 N446 Q447	Q439-S443 WeakPolarHBondContact O-CB 3.43Å; Q439-S443 PolarHBondContact O-N 3.09Å; Y441-S443 VanDerWaalsContact C-N 3.3Å; Y441-S443 PolarHBondContact O-N 2.73Å; S443-A445 PolarHBondContact O-N 3.18Å; S443-N446 PolarHBondContact O-N 3.45Å; S443-Q447 WeakPolarHBondContact O-CB 3.39Å; S443-Q447 PolarHBondContact O-N 3.18Å
444	S	88.7	Confident	86.9	Confident	57 Å²	57	44.9 Å²	44.9	40%	0.399	24%	0.239	S	C	.	.	H	α-helix	trans	-62	-42	-179.5	-57.7	0	0	0	0	112.9	N440 Y441 Q447 W448	N440-S444 VanDerWaalsContact O-CB 3.27Å; N440-S444 WeakPolarHBondContact O-CB 3.29Å; N440-S444 PolarHBondContact O-N 3.21Å; N440-S444 PolarHBondContact O-OG 2.93Å; Y441-S444 PolarHBondContact O-N 2.75Å; S444-Q447 PolarHBondContact O-N 3.05Å; S444-W448 WeakPolarHBondContact O-CB 3.41Å; S444-W448 PolarHBondContact O-N 3.24Å
445	A	88.3	Confident	87.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-67.4	-40.5	177.6	0	0	0	0	0	112	Y441 S443 W448 C449 V511 L515	Y441-A445 HydrophobicContact CE2-CB 4.44Å; Y441-A445 VanDerWaalsContact O-CB 3.25Å; Y441-A445 WeakPolarHBondContact O-CB 3.36Å; Y441-A445 PolarHBondContact O-N 3.09Å; S443-A445 PolarHBondContact O-N 3.18Å; A445-W448 PolarHBondContact O-N 3.22Å; A445-C449 WeakPolarHBondContact O-CB 3.41Å; A445-C449 PolarHBondContact O-N 3.24Å; A445-C449 PolarHBondContact O-SG 2.85Å; A445-V511 HydrophobicContact CB-CG1 3.49Å; A445-V511 VanDerWaalsContact CB-CG1 3.49Å; A445-L515 HydrophobicContact CB-CD1 3.95Å; A445-L515 HydrophobicContact CB-CD2 4.09Å; A445-L515 HydrophobicContact CB-CG 4.21Å
446	N	89.2	Confident	87.5	Confident	52 Å²	52	47.7 Å²	47.7	28%	0.278	25%	0.252	S	S	.	.	H	α-helix	trans	-62.9	-44.7	172.9	-85.6	-65.8	0	0	0	111.8	I442 S443 C449 A450 R514	I442-N446 WeakPolarHBondContact O-CB 3.39Å; I442-N446 PolarHBondContact O-N 3.26Å; I442-N446 PolarHBondContact O-ND2 3.32Å; S443-N446 PolarHBondContact O-N 3.45Å; N446-C449 PolarHBondContact O-N 3.47Å; N446-A450 PolarHBondContact O-N 2.76Å; N446-R514 PolarHBondContact OD1-NH1 3.34Å
447	Q	91.3	Very high	87.3	Confident	122 Å²	122	47.3 Å²	47.3	57%	0.57	26%	0.261	S	S	*	.	H	α-helix	trans	-63.7	-41.5	177.5	-176.8	56.9	45.8	0	0	111.9	S443 S444 A450 T451	S443-Q447 WeakPolarHBondContact O-CB 3.39Å; S443-Q447 PolarHBondContact O-N 3.18Å; S444-Q447 PolarHBondContact O-N 3.05Å; Q447-A450 PolarHBondContact O-N 3.49Å; Q447-T451 PolarHBondContact NE2-OG1 2.75Å; Q447-T451 WeakPolarHBondContact O-CB 3.47Å; Q447-T451 PolarHBondContact O-N 2.76Å; Q447-T451 PolarHBondContact O-OG1 3.4Å
448	W	92.9	Very high	86.6	Confident	13 Å²	13	45 Å²	45	5%	0.049	27%	0.269	C	S	.	.	H	α-helix	trans	-63	-45.1	173.9	-172	93.1	0	0	0	111.4	S444 A445 A450 T451 G452 F479 S482 M486 L515 V518 K519	S444-W448 WeakPolarHBondContact O-CB 3.41Å; S444-W448 PolarHBondContact O-N 3.24Å; A445-W448 PolarHBondContact O-N 3.22Å; W448-A450 PolarHBondContact O-N 3.44Å; W448-T451 PolarHBondContact O-N 2.62Å; W448-G452 PolarHBondContact O-N 3.43Å; W448-F479 AromaticContact CD1-CE2 3.84Å; W448-F479 HydrophobicContact CD2-CE1 4.33Å; W448-F479 HydrophobicContact CD2-CE2 4.09Å; W448-F479 AromaticContact CD2-CZ 3.55Å; W448-F479 HydrophobicContact CD2-CZ 3.55Å; W448-F479 AromaticContact CE2-CE1 3.68Å; W448-F479 AromaticContact CE2-CE2 3.64Å; W448-F479 AromaticContact CE2-CZ 3.18Å; W448-F479 AromaticContact CE3-CZ 3.98Å; W448-F479 HydrophobicContact CE3-CZ 3.98Å; W448-F479 HydrophobicContact CG-CE2 4.2Å; W448-F479 HydrophobicContact CG-CZ 4.11Å; W448-F479 HydrophobicContact CH2-CD1 4.49Å; W448-F479 AromaticContact CH2-CE1 3.55Å; W448-F479 HydrophobicContact CH2-CE1 3.55Å; W448-F479 AromaticContact CH2-CZ 3.78Å; W448-F479 HydrophobicContact CH2-CZ 3.78Å; W448-F479 AromaticContact CZ2-CD1 3.94Å; W448-F479 HydrophobicContact CZ2-CD1 3.94Å; W448-F479 AromaticContact CZ2-CE1 3.24Å; W448-F479 HydrophobicContact CZ2-CE1 3.24Å; W448-F479 HydrophobicContact CZ2-CE2 4.08Å; W448-F479 AromaticContact CZ2-CZ 3.31Å; W448-F479 HydrophobicContact CZ2-CZ 3.31Å; W448-F479 HydrophobicContact CZ3-CE1 4.22Å; W448-F479 HydrophobicContact CZ3-CZ 4.11Å; W448-F479 AromaticContact NE1-CE2 3.47Å; W448-F479 AromaticContact NE1-CZ 3.57Å; W448-F479 WeakPolarHBondContact O-CZ 3.41Å; W448-S482 PolarHBondContact NE1-OG 3.41Å; W448-M486 HydrophobicContact CB-CE 4.04Å; W448-M486 HydrophobicContact CB-CG 4.31Å; W448-M486 HydrophobicContact CB-SD 4.22Å; W448-M486 HydrophobicContact CD2-CG 4.38Å; W448-M486 HydrophobicContact CG-CE 4.25Å; W448-M486 HydrophobicContact CG-CG 3.96Å; W448-M486 HydrophobicContact CG-SD 4.48Å; W448-L515 HydrophobicContact CD2-CD2 4.31Å; W448-L515 HydrophobicContact CE3-CD2 3.55Å; W448-L515 HydrophobicContact CZ3-CD2 4.06Å; W448-V518 HydrophobicContact CE3-CG1 4.26Å; W448-V518 HydrophobicContact CH2-CG1 4Å; W448-V518 HydrophobicContact CZ3-CB 3.89Å; W448-V518 HydrophobicContact CZ3-CG1 3.56Å; W448-K519 HydrophobicContact CH2-CG 3.58Å; W448-K519 HydrophobicContact CZ2-CG 4.46Å; W448-K519 HydrophobicContact CZ3-CG 4.18Å
449	C	91.2	Very high	85.5	Confident	4 Å²	4	45 Å²	45	3%	0.027	27%	0.271	C	S	.	.	H	α-helix	trans	-58.3	-45.3	175.4	-71.1	0	0	0	0	112.1	A445 N446 G452 V453 V518	A445-C449 WeakPolarHBondContact O-CB 3.41Å; A445-C449 PolarHBondContact O-N 3.24Å; A445-C449 PolarHBondContact O-SG 2.85Å; N446-C449 PolarHBondContact O-N 3.47Å; C449-G452 PolarHBondContact O-N 3.19Å; C449-V453 WeakPolarHBondContact O-CG2 3.46Å; C449-V453 PolarHBondContact O-N 3.24Å; C449-V518 HydrophobicContact CB-CG2 4.28Å
450	A	90.5	Very high	84.1	Confident	42 Å²	42	49 Å²	49	35%	0.347	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-51.1	176.9	0	0	0	0	0	111.3	N446 Q447 W448 G452 V453 D454	N446-A450 PolarHBondContact O-N 2.76Å; Q447-A450 PolarHBondContact O-N 3.49Å; W448-A450 PolarHBondContact O-N 3.44Å; A450-G452 PolarHBondContact O-N 3.18Å; A450-V453 PolarHBondContact O-N 3.09Å; A450-D454 PolarHBondContact O-N 3.29Å
451	T	90.8	Very high	82.7	Confident	59 Å²	59	53 Å²	53	36%	0.362	32%	0.32	S	S	.	.	H	α-helix	trans	-59	-34.3	177.7	-57.8	0	0	0	0	112.2	Q447 W448 L455 F479	Q447-T451 PolarHBondContact NE2-OG1 2.75Å; Q447-T451 WeakPolarHBondContact O-CB 3.47Å; Q447-T451 PolarHBondContact O-N 2.76Å; Q447-T451 PolarHBondContact O-OG1 3.4Å; W448-T451 PolarHBondContact O-N 2.62Å; T451-L455 WeakPolarHBondContact O-CB 3.13Å; T451-L455 PolarHBondContact O-N 3.35Å; T451-F479 HydrophobicContact CG2-CD2 4.34Å; T451-F479 HydrophobicContact CG2-CE2 3.98Å
452	G	89.9	Confident	81.3	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-70.8	-39.8	174.8	0	0	0	0	0	113.8	W448 C449 A450 L455 L456	W448-G452 PolarHBondContact O-N 3.43Å; C449-G452 PolarHBondContact O-N 3.19Å; A450-G452 PolarHBondContact O-N 3.18Å; G452-L455 PolarHBondContact O-N 2.97Å; G452-L456 WeakPolarHBondContact O-CD1 3.29Å; G452-L456 WeakPolarHBondContact O-CG 3.47Å; G452-L456 PolarHBondContact O-N 3.44Å
453	V	89.1	Confident	80.6	Confident	67 Å²	67	61.9 Å²	61.9	41%	0.406	36%	0.361	S	S	.	.	H	α-helix	trans	-63.3	-44.5	172.5	170.9	0	0	0	0	110.5	C449 A450 L455 L456 T457 V518	C449-V453 WeakPolarHBondContact O-CG2 3.46Å; C449-V453 PolarHBondContact O-N 3.24Å; A450-V453 PolarHBondContact O-N 3.09Å; V453-L455 VanDerWaalsContact C-N 3.31Å; V453-L455 PolarHBondContact O-N 3.17Å; V453-L456 WeakPolarHBondContact O-CB 3.37Å; V453-L456 PolarHBondContact O-N 2.84Å; V453-L456 VanDerWaalsContact O-N 3.08Å; V453-T457 HydrophobicContact CG1-CG2 4.3Å; V453-T457 WeakPolarHBondContact O-CG2 3.41Å; V453-T457 PolarHBondContact O-N 3.19Å; V453-T457 PolarHBondContact O-OG1 2.98Å; V453-T457 VanDerWaalsContact O-OG1 3.13Å; V453-V518 HydrophobicContact CG2-CG2 4.16Å
454	D	87.5	Confident	79.7	Confident	104 Å²	104	67 Å²	67	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-62.2	-37.4	176.5	-64.9	-28.4	0	0	0	112.2	A450 L456 T457 G458	A450-D454 PolarHBondContact O-N 3.29Å; D454-L456 VanDerWaalsContact C-N 3.3Å; D454-L456 PolarHBondContact O-N 2.93Å; D454-T457 PolarHBondContact O-OG1 2.97Å; D454-G458 WeakPolarHBondContact O-CA 3.42Å; D454-G458 PolarHBondContact O-N 2.96Å
455	L	86.4	Confident	78.9	Confident	41 Å²	41	66.1 Å²	66.1	22%	0.215	37%	0.372	C	S	.	.	H	α-helix	trans	-67	-30.5	174.4	-165.1	78.4	0	0	0	112.9	T451 G452 V453 R475 V476 F479	T451-L455 WeakPolarHBondContact O-CB 3.13Å; T451-L455 PolarHBondContact O-N 3.35Å; G452-L455 PolarHBondContact O-N 2.97Å; V453-L455 VanDerWaalsContact C-N 3.31Å; V453-L455 PolarHBondContact O-N 3.17Å; L455-R475 HydrophobicContact CD1-CB 4.49Å; L455-V476 HydrophobicContact CD2-CB 4.4Å; L455-V476 HydrophobicContact CD2-CG2 4.05Å; L455-V476 HydrophobicContact CG-CG2 4.42Å; L455-F479 HydrophobicContact CD2-CB 3.47Å; L455-F479 VanDerWaalsContact CD2-CB 3.47Å; L455-F479 HydrophobicContact CD2-CD1 3.8Å; L455-F479 HydrophobicContact CD2-CD2 4.41Å; L455-F479 HydrophobicContact CD2-CG 3.62Å
456	L	84	Confident	78.5	Confident	35 Å²	35	67.7 Å²	67.7	18%	0.183	39%	0.385	C	S	.	.	H	α-helix	trans	-80	-41.5	179	-73.4	162.3	0	0	0	112	G452 V453 D454 L521 R525	G452-L456 WeakPolarHBondContact O-CD1 3.29Å; G452-L456 WeakPolarHBondContact O-CG 3.47Å; G452-L456 PolarHBondContact O-N 3.44Å; V453-L456 WeakPolarHBondContact O-CB 3.37Å; V453-L456 PolarHBondContact O-N 2.84Å; V453-L456 VanDerWaalsContact O-N 3.08Å; D454-L456 VanDerWaalsContact C-N 3.3Å; D454-L456 PolarHBondContact O-N 2.93Å; L456-L521 HydrophobicContact CD1-CB 3.49Å; L456-L521 VanDerWaalsContact CD1-CB 3.49Å; L456-L521 HydrophobicContact CD1-CD1 4.17Å; L456-L521 HydrophobicContact CD1-CG 4.46Å; L456-L521 HydrophobicContact CD2-CB 4.19Å; L456-R525 HydrophobicContact CD2-CB 3.83Å; L456-R525 HydrophobicContact CD2-CG 4.2Å
457	T	81.9	Confident	78.1	Confident	89 Å²	89	72.8 Å²	72.8	55%	0.546	41%	0.407	S	S	.	.	H	α-helix	trans	-75.7	-44.5	178.6	56.8	0	0	0	0	111.8	V453 D454 A459 S460	V453-T457 HydrophobicContact CG1-CG2 4.3Å; V453-T457 WeakPolarHBondContact O-CG2 3.41Å; V453-T457 PolarHBondContact O-N 3.19Å; V453-T457 PolarHBondContact O-OG1 2.98Å; V453-T457 VanDerWaalsContact O-OG1 3.13Å; D454-T457 PolarHBondContact O-OG1 2.97Å; T457-A459 PolarHBondContact O-N 2.84Å; T457-S460 PolarHBondContact O-N 2.89Å
458	G	68.7	Low	77.6	Confident	54 Å²	54	70.4 Å²	70.4	56%	0.557	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	12.1	-178.4	0	0	0	0	0	116.1	D454	D454-G458 WeakPolarHBondContact O-CA 3.42Å; D454-G458 PolarHBondContact O-N 2.96Å
459	A	56.6	Low	77.1	Confident	14 Å²	14	69.8 Å²	69.8	12%	0.116	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	10.9	178	0	0	0	0	0	113.4	T457 M461 R525	T457-A459 PolarHBondContact O-N 2.84Å; A459-M461 PolarHBondContact O-N 3.02Å; A459-R525 PolarHBondContact O-NH2 2.99Å
460	S	55.3	Low	76.8	Confident	109 Å²	109	73 Å²	73	76%	0.762	41%	0.409	S	S	*	.			trans	-80.2	36.7	-178.1	-165.7	0	0	0	0	114.6	T457	T457-S460 PolarHBondContact O-N 2.89Å
461	M	56.1	Low	76.6	Confident	153 Å²	153	73.5 Å²	73.5	75%	0.754	41%	0.413	S	S	*	.	S	Bend	trans	-119.3	155.8	175.5	-62.6	-170.5	-64.7	0	0	110.2	A459	A459-M461 PolarHBondContact O-N 3.02Å
462	E	58.7	Low	76.3	Confident	181 Å²	181	70.9 Å²	70.9	85%	0.846	40%	0.397	S	S	*	.			trans	-69.2	137.2	-173	-57.1	-172.7	143	0	0	111.2	E464	E462-E464 PolarHBondContact O-N 2.94Å
463	F	68.8	Low	76.2	Confident	42 Å²	42	70.9 Å²	70.9	18%	0.184	40%	0.397	C	S	.	.			trans	-89.4	98.2	177.7	-61.8	-69.8	0	0	0	109.4	S465 Q468 C469 A472 L529 L532	F463-S465 VanDerWaalsContact C-N 3.26Å; F463-S465 PolarHBondContact O-N 2.97Å; F463-Q468 HydrophobicContact CD1-CB 4.2Å; F463-C469 HydrophobicContact CB-CB 4.11Å; F463-C469 HydrophobicContact CD1-CB 4.27Å; F463-C469 HydrophobicContact CG-CB 4.06Å; F463-A472 HydrophobicContact CE1-CB 3.56Å; F463-A472 HydrophobicContact CZ-CB 3.94Å; F463-L529 HydrophobicContact CD2-CD2 4.23Å; F463-L529 HydrophobicContact CE1-CD2 4.41Å; F463-L529 HydrophobicContact CE2-CD2 3.4Å; F463-L529 HydrophobicContact CZ-CD2 3.51Å; F463-L532 HydrophobicContact CB-CD2 4.35Å; F463-L532 HydrophobicContact CD2-CD1 4.06Å; F463-L532 HydrophobicContact CD2-CD2 4.2Å
464	E	67	Low	76.2	Confident	170 Å²	170	72.6 Å²	72.6	79%	0.794	40%	0.4	S	S	*	.			trans	-67.4	-27	-178.1	-54.6	169.9	131.2	0	0	112.2	E462 Q468	E462-E464 PolarHBondContact O-N 2.94Å; E464-Q468 PolarHBondContact OE2-NE2 2.97Å
465	S	72.8	Confident	76.3	Confident	37 Å²	37	74.2 Å²	74.2	26%	0.259	40%	0.399	S	S	.	.	S	Bend	trans	-133.2	157	179.4	88.5	0	0	0	0	113.5	F463 E467 Q468 C469	F463-S465 VanDerWaalsContact C-N 3.26Å; F463-S465 PolarHBondContact O-N 2.97Å; S465-E467 PolarHBondContact O-N 3.03Å; S465-E467 PolarHBondContact OG-N 2.91Å; S465-Q468 PolarHBondContact O-N 2.79Å; S465-Q468 PolarHBondContact OG-N 2.83Å; S465-Q468 VanDerWaalsContact OG-N 3.1Å; S465-C469 PolarHBondContact O-N 3.08Å
466	A	79.4	Confident	76.4	Confident	34 Å²	34	72.6 Å²	72.6	28%	0.281	39%	0.39	S	S	.	.	H	α-helix	trans	-58.9	-35.8	170.9	0	0	0	0	0	111.4	C469 E470 L533	A466-C469 PolarHBondContact O-N 3.22Å; A466-E470 WeakPolarHBondContact O-CB 3.48Å; A466-E470 PolarHBondContact O-N 3.06Å; A466-L533 HydrophobicContact CB-CD2 4.28Å; A466-L533 WeakPolarHBondContact O-CD2 3.34Å
467	E	81.9	Confident	76.6	Confident	158 Å²	158	75.2 Å²	75.2	74%	0.738	40%	0.398	S	S	*	.	H	α-helix	trans	-64.6	-42.9	178.5	-55.8	179.1	152.5	0	0	112.2	S465 C469 E470 A471	S465-E467 PolarHBondContact O-N 3.03Å; S465-E467 PolarHBondContact OG-N 2.91Å; E467-C469 VanDerWaalsContact C-N 3.28Å; E467-C469 PolarHBondContact O-N 2.85Å; E467-E470 PolarHBondContact O-N 3Å; E467-A471 VanDerWaalsContact O-CB 3.27Å; E467-A471 WeakPolarHBondContact O-CB 3.47Å; E467-A471 PolarHBondContact O-N 2.91Å
468	Q	80.8	Confident	77	Confident	72 Å²	72	75 Å²	75	34%	0.336	40%	0.396	S	S	.	.	H	α-helix	trans	-60	-40.8	174.5	-69.4	176.3	1.1	0	0	111.3	F463 E464 S465 A472	F463-Q468 HydrophobicContact CD1-CB 4.2Å; E464-Q468 PolarHBondContact OE2-NE2 2.97Å; S465-Q468 PolarHBondContact O-N 2.79Å; S465-Q468 PolarHBondContact OG-N 2.83Å; S465-Q468 VanDerWaalsContact OG-N 3.1Å; Q468-A472 WeakPolarHBondContact O-CB 3.46Å; Q468-A472 PolarHBondContact O-N 2.88Å
469	C	82.2	Confident	78.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-70.6	-39.5	178	-160.5	0	0	0	0	112.4	F463 S465 A466 E467 A472 L473 L533	F463-C469 HydrophobicContact CB-CB 4.11Å; F463-C469 HydrophobicContact CD1-CB 4.27Å; F463-C469 HydrophobicContact CG-CB 4.06Å; S465-C469 PolarHBondContact O-N 3.08Å; A466-C469 PolarHBondContact O-N 3.22Å; E467-C469 VanDerWaalsContact C-N 3.28Å; E467-C469 PolarHBondContact O-N 2.85Å; C469-A472 PolarHBondContact O-N 3.26Å; C469-L473 VanDerWaalsContact O-CB 3.29Å; C469-L473 WeakPolarHBondContact O-CB 3.44Å; C469-L473 PolarHBondContact O-N 2.87Å; C469-L533 HydrophobicContact CB-CD2 4.04Å; C469-L533 HydrophobicContact CB-CG 4.07Å
470	E	84.6	Confident	79.7	Confident	73 Å²	73	73.9 Å²	73.9	34%	0.341	38%	0.375	S	S	.	.	H	α-helix	trans	-65.1	-42	175.3	-160.3	108.2	-137.8	0	0	111.1	A466 E467 L473 Q474 L533 R537	A466-E470 WeakPolarHBondContact O-CB 3.48Å; A466-E470 PolarHBondContact O-N 3.06Å; E467-E470 PolarHBondContact O-N 3Å; E470-L473 PolarHBondContact O-N 3.47Å; E470-Q474 WeakPolarHBondContact O-CB 3.35Å; E470-Q474 PolarHBondContact O-N 2.91Å; E470-L533 HydrophobicContact CB-CD1 4.45Å; E470-L533 HydrophobicContact CB-CD2 4.16Å; E470-R537 IonicContact OE1-NH2 3.69Å; E470-R537 IonicContact OE2-CZ 3.77Å; E470-R537 IonicContact OE2-NH2 2.66Å; E470-R537 PolarHBondContact OE2-NH2 2.96Å
471	A	85.8	Confident	81.2	Confident	52 Å²	52	76 Å²	76	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-39.5	174.9	0	0	0	0	0	112.6	E467 Q474 R475	E467-A471 VanDerWaalsContact O-CB 3.27Å; E467-A471 WeakPolarHBondContact O-CB 3.47Å; E467-A471 PolarHBondContact O-N 2.91Å; A471-Q474 PolarHBondContact O-N 2.77Å; A471-R475 WeakPolarHBondContact O-CG 3.37Å; A471-R475 PolarHBondContact O-N 2.83Å
472	A	85	Confident	82.8	Confident	3 Å²	3	70.7 Å²	70.7	3%	0.025	35%	0.348	C	S	.	.	H	α-helix	trans	-63.8	-44.2	172.1	0	0	0	0	0	111.6	F463 Q468 C469 Q474 R475 V476 L529	F463-A472 HydrophobicContact CE1-CB 3.56Å; F463-A472 HydrophobicContact CZ-CB 3.94Å; Q468-A472 WeakPolarHBondContact O-CB 3.46Å; Q468-A472 PolarHBondContact O-N 2.88Å; C469-A472 PolarHBondContact O-N 3.26Å; A472-Q474 VanDerWaalsContact C-N 3.3Å; A472-Q474 PolarHBondContact O-N 2.88Å; A472-R475 PolarHBondContact O-N 2.94Å; A472-V476 WeakPolarHBondContact O-CG2 3.44Å; A472-V476 PolarHBondContact O-N 3.15Å; A472-V476 VanDerWaalsContact O-N 3.08Å; A472-L529 HydrophobicContact CB-CD1 4.28Å; A472-L529 HydrophobicContact CB-CD2 4.43Å
473	L	87.3	Confident	84	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-38.1	175.5	177.7	54.5	0	0	0	111.6	C469 E470 R477 C526 L529 K530 L533	C469-L473 VanDerWaalsContact O-CB 3.29Å; C469-L473 WeakPolarHBondContact O-CB 3.44Å; C469-L473 PolarHBondContact O-N 2.87Å; E470-L473 PolarHBondContact O-N 3.47Å; L473-R477 HydrophobicContact CD1-CG 4.33Å; L473-R477 VanDerWaalsContact CD2-NH2 3.34Å; L473-R477 WeakPolarHBondContact O-CB 3.41Å; L473-R477 WeakPolarHBondContact O-CD 3.27Å; L473-R477 WeakPolarHBondContact O-CG 3.26Å; L473-R477 PolarHBondContact O-N 2.97Å; L473-C526 HydrophobicContact CD1-CB 3.96Å; L473-L529 HydrophobicContact CB-CB 4.02Å; L473-L529 HydrophobicContact CB-CD1 4.21Å; L473-L529 HydrophobicContact CD1-CB 4.12Å; L473-L529 HydrophobicContact CG-CB 4.43Å; L473-K530 HydrophobicContact CD1-CG 4.44Å; L473-K530 HydrophobicContact CD2-CG 3.89Å; L473-L533 HydrophobicContact CB-CD1 4.45Å; L473-L533 HydrophobicContact CD2-CD1 3.48Å; L473-L533 VanDerWaalsContact CD2-CD1 3.48Å
474	Q	89	Confident	84.5	Confident	103 Å²	103	65.7 Å²	65.7	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-67.9	-39.9	175.5	-167.5	66.6	-3.2	0	0	112.1	E470 A471 A472 R477 T478	E470-Q474 WeakPolarHBondContact O-CB 3.35Å; E470-Q474 PolarHBondContact O-N 2.91Å; A471-Q474 PolarHBondContact O-N 2.77Å; A472-Q474 VanDerWaalsContact C-N 3.3Å; A472-Q474 PolarHBondContact O-N 2.88Å; Q474-R477 PolarHBondContact O-N 3.48Å; Q474-T478 PolarHBondContact O-N 2.85Å; Q474-T478 PolarHBondContact O-OG1 2.7Å; Q474-T478 VanDerWaalsContact O-OG1 3.05Å
475	R	89.2	Confident	85	Confident	138 Å²	138	65.3 Å²	65.3	52%	0.521	33%	0.327	S	S	.	.	H	α-helix	trans	-58.2	-48.7	172.7	-76.4	-173.8	-72.6	157.1	-4.5	112.1	L455 A471 A472 R477 T478 F479	L455-R475 HydrophobicContact CD1-CB 4.49Å; A471-R475 WeakPolarHBondContact O-CG 3.37Å; A471-R475 PolarHBondContact O-N 2.83Å; A472-R475 PolarHBondContact O-N 2.94Å; R475-R477 PolarHBondContact O-N 3.44Å; R475-T478 PolarHBondContact O-N 3.48Å; R475-F479 PolarHBondContact O-N 3.27Å
476	V	88.6	Confident	85.2	Confident	6 Å²	6	66.2 Å²	66.2	4%	0.036	33%	0.328	C	S	.	.	H	α-helix	trans	-66.5	-35.8	179	-173.3	0	0	0	0	111.9	L455 A472 L480 C522 R525 C526 L529	L455-V476 HydrophobicContact CD2-CB 4.4Å; L455-V476 HydrophobicContact CD2-CG2 4.05Å; L455-V476 HydrophobicContact CG-CG2 4.42Å; A472-V476 WeakPolarHBondContact O-CG2 3.44Å; A472-V476 PolarHBondContact O-N 3.15Å; A472-V476 VanDerWaalsContact O-N 3.08Å; V476-L480 HydrophobicContact CG1-CD1 4.37Å; V476-L480 WeakPolarHBondContact O-CB 3.34Å; V476-L480 WeakPolarHBondContact O-CG 3.38Å; V476-L480 PolarHBondContact O-N 3.38Å; V476-C522 HydrophobicContact CG1-CB 3.79Å; V476-C522 VanDerWaalsContact CG1-O 3.31Å; V476-C522 WeakPolarHBondContact CG1-O 3.4Å; V476-R525 HydrophobicContact CG2-CG 4.34Å; V476-C526 WeakPolarHBondContact CG1-SG 3.32Å; V476-L529 HydrophobicContact CG2-CD1 4.34Å
477	R	89.1	Confident	84.9	Confident	91 Å²	91	69.3 Å²	69.3	34%	0.343	35%	0.347	S	S	.	.	H	α-helix	trans	-63.7	-42.2	171.8	-74.2	167.1	178.9	170	1.4	112.9	L473 Q474 R475 L480 K481	L473-R477 HydrophobicContact CD1-CG 4.33Å; L473-R477 VanDerWaalsContact CD2-NH2 3.34Å; L473-R477 WeakPolarHBondContact O-CB 3.41Å; L473-R477 WeakPolarHBondContact O-CD 3.27Å; L473-R477 WeakPolarHBondContact O-CG 3.26Å; L473-R477 PolarHBondContact O-N 2.97Å; Q474-R477 PolarHBondContact O-N 3.48Å; R475-R477 PolarHBondContact O-N 3.44Å; R477-L480 PolarHBondContact O-N 2.85Å; R477-K481 WeakPolarHBondContact O-CG 3.46Å; R477-K481 PolarHBondContact O-N 2.85Å; R477-K481 VanDerWaalsContact O-N 3.16Å
478	T	90.5	Very high	84.5	Confident	83 Å²	83	63.4 Å²	63.4	51%	0.509	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-40.4	178.4	-61.2	0	0	0	0	111.2	Q474 R475 K481 S482	Q474-T478 PolarHBondContact O-N 2.85Å; Q474-T478 PolarHBondContact O-OG1 2.7Å; Q474-T478 VanDerWaalsContact O-OG1 3.05Å; R475-T478 PolarHBondContact O-N 3.48Å; T478-K481 PolarHBondContact O-N 2.97Å; T478-S482 PolarHBondContact O-N 2.89Å
479	F	91.9	Very high	83.7	Confident	20 Å²	20	64.5 Å²	64.5	9%	0.088	33%	0.327	C	S	.	.	H	α-helix	trans	-66.7	-39.9	174.2	177.6	-99.3	0	0	0	113.1	W448 T451 L455 R475 K481 S482 G483 V518	W448-F479 AromaticContact CD1-CE2 3.84Å; W448-F479 HydrophobicContact CD2-CE1 4.33Å; W448-F479 HydrophobicContact CD2-CE2 4.09Å; W448-F479 AromaticContact CD2-CZ 3.55Å; W448-F479 HydrophobicContact CD2-CZ 3.55Å; W448-F479 AromaticContact CE2-CE1 3.68Å; W448-F479 AromaticContact CE2-CE2 3.64Å; W448-F479 AromaticContact CE2-CZ 3.18Å; W448-F479 AromaticContact CE3-CZ 3.98Å; W448-F479 HydrophobicContact CE3-CZ 3.98Å; W448-F479 HydrophobicContact CG-CE2 4.2Å; W448-F479 HydrophobicContact CG-CZ 4.11Å; W448-F479 HydrophobicContact CH2-CD1 4.49Å; W448-F479 AromaticContact CH2-CE1 3.55Å; W448-F479 HydrophobicContact CH2-CE1 3.55Å; W448-F479 AromaticContact CH2-CZ 3.78Å; W448-F479 HydrophobicContact CH2-CZ 3.78Å; W448-F479 AromaticContact CZ2-CD1 3.94Å; W448-F479 HydrophobicContact CZ2-CD1 3.94Å; W448-F479 AromaticContact CZ2-CE1 3.24Å; W448-F479 HydrophobicContact CZ2-CE1 3.24Å; W448-F479 HydrophobicContact CZ2-CE2 4.08Å; W448-F479 AromaticContact CZ2-CZ 3.31Å; W448-F479 HydrophobicContact CZ2-CZ 3.31Å; W448-F479 HydrophobicContact CZ3-CE1 4.22Å; W448-F479 HydrophobicContact CZ3-CZ 4.11Å; W448-F479 AromaticContact NE1-CE2 3.47Å; W448-F479 AromaticContact NE1-CZ 3.57Å; W448-F479 WeakPolarHBondContact O-CZ 3.41Å; T451-F479 HydrophobicContact CG2-CD2 4.34Å; T451-F479 HydrophobicContact CG2-CE2 3.98Å; L455-F479 HydrophobicContact CD2-CB 3.47Å; L455-F479 VanDerWaalsContact CD2-CB 3.47Å; L455-F479 HydrophobicContact CD2-CD1 3.8Å; L455-F479 HydrophobicContact CD2-CD2 4.41Å; L455-F479 HydrophobicContact CD2-CG 3.62Å; R475-F479 PolarHBondContact O-N 3.27Å; F479-K481 VanDerWaalsContact C-N 3.27Å; F479-K481 PolarHBondContact O-N 3.28Å; F479-S482 PolarHBondContact O-N 3.36Å; F479-S482 PolarHBondContact O-OG 2.9Å; F479-G483 PolarHBondContact O-N 3.01Å; F479-G483 VanDerWaalsContact O-N 3.16Å; F479-V518 HydrophobicContact CE1-CG1 4.19Å; F479-V518 HydrophobicContact CZ-CG1 4.45Å
480	L	90	Very high	82.7	Confident	26 Å²	26	68.1 Å²	68.1	14%	0.136	35%	0.346	C	S	.	.	H	α-helix	trans	-58.8	-39.3	173.9	-82.3	169.3	0	0	0	112	V476 R477 G483 D484 C522 Q523	V476-L480 HydrophobicContact CG1-CD1 4.37Å; V476-L480 WeakPolarHBondContact O-CB 3.34Å; V476-L480 WeakPolarHBondContact O-CG 3.38Å; V476-L480 PolarHBondContact O-N 3.38Å; R477-L480 PolarHBondContact O-N 2.85Å; L480-G483 WeakPolarHBondContact O-CA 3.37Å; L480-G483 PolarHBondContact O-N 3.23Å; L480-G483 VanDerWaalsContact O-N 3.1Å; L480-D484 PolarHBondContact O-N 3.12Å; L480-C522 HydrophobicContact CD1-CB 4.23Å; L480-C522 HydrophobicContact CD2-CB 3.64Å; L480-C522 HydrophobicContact CG-CB 3.84Å; L480-Q523 HydrophobicContact CD1-CG 4.18Å; L480-Q523 HydrophobicContact CD2-CG 4.13Å
481	K	87.5	Confident	81.3	Confident	152 Å²	152	71.7 Å²	71.7	66%	0.661	37%	0.367	S	S	*	.	H	α-helix	trans	-61.5	-43.7	176.6	-74.5	-178.2	173.6	-168	0	113.4	R477 T478 F479 G483 D484	R477-K481 WeakPolarHBondContact O-CG 3.46Å; R477-K481 PolarHBondContact O-N 2.85Å; R477-K481 VanDerWaalsContact O-N 3.16Å; T478-K481 PolarHBondContact O-N 2.97Å; F479-K481 VanDerWaalsContact C-N 3.27Å; F479-K481 PolarHBondContact O-N 3.28Å; K481-G483 PolarHBondContact O-N 3.16Å; K481-D484 PolarHBondContact O-N 3.33Å
482	S	89	Confident	79.8	Confident	43 Å²	43	72 Å²	72	30%	0.301	36%	0.364	S	S	.	.	H	α-helix	trans	-68.9	-21.1	175.6	65.1	0	0	0	0	112.4	W448 T478 F479 D484 E485	W448-S482 PolarHBondContact NE1-OG 3.41Å; T478-S482 PolarHBondContact O-N 2.89Å; F479-S482 PolarHBondContact O-N 3.36Å; F479-S482 PolarHBondContact O-OG 2.9Å; S482-D484 VanDerWaalsContact C-N 3.27Å; S482-D484 PolarHBondContact O-N 3.11Å; S482-E485 PolarHBondContact O-N 3.37Å
483	G	83.5	Confident	78.1	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-65.6	-26.4	168.4	0	0	0	0	0	113.8	F479 L480 K481 E485 M486 K519	F479-G483 PolarHBondContact O-N 3.01Å; F479-G483 VanDerWaalsContact O-N 3.16Å; L480-G483 WeakPolarHBondContact O-CA 3.37Å; L480-G483 PolarHBondContact O-N 3.23Å; L480-G483 VanDerWaalsContact O-N 3.1Å; K481-G483 PolarHBondContact O-N 3.16Å; G483-E485 VanDerWaalsContact C-N 3.26Å; G483-E485 PolarHBondContact O-N 2.85Å; G483-M486 WeakPolarHBondContact O-CB 3.49Å; G483-M486 PolarHBondContact O-N 3.21Å; G483-K519 VanDerWaalsContact C-CE 3.48Å; G483-K519 VanDerWaalsContact C-NZ 3.26Å; G483-K519 WeakPolarHBondContact O-CE 3.19Å; G483-K519 PolarHBondContact O-NZ 3.17Å
484	D	79.1	Confident	76.5	Confident	117 Å²	117	80.3 Å²	80.3	63%	0.626	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-14.2	179.5	-62.6	-29.5	0	0	0	112.8	L480 K481 S482 K519	L480-D484 PolarHBondContact O-N 3.12Å; K481-D484 PolarHBondContact O-N 3.33Å; S482-D484 VanDerWaalsContact C-N 3.27Å; S482-D484 PolarHBondContact O-N 3.11Å; D484-K519 IonicContact OD1-NZ 2.91Å; D484-K519 PolarHBondContact OD1-NZ 3.03Å
485	E	77.9	Confident	74.8	Confident	162 Å²	162	75.8 Å²	75.8	76%	0.757	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-15.2	168.9	-61.2	172.7	173.1	0	0	112.4	S482 G483 C487	S482-E485 PolarHBondContact O-N 3.37Å; G483-E485 VanDerWaalsContact C-N 3.26Å; G483-E485 PolarHBondContact O-N 2.85Å; E485-C487 PolarHBondContact O-N 3.38Å
486	M	78	Confident	73	Confident	56 Å²	56	74.4 Å²	74.4	28%	0.276	40%	0.398	S	S	.	.			trans	-80.2	83.2	178.7	-68.5	-73.1	161.7	0	0	111.4	W448 G483 L515	W448-M486 HydrophobicContact CB-CE 4.04Å; W448-M486 HydrophobicContact CB-CG 4.31Å; W448-M486 HydrophobicContact CB-SD 4.22Å; W448-M486 HydrophobicContact CD2-CG 4.38Å; W448-M486 HydrophobicContact CG-CE 4.25Å; W448-M486 HydrophobicContact CG-CG 3.96Å; W448-M486 HydrophobicContact CG-SD 4.48Å; G483-M486 WeakPolarHBondContact O-CB 3.49Å; G483-M486 PolarHBondContact O-N 3.21Å; M486-L515 HydrophobicContact CB-CD2 4.36Å
487	C	72.6	Confident	71.5	Confident	99 Å²	99	79.5 Å²	79.5	67%	0.669	42%	0.424	S	S	*	.			trans	-136.8	140	175.1	-172.5	0	0	0	0	111.1	E485	E485-C487 PolarHBondContact O-N 3.38Å
488	F	72.8	Confident	70	Confident	34 Å²	34	76 Å²	76	15%	0.149	41%	0.412	C	S	.	.			trans	-106.8	103.7	169.5	-165.5	-108.6	0	0	0	110.1	R437 L438 Y441 L490 L508	R437-F488 HydrophobicContact CB-CE2 4.33Å; L438-F488 HydrophobicContact CB-CE2 4.48Å; L438-F488 HydrophobicContact CB-CZ 3.96Å; L438-F488 HydrophobicContact CD1-CD1 4.5Å; L438-F488 HydrophobicContact CD1-CE1 4Å; L438-F488 HydrophobicContact CD1-CZ 4.01Å; Y441-F488 VanDerWaalsContact CB-CD2 3.49Å; Y441-F488 HydrophobicContact CD1-CB 3.68Å; Y441-F488 AromaticContact CD1-CD2 3.95Å; Y441-F488 HydrophobicContact CD1-CD2 3.95Å; Y441-F488 AromaticContact CD1-CG 3.91Å; Y441-F488 HydrophobicContact CD1-CG 3.91Å; Y441-F488 HydrophobicContact CD2-CB 3.83Å; Y441-F488 HydrophobicContact CD2-CD2 4.09Å; Y441-F488 HydrophobicContact CD2-CG 4.4Å; Y441-F488 HydrophobicContact CE1-CB 3.61Å; Y441-F488 HydrophobicContact CE1-CG 4.31Å; Y441-F488 HydrophobicContact CE2-CB 3.77Å; Y441-F488 HydrophobicContact CG-CB 3.77Å; Y441-F488 AromaticContact CG-CD2 3.57Å; Y441-F488 HydrophobicContact CG-CD2 3.57Å; Y441-F488 HydrophobicContact CG-CE2 4.45Å; Y441-F488 AromaticContact CG-CG 3.95Å; Y441-F488 HydrophobicContact CG-CG 3.95Å; F488-L490 HydrophobicContact CD1-CD2 3.96Å; F488-L490 HydrophobicContact CD1-CG 4.02Å; F488-L490 HydrophobicContact CE1-CD2 3.82Å; F488-L490 HydrophobicContact CE1-CG 4.38Å; F488-L490 PolarHBondContact O-N 3.04Å; F488-L508 HydrophobicContact CD1-CD2 4.39Å
489	D	64.1	Low	68.3	Low	95 Å²	95	74 Å²	74	51%	0.508	40%	0.398	S	S	.	.			trans	-71.5	125.9	176.4	-174.6	7.5	0	0	0	111.2	D491	D489-D491 WeakPolarHBondContact OD1-CB 3.28Å; D489-D491 PolarHBondContact OD1-N 3.02Å
490	L	61.3	Low	66.4	Low	76 Å²	76	78 Å²	78	40%	0.398	42%	0.424	S	S	.	.			trans	-108.4	7.4	-176.5	-79.7	168.7	0	0	0	113.2	F488 T492 L499	F488-L490 HydrophobicContact CD1-CD2 3.96Å; F488-L490 HydrophobicContact CD1-CG 4.02Å; F488-L490 HydrophobicContact CE1-CD2 3.82Å; F488-L490 HydrophobicContact CE1-CG 4.38Å; F488-L490 PolarHBondContact O-N 3.04Å; L490-T492 PolarHBondContact O-N 2.92Å; L490-L499 HydrophobicContact CD1-CD1 4.39Å; L490-L499 HydrophobicContact CD2-CD1 3.82Å
491	D	55.4	Low	65	Low	149 Å²	149	77.5 Å²	77.5	80%	0.797	42%	0.423	S	S	*	.			trans	-65.1	-1.1	-173	-98.5	14.6	0	0	0	116	D489	D489-D491 WeakPolarHBondContact OD1-CB 3.28Å; D489-D491 PolarHBondContact OD1-N 3.02Å
492	T	53.7	Low	63.4	Low	58 Å²	58	78.9 Å²	78.9	36%	0.356	43%	0.425	S	S	.	.	S	Bend	trans	-95.1	127.9	173.5	35.5	0	0	0	0	112.7	L490 D494 S495	L490-T492 PolarHBondContact O-N 2.92Å; T492-D494 PolarHBondContact O-N 3.36Å; T492-D494 VanDerWaalsContact O-N 3.08Å; T492-S495 VanDerWaalsContact O-CB 3.27Å; T492-S495 WeakPolarHBondContact O-CB 3.31Å; T492-S495 PolarHBondContact O-N 3.07Å; T492-S495 PolarHBondContact O-OG 3.19Å; T492-S495 PolarHBondContact OG1-OG 2.7Å
493	S	50.5	Low	62.3	Low	98 Å²	98	82.5 Å²	82.5	69%	0.685	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-56	-26.9	172.9	-56.1	0	0	0	0	113.2	S495 L496	S493-S495 PolarHBondContact O-N 3.02Å; S493-L496 WeakPolarHBondContact O-CB 3.47Å; S493-L496 PolarHBondContact O-N 3.02Å
494	D	52.1	Low	61.6	Low	80 Å²	80	83.8 Å²	83.8	43%	0.428	45%	0.449	S	S	.	.	G	3₁₀ helix	trans	-63.9	-26	175.7	-45.1	-46.4	0	0	0	112.5	T492 L496	T492-D494 PolarHBondContact O-N 3.36Å; T492-D494 VanDerWaalsContact O-N 3.08Å; D494-L496 VanDerWaalsContact C-N 3.35Å
495	S	53.9	Low	61.1	Low	8 Å²	8	83.8 Å²	83.8	6%	0.056	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-75.1	-23	176.7	-55.6	0	0	0	0	113	T492 S493 L497 L498	T492-S495 VanDerWaalsContact O-CB 3.27Å; T492-S495 WeakPolarHBondContact O-CB 3.31Å; T492-S495 PolarHBondContact O-N 3.07Å; T492-S495 PolarHBondContact O-OG 3.19Å; T492-S495 PolarHBondContact OG1-OG 2.7Å; S493-S495 PolarHBondContact O-N 3.02Å; S495-L497 PolarHBondContact O-N 2.67Å; S495-L498 PolarHBondContact O-N 3.31Å
496	L	51.6	Low	61	Low	110 Å²	110	78 Å²	78	58%	0.576	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-68.8	-24.6	177.6	-67.6	168.7	0	0	0	112.3	S493 D494 L498 L499 T500	S493-L496 WeakPolarHBondContact O-CB 3.47Å; S493-L496 PolarHBondContact O-N 3.02Å; D494-L496 VanDerWaalsContact C-N 3.35Å; L496-L498 PolarHBondContact O-N 3.24Å; L496-L499 HydrophobicContact CD2-CD1 4.39Å; L496-L499 CarbonylContact O-C 3.58Å; L496-L499 PolarHBondContact O-N 3.04Å; L496-L499 VanDerWaalsContact O-N 3.08Å; L496-T500 PolarHBondContact O-N 3.18Å
497	L	56.4	Low	61	Low	112 Å²	112	78.8 Å²	78.8	59%	0.586	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-70	-15.6	174.4	-92	164.2	0	0	0	114.2	S495 T500	S495-L497 PolarHBondContact O-N 2.67Å; L497-T500 PolarHBondContact O-OG1 2.99Å
498	L	58.1	Low	61.3	Low	18 Å²	18	74.4 Å²	74.4	9%	0.094	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-17.7	168.6	-83.1	151	0	0	0	112.2	F431 A435 S495 L496 T504	F431-L498 HydrophobicContact CD2-CG 4.19Å; F431-L498 HydrophobicContact CE2-CD2 3.79Å; F431-L498 HydrophobicContact CE2-CG 3.78Å; F431-L498 HydrophobicContact CZ-CD2 3.93Å; F431-L498 HydrophobicContact CZ-CG 4.42Å; A435-L498 HydrophobicContact CB-CD1 4.21Å; A435-L498 HydrophobicContact CB-CD2 3.94Å; S495-L498 PolarHBondContact O-N 3.31Å; L496-L498 PolarHBondContact O-N 3.24Å; L498-T504 WeakPolarHBondContact O-CB 3.28Å; L498-T504 WeakPolarHBondContact O-CG2 3.33Å; L498-T504 PolarHBondContact O-OG1 2.75Å
499	L	55.1	Low	61.7	Low	41 Å²	41	77 Å²	77	22%	0.215	41%	0.409	C	S	.	.	S	Bend	trans	-94.1	5.3	178.3	-75.7	166.6	0	0	0	113.4	L490 L496 S501 K505 L508	L490-L499 HydrophobicContact CD1-CD1 4.39Å; L490-L499 HydrophobicContact CD2-CD1 3.82Å; L496-L499 HydrophobicContact CD2-CD1 4.39Å; L496-L499 CarbonylContact O-C 3.58Å; L496-L499 PolarHBondContact O-N 3.04Å; L496-L499 VanDerWaalsContact O-N 3.08Å; L499-S501 VanDerWaalsContact C-N 3.28Å; L499-S501 PolarHBondContact O-N 3.23Å; L499-K505 HydrophobicContact CD2-CB 3.75Å; L499-K505 HydrophobicContact CD2-CG 4.1Å; L499-L508 HydrophobicContact CD2-CD1 3.8Å
500	T	52.9	Low	62.7	Low	104 Å²	104	78.1 Å²	78.1	64%	0.638	41%	0.412	S	S	*	.	S	Bend	trans	-69.8	-24	173.7	44.6	0	0	0	0	112.9	L496 L497	L496-T500 PolarHBondContact O-N 3.18Å; L497-T500 PolarHBondContact O-OG1 2.99Å
501	S	60.1	Low	63.8	Low	15 Å²	15	74.9 Å²	74.9	11%	0.105	40%	0.395	C	S	.	.	S	Bend	trans	-84	128.9	166.3	26.5	0	0	0	0	111.5	E355 L499 D503 T504 K505	E355-S501 WeakPolarHBondContact OE1-CB 2.83Å; E355-S501 PolarHBondContact OE1-OG 3.42Å; L499-S501 VanDerWaalsContact C-N 3.28Å; L499-S501 PolarHBondContact O-N 3.23Å; S501-D503 PolarHBondContact O-N 2.78Å; S501-T504 PolarHBondContact O-N 2.77Å; S501-T504 PolarHBondContact OG-OG1 2.93Å; S501-K505 PolarHBondContact O-N 2.85Å
502	Y	53.6	Low	65.3	Low	182 Å²	182	70.6 Å²	70.6	71%	0.714	37%	0.372	S	S	*	.	H	α-helix	trans	-54.3	-36.2	173.8	179.9	-94.9	0	0	0	112.4	K505 T506	Y502-K505 PolarHBondContact O-N 2.87Å; Y502-T506 HydrophobicContact CD1-CG2 4.19Å; Y502-T506 HydrophobicContact CE1-CG2 3.83Å; Y502-T506 HydrophobicContact CE2-CG2 4.34Å; Y502-T506 WeakPolarHBondContact O-CG2 3.25Å; Y502-T506 PolarHBondContact O-N 2.88Å; Y502-T506 PolarHBondContact O-OG1 2.58Å
503	D	65.2	Low	66.9	Low	118 Å²	118	70.1 Å²	70.1	63%	0.631	37%	0.374	S	S	*	.	H	α-helix	trans	-67.9	-43.2	-177.9	-55.3	-29.7	0	0	0	111.8	S501 K505 T506 L507	S501-D503 PolarHBondContact O-N 2.78Å; D503-K505 VanDerWaalsContact C-N 3.32Å; D503-K505 PolarHBondContact O-N 3.33Å; D503-T506 WeakPolarHBondContact CA-OG1 3.36Å; D503-T506 PolarHBondContact O-N 2.91Å; D503-T506 PolarHBondContact O-OG1 2.81Å; D503-L507 VanDerWaalsContact O-CB 3.29Å; D503-L507 WeakPolarHBondContact O-CB 3.38Å; D503-L507 PolarHBondContact O-N 2.78Å
504	T	68.8	Low	68.6	Low	28 Å²	28	71.1 Å²	71.1	17%	0.172	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-40.5	177.3	-52.6	0	0	0	0	111.8	L438 L498 S501 L508	L438-T504 HydrophobicContact CD2-CG2 3.63Å; L498-T504 WeakPolarHBondContact O-CB 3.28Å; L498-T504 WeakPolarHBondContact O-CG2 3.33Å; L498-T504 PolarHBondContact O-OG1 2.75Å; S501-T504 PolarHBondContact O-N 2.77Å; S501-T504 PolarHBondContact OG-OG1 2.93Å; T504-L508 PolarHBondContact O-N 2.75Å; T504-L508 VanDerWaalsContact O-N 3.15Å
505	K	70	Confident	70.4	Confident	116 Å²	116	67.8 Å²	67.8	50%	0.504	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-49.9	176.5	-174	-178.8	174.5	-175	0	111.8	L499 S501 Y502 D503 L507 L508 D509	L499-K505 HydrophobicContact CD2-CB 3.75Å; L499-K505 HydrophobicContact CD2-CG 4.1Å; S501-K505 PolarHBondContact O-N 2.85Å; Y502-K505 PolarHBondContact O-N 2.87Å; D503-K505 VanDerWaalsContact C-N 3.32Å; D503-K505 PolarHBondContact O-N 3.33Å; K505-L507 VanDerWaalsContact C-N 3.27Å; K505-L507 PolarHBondContact O-N 2.85Å; K505-L508 WeakPolarHBondContact O-CB 3.47Å; K505-L508 PolarHBondContact O-N 3.47Å; K505-L508 VanDerWaalsContact O-N 3.15Å; K505-D509 PolarHBondContact O-N 2.84Å
506	T	75.4	Confident	72.1	Confident	40 Å²	40	71.7 Å²	71.7	25%	0.245	37%	0.369	C	S	.	.	H	α-helix	trans	-66	-30.1	-178.4	52	0	0	0	0	112.6	Y502 D503 Q510	Y502-T506 HydrophobicContact CD1-CG2 4.19Å; Y502-T506 HydrophobicContact CE1-CG2 3.83Å; Y502-T506 HydrophobicContact CE2-CG2 4.34Å; Y502-T506 WeakPolarHBondContact O-CG2 3.25Å; Y502-T506 PolarHBondContact O-N 2.88Å; Y502-T506 PolarHBondContact O-OG1 2.58Å; D503-T506 WeakPolarHBondContact CA-OG1 3.36Å; D503-T506 PolarHBondContact O-N 2.91Å; D503-T506 PolarHBondContact O-OG1 2.81Å; T506-Q510 VanDerWaalsContact O-CG 3.24Å; T506-Q510 WeakPolarHBondContact O-CG 3.2Å; T506-Q510 PolarHBondContact O-N 2.81Å; T506-Q510 PolarHBondContact O-NE2 2.9Å
507	L	77.5	Confident	73.9	Confident	73 Å²	73	71.1 Å²	71.1	38%	0.382	37%	0.366	S	S	.	.	H	α-helix	trans	-65.5	-44.7	170.5	-178.8	61	0	0	0	112.1	I442 D503 K505 Q510 V511	I442-L507 HydrophobicContact CD1-CD2 3.95Å; I442-L507 HydrophobicContact CD1-CG 4.37Å; D503-L507 VanDerWaalsContact O-CB 3.29Å; D503-L507 WeakPolarHBondContact O-CB 3.38Å; D503-L507 PolarHBondContact O-N 2.78Å; K505-L507 VanDerWaalsContact C-N 3.27Å; K505-L507 PolarHBondContact O-N 2.85Å; L507-Q510 PolarHBondContact O-N 2.89Å; L507-V511 WeakPolarHBondContact O-CG2 3.5Å; L507-V511 PolarHBondContact O-N 2.7Å
508	L	79.5	Confident	75.6	Confident	7 Å²	7	66.2 Å²	66.2	4%	0.037	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-45.2	174.3	-91.8	161.7	0	0	0	112.1	L438 Y441 F488 L499 T504 K505 Q510 V511 N512	L438-L508 HydrophobicContact CD1-CD1 3.83Å; L438-L508 HydrophobicContact CD1-CD2 3.75Å; L438-L508 HydrophobicContact CD1-CG 3.9Å; Y441-L508 HydrophobicContact CD1-CD2 4.27Å; Y441-L508 HydrophobicContact CE1-CD2 4.1Å; F488-L508 HydrophobicContact CD1-CD2 4.39Å; L499-L508 HydrophobicContact CD2-CD1 3.8Å; T504-L508 PolarHBondContact O-N 2.75Å; T504-L508 VanDerWaalsContact O-N 3.15Å; K505-L508 WeakPolarHBondContact O-CB 3.47Å; K505-L508 PolarHBondContact O-N 3.47Å; K505-L508 VanDerWaalsContact O-N 3.15Å; L508-Q510 VanDerWaalsContact C-N 3.33Å; L508-Q510 PolarHBondContact O-N 3.19Å; L508-V511 PolarHBondContact O-N 2.92Å; L508-N512 WeakPolarHBondContact O-CB 3.23Å; L508-N512 VanDerWaalsContact O-CG 3.25Å; L508-N512 PolarHBondContact O-N 2.89Å; L508-N512 PolarHBondContact O-ND2 3.37Å
509	D	80.5	Confident	77.1	Confident	88 Å²	88	67.5 Å²	67.5	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-61.1	-40.4	177.5	-70	-29.4	0	0	0	111.4	K505 N512 A513	K505-D509 PolarHBondContact O-N 2.84Å; D509-N512 PolarHBondContact O-N 3.38Å; D509-A513 WeakPolarHBondContact O-CB 3.32Å; D509-A513 PolarHBondContact O-N 2.72Å
510	Q	84.3	Confident	78.8	Confident	120 Å²	120	69.9 Å²	69.9	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-65.5	-41	174.4	-74.3	171.1	46.9	0	0	113.4	T506 L507 L508 A513 R514	T506-Q510 VanDerWaalsContact O-CG 3.24Å; T506-Q510 WeakPolarHBondContact O-CG 3.2Å; T506-Q510 PolarHBondContact O-N 2.81Å; T506-Q510 PolarHBondContact O-NE2 2.9Å; L507-Q510 PolarHBondContact O-N 2.89Å; L508-Q510 VanDerWaalsContact C-N 3.33Å; L508-Q510 PolarHBondContact O-N 3.19Å; Q510-A513 PolarHBondContact O-N 3.05Å; Q510-R514 WeakPolarHBondContact O-CG 3.41Å; Q510-R514 PolarHBondContact O-N 3.13Å; Q510-R514 VanDerWaalsContact O-N 3.1Å
511	V	85.8	Confident	80.5	Confident	7 Å²	7	69.2 Å²	69.2	4%	0.042	35%	0.348	C	S	.	.	H	α-helix	trans	-65.6	-43.6	176.7	169.6	0	0	0	0	110.6	Y441 I442 A445 L507 L508 R514 L515	Y441-V511 HydrophobicContact CE1-CG1 4.17Å; I442-V511 HydrophobicContact CG2-CG2 4.37Å; A445-V511 HydrophobicContact CB-CG1 3.49Å; A445-V511 VanDerWaalsContact CB-CG1 3.49Å; L507-V511 WeakPolarHBondContact O-CG2 3.5Å; L507-V511 PolarHBondContact O-N 2.7Å; L508-V511 PolarHBondContact O-N 2.92Å; V511-R514 PolarHBondContact O-N 3.29Å; V511-L515 HydrophobicContact CG1-CD1 4.4Å; V511-L515 WeakPolarHBondContact O-CG 3.38Å; V511-L515 PolarHBondContact O-N 3.18Å
512	N	86.5	Confident	81.9	Confident	59 Å²	59	68.5 Å²	68.5	32%	0.316	34%	0.343	S	S	.	.	H	α-helix	trans	-67.1	-35.4	178.3	-68.7	-27.6	0	0	0	112.6	Y441 L508 D509 T516	Y441-N512 PolarHBondContact OH-OD1 2.8Å; L508-N512 WeakPolarHBondContact O-CB 3.23Å; L508-N512 VanDerWaalsContact O-CG 3.25Å; L508-N512 PolarHBondContact O-N 2.89Å; L508-N512 PolarHBondContact O-ND2 3.37Å; D509-N512 PolarHBondContact O-N 3.38Å; N512-T516 PolarHBondContact O-N 3.32Å; N512-T516 VanDerWaalsContact O-N 3.1Å; N512-T516 PolarHBondContact O-OG1 3.42Å
513	A	86.3	Confident	83.7	Confident	48 Å²	48	64.6 Å²	64.6	40%	0.397	33%	0.331	S	S	.	.	H	α-helix	trans	-61	-50.6	170.9	0	0	0	0	0	111.3	D509 Q510 L515 T516 D517	D509-A513 WeakPolarHBondContact O-CB 3.32Å; D509-A513 PolarHBondContact O-N 2.72Å; Q510-A513 PolarHBondContact O-N 3.05Å; A513-L515 PolarHBondContact O-N 2.76Å; A513-T516 CarbonylContact O-C 3.55Å; A513-T516 WeakPolarHBondContact O-CA 3.23Å; A513-T516 WeakPolarHBondContact O-CB 3.43Å; A513-T516 PolarHBondContact O-N 3.09Å; A513-D517 PolarHBondContact O-N 3.04Å
514	R	87.7	Confident	84.8	Confident	120 Å²	120	63 Å²	63	45%	0.453	32%	0.323	S	S	.	.	H	α-helix	trans	-62.1	-38	179.4	-71.4	175.8	65.9	-146.6	-4.9	113.2	N446 Q510 V511 T516 D517 V518	N446-R514 PolarHBondContact OD1-NH1 3.34Å; Q510-R514 WeakPolarHBondContact O-CG 3.41Å; Q510-R514 PolarHBondContact O-N 3.13Å; Q510-R514 VanDerWaalsContact O-N 3.1Å; V511-R514 PolarHBondContact O-N 3.29Å; R514-T516 VanDerWaalsContact C-N 3.3Å; R514-T516 PolarHBondContact O-N 3.48Å; R514-D517 PolarHBondContact O-N 3.4Å; R514-V518 WeakPolarHBondContact O-CG2 3.41Å; R514-V518 PolarHBondContact O-N 3.17Å
515	L	89.5	Confident	85.7	Confident	10 Å²	10	64 Å²	64	5%	0.052	32%	0.323	C	S	.	.	H	α-helix	trans	-58.9	-43	170.8	-75.9	171.9	0	0	0	111.4	Y441 A445 W448 M486 V511 A513 K519	Y441-L515 VanDerWaalsContact OH-CD1 3.22Å; Y441-L515 WeakPolarHBondContact OH-CD1 3.49Å; A445-L515 HydrophobicContact CB-CD1 3.95Å; A445-L515 HydrophobicContact CB-CD2 4.09Å; A445-L515 HydrophobicContact CB-CG 4.21Å; W448-L515 HydrophobicContact CD2-CD2 4.31Å; W448-L515 HydrophobicContact CE3-CD2 3.55Å; W448-L515 HydrophobicContact CZ3-CD2 4.06Å; M486-L515 HydrophobicContact CB-CD2 4.36Å; V511-L515 HydrophobicContact CG1-CD1 4.4Å; V511-L515 WeakPolarHBondContact O-CG 3.38Å; V511-L515 PolarHBondContact O-N 3.18Å; A513-L515 PolarHBondContact O-N 2.76Å; L515-K519 WeakPolarHBondContact O-CB 3.49Å; L515-K519 WeakPolarHBondContact O-CG 3.27Å; L515-K519 PolarHBondContact O-N 3.47Å
516	T	88.5	Confident	86.5	Confident	90 Å²	90	59.1 Å²	59.1	55%	0.552	30%	0.303	S	S	*	.	H	α-helix	trans	-66.7	-44.9	179.6	-55.7	0	0	0	0	111.6	N512 A513 R514 K519 Q520	N512-T516 PolarHBondContact O-N 3.32Å; N512-T516 VanDerWaalsContact O-N 3.1Å; N512-T516 PolarHBondContact O-OG1 3.42Å; A513-T516 CarbonylContact O-C 3.55Å; A513-T516 WeakPolarHBondContact O-CA 3.23Å; A513-T516 WeakPolarHBondContact O-CB 3.43Å; A513-T516 PolarHBondContact O-N 3.09Å; R514-T516 VanDerWaalsContact C-N 3.3Å; R514-T516 PolarHBondContact O-N 3.48Å; T516-K519 PolarHBondContact O-N 3.3Å; T516-Q520 WeakPolarHBondContact O-CB 3.35Å; T516-Q520 PolarHBondContact O-N 2.87Å
517	D	90.7	Very high	87.1	Confident	97 Å²	97	64.1 Å²	64.1	52%	0.519	32%	0.322	S	S	.	.	H	α-helix	trans	-60.3	-48	177.3	-68.2	-32.6	0	0	0	111.8	A513 R514 Q520 L521	A513-D517 PolarHBondContact O-N 3.04Å; R514-D517 PolarHBondContact O-N 3.4Å; D517-Q520 PolarHBondContact O-N 3.49Å; D517-L521 VanDerWaalsContact O-CG 3.31Å; D517-L521 WeakPolarHBondContact O-CG 3.18Å; D517-L521 PolarHBondContact O-N 3.47Å
518	V	91.3	Very high	87.5	Confident	9 Å²	9	65.2 Å²	65.2	6%	0.055	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-40.8	178.4	173.7	0	0	0	0	111	W448 C449 V453 F479 R514 Q520 L521 C522	W448-V518 HydrophobicContact CE3-CG1 4.26Å; W448-V518 HydrophobicContact CH2-CG1 4Å; W448-V518 HydrophobicContact CZ3-CB 3.89Å; W448-V518 HydrophobicContact CZ3-CG1 3.56Å; C449-V518 HydrophobicContact CB-CG2 4.28Å; V453-V518 HydrophobicContact CG2-CG2 4.16Å; F479-V518 HydrophobicContact CE1-CG1 4.19Å; F479-V518 HydrophobicContact CZ-CG1 4.45Å; R514-V518 WeakPolarHBondContact O-CG2 3.41Å; R514-V518 PolarHBondContact O-N 3.17Å; V518-Q520 PolarHBondContact O-N 2.93Å; V518-L521 PolarHBondContact O-N 2.93Å; V518-C522 WeakPolarHBondContact O-CB 3.46Å; V518-C522 PolarHBondContact O-N 3.27Å; V518-C522 PolarHBondContact O-SG 3.42Å; V518-C522 VanDerWaalsContact O-SG 3.35Å
519	K	89.9	Confident	87.7	Confident	45 Å²	45	65 Å²	65	20%	0.196	32%	0.322	C	S	.	.	H	α-helix	trans	-57.1	-47.6	170.8	-79.4	-171.4	-179.6	-158.2	0	111.5	W448 G483 D484 L515 T516 L521 C522 Q523	W448-K519 HydrophobicContact CH2-CG 3.58Å; W448-K519 HydrophobicContact CZ2-CG 4.46Å; W448-K519 HydrophobicContact CZ3-CG 4.18Å; G483-K519 VanDerWaalsContact C-CE 3.48Å; G483-K519 VanDerWaalsContact C-NZ 3.26Å; G483-K519 WeakPolarHBondContact O-CE 3.19Å; G483-K519 PolarHBondContact O-NZ 3.17Å; D484-K519 IonicContact OD1-NZ 2.91Å; D484-K519 PolarHBondContact OD1-NZ 3.03Å; L515-K519 WeakPolarHBondContact O-CB 3.49Å; L515-K519 WeakPolarHBondContact O-CG 3.27Å; L515-K519 PolarHBondContact O-N 3.47Å; T516-K519 PolarHBondContact O-N 3.3Å; K519-L521 PolarHBondContact O-N 3.44Å; K519-C522 PolarHBondContact O-N 3.33Å; K519-Q523 WeakPolarHBondContact O-CG 3.47Å; K519-Q523 PolarHBondContact O-N 3.44Å
520	Q	90.3	Very high	88	Confident	92 Å²	92	66.6 Å²	66.6	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-64.1	-41.7	-179.5	-172.8	60.8	58.7	0	0	112.1	T516 D517 V518 Q523 N524	T516-Q520 WeakPolarHBondContact O-CB 3.35Å; T516-Q520 PolarHBondContact O-N 2.87Å; D517-Q520 PolarHBondContact O-N 3.49Å; V518-Q520 PolarHBondContact O-N 2.93Å; Q520-Q523 PolarHBondContact O-N 2.94Å; Q520-N524 PolarHBondContact NE2-OD1 3.46Å; Q520-N524 WeakPolarHBondContact O-CB 3.43Å; Q520-N524 PolarHBondContact O-N 3.13Å; Q520-N524 PolarHBondContact O-ND2 3.24Å; Q520-N524 PolarHBondContact O-OD1 3.36Å
521	L	90.1	Very high	87.9	Confident	89 Å²	89	68.1 Å²	68.1	47%	0.466	33%	0.326	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.4	-69.7	168.9	0	0	0	111.7	L456 D517 V518 K519 N524 R525	L456-L521 HydrophobicContact CD1-CB 3.49Å; L456-L521 VanDerWaalsContact CD1-CB 3.49Å; L456-L521 HydrophobicContact CD1-CD1 4.17Å; L456-L521 HydrophobicContact CD1-CG 4.46Å; L456-L521 HydrophobicContact CD2-CB 4.19Å; D517-L521 VanDerWaalsContact O-CG 3.31Å; D517-L521 WeakPolarHBondContact O-CG 3.18Å; D517-L521 PolarHBondContact O-N 3.47Å; V518-L521 PolarHBondContact O-N 2.93Å; K519-L521 PolarHBondContact O-N 3.44Å; L521-N524 PolarHBondContact O-N 2.99Å; L521-R525 WeakPolarHBondContact O-CB 3.47Å; L521-R525 PolarHBondContact O-N 2.98Å
522	C	89.3	Confident	87.7	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.9	-35.5	174.3	-70	0	0	0	0	113	V476 L480 V518 K519 R525 C526	V476-C522 HydrophobicContact CG1-CB 3.79Å; V476-C522 VanDerWaalsContact CG1-O 3.31Å; V476-C522 WeakPolarHBondContact CG1-O 3.4Å; L480-C522 HydrophobicContact CD1-CB 4.23Å; L480-C522 HydrophobicContact CD2-CB 3.64Å; L480-C522 HydrophobicContact CG-CB 3.84Å; V518-C522 WeakPolarHBondContact O-CB 3.46Å; V518-C522 PolarHBondContact O-N 3.27Å; V518-C522 PolarHBondContact O-SG 3.42Å; V518-C522 VanDerWaalsContact O-SG 3.35Å; K519-C522 PolarHBondContact O-N 3.33Å; C522-R525 PolarHBondContact O-N 2.97Å; C522-C526 PolarHBondContact O-N 3.49Å; C522-C526 PolarHBondContact O-SG 3.3Å; C522-C526 VanDerWaalsContact O-SG 3.38Å
523	Q	90.2	Very high	87.4	Confident	101 Å²	101	67.4 Å²	67.4	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-66.8	-44	172.2	-71.6	178.4	23.2	0	0	111.9	L480 K519 Q520 R525 C526 F527	L480-Q523 HydrophobicContact CD1-CG 4.18Å; L480-Q523 HydrophobicContact CD2-CG 4.13Å; K519-Q523 WeakPolarHBondContact O-CG 3.47Å; K519-Q523 PolarHBondContact O-N 3.44Å; Q520-Q523 PolarHBondContact O-N 2.94Å; Q523-R525 VanDerWaalsContact C-N 3.31Å; Q523-R525 PolarHBondContact O-N 3.42Å; Q523-C526 WeakPolarHBondContact O-CB 3.4Å; Q523-C526 PolarHBondContact O-N 2.89Å; Q523-C526 VanDerWaalsContact O-N 3.13Å; Q523-F527 PolarHBondContact O-N 3.02Å
524	N	88.8	Confident	86.9	Confident	85 Å²	85	68.2 Å²	68.2	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-59.4	-42.5	174.5	-68.2	-10.1	0	0	0	110.9	Q520 L521 F527 F528	Q520-N524 PolarHBondContact NE2-OD1 3.46Å; Q520-N524 WeakPolarHBondContact O-CB 3.43Å; Q520-N524 PolarHBondContact O-N 3.13Å; Q520-N524 PolarHBondContact O-ND2 3.24Å; Q520-N524 PolarHBondContact O-OD1 3.36Å; L521-N524 PolarHBondContact O-N 2.99Å; N524-F527 PolarHBondContact O-N 3.32Å; N524-F528 WeakPolarHBondContact O-CB 3.45Å; N524-F528 PolarHBondContact O-N 2.96Å
525	R	87	Confident	85.9	Confident	49 Å²	49	68.9 Å²	68.9	19%	0.185	33%	0.33	C	S	.	.	H	α-helix	trans	-64.1	-39.8	174.1	-167.4	67.3	178.4	172.2	2.2	111.9	L456 A459 V476 L521 C522 Q523 F528 L529	L456-R525 HydrophobicContact CD2-CB 3.83Å; L456-R525 HydrophobicContact CD2-CG 4.2Å; A459-R525 PolarHBondContact O-NH2 2.99Å; V476-R525 HydrophobicContact CG2-CG 4.34Å; L521-R525 WeakPolarHBondContact O-CB 3.47Å; L521-R525 PolarHBondContact O-N 2.98Å; C522-R525 PolarHBondContact O-N 2.97Å; Q523-R525 VanDerWaalsContact C-N 3.31Å; Q523-R525 PolarHBondContact O-N 3.42Å; R525-F528 PolarHBondContact O-N 2.96Å; R525-L529 HydrophobicContact CG-CD1 4.06Å; R525-L529 WeakPolarHBondContact O-CB 3.47Å; R525-L529 VanDerWaalsContact O-CG 3.24Å; R525-L529 WeakPolarHBondContact O-CG 3.37Å; R525-L529 PolarHBondContact O-N 3.17Å
526	C	88.5	Confident	84.6	Confident	13 Å²	13	71.4 Å²	71.4	9%	0.088	35%	0.346	C	S	.	.	H	α-helix	trans	-61.6	-40.8	172.3	-78.9	0	0	0	0	113	L473 V476 C522 Q523 K530	L473-C526 HydrophobicContact CD1-CB 3.96Å; V476-C526 WeakPolarHBondContact CG1-SG 3.32Å; C522-C526 PolarHBondContact O-N 3.49Å; C522-C526 PolarHBondContact O-SG 3.3Å; C522-C526 VanDerWaalsContact O-SG 3.38Å; Q523-C526 WeakPolarHBondContact O-CB 3.4Å; Q523-C526 PolarHBondContact O-N 2.89Å; Q523-C526 VanDerWaalsContact O-N 3.13Å; C526-K530 WeakPolarHBondContact O-CB 3.35Å; C526-K530 VanDerWaalsContact O-CG 3.32Å; C526-K530 WeakPolarHBondContact O-CG 3.44Å; C526-K530 PolarHBondContact O-N 3.34Å
527	F	86.5	Confident	83.3	Confident	145 Å²	145	75.3 Å²	75.3	64%	0.636	35%	0.351	S	S	*	.	H	α-helix	trans	-65.9	-45.1	175.7	-179.7	-95.7	0	0	0	111.6	Q523 N524 L529 K530 R531	Q523-F527 PolarHBondContact O-N 3.02Å; N524-F527 PolarHBondContact O-N 3.32Å; F527-L529 PolarHBondContact O-N 2.86Å; F527-K530 PolarHBondContact O-N 3.2Å; F527-R531 WeakPolarHBondContact O-CB 3.25Å; F527-R531 PolarHBondContact O-N 3.11Å
528	F	85.8	Confident	81.5	Confident	96 Å²	96	75.3 Å²	75.3	42%	0.421	36%	0.358	S	S	.	.	H	α-helix	trans	-56.3	-49.7	174.4	178.2	-94.2	0	0	0	111.8	N524 R525 R531 L532	N524-F528 WeakPolarHBondContact O-CB 3.45Å; N524-F528 PolarHBondContact O-N 2.96Å; R525-F528 PolarHBondContact O-N 2.96Å; F528-R531 CarbonylContact O-C 3.6Å; F528-R531 PolarHBondContact O-N 3.41Å; F528-L532 HydrophobicContact CD1-CD1 4.42Å; F528-L532 HydrophobicContact CE1-CD1 3.58Å; F528-L532 HydrophobicContact CZ-CD1 3.8Å; F528-L532 WeakPolarHBondContact O-CB 3.3Å; F528-L532 PolarHBondContact O-N 3.32Å
529	L	85.2	Confident	79.5	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-67	-38.4	-179.9	-67.3	168.1	0	0	0	112.6	F463 A472 L473 V476 R525 F527 R531 L532 L533	F463-L529 HydrophobicContact CD2-CD2 4.23Å; F463-L529 HydrophobicContact CE1-CD2 4.41Å; F463-L529 HydrophobicContact CE2-CD2 3.4Å; F463-L529 HydrophobicContact CZ-CD2 3.51Å; A472-L529 HydrophobicContact CB-CD1 4.28Å; A472-L529 HydrophobicContact CB-CD2 4.43Å; L473-L529 HydrophobicContact CB-CB 4.02Å; L473-L529 HydrophobicContact CB-CD1 4.21Å; L473-L529 HydrophobicContact CD1-CB 4.12Å; L473-L529 HydrophobicContact CG-CB 4.43Å; V476-L529 HydrophobicContact CG2-CD1 4.34Å; R525-L529 HydrophobicContact CG-CD1 4.06Å; R525-L529 WeakPolarHBondContact O-CB 3.47Å; R525-L529 VanDerWaalsContact O-CG 3.24Å; R525-L529 WeakPolarHBondContact O-CG 3.37Å; R525-L529 PolarHBondContact O-N 3.17Å; F527-L529 PolarHBondContact O-N 2.86Å; L529-R531 VanDerWaalsContact C-N 3.33Å; L529-R531 PolarHBondContact O-N 2.85Å; L529-L532 PolarHBondContact O-N 3.11Å; L529-L533 WeakPolarHBondContact O-CB 3.42Å; L529-L533 PolarHBondContact O-N 3.26Å
530	K	85.1	Confident	77.1	Confident	122 Å²	122	81.7 Å²	81.7	53%	0.53	42%	0.415	S	S	.	.	H	α-helix	trans	-57.3	-45.7	170	-78.4	175.7	178	-179.6	0	111.6	L473 C526 F527 L532 L533 S534	L473-K530 HydrophobicContact CD1-CG 4.44Å; L473-K530 HydrophobicContact CD2-CG 3.89Å; C526-K530 WeakPolarHBondContact O-CB 3.35Å; C526-K530 VanDerWaalsContact O-CG 3.32Å; C526-K530 WeakPolarHBondContact O-CG 3.44Å; C526-K530 PolarHBondContact O-N 3.34Å; F527-K530 PolarHBondContact O-N 3.2Å; K530-L532 VanDerWaalsContact C-N 3.33Å; K530-L533 PolarHBondContact O-N 3.14Å; K530-S534 PolarHBondContact O-N 3.12Å; K530-S534 PolarHBondContact O-OG 2.87Å
531	R	83.1	Confident	74.6	Confident	152 Å²	152	85.2 Å²	85.2	57%	0.574	43%	0.432	S	S	*	.	H	α-helix	trans	-68.6	-29.9	178.3	172.5	171.5	144.5	152.5	-7.1	112.6	F527 F528 L529 S534 K535	F527-R531 WeakPolarHBondContact O-CB 3.25Å; F527-R531 PolarHBondContact O-N 3.11Å; F528-R531 CarbonylContact O-C 3.6Å; F528-R531 PolarHBondContact O-N 3.41Å; L529-R531 VanDerWaalsContact C-N 3.33Å; L529-R531 PolarHBondContact O-N 2.85Å; R531-S534 WeakPolarHBondContact CA-OG 3.41Å; R531-S534 PolarHBondContact O-OG 2.93Å; R531-K535 WeakPolarHBondContact O-CG 3.2Å; R531-K535 PolarHBondContact O-N 3.22Å; R531-K535 VanDerWaalsContact O-N 3.12Å
532	L	80.9	Confident	72	Confident	41 Å²	41	85.9 Å²	85.9	22%	0.215	44%	0.444	C	S	.	.	H	α-helix	trans	-75	-41.1	175.5	-154.4	151.5	0	0	0	110.9	F463 F528 L529 K530 K535 T536	F463-L532 HydrophobicContact CB-CD2 4.35Å; F463-L532 HydrophobicContact CD2-CD1 4.06Å; F463-L532 HydrophobicContact CD2-CD2 4.2Å; F528-L532 HydrophobicContact CD1-CD1 4.42Å; F528-L532 HydrophobicContact CE1-CD1 3.58Å; F528-L532 HydrophobicContact CZ-CD1 3.8Å; F528-L532 WeakPolarHBondContact O-CB 3.3Å; F528-L532 PolarHBondContact O-N 3.32Å; L529-L532 PolarHBondContact O-N 3.11Å; K530-L532 VanDerWaalsContact C-N 3.33Å; L532-K535 CarbonylContact O-C 3.53Å; L532-K535 WeakPolarHBondContact O-CA 3.29Å; L532-K535 WeakPolarHBondContact O-CB 3.17Å; L532-K535 PolarHBondContact O-N 3.47Å; L532-K535 VanDerWaalsContact O-N 3.13Å; L532-T536 HydrophobicContact CD2-CG2 3.97Å; L532-T536 PolarHBondContact O-N 2.97Å; L532-T536 PolarHBondContact O-OG1 3.09Å
533	L	81.5	Confident	69.4	Low	11 Å²	11	96.5 Å²	96.5	6%	0.058	49%	0.485	C	S	.	.	H	α-helix	trans	-60.6	-43.7	169.8	-81.4	160.5	0	0	0	113.1	A466 C469 E470 L473 L529 K530 K535 T536 R537	A466-L533 HydrophobicContact CB-CD2 4.28Å; A466-L533 WeakPolarHBondContact O-CD2 3.34Å; C469-L533 HydrophobicContact CB-CD2 4.04Å; C469-L533 HydrophobicContact CB-CG 4.07Å; E470-L533 HydrophobicContact CB-CD1 4.45Å; E470-L533 HydrophobicContact CB-CD2 4.16Å; L473-L533 HydrophobicContact CB-CD1 4.45Å; L473-L533 HydrophobicContact CD2-CD1 3.48Å; L473-L533 VanDerWaalsContact CD2-CD1 3.48Å; L529-L533 WeakPolarHBondContact O-CB 3.42Å; L529-L533 PolarHBondContact O-N 3.26Å; K530-L533 PolarHBondContact O-N 3.14Å; L533-K535 PolarHBondContact O-N 2.96Å; L533-T536 PolarHBondContact O-N 3.1Å; L533-T536 PolarHBondContact O-OG1 3.41Å; L533-R537 WeakPolarHBondContact O-CB 3.45Å; L533-R537 WeakPolarHBondContact O-CG 3.43Å; L533-R537 PolarHBondContact O-N 2.71Å
534	S	74.4	Confident	66.9	Low	64 Å²	64	96.7 Å²	96.7	45%	0.448	50%	0.498	S	S	.	.	H	α-helix	trans	-64.2	-32.1	174.4	60.2	0	0	0	0	111.8	K530 R531 S538	K530-S534 PolarHBondContact O-N 3.12Å; K530-S534 PolarHBondContact O-OG 2.87Å; R531-S534 WeakPolarHBondContact CA-OG 3.41Å; R531-S534 PolarHBondContact O-OG 2.93Å; S534-S538 VanDerWaalsContact O-CB 3.29Å; S534-S538 WeakPolarHBondContact O-CB 3.39Å; S534-S538 PolarHBondContact O-N 3.12Å; S534-S538 PolarHBondContact O-OG 2.69Å
535	K	67.6	Low	64.5	Low	134 Å²	134	97.4 Å²	97.4	58%	0.583	51%	0.507	S	S	*	.	H	α-helix	trans	-69.9	-51.7	172.1	-82.4	-167	168.6	-154.8	0	112.2	R531 L532 L533 R537 S538 S539	R531-K535 WeakPolarHBondContact O-CG 3.2Å; R531-K535 PolarHBondContact O-N 3.22Å; R531-K535 VanDerWaalsContact O-N 3.12Å; L532-K535 CarbonylContact O-C 3.53Å; L532-K535 WeakPolarHBondContact O-CA 3.29Å; L532-K535 WeakPolarHBondContact O-CB 3.17Å; L532-K535 PolarHBondContact O-N 3.47Å; L532-K535 VanDerWaalsContact O-N 3.13Å; L533-K535 PolarHBondContact O-N 2.96Å; K535-R537 VanDerWaalsContact C-N 3.26Å; K535-R537 PolarHBondContact O-N 3.45Å; K535-S538 CarbonylContact O-C 3.57Å; K535-S538 PolarHBondContact O-N 3.36Å; K535-S539 WeakPolarHBondContact O-CA 3.37Å; K535-S539 WeakPolarHBondContact O-CB 3.44Å; K535-S539 PolarHBondContact O-N 3.14Å
536	T	61.8	Low	62	Low	63 Å²	63	103.7 Å²	103.7	39%	0.387	54%	0.536	S	S	.	.	H	α-helix	trans	-64.7	-29.1	-178.7	50.9	0	0	0	0	112.9	L532 L533	L532-T536 HydrophobicContact CD2-CG2 3.97Å; L532-T536 PolarHBondContact O-N 2.97Å; L532-T536 PolarHBondContact O-OG1 3.09Å; L533-T536 PolarHBondContact O-N 3.1Å; L533-T536 PolarHBondContact O-OG1 3.41Å
537	R	61.3	Low	59.5	Low	173 Å²	173	108.6 Å²	108.6	65%	0.653	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	-12.2	171.2	-65.7	-176.7	-175.7	-160.7	5.7	114.9	E470 L533 K535	E470-R537 IonicContact OE1-NH2 3.69Å; E470-R537 IonicContact OE2-CZ 3.77Å; E470-R537 IonicContact OE2-NH2 2.66Å; E470-R537 PolarHBondContact OE2-NH2 2.96Å; L533-R537 WeakPolarHBondContact O-CB 3.45Å; L533-R537 WeakPolarHBondContact O-CG 3.43Å; L533-R537 PolarHBondContact O-N 2.71Å; K535-R537 VanDerWaalsContact C-N 3.26Å; K535-R537 PolarHBondContact O-N 3.45Å
538	S	53	Low	57	Low	96 Å²	96	111.1 Å²	111.1	67%	0.671	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	-18.9	-178.8	-48.8	0	0	0	0	114	S534 K535 A540	S534-S538 VanDerWaalsContact O-CB 3.29Å; S534-S538 WeakPolarHBondContact O-CB 3.39Å; S534-S538 PolarHBondContact O-N 3.12Å; S534-S538 PolarHBondContact O-OG 2.69Å; K535-S538 CarbonylContact O-C 3.57Å; K535-S538 PolarHBondContact O-N 3.36Å; S538-A540 PolarHBondContact O-N 3.28Å
539	S	48.5	Very low	54.6	Low	90 Å²	90	111.9 Å²	111.9	63%	0.629	60%	0.597	S	S	*	*			trans	-85.9	48.8	-169.9	-172.3	0	0	0	0	113	K535 Q541	K535-S539 WeakPolarHBondContact O-CA 3.37Å; K535-S539 WeakPolarHBondContact O-CB 3.44Å; K535-S539 PolarHBondContact O-N 3.14Å; S539-Q541 PolarHBondContact O-N 3.03Å
540	A	39.4	Very low	52.3	Low	99 Å²	99	121.1 Å²	121.1	82%	0.818	64%	0.64	S	S	*	*			trans	-78.1	1.4	169.4	0	0	0	0	0	113	S538	S538-A540 PolarHBondContact O-N 3.28Å
541	Q	38.7	Very low	49.9	Very low	166 Å²	166	126.8 Å²	126.8	78%	0.776	66%	0.658	S	S	*	*	S	Bend	trans	-138.7	110.8	-173.8	-67.9	-177.5	-24	0	0	113.2	S539	S539-Q541 PolarHBondContact O-N 3.03Å
542	S	34.6	Very low	47.6	Very low	102 Å²	102	127.7 Å²	127.7	71%	0.713	67%	0.672	S	S	*	*			trans	53.4	105.6	147.7	60.5	0	0	0	0	123.5
543	Y	36.1	Very low	45.3	Very low	223 Å²	223	129 Å²	129	88%	0.875	70%	0.696	S	S	*	*				68.1	119.8	118.9	-74.5	-71.8	0	0	0	125.5
544	S	36.7	Very low	43.1	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	74%	0.739	S	S	*	*				88.1	154.6	126.5	-77.1	0	0	0	0	123.4
545	P	39.6	Very low	41	Very low	99 Å²	99	140.8 Å²	140.8	64%	0.643	76%	0.755	S	S	*	*			trans	-138.8	-137.8	-140.2	45.9	-25.1	0	0	0	115.5
546	F	34.3	Very low	39.4	Very low	182 Å²	182	142.8 Å²	142.8	80%	0.798	77%	0.771	S	S	*	*			trans	86.5	150.7	179.4	-60.4	-72.2	0	0	0	116.9
547	T	34.9	Very low	37.9	Very low	116 Å²	116	145.3 Å²	145.3	71%	0.712	79%	0.791	S	S	*	*			cis	-173.2	150.1	-48.8	22	0	0	0	0	108.6
548	E	35.5	Very low	36.4	Very low	197 Å²	197	140.4 Å²	140.4	92%	0.921	79%	0.794	S	S	*	*			trans	174.6	-178.2	132.7	-97.7	179.9	154.5	0	0	113.9
549	S	34.7	Very low	35.3	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	80%	0.8	S	S	*	*			trans	-131.3	171.9	-157.2	-55.7	0	0	0	0	114.9
550	E	36.5	Very low	34.5	Very low	195 Å²	195	148.4 Å²	148.4	91%	0.911	81%	0.812	S	S	*	*				176.9	-174.6	115	-89.8	-162	150	0	0	113.8
551	R	34.1	Very low	34.3	Very low	241 Å²	241	149.6 Å²	149.6	91%	0.909	81%	0.809	S	S	*	*			trans	-143.7	171.4	-160.9	-65	-179.2	174.9	-178.5	-0.7	114.9
552	I	36.1	Very low	34.6	Very low	170 Å²	170	147.2 Å²	147.2	87%	0.872	81%	0.808	S	S	*	*			trans	136.3	137.3	148.3	-74.5	159.4	0	0	0	112
553	G	32.9	Very low	34.8	Very low	69 Å²	69	147.3 Å²	147.3	71%	0.711	81%	0.806	S	S	*	*			cis	121.9	89.9	-24.9	0	0	0	0	0	118.6
554	M	33.9	Very low	34.8	Very low	194 Å²	194	141.6 Å²	141.6	96%	0.956	80%	0.799	S	S	*	*			trans	-158.6	167	165.3	-114.7	177.7	-178	0	0	114.6
555	T	30.7	Very low	34.6	Very low	128 Å²	128	146.1 Å²	146.1	79%	0.785	81%	0.805	S	S	*	*			trans	-145.7	170.5	-165.6	49.1	0	0	0	0	113.6
556	L	33.7	Very low	34.2	Very low	177 Å²	177	144.9 Å²	144.9	93%	0.927	81%	0.811	S	S	*	*				179.8	179.3	127.6	-95.2	167.5	0	0	0	113.9
557	S	30.1	Very low	34.1	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	81%	0.813	S	S	*	*			trans	-143.4	170.8	-161.4	-175.4	0	0	0	0	114.3
558	G	31.6	Very low	33.9	Very low	70 Å²	70	146.4 Å²	146.4	72%	0.722	81%	0.814	S	S	*	*			trans	-167.2	146.2	172.4	0	0	0	0	0	114.5
559	T	30	Very low	33.6	Very low	127 Å²	127	143.4 Å²	143.4	78%	0.779	81%	0.809	S	S	*	*			trans	-149.1	150	-167.1	51.6	0	0	0	0	114.3
560	Y	31	Very low	33.3	Very low	227 Å²	227	143.4 Å²	143.4	89%	0.89	81%	0.809	S	S	*	*			trans	-160.6	154.6	158.4	-134.3	-90.8	0	0	0	114.1
561	V	34.4	Very low	32.9	Very low	124 Å²	124	138.6 Å²	138.6	75%	0.752	80%	0.798	S	S	*	*			trans	-147.7	-167	-173.8	-132.9	0	0	0	0	113.4
562	P	45.2	Very low	32.8	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	79%	0.791	S	S	*	*			trans	-111.8	-130.1	-142.4	41.8	-18	0	0	0	113.1
563	P	39.8	Very low	32.4	Very low	104 Å²	104	129.7 Å²	129.7	68%	0.675	79%	0.787	S	S	*	*			cis	-139.9	174.9	6.3	45.4	-26.1	0	0	0	119.7
564	S	34.6	Very low	32.5	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	79%	0.785	S	S	*	*			trans	77.9	167.1	148.8	78.4	0	0	0	0	120.4
565	K	33	Very low	32.3	Very low	201 Å²	201	130.9 Å²	130.9	87%	0.874	78%	0.781	S	S	*	*			cis	-168.7	150.6	20.7	-147.6	167.4	-169.2	175.2	0	115.3
566	G	31.5	Very low	32.2	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	77%	0.772	S	S	*	*			trans	82.4	163.2	155.6	0	0	0	0	0	119.5
567	M	31.5	Very low	31.9	Very low	171 Å²	171	124.8 Å²	124.8	84%	0.842	76%	0.762	S	S	*	*			cis	-161.6	167.3	-14.4	-167	50.5	139	0	0	112.2
568	Q	30.8	Very low	31.7	Very low	158 Å²	158	125.8 Å²	125.8	74%	0.738	76%	0.759	S	S	*	*			trans	-66.6	172.3	-172.3	-55.6	165.6	8.5	0	0	115.4
569	T	28.9	Very low	31.5	Very low	134 Å²	134	128.4 Å²	128.4	82%	0.822	76%	0.761	S	S	*	*				-163.5	-172.8	62.5	47.2	0	0	0	0	116.5
570	S	28.6	Very low	31.4	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	75%	0.752	S	S	*	*			trans	-85.6	-173.5	-168	56.5	0	0	0	0	115.4
571	S	29.7	Very low	31.2	Very low	95 Å²	95	123.6 Å²	123.6	66%	0.664	75%	0.747	S	S	*	*			cis	-168.7	169.6	24.5	61.4	0	0	0	0	116.2
572	S	30.4	Very low	30.9	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	75%	0.747	S	S	*	*			trans	77.7	152.5	146.8	67.4	0	0	0	0	123.4
573	S	27.7	Very low	30	Very low	113 Å²	113	127 Å²	127	79%	0.79	75%	0.75	S	S	*	*			trans	-138.9	-163.7	-177.5	-35	0	0	0	0	108.3
574	P	36	Very low	29.5	Very low	103 Å²	103	126.1 Å²	126.1	67%	0.669	75%	0.751	S	S	*	*			cis	-132.5	-163.1	-28.2	40.5	-22.2	0	0	0	113.1
575	Q	29.2	Very low	29.2	Very low	185 Å²	185	129 Å²	129	86%	0.864	76%	0.757	S	S	*	*			trans	68.6	156.3	159.6	-73.4	178.8	-74.8	0	0	118.4
576	A	27.9	Very low	29.1	Very low	72 Å²	72	125 Å²	125	60%	0.595	75%	0.752	S	S	*	*			cis	-166.5	171.6	-18.6	0	0	0	0	0	109.6
577	S	27.5	Very low	29	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	76%	0.758	S	S	*	*			trans	53.6	149.8	150.3	53.2	0	0	0	0	120.2
578	D	25.9	Very low	28.7	Very low	137 Å²	137	127.8 Å²	127.8	73%	0.733	76%	0.756	S	S	*	*			cis	-165.9	169	-0.4	-123.9	-40.9	0	0	0	110.1
579	T	27.1	Very low	28.7	Very low	124 Å²	124	127.3 Å²	127.3	76%	0.761	76%	0.757	S	S	*	*			trans	58.2	168.3	155.5	52.5	0	0	0	0	120.2
580	S	28.1	Very low	28.6	Very low	84 Å²	84	125.4 Å²	125.4	59%	0.587	75%	0.754	S	S	*	*			cis	-167.2	164.4	-47.7	55.7	0	0	0	0	108.9
581	E	27.6	Very low	28.7	Very low	169 Å²	169	123.5 Å²	123.5	79%	0.79	75%	0.753	S	S	*	*			trans	63	119.2	161.8	-75.9	154.8	-157	0	0	117.7
582	E	27.2	Very low	28.7	Very low	162 Å²	162	122.6 Å²	122.6	76%	0.757	76%	0.759	S	S	*	*				78.3	113.9	72.1	-173.8	179.3	-110	0	0	113.6
583	N	27.4	Very low	28.6	Very low	151 Å²	151	124.8 Å²	124.8	81%	0.807	76%	0.761	S	S	*	*				-169.5	156.4	119.7	-108.5	-82	0	0	0	112.8
584	A	29.6	Very low	28.8	Very low	85 Å²	85	126.8 Å²	126.8	70%	0.702	76%	0.763	S	S	*	*			trans	-106.5	-171.1	-179.7	0	0	0	0	0	111.8
585	L	27	Very low	28.6	Very low	162 Å²	162	130.2 Å²	130.2	85%	0.848	76%	0.762	S	S	*	*			trans	146	158.6	158.5	-79.9	162.9	0	0	0	110.1
586	P	30.4	Very low	28.7	Very low	117 Å²	117	125.4 Å²	125.4	76%	0.76	75%	0.749	S	S	*	*				-134	-161.5	-51.2	38.5	-20.5	0	0	0	113.1
587	Q	29.8	Very low	28.9	Very low	190 Å²	190	129.1 Å²	129.1	89%	0.888	76%	0.759	S	S	*	*			trans	-84.1	-177.6	-171	-59.6	169.3	-31.6	0	0	116.1
588	S	26.4	Very low	29.2	Very low	115 Å²	115	130 Å²	130	80%	0.804	75%	0.753	S	S	*	*			trans	106.5	138.2	171.6	-150	0	0	0	0	112.5
589	I	29.8	Very low	29.5	Very low	148 Å²	148	127.1 Å²	127.1	76%	0.759	75%	0.749	S	S	*	*			cis	-139.9	158.3	42.7	-74.7	165.4	0	0	0	113.3
590	A	27.7	Very low	29.6	Very low	93 Å²	93	126.4 Å²	126.4	77%	0.769	75%	0.747	S	S	*	*			trans	-74.2	170	-175.5	0	0	0	0	0	116.6
591	G	30.6	Very low	29.6	Very low	74 Å²	74	130.3 Å²	130.3	76%	0.763	75%	0.754	S	S	*	*			trans	-166.5	70.7	179.5	0	0	0	0	0	117.5
592	G	30.2	Very low	29.8	Very low	76 Å²	76	129.9 Å²	129.9	78%	0.784	76%	0.757	S	S	*	*			trans	65.6	100.1	149	0	0	0	0	0	120.5
593	N	27	Very low	29.9	Very low	156 Å²	156	129.9 Å²	129.9	83%	0.834	76%	0.762	S	S	*	*			trans	-77.7	124	162.3	-77.1	-23.7	0	0	0	111.1
594	L	33.1	Very low	30.3	Very low	156 Å²	156	130.5 Å²	130.5	82%	0.817	77%	0.766	S	S	*	*			trans	-138.6	13.1	173.5	-150.7	79.9	0	0	0	114.1
595	W	32.1	Very low	30.3	Very low	174 Å²	174	129.1 Å²	129.1	66%	0.659	76%	0.76	S	S	*	*	S	Bend	trans	-112.2	-5	-178.3	-66.5	-27.6	0	0	0	114.8	D597 K763	W595-D597 PolarHBondContact O-N 2.86Å; W595-K763 HydrophobicContact CZ2-CD 4.32Å
596	S	31.4	Very low	30.5	Very low	84 Å²	84	131.4 Å²	131.4	59%	0.587	76%	0.763	S	S	*	*	G	3₁₀ helix	trans	-65	-38	-179.5	-54.1	0	0	0	0	112.9	M598	S596-M598 PolarHBondContact O-N 3.18Å
597	D	31.2	Very low	30.6	Very low	150 Å²	150	131.3 Å²	131.3	80%	0.802	77%	0.765	S	S	*	*	G	3₁₀ helix	trans	-74.5	-6.6	-173.9	-58.8	-10.2	0	0	0	113.8	W595	W595-D597 PolarHBondContact O-N 2.86Å
598	M	34.7	Very low	30.6	Very low	122 Å²	122	134 Å²	134	60%	0.601	77%	0.767	S	S	*	*	G	3₁₀ helix	trans	-94.1	-2.3	-174.1	-145.1	70.9	148.2	0	0	113.4	S596 E624	S596-M598 PolarHBondContact O-N 3.18Å; M598-E624 VanDerWaalsContact CE-OE2 3.26Å; M598-E624 WeakPolarHBondContact CE-OE2 3.31Å
599	A	30.7	Very low	30.8	Very low	78 Å²	78	132.5 Å²	132.5	65%	0.645	76%	0.756	S	S	*	*			trans	-108.9	19.9	-164.3	0	0	0	0	0	115.5	F601	A599-F601 PolarHBondContact O-N 3.27Å
600	C	29	Very low	30.9	Very low	108 Å²	108	129.2 Å²	129.2	73%	0.73	75%	0.746	S	S	*	*			trans	-84.8	97	-177.5	-55.9	0	0	0	0	112.3
601	F	28.2	Very low	31.4	Very low	166 Å²	166	129 Å²	129	73%	0.728	74%	0.739	S	S	*	*			trans	-139.6	48.1	-179.4	-87.3	-68.5	0	0	0	115	A599	A599-F601 PolarHBondContact O-N 3.27Å
602	D	33.2	Very low	31.8	Very low	160 Å²	160	130.6 Å²	130.6	86%	0.856	73%	0.73	S	S	*	*			trans	-111.9	114.9	155.2	-60.9	-67.2	0	0	0	106.4
603	D	29.5	Very low	32.6	Very low	162 Å²	162	128.5 Å²	128.5	87%	0.866	70%	0.703	S	S	*	*				70.5	74.4	80.1	-155.1	41.8	0	0	0	114.9
604	D	34.3	Very low	33.6	Very low	164 Å²	164	124.6 Å²	124.6	88%	0.877	68%	0.682	S	S	*	*			trans	-150.5	153	138.1	-158.1	-7.7	0	0	0	110.6
605	G	30.7	Very low	34.6	Very low	56 Å²	56	121.3 Å²	121.3	58%	0.577	67%	0.67	S	S	*	*			trans	-118.2	79.1	-165.3	0	0	0	0	0	115.4
606	K	31.5	Very low	36	Very low	210 Å²	210	119.8 Å²	119.8	91%	0.913	67%	0.668	S	S	*	*			trans	-163.4	85.5	154	-90.9	127.7	-174.2	174.5	0	112.7
607	S	32.2	Very low	37.6	Very low	116 Å²	116	121.7 Å²	121.7	81%	0.811	66%	0.662	S	S	*	*			trans	-151.9	135	157.2	-170.1	0	0	0	0	112.6	C609	S607-C609 PolarHBondContact O-N 3.36Å
608	R	29.5	Very low	39.3	Very low	245 Å²	245	115.6 Å²	115.6	93%	0.925	63%	0.631	S	S	*	*			trans	-76.6	85.4	174.4	-82.6	177	163.2	164.1	-7	109.3	S610	R608-S610 PolarHBondContact O-N 3.46Å; R608-S610 VanDerWaalsContact O-N 3.12Å
609	C	29.7	Very low	41.1	Very low	84 Å²	84	112.4 Å²	112.4	57%	0.568	62%	0.624	S	S	*	*			trans	-72.5	103.4	172.8	-146.6	0	0	0	0	109.4	S607 S613	S607-C609 PolarHBondContact O-N 3.36Å; C609-S613 PolarHBondContact SG-OG 3.39Å; C609-S613 VanDerWaalsContact SG-OG 3.38Å
610	S	31.5	Very low	43.5	Very low	79 Å²	79	116 Å²	116	55%	0.552	63%	0.626	S	S	*	*			trans	-55.5	148.6	179.3	-49.8	0	0	0	0	112	R608 D612 S613	R608-S610 PolarHBondContact O-N 3.46Å; R608-S610 VanDerWaalsContact O-N 3.12Å; S610-D612 PolarHBondContact O-N 3.1Å; S610-S613 WeakPolarHBondContact O-CB 3.32Å; S610-S613 PolarHBondContact O-N 3.12Å; S610-S613 VanDerWaalsContact O-N 3.17Å; S610-S613 PolarHBondContact O-OG 3.2Å
611	S	38.4	Very low	46	Very low	88 Å²	88	111.2 Å²	111.2	62%	0.615	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-45.5	-38.9	177.4	36.6	0	0	0	0	113.4	S613 L614 P615	S611-S613 PolarHBondContact O-N 3.16Å; S611-S613 VanDerWaalsContact O-N 3.11Å; S611-L614 PolarHBondContact O-N 3.41Å; S611-P615 WeakPolarHBondContact O-CD 3.45Å
612	D	40	Very low	48.6	Very low	109 Å²	109	104.1 Å²	104.1	58%	0.583	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.3	-1.9	-167.6	-35.4	-23.6	0	0	0	113	S610	S610-D612 PolarHBondContact O-N 3.1Å
613	S	47.2	Very low	51.2	Low	31 Å²	31	101.2 Å²	101.2	22%	0.217	55%	0.547	C	S	.	.	H	α-helix	trans	-83.2	-27.2	174.4	64.5	0	0	0	0	113.5	C609 S610 S611 R617	C609-S613 PolarHBondContact SG-OG 3.39Å; C609-S613 VanDerWaalsContact SG-OG 3.38Å; S610-S613 WeakPolarHBondContact O-CB 3.32Å; S610-S613 PolarHBondContact O-N 3.12Å; S610-S613 VanDerWaalsContact O-N 3.17Å; S610-S613 PolarHBondContact O-OG 3.2Å; S611-S613 PolarHBondContact O-N 3.16Å; S611-S613 VanDerWaalsContact O-N 3.11Å; S613-R617 PolarHBondContact O-N 2.85Å
614	L	47.3	Very low	54	Low	74 Å²	74	96.4 Å²	96.4	39%	0.387	52%	0.52	S	S	.	.	H	α-helix	trans	-69.7	-45.6	-176.7	-75.7	154.2	0	0	0	113.3	S611 K616 R617 S618 F774	S611-L614 PolarHBondContact O-N 3.41Å; L614-K616 VanDerWaalsContact C-N 3.31Å; L614-K616 PolarHBondContact O-N 3Å; L614-R617 PolarHBondContact O-N 2.84Å; L614-S618 PolarHBondContact O-N 3.31Å; L614-S618 VanDerWaalsContact O-N 3.16Å; L614-F774 HydrophobicContact CD2-CD1 4.3Å
615	P	54.8	Low	56.7	Low	87 Å²	87	88.7 Å²	88.7	57%	0.565	48%	0.478	S	S	*	.	H	α-helix	trans	-60.7	-40.3	177.8	-23.8	34.8	0	0	0	112.4	S611 R617 S618 A619	S611-P615 WeakPolarHBondContact O-CD 3.45Å; P615-R617 VanDerWaalsContact C-N 3.34Å; P615-R617 PolarHBondContact O-N 3.49Å; P615-S618 PolarHBondContact O-N 3.12Å; P615-A619 WeakPolarHBondContact O-CB 3.47Å; P615-A619 PolarHBondContact O-N 2.92Å
616	K	61.6	Low	59.7	Low	143 Å²	143	86.9 Å²	86.9	62%	0.622	46%	0.456	S	S	*	.	H	α-helix	trans	-61	-41.7	179	-62.7	-177.9	-178.4	-177.5	0	111.8	L614 A619 F620	L614-K616 VanDerWaalsContact C-N 3.31Å; L614-K616 PolarHBondContact O-N 3Å; K616-A619 PolarHBondContact O-N 2.99Å; K616-F620 WeakPolarHBondContact O-CD2 3.4Å; K616-F620 PolarHBondContact O-N 3.1Å; K616-F620 VanDerWaalsContact O-N 3.09Å
617	R	63.2	Low	62.6	Low	124 Å²	124	80.7 Å²	80.7	47%	0.468	44%	0.436	S	S	.	.	H	α-helix	trans	-69	-37.9	178	-73.5	179.9	172.7	175.6	-4.2	113	S613 L614 P615 F620 V621 F774	S613-R617 PolarHBondContact O-N 2.85Å; L614-R617 PolarHBondContact O-N 2.84Å; P615-R617 VanDerWaalsContact C-N 3.34Å; P615-R617 PolarHBondContact O-N 3.49Å; R617-F620 PolarHBondContact O-N 3.27Å; R617-V621 WeakPolarHBondContact O-CG2 3.41Å; R617-V621 PolarHBondContact O-N 2.84Å; R617-F774 HydrophobicContact CB-CD1 4.4Å; R617-F774 HydrophobicContact CB-CD2 4.47Å; R617-F774 HydrophobicContact CB-CE1 3.98Å; R617-F774 HydrophobicContact CB-CE2 4.03Å; R617-F774 HydrophobicContact CB-CZ 3.79Å; R617-F774 HydrophobicContact CG-CE1 4.5Å; R617-F774 HydrophobicContact CG-CZ 4.4Å
618	S	67.2	Low	65.6	Low	21 Å²	21	77.6 Å²	77.6	15%	0.147	41%	0.412	C	S	.	.	H	α-helix	trans	-62.4	-46	170.9	-175.8	0	0	0	0	111.4	L614 P615 F620 V621 I622 N771	L614-S618 PolarHBondContact O-N 3.31Å; L614-S618 VanDerWaalsContact O-N 3.16Å; P615-S618 PolarHBondContact O-N 3.12Å; S618-F620 VanDerWaalsContact C-N 3.33Å; S618-F620 PolarHBondContact O-N 2.88Å; S618-V621 PolarHBondContact O-N 3.19Å; S618-V621 VanDerWaalsContact O-N 3.08Å; S618-I622 WeakPolarHBondContact O-CG1 3.28Å; S618-I622 PolarHBondContact O-N 3.11Å; S618-N771 PolarHBondContact OG-OD1 3.06Å
619	A	73.9	Confident	68.8	Low	56 Å²	56	66 Å²	66	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-58.4	-38.9	177.9	0	0	0	0	0	113.4	P615 K616 V621 I622 N623	P615-A619 WeakPolarHBondContact O-CB 3.47Å; P615-A619 PolarHBondContact O-N 2.92Å; K616-A619 PolarHBondContact O-N 2.99Å; A619-V621 PolarHBondContact O-N 3.28Å; A619-I622 PolarHBondContact O-N 3.46Å; A619-N623 VanDerWaalsContact O-CB 3.3Å; A619-N623 WeakPolarHBondContact O-CB 3.46Å; A619-N623 PolarHBondContact O-N 2.95Å
620	F	80.2	Confident	71.9	Confident	153 Å²	153	65.5 Å²	65.5	67%	0.671	36%	0.358	S	S	*	.	H	α-helix	trans	-59.9	-43.1	173.6	-81.1	-65.6	0	0	0	112.9	K616 R617 S618 N623 E624	K616-F620 WeakPolarHBondContact O-CD2 3.4Å; K616-F620 PolarHBondContact O-N 3.1Å; K616-F620 VanDerWaalsContact O-N 3.09Å; R617-F620 PolarHBondContact O-N 3.27Å; S618-F620 VanDerWaalsContact C-N 3.33Å; S618-F620 PolarHBondContact O-N 2.88Å; F620-N623 PolarHBondContact O-N 2.77Å; F620-E624 WeakPolarHBondContact O-CB 3.12Å; F620-E624 PolarHBondContact O-N 2.96Å
621	V	81	Confident	75	Confident	7 Å²	7	64.4 Å²	64.4	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-74.8	-34.2	-177.8	-175.9	0	0	0	0	111.6	R617 S618 A619 E624 L625 L767 V770 N771 F774	R617-V621 WeakPolarHBondContact O-CG2 3.41Å; R617-V621 PolarHBondContact O-N 2.84Å; S618-V621 PolarHBondContact O-N 3.19Å; S618-V621 VanDerWaalsContact O-N 3.08Å; A619-V621 PolarHBondContact O-N 3.28Å; V621-E624 PolarHBondContact O-N 3.43Å; V621-L625 WeakPolarHBondContact O-CB 3.34Å; V621-L625 PolarHBondContact O-N 3.13Å; V621-L767 HydrophobicContact CG1-CD2 4.12Å; V621-V770 HydrophobicContact CB-CG1 4.48Å; V621-V770 HydrophobicContact CG1-CB 4.33Å; V621-V770 HydrophobicContact CG1-CG1 4.12Å; V621-V770 HydrophobicContact CG2-CG1 3.59Å; V621-N771 VanDerWaalsContact CG1-ND2 3.31Å; V621-N771 WeakPolarHBondContact CG1-ND2 3.41Å; V621-F774 HydrophobicContact CG2-CE2 4.13Å
622	I	84.2	Confident	77.8	Confident	17 Å²	17	60.6 Å²	60.6	9%	0.087	32%	0.322	C	S	.	.	H	α-helix	trans	-65.8	-41.6	171.7	-65.3	174.2	0	0	0	110.1	S618 A619 L625 V626 I698	S618-I622 WeakPolarHBondContact O-CG1 3.28Å; S618-I622 PolarHBondContact O-N 3.11Å; A619-I622 PolarHBondContact O-N 3.46Å; I622-L625 PolarHBondContact O-N 2.96Å; I622-V626 WeakPolarHBondContact O-CG2 3.12Å; I622-V626 PolarHBondContact O-N 3.38Å; I622-I698 HydrophobicContact CD1-CG1 4.21Å; I622-I698 HydrophobicContact CG1-CG1 4.16Å; I622-I698 HydrophobicContact CG2-CD1 4.01Å; I622-I698 HydrophobicContact CG2-CG1 4.16Å
623	N	86.7	Confident	80.5	Confident	99 Å²	99	55.6 Å²	55.6	53%	0.529	30%	0.296	S	S	.	.	H	α-helix	trans	-64.8	-44.6	174.1	-170.8	85.4	0	0	0	111.8	A619 F620 L625 V626 T627	A619-N623 VanDerWaalsContact O-CB 3.3Å; A619-N623 WeakPolarHBondContact O-CB 3.46Å; A619-N623 PolarHBondContact O-N 2.95Å; F620-N623 PolarHBondContact O-N 2.77Å; N623-L625 PolarHBondContact O-N 3.25Å; N623-V626 PolarHBondContact O-N 3.39Å; N623-T627 PolarHBondContact ND2-OG1 3.26Å; N623-T627 WeakPolarHBondContact O-CB 3.32Å; N623-T627 PolarHBondContact O-N 2.96Å; N623-T627 PolarHBondContact O-OG1 3.05Å
624	E	89.5	Confident	82.9	Confident	62 Å²	62	58 Å²	58	29%	0.29	31%	0.306	S	S	.	.	H	α-helix	trans	-56.1	-48.1	173.7	-173.8	-169.4	166.2	0	0	111.4	M598 F620 V621 V626 T628 L767	M598-E624 VanDerWaalsContact CE-OE2 3.26Å; M598-E624 WeakPolarHBondContact CE-OE2 3.31Å; F620-E624 WeakPolarHBondContact O-CB 3.12Å; F620-E624 PolarHBondContact O-N 2.96Å; V621-E624 PolarHBondContact O-N 3.43Å; E624-V626 PolarHBondContact O-N 2.87Å; E624-T628 HydrophobicContact CG-CG2 4.38Å; E624-T628 VanDerWaalsContact O-CB 3.31Å; E624-T628 WeakPolarHBondContact O-CB 3.44Å; E624-T628 VanDerWaalsContact O-CG2 3.29Å; E624-T628 WeakPolarHBondContact O-CG2 3.44Å; E624-T628 PolarHBondContact O-N 3.15Å; E624-T628 PolarHBondContact O-OG1 2.92Å; E624-L767 HydrophobicContact CG-CD2 4.26Å
625	L	91.1	Very high	85.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-56	-49.2	176.8	171.6	63.2	0	0	0	111.6	V621 I622 N623 T628 E629 L686 I698 F702 R760 Y764 L767	V621-L625 WeakPolarHBondContact O-CB 3.34Å; V621-L625 PolarHBondContact O-N 3.13Å; I622-L625 PolarHBondContact O-N 2.96Å; N623-L625 PolarHBondContact O-N 3.25Å; L625-T628 PolarHBondContact O-OG1 3.05Å; L625-E629 VanDerWaalsContact O-CB 3.24Å; L625-E629 WeakPolarHBondContact O-CB 3.23Å; L625-E629 PolarHBondContact O-N 3.08Å; L625-L686 HydrophobicContact CD1-CD1 4.16Å; L625-L686 HydrophobicContact CD2-CD1 4.42Å; L625-L686 HydrophobicContact CD2-CD2 3.94Å; L625-L686 HydrophobicContact CG-CD1 4.15Å; L625-I698 HydrophobicContact CD2-CD1 4.32Å; L625-I698 HydrophobicContact CD2-CG2 3.54Å; L625-F702 HydrophobicContact CD1-CZ 4.21Å; L625-F702 HydrophobicContact CD2-CE2 4.02Å; L625-F702 HydrophobicContact CD2-CZ 4.47Å; L625-R760 PolarHBondContact O-NH2 3.24Å; L625-R760 VanDerWaalsContact O-NH2 3.09Å; L625-Y764 HydrophobicContact CD1-CD1 4.09Å; L625-Y764 HydrophobicContact CD1-CE1 4.12Å; L625-L767 HydrophobicContact CB-CD1 4.18Å; L625-L767 HydrophobicContact CD1-CD1 3.67Å
626	V	92.1	Very high	87.2	Confident	18 Å²	18	53 Å²	53	11%	0.109	27%	0.273	C	S	.	.	H	α-helix	trans	-70.3	-46.2	-178.3	171.3	0	0	0	0	112.3	I622 N623 E624 T628 E629 Q630 L686 L687	I622-V626 WeakPolarHBondContact O-CG2 3.12Å; I622-V626 PolarHBondContact O-N 3.38Å; N623-V626 PolarHBondContact O-N 3.39Å; E624-V626 PolarHBondContact O-N 2.87Å; V626-T628 VanDerWaalsContact C-N 3.35Å; V626-T628 PolarHBondContact O-N 3.27Å; V626-E629 WeakPolarHBondContact O-CB 3.14Å; V626-E629 PolarHBondContact O-N 3.3Å; V626-Q630 PolarHBondContact O-N 3.47Å; V626-L686 HydrophobicContact CG2-CB 4.42Å; V626-L687 HydrophobicContact CG1-CD2 3.59Å; V626-L687 HydrophobicContact CG1-CG 4.36Å
627	T	92.9	Very high	88.9	Confident	80 Å²	80	46.8 Å²	46.8	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-42.1	178.3	-58	0	0	0	0	111.3	N623 E629 S631	N623-T627 PolarHBondContact ND2-OG1 3.26Å; N623-T627 WeakPolarHBondContact O-CB 3.32Å; N623-T627 PolarHBondContact O-N 2.96Å; N623-T627 PolarHBondContact O-OG1 3.05Å; T627-E629 VanDerWaalsContact C-N 3.32Å; T627-S631 PolarHBondContact O-N 3.12Å; T627-S631 VanDerWaalsContact O-N 3.09Å
628	T	94.8	Very high	90.5	Very high	52 Å²	52	41.9 Å²	41.9	32%	0.319	23%	0.233	S	C	.	.	H	α-helix	trans	-75.9	-19	176.7	61.3	0	0	0	0	113.2	E624 L625 V626 Y632 R760	E624-T628 HydrophobicContact CG-CG2 4.38Å; E624-T628 VanDerWaalsContact O-CB 3.31Å; E624-T628 WeakPolarHBondContact O-CB 3.44Å; E624-T628 VanDerWaalsContact O-CG2 3.29Å; E624-T628 WeakPolarHBondContact O-CG2 3.44Å; E624-T628 PolarHBondContact O-N 3.15Å; E624-T628 PolarHBondContact O-OG1 2.92Å; L625-T628 PolarHBondContact O-OG1 3.05Å; V626-T628 VanDerWaalsContact C-N 3.35Å; V626-T628 PolarHBondContact O-N 3.27Å; T628-Y632 VanDerWaalsContact O-CB 3.26Å; T628-Y632 WeakPolarHBondContact O-CB 3.39Å; T628-Y632 PolarHBondContact O-N 3.44Å; T628-R760 VanDerWaalsContact CB-NH1 3.29Å; T628-R760 PolarHBondContact O-NH1 3.07Å; T628-R760 PolarHBondContact OG1-NH1 3.21Å
629	E	96.4	Very high	91.8	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-73.3	-48	170.2	-172.8	67.6	-166.8	0	0	111.1	L625 V626 T627 S631 Y632 V633 H678 L683 L686 R760 Y764	L625-E629 VanDerWaalsContact O-CB 3.24Å; L625-E629 WeakPolarHBondContact O-CB 3.23Å; L625-E629 PolarHBondContact O-N 3.08Å; V626-E629 WeakPolarHBondContact O-CB 3.14Å; V626-E629 PolarHBondContact O-N 3.3Å; T627-E629 VanDerWaalsContact C-N 3.32Å; E629-S631 PolarHBondContact O-N 3.05Å; E629-Y632 WeakPolarHBondContact O-CB 3.33Å; E629-Y632 PolarHBondContact O-N 2.97Å; E629-Y632 VanDerWaalsContact O-N 3.14Å; E629-V633 PolarHBondContact O-N 2.84Å; E629-H678 IonicContact OE1-CE1 2.9Å; E629-H678 IonicContact OE1-CG 2.7Å; E629-H678 IonicContact OE1-ND1 3.54Å; E629-H678 PolarHBondContact OE1-ND1 3Å; E629-L683 HydrophobicContact CB-CD1 4.04Å; E629-L683 HydrophobicContact CG-CB 3.83Å; E629-L683 HydrophobicContact CG-CD1 3.66Å; E629-L683 HydrophobicContact CG-CG 4.26Å; E629-L686 HydrophobicContact CB-CD1 4.37Å; E629-L686 HydrophobicContact CG-CD1 4Å; E629-R760 VanDerWaalsContact CA-NH2 3.3Å; E629-R760 IonicContact OE2-CZ 2.85Å; E629-R760 IonicContact OE2-NE 2.7Å; E629-R760 PolarHBondContact OE2-NE 2.85Å; E629-R760 IonicContact OE2-NH2 3.88Å; E629-R760 PolarHBondContact OE2-NH2 3.33Å; E629-Y764 PolarHBondContact OE2-OH 2.94Å
630	Q	96.7	Very high	92.8	Very high	74 Å²	74	40 Å²	40	35%	0.346	21%	0.212	S	C	.	.	H	α-helix	trans	-56.2	-53.1	175.9	-176.9	61.7	66.4	0	0	110.3	V626 Y632 V633 D634	V626-Q630 PolarHBondContact O-N 3.47Å; Q630-Y632 VanDerWaalsContact C-N 3.25Å; Q630-Y632 PolarHBondContact O-N 3.29Å; Q630-V633 PolarHBondContact O-N 3.43Å; Q630-V633 VanDerWaalsContact O-N 3.12Å; Q630-D634 WeakPolarHBondContact CG-OD2 3.49Å; Q630-D634 VanDerWaalsContact NE2-CG 3.25Å; Q630-D634 PolarHBondContact NE2-OD1 3.33Å; Q630-D634 PolarHBondContact NE2-OD2 3.18Å; Q630-D634 PolarHBondContact O-N 2.91Å; Q630-D634 VanDerWaalsContact O-OD2 3.09Å
631	S	95.5	Very high	93.5	Very high	57 Å²	57	37.3 Å²	37.3	40%	0.399	21%	0.205	S	C	.	.	H	α-helix	trans	-55.9	-38.1	176	-173.6	0	0	0	0	112.9	T627 E629 E635	T627-S631 PolarHBondContact O-N 3.12Å; T627-S631 VanDerWaalsContact O-N 3.09Å; E629-S631 PolarHBondContact O-N 3.05Å; S631-E635 WeakPolarHBondContact O-CB 3.44Å; S631-E635 WeakPolarHBondContact O-CG 3.39Å; S631-E635 PolarHBondContact O-N 3.46Å
632	Y	97.5	Very high	94.1	Very high	8 Å²	8	39.5 Å²	39.5	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-68.4	-43.1	178	172.9	-117.7	0	0	0	112.2	T628 E629 Q630 D634 L636 I674 H678 Y712 K756 P757 R760	T628-Y632 VanDerWaalsContact O-CB 3.26Å; T628-Y632 WeakPolarHBondContact O-CB 3.39Å; T628-Y632 PolarHBondContact O-N 3.44Å; E629-Y632 WeakPolarHBondContact O-CB 3.33Å; E629-Y632 PolarHBondContact O-N 2.97Å; E629-Y632 VanDerWaalsContact O-N 3.14Å; Q630-Y632 VanDerWaalsContact C-N 3.25Å; Q630-Y632 PolarHBondContact O-N 3.29Å; Y632-D634 VanDerWaalsContact C-N 3.34Å; Y632-L636 HydrophobicContact CD2-CG 4.26Å; Y632-L636 HydrophobicContact CE1-CD1 4.02Å; Y632-L636 HydrophobicContact CE2-CD1 3.9Å; Y632-L636 HydrophobicContact CE2-CD2 4.17Å; Y632-L636 HydrophobicContact CE2-CG 3.89Å; Y632-L636 WeakPolarHBondContact O-CB 3.31Å; Y632-L636 WeakPolarHBondContact O-CG 3.34Å; Y632-L636 PolarHBondContact O-N 3.5Å; Y632-I674 WeakPolarHBondContact OH-CG2 3.34Å; Y632-H678 AromaticContact CE1-CD2 4Å; Y632-H678 AromaticContact CE1-CG 3.93Å; Y632-Y712 WeakPolarHBondContact CE1-OH 3.47Å; Y632-Y712 PolarHBondContact OH-OH 3.36Å; Y632-Y712 VanDerWaalsContact OH-OH 3.07Å; Y632-K756 HydrophobicContact CD2-CB 4.29Å; Y632-K756 HydrophobicContact CE2-CB 4.03Å; Y632-P757 WeakPolarHBondContact OH-CA 3.4Å; Y632-P757 WeakPolarHBondContact OH-CB 3.2Å; Y632-R760 HydrophobicContact CD1-CB 4.37Å; Y632-R760 HydrophobicContact CD1-CG 3.71Å; Y632-R760 HydrophobicContact CD2-CB 4.18Å; Y632-R760 HydrophobicContact CD2-CG 4.29Å; Y632-R760 HydrophobicContact CE1-CB 4.06Å; Y632-R760 HydrophobicContact CE1-CG 3.67Å; Y632-R760 HydrophobicContact CE2-CB 3.86Å; Y632-R760 HydrophobicContact CE2-CG 4.26Å; Y632-R760 HydrophobicContact CG-CB 4.43Å; Y632-R760 HydrophobicContact CG-CG 4.03Å
633	V	97.7	Very high	94.4	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.024	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-35.9	175.9	170.1	0	0	0	0	111.9	E629 Q630 S637 H678 K679 L683	E629-V633 PolarHBondContact O-N 2.84Å; Q630-V633 PolarHBondContact O-N 3.43Å; Q630-V633 VanDerWaalsContact O-N 3.12Å; V633-S637 WeakPolarHBondContact O-CB 3.28Å; V633-S637 PolarHBondContact O-N 2.96Å; V633-S637 PolarHBondContact O-OG 3.29Å; V633-H678 HydrophobicContact CG2-CB 3.78Å; V633-K679 HydrophobicContact CG1-CB 3.85Å; V633-K679 HydrophobicContact CG1-CD 4.27Å; V633-K679 HydrophobicContact CG1-CG 3.93Å; V633-L683 HydrophobicContact CB-CD2 4.04Å; V633-L683 HydrophobicContact CG1-CD2 4.17Å; V633-L683 HydrophobicContact CG2-CB 4.31Å; V633-L683 HydrophobicContact CG2-CD2 3.93Å
634	D	96.5	Very high	94.7	Very high	81 Å²	81	35.7 Å²	35.7	43%	0.433	20%	0.196	S	C	.	.	H	α-helix	trans	-72	-43.5	178.1	-63.3	-29.3	0	0	0	111.4	Q630 Y632 L636 S637 S638	Q630-D634 WeakPolarHBondContact CG-OD2 3.49Å; Q630-D634 VanDerWaalsContact NE2-CG 3.25Å; Q630-D634 PolarHBondContact NE2-OD1 3.33Å; Q630-D634 PolarHBondContact NE2-OD2 3.18Å; Q630-D634 PolarHBondContact O-N 2.91Å; Q630-D634 VanDerWaalsContact O-OD2 3.09Å; Y632-D634 VanDerWaalsContact C-N 3.34Å; D634-L636 PolarHBondContact O-N 3.07Å; D634-S637 WeakPolarHBondContact O-CB 3.27Å; D634-S637 PolarHBondContact O-N 3.03Å; D634-S638 PolarHBondContact O-N 3.36Å
635	E	96.1	Very high	94.7	Very high	56 Å²	56	35.2 Å²	35.2	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-62.2	-41.3	173.3	-73.9	178.6	134.9	0	0	112.3	S631 S638 V639 K756	S631-E635 WeakPolarHBondContact O-CB 3.44Å; S631-E635 WeakPolarHBondContact O-CG 3.39Å; S631-E635 PolarHBondContact O-N 3.46Å; E635-S638 PolarHBondContact O-N 3.05Å; E635-V639 WeakPolarHBondContact O-CG2 3.32Å; E635-V639 PolarHBondContact O-N 3.21Å; E635-V639 VanDerWaalsContact O-N 3.16Å; E635-K756 HydrophobicContact CB-CD 4.06Å; E635-K756 VanDerWaalsContact OE1-CE 3.31Å; E635-K756 WeakPolarHBondContact OE1-CE 3.36Å; E635-K756 IonicContact OE1-NZ 2.73Å; E635-K756 PolarHBondContact OE1-NZ 3.39Å; E635-K756 WeakPolarHBondContact OE2-CD 3.27Å; E635-K756 VanDerWaalsContact OE2-CE 3.27Å; E635-K756 WeakPolarHBondContact OE2-CE 3.44Å; E635-K756 IonicContact OE2-NZ 3.17Å; E635-K756 PolarHBondContact OE2-NZ 3.24Å
636	L	97.2	Very high	94.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-40.3	173.5	-73.5	-163.1	0	0	0	112.3	Y632 D634 S638 V639 M640 L671 I674 H675 P757	Y632-L636 HydrophobicContact CD2-CG 4.26Å; Y632-L636 HydrophobicContact CE1-CD1 4.02Å; Y632-L636 HydrophobicContact CE2-CD1 3.9Å; Y632-L636 HydrophobicContact CE2-CD2 4.17Å; Y632-L636 HydrophobicContact CE2-CG 3.89Å; Y632-L636 WeakPolarHBondContact O-CB 3.31Å; Y632-L636 WeakPolarHBondContact O-CG 3.34Å; Y632-L636 PolarHBondContact O-N 3.5Å; D634-L636 PolarHBondContact O-N 3.07Å; L636-S638 VanDerWaalsContact C-N 3.31Å; L636-S638 PolarHBondContact O-N 3.35Å; L636-V639 PolarHBondContact O-N 3.05Å; L636-M640 WeakPolarHBondContact O-CG 3.4Å; L636-M640 PolarHBondContact O-N 2.94Å; L636-L671 HydrophobicContact CD1-CD1 4.46Å; L636-L671 HydrophobicContact CD2-CD1 3.72Å; L636-L671 HydrophobicContact CD2-CG 4.43Å; L636-I674 HydrophobicContact CD1-CG2 3.91Å; L636-H675 HydrophobicContact CB-CB 4.36Å; L636-H675 HydrophobicContact CD1-CB 4.19Å; L636-P757 HydrophobicContact CD2-CG 4.5Å
637	S	97.1	Very high	94.3	Very high	11 Å²	11	34.5 Å²	34.5	8%	0.077	20%	0.195	C	C	.	.	H	α-helix	trans	-57.4	-47.6	173.8	-58.9	0	0	0	0	110.2	V633 D634 V639 M640 D641 H675 K679	V633-S637 WeakPolarHBondContact O-CB 3.28Å; V633-S637 PolarHBondContact O-N 2.96Å; V633-S637 PolarHBondContact O-OG 3.29Å; D634-S637 WeakPolarHBondContact O-CB 3.27Å; D634-S637 PolarHBondContact O-N 3.03Å; S637-V639 VanDerWaalsContact C-N 3.29Å; S637-V639 PolarHBondContact O-N 2.89Å; S637-M640 WeakPolarHBondContact O-CB 3.23Å; S637-M640 PolarHBondContact O-N 3.34Å; S637-D641 WeakPolarHBondContact O-CB 3.42Å; S637-D641 PolarHBondContact O-N 3.38Å; S637-D641 VanDerWaalsContact O-OD2 3.1Å; S637-H675 VanDerWaalsContact CA-NE2 3.34Å; S637-H675 WeakPolarHBondContact CA-NE2 2.96Å; S637-H675 PolarHBondContact N-NE2 3.48Å; S637-H675 PolarHBondContact OG-NE2 2.9Å; S637-K679 PolarHBondContact OG-NZ 2.9Å
638	S	95.9	Very high	93.8	Very high	22 Å²	22	35.6 Å²	35.6	15%	0.154	20%	0.198	C	C	.	.	H	α-helix	trans	-58.6	-36.3	177.8	-169.6	0	0	0	0	113.4	D634 E635 L636 H642 H746	D634-S638 PolarHBondContact O-N 3.36Å; E635-S638 PolarHBondContact O-N 3.05Å; L636-S638 VanDerWaalsContact C-N 3.31Å; L636-S638 PolarHBondContact O-N 3.35Å; S638-H642 WeakPolarHBondContact O-CB 3.33Å; S638-H642 PolarHBondContact O-N 2.86Å; S638-H642 VanDerWaalsContact O-N 3.14Å; S638-H642 PolarHBondContact O-ND1 2.85Å; S638-H746 WeakPolarHBondContact CB-NE2 3Å; S638-H746 PolarHBondContact OG-NE2 3.03Å
639	V	95.4	Very high	93.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	22%	0.215	C	C	.	.	H	α-helix	trans	-67.8	-43.8	173.6	176.7	0	0	0	0	111.9	E635 L636 S637 Y643 V644 F668 L671 H746 L750 Y753	E635-V639 WeakPolarHBondContact O-CG2 3.32Å; E635-V639 PolarHBondContact O-N 3.21Å; E635-V639 VanDerWaalsContact O-N 3.16Å; L636-V639 PolarHBondContact O-N 3.05Å; S637-V639 VanDerWaalsContact C-N 3.29Å; S637-V639 PolarHBondContact O-N 2.89Å; V639-Y643 WeakPolarHBondContact O-CB 3.31Å; V639-Y643 PolarHBondContact O-N 2.95Å; V639-V644 PolarHBondContact O-N 3.46Å; V639-F668 HydrophobicContact CG1-CE1 4.31Å; V639-L671 HydrophobicContact CB-CD2 4.47Å; V639-L671 HydrophobicContact CG1-CD2 3.72Å; V639-H746 WeakPolarHBondContact CG2-CE1 3.44Å; V639-L750 HydrophobicContact CG1-CD1 4.06Å; V639-Y753 HydrophobicContact CG2-CD1 3.98Å; V639-Y753 HydrophobicContact CG2-CG 4.08Å
640	M	94.9	Very high	92.5	Very high	36 Å²	36	41.9 Å²	41.9	18%	0.177	23%	0.232	C	C	.	.	I	π-helix	trans	-60.2	-47.3	175.9	-65.9	-63.1	-60.4	0	0	111.1	L636 S637 H642 V644 S645 A672 H675	L636-M640 WeakPolarHBondContact O-CG 3.4Å; L636-M640 PolarHBondContact O-N 2.94Å; S637-M640 WeakPolarHBondContact O-CB 3.23Å; S637-M640 PolarHBondContact O-N 3.34Å; M640-H642 PolarHBondContact O-N 3.28Å; M640-V644 HydrophobicContact CE-CB 4.31Å; M640-V644 HydrophobicContact CE-CG1 4.11Å; M640-V644 HydrophobicContact CE-CG2 4.39Å; M640-V644 PolarHBondContact O-N 2.86Å; M640-V644 HydrophobicContact SD-CB 4.26Å; M640-V644 HydrophobicContact SD-CG1 4.48Å; M640-V644 HydrophobicContact SD-CG2 3.73Å; M640-S645 PolarHBondContact O-N 2.71Å; M640-S645 PolarHBondContact O-OG 2.63Å; M640-A672 HydrophobicContact CE-CB 3.72Å; M640-A672 HydrophobicContact SD-CB 4.19Å; M640-H675 HydrophobicContact CG-CB 4.42Å
641	D	94.3	Very high	91.6	Very high	96 Å²	96	39 Å²	39	51%	0.513	22%	0.22	S	C	.	.	I	π-helix	trans	-74.1	-24.9	-171.7	-61.6	-26.7	0	0	0	113.6	S637 S645	S637-D641 WeakPolarHBondContact O-CB 3.42Å; S637-D641 PolarHBondContact O-N 3.38Å; S637-D641 VanDerWaalsContact O-OD2 3.1Å; D641-S645 PolarHBondContact O-OG 2.98Å
642	H	93.1	Very high	90.4	Very high	53 Å²	53	43.4 Å²	43.4	25%	0.245	25%	0.245	C	C	.	.	I	π-helix	trans	-118.7	-17	-174.9	-57.9	87.2	0	0	0	116.3	S638 M640 A646 C740 A744	S638-H642 WeakPolarHBondContact O-CB 3.33Å; S638-H642 PolarHBondContact O-N 2.86Å; S638-H642 VanDerWaalsContact O-N 3.14Å; S638-H642 PolarHBondContact O-ND1 2.85Å; M640-H642 PolarHBondContact O-N 3.28Å; H642-A646 WeakPolarHBondContact O-CB 3.43Å; H642-C740 PolarHBondContact O-SG 3.11Å; H642-A744 HydrophobicContact CB-CB 3.66Å
643	Y	92.1	Very high	89	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.008	28%	0.279	C	S	.	.	I	π-helix	trans	-122.3	-42.6	-179.4	-60.4	-102.5	0	0	0	112.8	V639 A646 I647 C740 Q741 A744 H746 L750	V639-Y643 WeakPolarHBondContact O-CB 3.31Å; V639-Y643 PolarHBondContact O-N 2.95Å; Y643-A646 PolarHBondContact O-N 2.84Å; Y643-I647 PolarHBondContact O-N 3.01Å; Y643-C740 HydrophobicContact CD1-CB 3.51Å; Y643-C740 HydrophobicContact CE1-CB 3.61Å; Y643-C740 HydrophobicContact CG-CB 4.13Å; Y643-Q741 WeakPolarHBondContact OH-CA 3.49Å; Y643-A744 HydrophobicContact CE2-CB 4.03Å; Y643-H746 AromaticContact CE2-CE1 3.4Å; Y643-H746 VanDerWaalsContact CE2-CE1 3.4Å; Y643-H746 WeakPolarHBondContact CE2-CE1 3.47Å; Y643-H746 AromaticContact CE2-ND1 3.4Å; Y643-H746 WeakPolarHBondContact CE2-ND1 3.45Å; Y643-H746 AromaticContact CZ-ND1 3.68Å; Y643-H746 PolarHBondContact OH-ND1 3.23Å; Y643-L750 HydrophobicContact CD1-CB 4.22Å; Y643-L750 HydrophobicContact CD1-CD1 3.84Å; Y643-L750 HydrophobicContact CD1-CD2 3.88Å; Y643-L750 HydrophobicContact CD1-CG 4.18Å; Y643-L750 HydrophobicContact CD2-CD1 4.27Å; Y643-L750 HydrophobicContact CE1-CB 3.85Å; Y643-L750 HydrophobicContact CE1-CD1 4.06Å; Y643-L750 HydrophobicContact CE1-CD2 4.36Å; Y643-L750 HydrophobicContact CE1-CG 4.29Å; Y643-L750 HydrophobicContact CE2-CD1 4.47Å; Y643-L750 HydrophobicContact CG-CD1 3.91Å; Y643-L750 HydrophobicContact CG-CD2 4.49Å
644	V	92	Very high	87.7	Confident	35 Å²	35	47 Å²	47	21%	0.212	28%	0.283	C	S	.	.	I	π-helix	trans	-71.3	-48.3	178.8	-175.5	0	0	0	0	110.1	V639 M640 A646 I647 F668	V639-V644 PolarHBondContact O-N 3.46Å; M640-V644 HydrophobicContact CE-CB 4.31Å; M640-V644 HydrophobicContact CE-CG1 4.11Å; M640-V644 HydrophobicContact CE-CG2 4.39Å; M640-V644 PolarHBondContact O-N 2.86Å; M640-V644 HydrophobicContact SD-CB 4.26Å; M640-V644 HydrophobicContact SD-CG1 4.48Å; M640-V644 HydrophobicContact SD-CG2 3.73Å; V644-A646 PolarHBondContact O-N 3.24Å; V644-I647 PolarHBondContact O-N 2.95Å; V644-F668 HydrophobicContact CB-CE2 4.27Å; V644-F668 HydrophobicContact CB-CZ 4.41Å; V644-F668 HydrophobicContact CG1-CD2 4.45Å; V644-F668 HydrophobicContact CG1-CE2 4.45Å; V644-F668 HydrophobicContact CG2-CD1 3.8Å; V644-F668 HydrophobicContact CG2-CD2 3.94Å; V644-F668 HydrophobicContact CG2-CE1 3.71Å; V644-F668 HydrophobicContact CG2-CE2 3.82Å; V644-F668 HydrophobicContact CG2-CG 3.93Å; V644-F668 HydrophobicContact CG2-CZ 3.72Å
645	S	90.3	Very high	86.2	Confident	51 Å²	51	51.5 Å²	51.5	36%	0.357	30%	0.301	S	S	.	.	H	α-helix	trans	-50.8	-44.4	169.3	58	0	0	0	0	112.5	M640 D641 I647 D648 D649	M640-S645 PolarHBondContact O-N 2.71Å; M640-S645 PolarHBondContact O-OG 2.63Å; D641-S645 PolarHBondContact O-OG 2.98Å; S645-I647 VanDerWaalsContact C-N 3.26Å; S645-I647 PolarHBondContact O-N 2.92Å; S645-D648 PolarHBondContact O-N 3.17Å; S645-D648 VanDerWaalsContact O-N 3.09Å; S645-D649 PolarHBondContact O-N 2.87Å
646	A	88.8	Confident	85.1	Confident	2 Å²	2	50.1 Å²	50.1	2%	0.017	30%	0.295	C	S	.	.	H	α-helix	trans	-71.7	-12.2	-174.4	0	0	0	0	0	114.8	H642 Y643 V644 D649 P650 F736 C740	H642-A646 WeakPolarHBondContact O-CB 3.43Å; Y643-A646 PolarHBondContact O-N 2.84Å; V644-A646 PolarHBondContact O-N 3.24Å; A646-D649 WeakPolarHBondContact CA-O 3.38Å; A646-P650 VanDerWaalsContact O-CA 3.25Å; A646-P650 WeakPolarHBondContact O-CA 3.31Å; A646-F736 HydrophobicContact CB-CE2 4.25Å; A646-F736 HydrophobicContact CB-CZ 3.95Å; A646-F736 VanDerWaalsContact O-CE2 3.23Å; A646-F736 WeakPolarHBondContact O-CE2 3.41Å; A646-F736 WeakPolarHBondContact O-CZ 3.45Å; A646-C740 VanDerWaalsContact CB-SG 3.59Å
647	I	85.1	Confident	84.1	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.01	30%	0.303	C	S	.	.	H	α-helix	trans	-79.6	-28.9	170.3	-69.2	-155.6	0	0	0	111.6	Y643 V644 S645 L656 Q661 R664 L667 F668 F736	Y643-I647 PolarHBondContact O-N 3.01Å; V644-I647 PolarHBondContact O-N 2.95Å; S645-I647 VanDerWaalsContact C-N 3.26Å; S645-I647 PolarHBondContact O-N 2.92Å; I647-L656 HydrophobicContact CB-CD2 4.22Å; I647-L656 HydrophobicContact CD1-CD2 4.13Å; I647-L656 HydrophobicContact CG1-CD2 3.91Å; I647-L656 HydrophobicContact CG2-CD2 3.93Å; I647-Q661 HydrophobicContact CG2-CG 3.89Å; I647-Q661 PolarHBondContact O-NE2 2.77Å; I647-R664 HydrophobicContact CD1-CB 4.41Å; I647-R664 HydrophobicContact CG2-CB 4.02Å; I647-L667 HydrophobicContact CD1-CD2 3.73Å; I647-F668 HydrophobicContact CD1-CE2 3.72Å; I647-F668 HydrophobicContact CD1-CZ 4.29Å; I647-F668 HydrophobicContact CG1-CE2 4.24Å; I647-F736 HydrophobicContact CG1-CE1 4.28Å; I647-F736 HydrophobicContact CG1-CZ 3.98Å
648	D	82.1	Confident	83.1	Confident	104 Å²	104	55.4 Å²	55.4	56%	0.556	33%	0.331	S	S	*	.	H	α-helix	trans	-91.1	-31.6	177.4	-68.4	-3.1	0	0	0	111.5	S645 R664	S645-D648 PolarHBondContact O-N 3.17Å; S645-D648 VanDerWaalsContact O-N 3.09Å; D648-R664 IonicContact OD1-CZ 3.83Å; D648-R664 IonicContact OD1-NH1 3.98Å; D648-R664 PolarHBondContact OD1-NH1 3.44Å; D648-R664 IonicContact OD2-NH1 2.63Å; D648-R664 PolarHBondContact OD2-NH1 2.94Å
649	D	83.8	Confident	82	Confident	126 Å²	126	56.5 Å²	56.5	67%	0.674	34%	0.342	S	S	*	.	S	Bend	trans	-129.5	86.3	172.8	-176.7	35.3	0	0	0	111.9	S645 A646	S645-D649 PolarHBondContact O-N 2.87Å; A646-D649 WeakPolarHBondContact CA-O 3.38Å
650	P	81.3	Confident	81.1	Confident	57 Å²	57	56.8 Å²	56.8	37%	0.37	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-72.6	146.4	-172.5	27.7	-34.4	0	0	0	113.8	A646 F736	A646-P650 VanDerWaalsContact O-CA 3.25Å; A646-P650 WeakPolarHBondContact O-CA 3.31Å; P650-F736 HydrophobicContact CB-CE2 4.23Å
651	P	76.4	Confident	80.5	Confident	13 Å²	13	59 Å²	59	8%	0.084	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-57.1	141.9	177.9	-15.6	24.7	0	0	0	112.5	G653 C654 T739	P651-G653 PolarHBondContact O-N 3.3Å; P651-C654 HydrophobicContact CB-CB 4.27Å; P651-C654 HydrophobicContact CG-CB 4.36Å; P651-C654 WeakPolarHBondContact O-CB 3.46Å; P651-C654 PolarHBondContact O-N 3.17Å; P651-T739 HydrophobicContact CB-CG2 3.86Å; P651-T739 HydrophobicContact CG-CG2 3.92Å
652	T	71.4	Confident	79.9	Confident	151 Å²	151	58.6 Å²	58.6	93%	0.926	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	122.8	177	28.2	0	0	0	0	111.8
653	G	67	Low	79.7	Confident	73 Å²	73	59.3 Å²	59.3	75%	0.753	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-3.7	-176.5	0	0	0	0	0	115.7	P651	P651-G653 PolarHBondContact O-N 3.3Å
654	C	70	Confident	79.5	Confident	14 Å²	14	64.2 Å²	64.2	10%	0.095	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-99.3	116	175.1	-67.5	0	0	0	0	111.5	P651 F736	P651-C654 HydrophobicContact CB-CB 4.27Å; P651-C654 HydrophobicContact CG-CB 4.36Å; P651-C654 WeakPolarHBondContact O-CB 3.46Å; P651-C654 PolarHBondContact O-N 3.17Å; C654-F736 HydrophobicContact CB-CD2 4.2Å
655	H	67	Low	79.4	Confident	175 Å²	175	68.1 Å²	68.1	81%	0.81	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-89.3	122.9	169.1	-66.8	-70.4	0	0	0	110.4
656	L	72.1	Confident	79.4	Confident	28 Å²	28	68.3 Å²	68.3	15%	0.147	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-93.1	133.1	168.9	-176.8	68.9	0	0	0	109.1	I647 S658 V660 Q661 F736	I647-L656 HydrophobicContact CB-CD2 4.22Å; I647-L656 HydrophobicContact CD1-CD2 4.13Å; I647-L656 HydrophobicContact CG1-CD2 3.91Å; I647-L656 HydrophobicContact CG2-CD2 3.93Å; L656-S658 PolarHBondContact O-N 3.47Å; L656-V660 HydrophobicContact CD1-CB 4.47Å; L656-V660 HydrophobicContact CD1-CG1 4.23Å; L656-Q661 HydrophobicContact CD2-CB 3.86Å; L656-Q661 HydrophobicContact CD2-CG 4.19Å; L656-Q661 HydrophobicContact CG-CB 4.47Å; L656-F736 HydrophobicContact CB-CD2 4.24Å; L656-F736 HydrophobicContact CB-CE2 4.45Å; L656-F736 HydrophobicContact CD1-CD1 3.7Å; L656-F736 HydrophobicContact CD1-CD2 4.3Å; L656-F736 HydrophobicContact CD1-CE1 3.9Å; L656-F736 HydrophobicContact CD1-CE2 4.47Å; L656-F736 HydrophobicContact CD1-CG 3.92Å; L656-F736 HydrophobicContact CD1-CZ 4.29Å; L656-F736 HydrophobicContact CD2-CZ 4.41Å
657	P	75.5	Confident	79.6	Confident	26 Å²	26	68.4 Å²	68.4	17%	0.169	40%	0.402	C	S	.	.	P	Polyproline II helix	trans	-59.9	129.7	173.6	-23.6	34.2	0	0	0	111.3	A659 V660 Q661 E732	P657-A659 PolarHBondContact O-N 3.01Å; P657-A659 VanDerWaalsContact O-N 3.14Å; P657-V660 HydrophobicContact CB-CG2 4.29Å; P657-V660 PolarHBondContact O-N 3.46Å; P657-Q661 PolarHBondContact O-N 2.92Å; P657-E732 HydrophobicContact CG-CB 3.64Å
658	S	76	Confident	80	Confident	96 Å²	96	69 Å²	69	67%	0.671	40%	0.404	S	S	*	.	H	α-helix	trans	-60.9	-26.2	-178.1	56.8	0	0	0	0	113.3	L656 A662	L656-S658 PolarHBondContact O-N 3.47Å; S658-A662 VanDerWaalsContact O-CB 3.26Å; S658-A662 WeakPolarHBondContact O-CB 3.43Å; S658-A662 PolarHBondContact O-N 3.46Å
659	A	74.1	Confident	80.5	Confident	46 Å²	46	65.2 Å²	65.2	38%	0.38	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-45.4	170.2	0	0	0	0	0	112.2	P657 A662 Q663	P657-A659 PolarHBondContact O-N 3.01Å; P657-A659 VanDerWaalsContact O-N 3.14Å; A659-A662 PolarHBondContact O-N 3.1Å; A659-Q663 WeakPolarHBondContact O-CB 3.47Å; A659-Q663 VanDerWaalsContact O-CG 3.29Å; A659-Q663 WeakPolarHBondContact O-CG 3.46Å; A659-Q663 PolarHBondContact O-N 2.81Å; A659-Q663 PolarHBondContact O-OE1 3.47Å
660	V	76.3	Confident	81.1	Confident	6 Å²	6	60.1 Å²	60.1	4%	0.036	36%	0.363	C	S	.	.	H	α-helix	trans	-73.7	-38.4	-179.7	178.6	0	0	0	0	111	L656 P657 A662 Q663 R664 H729	L656-V660 HydrophobicContact CD1-CB 4.47Å; L656-V660 HydrophobicContact CD1-CG1 4.23Å; P657-V660 HydrophobicContact CB-CG2 4.29Å; P657-V660 PolarHBondContact O-N 3.46Å; V660-A662 VanDerWaalsContact C-N 3.34Å; V660-A662 PolarHBondContact O-N 3.32Å; V660-Q663 CarbonylContact O-C 3.52Å; V660-Q663 WeakPolarHBondContact O-CA 3.47Å; V660-Q663 PolarHBondContact O-N 3.21Å; V660-R664 PolarHBondContact O-N 3.05Å; V660-H729 HydrophobicContact CG2-CB 3.74Å
661	Q	81.7	Confident	81.8	Confident	82 Å²	82	57.5 Å²	57.5	38%	0.383	35%	0.346	S	S	.	.	H	α-helix	trans	-59.2	-44.8	172.5	-166.3	176.1	40.8	0	0	111.5	I647 L656 P657 Q663 R664	I647-Q661 HydrophobicContact CG2-CG 3.89Å; I647-Q661 PolarHBondContact O-NE2 2.77Å; L656-Q661 HydrophobicContact CD2-CB 3.86Å; L656-Q661 HydrophobicContact CD2-CG 4.19Å; L656-Q661 HydrophobicContact CG-CB 4.47Å; P657-Q661 PolarHBondContact O-N 2.92Å; Q661-Q663 PolarHBondContact O-N 3.18Å; Q661-R664 PolarHBondContact O-N 2.98Å
662	A	82.6	Confident	82.7	Confident	89 Å²	89	59.3 Å²	59.3	74%	0.736	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-9	174.4	0	0	0	0	0	114.2	S658 A659 V660	S658-A662 VanDerWaalsContact O-CB 3.26Å; S658-A662 WeakPolarHBondContact O-CB 3.43Å; S658-A662 PolarHBondContact O-N 3.46Å; A659-A662 PolarHBondContact O-N 3.1Å; V660-A662 VanDerWaalsContact C-N 3.34Å; V660-A662 PolarHBondContact O-N 3.32Å
663	Q	87.2	Confident	83.9	Confident	67 Å²	67	55.9 Å²	55.9	31%	0.313	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	19.4	178.8	-67.5	-176.8	-68.6	0	0	112.8	A659 V660 Q661 D665 I666 L667 L725	A659-Q663 WeakPolarHBondContact O-CB 3.47Å; A659-Q663 VanDerWaalsContact O-CG 3.29Å; A659-Q663 WeakPolarHBondContact O-CG 3.46Å; A659-Q663 PolarHBondContact O-N 2.81Å; A659-Q663 PolarHBondContact O-OE1 3.47Å; V660-Q663 CarbonylContact O-C 3.52Å; V660-Q663 WeakPolarHBondContact O-CA 3.47Å; V660-Q663 PolarHBondContact O-N 3.21Å; Q661-Q663 PolarHBondContact O-N 3.18Å; Q663-D665 PolarHBondContact O-N 3Å; Q663-I666 HydrophobicContact CB-CB 4.45Å; Q663-I666 HydrophobicContact CB-CD1 4.35Å; Q663-I666 HydrophobicContact CG-CD1 4.21Å; Q663-I666 CarbonylContact O-C 3.47Å; Q663-I666 WeakPolarHBondContact O-CA 3.35Å; Q663-I666 WeakPolarHBondContact O-CB 3.27Å; Q663-I666 PolarHBondContact O-N 3.02Å; Q663-L667 PolarHBondContact O-N 2.89Å; Q663-L725 HydrophobicContact CB-CD1 4.32Å; Q663-L725 HydrophobicContact CB-CD2 3.96Å; Q663-L725 VanDerWaalsContact OE1-CD1 3.32Å
664	R	89.2	Confident	85.3	Confident	106 Å²	106	52.4 Å²	52.4	40%	0.4	30%	0.3	S	S	.	.	H	α-helix	trans	-52.6	-38.4	177.4	79.5	-174.9	-165.6	162.5	8.3	113.3	I647 D648 V660 Q661 I666 L667 F668	I647-R664 HydrophobicContact CD1-CB 4.41Å; I647-R664 HydrophobicContact CG2-CB 4.02Å; D648-R664 IonicContact OD1-CZ 3.83Å; D648-R664 IonicContact OD1-NH1 3.98Å; D648-R664 PolarHBondContact OD1-NH1 3.44Å; D648-R664 IonicContact OD2-NH1 2.63Å; D648-R664 PolarHBondContact OD2-NH1 2.94Å; V660-R664 PolarHBondContact O-N 3.05Å; Q661-R664 PolarHBondContact O-N 2.98Å; R664-I666 PolarHBondContact O-N 2.92Å; R664-L667 PolarHBondContact O-N 2.92Å; R664-F668 PolarHBondContact O-N 3.28Å
665	D	89.6	Confident	86.6	Confident	116 Å²	116	52.6 Å²	52.6	62%	0.62	30%	0.299	S	S	*	.	H	α-helix	trans	-67.8	-21.9	178.7	-58.8	-3.7	0	0	0	112	Q663 G669	Q663-D665 PolarHBondContact O-N 3Å; D665-G669 WeakPolarHBondContact O-CA 3.37Å; D665-G669 PolarHBondContact O-N 3.5Å; D665-G669 VanDerWaalsContact O-N 3.09Å
666	I	91	Very high	88	Confident	55 Å²	55	49.1 Å²	49.1	28%	0.282	28%	0.284	S	S	.	.	H	α-helix	trans	-89.3	-36.7	172.4	-58	175	0	0	0	110.5	Q663 R664 N718 K721 S722 L725	Q663-I666 HydrophobicContact CB-CB 4.45Å; Q663-I666 HydrophobicContact CB-CD1 4.35Å; Q663-I666 HydrophobicContact CG-CD1 4.21Å; Q663-I666 CarbonylContact O-C 3.47Å; Q663-I666 WeakPolarHBondContact O-CA 3.35Å; Q663-I666 WeakPolarHBondContact O-CB 3.27Å; Q663-I666 PolarHBondContact O-N 3.02Å; R664-I666 PolarHBondContact O-N 2.92Å; I666-N718 PolarHBondContact O-ND2 2.78Å; I666-K721 HydrophobicContact CG2-CB 3.58Å; I666-K721 HydrophobicContact CG2-CD 4.45Å; I666-S722 WeakPolarHBondContact O-CB 3.32Å; I666-L725 HydrophobicContact CG2-CD2 4.49Å
667	L	91.4	Very high	89.2	Confident	5 Å²	5	48.7 Å²	48.7	3%	0.026	28%	0.28	C	S	.	.	H	α-helix	trans	-63.2	-49.2	177.3	-178.3	59.8	0	0	0	111.7	I647 Q663 R664 S722 L725 L726 L754	I647-L667 HydrophobicContact CD1-CD2 3.73Å; Q663-L667 PolarHBondContact O-N 2.89Å; R664-L667 PolarHBondContact O-N 2.92Å; L667-S722 VanDerWaalsContact O-CB 3.31Å; L667-S722 WeakPolarHBondContact O-CB 3.45Å; L667-S722 PolarHBondContact O-OG 2.91Å; L667-L725 HydrophobicContact CB-CD2 3.9Å; L667-L725 HydrophobicContact CD1-CD2 4.4Å; L667-L726 HydrophobicContact CD1-CD1 4.21Å; L667-L726 HydrophobicContact CD1-CD2 3.77Å; L667-L726 HydrophobicContact CD1-CG 3.7Å; L667-L754 HydrophobicContact CD1-CD1 4.37Å
668	F	94.2	Very high	90.2	Very high	13 Å²	13	47.4 Å²	47.4	6%	0.057	27%	0.272	C	S	.	.	S	Bend	trans	-98.2	-19.9	-177.6	-61.7	-65.6	0	0	0	113.6	V639 V644 I647 R664 L671 Y715 L750 L754	V639-F668 HydrophobicContact CG1-CE1 4.31Å; V644-F668 HydrophobicContact CB-CE2 4.27Å; V644-F668 HydrophobicContact CB-CZ 4.41Å; V644-F668 HydrophobicContact CG1-CD2 4.45Å; V644-F668 HydrophobicContact CG1-CE2 4.45Å; V644-F668 HydrophobicContact CG2-CD1 3.8Å; V644-F668 HydrophobicContact CG2-CD2 3.94Å; V644-F668 HydrophobicContact CG2-CE1 3.71Å; V644-F668 HydrophobicContact CG2-CE2 3.82Å; V644-F668 HydrophobicContact CG2-CG 3.93Å; V644-F668 HydrophobicContact CG2-CZ 3.72Å; I647-F668 HydrophobicContact CD1-CE2 3.72Å; I647-F668 HydrophobicContact CD1-CZ 4.29Å; I647-F668 HydrophobicContact CG1-CE2 4.24Å; R664-F668 PolarHBondContact O-N 3.28Å; F668-L671 HydrophobicContact CB-CB 4.32Å; F668-L671 HydrophobicContact CD1-CD2 4.21Å; F668-L671 WeakPolarHBondContact O-CB 3.28Å; F668-L671 PolarHBondContact O-N 2.95Å; F668-Y715 VanDerWaalsContact O-CE2 3.3Å; F668-Y715 WeakPolarHBondContact O-CE2 3.14Å; F668-L750 HydrophobicContact CE1-CD1 4.42Å; F668-L750 HydrophobicContact CE1-CD2 4.31Å; F668-L754 HydrophobicContact CD1-CD2 3.9Å; F668-L754 HydrophobicContact CE1-CD2 4.34Å
669	G	93.3	Very high	91.2	Very high	26 Å²	26	47.4 Å²	47.4	27%	0.268	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-140.1	-171.3	0	0	0	0	0	111	D665 L671 N718	D665-G669 WeakPolarHBondContact O-CA 3.37Å; D665-G669 PolarHBondContact O-N 3.5Å; D665-G669 VanDerWaalsContact O-N 3.09Å; G669-L671 VanDerWaalsContact C-N 3.31Å; G669-L671 PolarHBondContact O-N 2.91Å; G669-N718 VanDerWaalsContact CA-ND2 3.27Å; G669-N718 WeakPolarHBondContact CA-ND2 3.49Å; G669-N718 PolarHBondContact N-ND2 2.72Å
670	N	95.1	Very high	92.2	Very high	19 Å²	19	48.5 Å²	48.5	10%	0.102	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	35.7	173.4	66.5	-35.5	0	0	0	113.4	A672 E673 I674 C711 T714 Y715	N670-A672 PolarHBondContact O-N 3.21Å; N670-E673 HydrophobicContact CB-CB 3.99Å; N670-E673 VanDerWaalsContact CB-OE2 3.3Å; N670-E673 WeakPolarHBondContact CB-OE2 3.49Å; N670-E673 PolarHBondContact ND2-OE2 2.97Å; N670-E673 WeakPolarHBondContact O-CB 3.38Å; N670-E673 PolarHBondContact O-N 3.19Å; N670-I674 PolarHBondContact O-N 2.96Å; N670-C711 PolarHBondContact ND2-O 3.1Å; N670-T714 HydrophobicContact CB-CG2 4.39Å; N670-Y715 VanDerWaalsContact OD1-CA 3.28Å; N670-Y715 WeakPolarHBondContact OD1-CA 3.35Å; N670-Y715 WeakPolarHBondContact OD1-CB 3.33Å; N670-Y715 PolarHBondContact OD1-N 3.4Å; N670-Y715 VanDerWaalsContact OD1-N 3.16Å
671	L	96.3	Very high	93.1	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-54.2	-37.9	177.6	-167.5	63.9	0	0	0	112.8	L636 V639 F668 G669 E673 I674 H675 Y715 L754 P757	L636-L671 HydrophobicContact CD1-CD1 4.46Å; L636-L671 HydrophobicContact CD2-CD1 3.72Å; L636-L671 HydrophobicContact CD2-CG 4.43Å; V639-L671 HydrophobicContact CB-CD2 4.47Å; V639-L671 HydrophobicContact CG1-CD2 3.72Å; F668-L671 HydrophobicContact CB-CB 4.32Å; F668-L671 HydrophobicContact CD1-CD2 4.21Å; F668-L671 WeakPolarHBondContact O-CB 3.28Å; F668-L671 PolarHBondContact O-N 2.95Å; G669-L671 VanDerWaalsContact C-N 3.31Å; G669-L671 PolarHBondContact O-N 2.91Å; L671-E673 VanDerWaalsContact C-N 3.34Å; L671-E673 PolarHBondContact O-N 2.92Å; L671-I674 PolarHBondContact O-N 3.47Å; L671-H675 VanDerWaalsContact O-CB 3.3Å; L671-H675 WeakPolarHBondContact O-CB 3.31Å; L671-H675 PolarHBondContact O-N 2.94Å; L671-Y715 HydrophobicContact CB-CE2 4.01Å; L671-Y715 HydrophobicContact CD1-CE2 3.76Å; L671-Y715 HydrophobicContact CG-CE2 4.49Å; L671-L754 HydrophobicContact CD2-CD2 3.97Å; L671-P757 HydrophobicContact CD1-CG 3.72Å
672	A	95.4	Very high	93.8	Very high	52 Å²	52	48.9 Å²	48.9	43%	0.43	26%	0.263	S	S	.	.	H	α-helix	trans	-65.1	-33.9	177.4	0	0	0	0	0	113.1	M640 N670 Q676	M640-A672 HydrophobicContact CE-CB 3.72Å; M640-A672 HydrophobicContact SD-CB 4.19Å; N670-A672 PolarHBondContact O-N 3.21Å; A672-Q676 WeakPolarHBondContact O-CB 3.49Å; A672-Q676 PolarHBondContact O-N 3.17Å
673	E	96	Very high	94.4	Very high	79 Å²	79	45.1 Å²	45.1	37%	0.369	23%	0.23	S	C	.	.	H	α-helix	trans	-67.8	-47.5	175.9	-171.6	-169.9	170.6	0	0	110.3	N670 L671 Q676 F677 C711	N670-E673 HydrophobicContact CB-CB 3.99Å; N670-E673 VanDerWaalsContact CB-OE2 3.3Å; N670-E673 WeakPolarHBondContact CB-OE2 3.49Å; N670-E673 PolarHBondContact ND2-OE2 2.97Å; N670-E673 WeakPolarHBondContact O-CB 3.38Å; N670-E673 PolarHBondContact O-N 3.19Å; L671-E673 VanDerWaalsContact C-N 3.34Å; L671-E673 PolarHBondContact O-N 2.92Å; E673-Q676 PolarHBondContact O-N 3.35Å; E673-F677 VanDerWaalsContact O-CB 3.31Å; E673-F677 WeakPolarHBondContact O-CB 3.46Å; E673-F677 PolarHBondContact O-N 3.22Å; E673-C711 HydrophobicContact CG-CB 4.1Å; E673-C711 WeakPolarHBondContact OE1-CB 3.4Å
674	I	96.6	Very high	94.8	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-50	175.2	-71.8	169.3	0	0	0	110.4	Y632 L636 N670 L671 Q676 F677 H678 C711 Y712 Y715 P757	Y632-I674 WeakPolarHBondContact OH-CG2 3.34Å; L636-I674 HydrophobicContact CD1-CG2 3.91Å; N670-I674 PolarHBondContact O-N 2.96Å; L671-I674 PolarHBondContact O-N 3.47Å; I674-Q676 PolarHBondContact O-N 3.45Å; I674-F677 PolarHBondContact O-N 3.26Å; I674-H678 WeakPolarHBondContact O-CB 3.4Å; I674-H678 PolarHBondContact O-CD2 3.25Å; I674-H678 VanDerWaalsContact O-CD2 3.23Å; I674-H678 PolarHBondContact O-N 3.16Å; I674-C711 HydrophobicContact CG1-CB 4.21Å; I674-C711 WeakPolarHBondContact CG1-SG 3.48Å; I674-Y712 HydrophobicContact CD1-CD1 4.23Å; I674-Y712 HydrophobicContact CD1-CE1 4.4Å; I674-Y712 HydrophobicContact CD1-CG 4.34Å; I674-Y712 HydrophobicContact CG1-CD2 4.47Å; I674-Y712 HydrophobicContact CG1-CE2 4.42Å; I674-Y712 HydrophobicContact CG2-CE1 4.42Å; I674-Y712 HydrophobicContact CG2-CE2 4.31Å; I674-Y715 HydrophobicContact CD1-CD2 3.72Å; I674-Y715 HydrophobicContact CD1-CG 3.67Å; I674-P757 HydrophobicContact CD1-CB 4.17Å
675	H	97.4	Very high	95	Very high	17 Å²	17	39.3 Å²	39.3	8%	0.079	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-49.5	179	174.2	-120	0	0	0	112	L636 S637 M640 L671 H678 K679	L636-H675 HydrophobicContact CB-CB 4.36Å; L636-H675 HydrophobicContact CD1-CB 4.19Å; S637-H675 VanDerWaalsContact CA-NE2 3.34Å; S637-H675 WeakPolarHBondContact CA-NE2 2.96Å; S637-H675 PolarHBondContact N-NE2 3.48Å; S637-H675 PolarHBondContact OG-NE2 2.9Å; M640-H675 HydrophobicContact CG-CB 4.42Å; L671-H675 VanDerWaalsContact O-CB 3.3Å; L671-H675 WeakPolarHBondContact O-CB 3.31Å; L671-H675 PolarHBondContact O-N 2.94Å; H675-H678 PolarHBondContact O-N 3.19Å; H675-K679 WeakPolarHBondContact O-CB 3.44Å; H675-K679 PolarHBondContact O-N 3.47Å
676	Q	96.6	Very high	95.1	Very high	103 Å²	103	33.8 Å²	33.8	48%	0.481	18%	0.183	S	C	.	.	H	α-helix	trans	-61.4	-46.7	178	179.5	67.1	-0.6	0	0	111.8	A672 E673 I674 K679 V680	A672-Q676 WeakPolarHBondContact O-CB 3.49Å; A672-Q676 PolarHBondContact O-N 3.17Å; E673-Q676 PolarHBondContact O-N 3.35Å; I674-Q676 PolarHBondContact O-N 3.45Å; Q676-K679 PolarHBondContact O-N 3Å; Q676-V680 WeakPolarHBondContact O-CB 3.35Å; Q676-V680 WeakPolarHBondContact O-CG2 3.3Å; Q676-V680 PolarHBondContact O-N 2.97Å
677	F	96.8	Very high	95.1	Very high	18 Å²	18	33.7 Å²	33.7	8%	0.079	18%	0.183	C	C	.	.	H	α-helix	trans	-59.6	-48	178	163.7	-110.7	0	0	0	112	E673 I674 H681 F682 H705 L709	E673-F677 VanDerWaalsContact O-CB 3.31Å; E673-F677 WeakPolarHBondContact O-CB 3.46Å; E673-F677 PolarHBondContact O-N 3.22Å; I674-F677 PolarHBondContact O-N 3.26Å; F677-H681 HydrophobicContact CD2-CB 4.1Å; F677-H681 HydrophobicContact CE2-CB 4.27Å; F677-H681 WeakPolarHBondContact O-CA 3.48Å; F677-H681 WeakPolarHBondContact O-CB 3.35Å; F677-H681 PolarHBondContact O-N 3.3Å; F677-F682 HydrophobicContact CE1-CB 4.01Å; F677-F682 HydrophobicContact CE1-CG 4.26Å; F677-F682 HydrophobicContact CE2-CB 4.22Å; F677-F682 HydrophobicContact CZ-CB 3.78Å; F677-F682 AromaticContact CZ-CD2 3.94Å; F677-F682 HydrophobicContact CZ-CD2 3.94Å; F677-F682 AromaticContact CZ-CG 3.98Å; F677-F682 HydrophobicContact CZ-CG 3.98Å; F677-F682 PolarHBondContact O-N 3.48Å; F677-H705 HydrophobicContact CE2-CB 3.91Å; F677-H705 HydrophobicContact CZ-CB 3.87Å; F677-L709 HydrophobicContact CE1-CD2 3.74Å; F677-L709 HydrophobicContact CE1-CG 3.91Å; F677-L709 HydrophobicContact CZ-CD2 4.24Å; F677-L709 HydrophobicContact CZ-CG 3.97Å
678	H	97.7	Very high	95.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	20%	0.202	C	C	.	.	I	π-helix	trans	-67.4	-44.2	179.8	-80.7	-78	0	0	0	112.2	E629 Y632 V633 I674 H675 F682 L683 Y712 Y764	E629-H678 IonicContact OE1-CE1 2.9Å; E629-H678 IonicContact OE1-CG 2.7Å; E629-H678 IonicContact OE1-ND1 3.54Å; E629-H678 PolarHBondContact OE1-ND1 3Å; Y632-H678 AromaticContact CE1-CD2 4Å; Y632-H678 AromaticContact CE1-CG 3.93Å; V633-H678 HydrophobicContact CG2-CB 3.78Å; I674-H678 WeakPolarHBondContact O-CB 3.4Å; I674-H678 PolarHBondContact O-CD2 3.25Å; I674-H678 VanDerWaalsContact O-CD2 3.23Å; I674-H678 PolarHBondContact O-N 3.16Å; H675-H678 PolarHBondContact O-N 3.19Å; H678-F682 AromaticContact CE1-CD1 3.5Å; H678-F682 VanDerWaalsContact CE1-CD1 3.5Å; H678-F682 WeakPolarHBondContact CE1-CD1 3.39Å; H678-F682 AromaticContact ND1-CD1 3.52Å; H678-L683 VanDerWaalsContact O-CB 3.23Å; H678-L683 WeakPolarHBondContact O-CB 3.45Å; H678-L683 PolarHBondContact O-N 3.37Å; H678-Y712 PolarHBondContact CD2-OH 2.92Å; H678-Y712 PolarHBondContact CE1-OH 2.96Å; H678-Y712 AromaticContact NE2-CE2 3.28Å; H678-Y712 VanDerWaalsContact NE2-CE2 3.28Å; H678-Y712 WeakPolarHBondContact NE2-CE2 3.32Å; H678-Y712 AromaticContact NE2-CZ 3.42Å; H678-Y712 PolarHBondContact NE2-OH 2.92Å; H678-Y764 PolarHBondContact CE1-OH 2.92Å
679	K	96.6	Very high	94.7	Very high	95 Å²	95	38.7 Å²	38.7	41%	0.413	20%	0.202	S	C	.	.	I	π-helix	trans	-68.4	-37.9	-178.2	-172	165.5	-176.4	164.3	0	113.8	V633 S637 H675 Q676	V633-K679 HydrophobicContact CG1-CB 3.85Å; V633-K679 HydrophobicContact CG1-CD 4.27Å; V633-K679 HydrophobicContact CG1-CG 3.93Å; S637-K679 PolarHBondContact OG-NZ 2.9Å; H675-K679 WeakPolarHBondContact O-CB 3.44Å; H675-K679 PolarHBondContact O-N 3.47Å; Q676-K679 PolarHBondContact O-N 3Å
680	V	96.2	Very high	94.4	Very high	69 Å²	69	39.5 Å²	39.5	42%	0.418	20%	0.204	S	C	.	.	I	π-helix	trans	-103.3	-26.2	-170.5	-177.5	0	0	0	0	113.4	Q676	Q676-V680 WeakPolarHBondContact O-CB 3.35Å; Q676-V680 WeakPolarHBondContact O-CG2 3.3Å; Q676-V680 PolarHBondContact O-N 2.97Å
681	H	94.9	Very high	93.8	Very high	96 Å²	96	48.3 Å²	48.3	44%	0.444	24%	0.236	S	C	.	.	I	π-helix	trans	-117.8	-57.5	-176.8	-55.2	-57.3	0	0	0	112.6	F677 S685	F677-H681 HydrophobicContact CD2-CB 4.1Å; F677-H681 HydrophobicContact CE2-CB 4.27Å; F677-H681 WeakPolarHBondContact O-CA 3.48Å; F677-H681 WeakPolarHBondContact O-CB 3.35Å; F677-H681 PolarHBondContact O-N 3.3Å; H681-S685 WeakPolarHBondContact O-CB 3.47Å; H681-S685 PolarHBondContact O-N 3.44Å; H681-S685 VanDerWaalsContact O-N 3.1Å
682	F	95.9	Very high	92.6	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-74.6	-50.9	-166.4	-159.6	-119.2	0	0	0	114.2	F677 H678 S685 L686 F702 H705 Y764	F677-F682 HydrophobicContact CE1-CB 4.01Å; F677-F682 HydrophobicContact CE1-CG 4.26Å; F677-F682 HydrophobicContact CE2-CB 4.22Å; F677-F682 HydrophobicContact CZ-CB 3.78Å; F677-F682 AromaticContact CZ-CD2 3.94Å; F677-F682 HydrophobicContact CZ-CD2 3.94Å; F677-F682 AromaticContact CZ-CG 3.98Å; F677-F682 HydrophobicContact CZ-CG 3.98Å; F677-F682 PolarHBondContact O-N 3.48Å; H678-F682 AromaticContact CE1-CD1 3.5Å; H678-F682 VanDerWaalsContact CE1-CD1 3.5Å; H678-F682 WeakPolarHBondContact CE1-CD1 3.39Å; H678-F682 AromaticContact ND1-CD1 3.52Å; F682-S685 PolarHBondContact O-N 3.09Å; F682-S685 VanDerWaalsContact O-N 3.14Å; F682-L686 HydrophobicContact CD1-CD1 3.81Å; F682-L686 HydrophobicContact CD1-CG 4.35Å; F682-L686 HydrophobicContact CE1-CD1 3.48Å; F682-L686 VanDerWaalsContact CE1-CD1 3.48Å; F682-L686 HydrophobicContact CE1-CG 4.1Å; F682-L686 HydrophobicContact CZ-CD1 4Å; F682-L686 HydrophobicContact CZ-CD2 4.24Å; F682-L686 HydrophobicContact CZ-CG 4.17Å; F682-L686 PolarHBondContact O-N 3.14Å; F682-F702 HydrophobicContact CE1-CE1 4.14Å; F682-F702 HydrophobicContact CE1-CZ 4.37Å; F682-F702 HydrophobicContact CE2-CD1 4.28Å; F682-F702 AromaticContact CZ-CD1 3.65Å; F682-F702 HydrophobicContact CZ-CD1 3.65Å; F682-F702 HydrophobicContact CZ-CD2 4.48Å; F682-F702 AromaticContact CZ-CE1 3.51Å; F682-F702 HydrophobicContact CZ-CE1 3.51Å; F682-F702 HydrophobicContact CZ-CE2 4.36Å; F682-F702 HydrophobicContact CZ-CG 4.16Å; F682-F702 AromaticContact CZ-CZ 3.89Å; F682-F702 HydrophobicContact CZ-CZ 3.89Å; F682-H705 HydrophobicContact CD2-CB 3.67Å; F682-H705 AromaticContact CD2-CD2 3.85Å; F682-H705 AromaticContact CD2-CG 3.95Å; F682-H705 HydrophobicContact CE2-CB 4.03Å; F682-Y764 HydrophobicContact CE1-CE1 4.04Å; F682-Y764 AromaticContact CE1-CZ 3.94Å
683	L	95.5	Very high	90.8	Very high	10 Å²	10	54.9 Å²	54.9	5%	0.052	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-44.9	176.6	170.3	63.2	0	0	0	112	E629 V633 H678 S685 L686 L687	E629-L683 HydrophobicContact CB-CD1 4.04Å; E629-L683 HydrophobicContact CG-CB 3.83Å; E629-L683 HydrophobicContact CG-CD1 3.66Å; E629-L683 HydrophobicContact CG-CG 4.26Å; V633-L683 HydrophobicContact CB-CD2 4.04Å; V633-L683 HydrophobicContact CG1-CD2 4.17Å; V633-L683 HydrophobicContact CG2-CB 4.31Å; V633-L683 HydrophobicContact CG2-CD2 3.93Å; H678-L683 VanDerWaalsContact O-CB 3.23Å; H678-L683 WeakPolarHBondContact O-CB 3.45Å; H678-L683 PolarHBondContact O-N 3.37Å; L683-S685 VanDerWaalsContact C-N 3.32Å; L683-S685 PolarHBondContact O-N 2.94Å; L683-L686 PolarHBondContact O-N 3.35Å; L683-L687 HydrophobicContact CD1-CD1 3.77Å; L683-L687 HydrophobicContact CD1-CG 3.91Å; L683-L687 HydrophobicContact CG-CD1 3.9Å; L683-L687 HydrophobicContact CG-CG 4.47Å; L683-L687 WeakPolarHBondContact O-CB 3.3Å; L683-L687 WeakPolarHBondContact O-CG 3.49Å; L683-L687 PolarHBondContact O-N 3.46Å
684	P	94.9	Very high	89.6	Confident	50 Å²	50	51.9 Å²	51.9	33%	0.325	27%	0.265	S	S	.	.	H	α-helix	trans	-59.1	-35.8	171.9	-28.7	37.7	0	0	0	114.5	R688	P684-R688 WeakPolarHBondContact O-CB 3.44Å; P684-R688 PolarHBondContact O-N 3.13Å; P684-R688 VanDerWaalsContact O-N 3.12Å
685	S	93.2	Very high	88.5	Confident	1 Å²	1	52.2 Å²	52.2	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-71.7	-44.2	176.2	-158.3	0	0	0	0	111.6	H681 F682 L683 L687 R688 S689 E704 H705	H681-S685 WeakPolarHBondContact O-CB 3.47Å; H681-S685 PolarHBondContact O-N 3.44Å; H681-S685 VanDerWaalsContact O-N 3.1Å; F682-S685 PolarHBondContact O-N 3.09Å; F682-S685 VanDerWaalsContact O-N 3.14Å; L683-S685 VanDerWaalsContact C-N 3.32Å; L683-S685 PolarHBondContact O-N 2.94Å; S685-L687 VanDerWaalsContact C-N 3.34Å; S685-L687 PolarHBondContact O-N 2.9Å; S685-R688 WeakPolarHBondContact O-CA 3.35Å; S685-R688 WeakPolarHBondContact O-CB 3.25Å; S685-R688 PolarHBondContact O-N 3.27Å; S685-R688 PolarHBondContact OG-NH1 2.89Å; S685-S689 PolarHBondContact O-N 3.46Å; S685-S689 PolarHBondContact O-OG 3.33Å; S685-E704 PolarHBondContact OG-OE2 3.34Å; S685-E704 VanDerWaalsContact OG-OE2 3.14Å; S685-H705 WeakPolarHBondContact CB-NE2 3.46Å; S685-H705 PolarHBondContact OG-NE2 3.33Å
686	L	92.3	Very high	87.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61.7	-38.4	173.4	-70.7	179.9	0	0	0	113	L625 V626 E629 F682 L683 R688 S690 I698 A701 F702	L625-L686 HydrophobicContact CD1-CD1 4.16Å; L625-L686 HydrophobicContact CD2-CD1 4.42Å; L625-L686 HydrophobicContact CD2-CD2 3.94Å; L625-L686 HydrophobicContact CG-CD1 4.15Å; V626-L686 HydrophobicContact CG2-CB 4.42Å; E629-L686 HydrophobicContact CB-CD1 4.37Å; E629-L686 HydrophobicContact CG-CD1 4Å; F682-L686 HydrophobicContact CD1-CD1 3.81Å; F682-L686 HydrophobicContact CD1-CG 4.35Å; F682-L686 HydrophobicContact CE1-CD1 3.48Å; F682-L686 VanDerWaalsContact CE1-CD1 3.48Å; F682-L686 HydrophobicContact CE1-CG 4.1Å; F682-L686 HydrophobicContact CZ-CD1 4Å; F682-L686 HydrophobicContact CZ-CD2 4.24Å; F682-L686 HydrophobicContact CZ-CG 4.17Å; F682-L686 PolarHBondContact O-N 3.14Å; L683-L686 PolarHBondContact O-N 3.35Å; L686-R688 PolarHBondContact O-N 3.31Å; L686-S690 VanDerWaalsContact O-CB 3.3Å; L686-S690 WeakPolarHBondContact O-CB 3.23Å; L686-S690 PolarHBondContact O-N 3.47Å; L686-S690 PolarHBondContact O-OG 3.04Å; L686-I698 HydrophobicContact CD2-CD1 3.91Å; L686-I698 HydrophobicContact CD2-CG2 4.3Å; L686-A701 HydrophobicContact CD2-CB 4.3Å; L686-F702 HydrophobicContact CD2-CE2 4.43Å
687	L	92	Very high	87	Confident	54 Å²	54	54.5 Å²	54.5	28%	0.283	28%	0.277	S	S	.	.	H	α-helix	trans	-66.8	-24.7	173.5	-78.1	168.6	0	0	0	113	V626 L683 S685 S690 R691	V626-L687 HydrophobicContact CG1-CD2 3.59Å; V626-L687 HydrophobicContact CG1-CG 4.36Å; L683-L687 HydrophobicContact CD1-CD1 3.77Å; L683-L687 HydrophobicContact CD1-CG 3.91Å; L683-L687 HydrophobicContact CG-CD1 3.9Å; L683-L687 HydrophobicContact CG-CG 4.47Å; L683-L687 WeakPolarHBondContact O-CB 3.3Å; L683-L687 WeakPolarHBondContact O-CG 3.49Å; L683-L687 PolarHBondContact O-N 3.46Å; S685-L687 VanDerWaalsContact C-N 3.34Å; S685-L687 PolarHBondContact O-N 2.9Å; L687-S690 WeakPolarHBondContact CA-OG 3.29Å; L687-S690 PolarHBondContact O-OG 3Å; L687-R691 VanDerWaalsContact O-CD 3.27Å; L687-R691 WeakPolarHBondContact O-CD 3.39Å; L687-R691 VanDerWaalsContact O-CG 3.3Å; L687-R691 WeakPolarHBondContact O-CG 3.2Å; L687-R691 PolarHBondContact O-NE 3.38Å
688	R	90.2	Very high	86.6	Confident	114 Å²	114	53.8 Å²	53.8	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-79.2	-56	172.8	-167.4	-165.6	-54.4	120.1	4.5	110.4	P684 S685 L686 S690 R691 E692	P684-R688 WeakPolarHBondContact O-CB 3.44Å; P684-R688 PolarHBondContact O-N 3.13Å; P684-R688 VanDerWaalsContact O-N 3.12Å; S685-R688 WeakPolarHBondContact O-CA 3.35Å; S685-R688 WeakPolarHBondContact O-CB 3.25Å; S685-R688 PolarHBondContact O-N 3.27Å; S685-R688 PolarHBondContact OG-NH1 2.89Å; L686-R688 PolarHBondContact O-N 3.31Å; R688-S690 VanDerWaalsContact C-N 3.26Å; R688-S690 PolarHBondContact O-N 3.08Å; R688-R691 WeakPolarHBondContact O-CA 3.43Å; R688-R691 WeakPolarHBondContact O-CB 3.3Å; R688-R691 PolarHBondContact O-N 3.29Å; R688-E692 WeakPolarHBondContact CD-OE1 3.49Å; R688-E692 VanDerWaalsContact CG-CD 3.49Å; R688-E692 HydrophobicContact CG-CG 4.4Å; R688-E692 WeakPolarHBondContact CG-OE1 3.39Å; R688-E692 PolarHBondContact O-N 3.18Å
689	S	86.9	Confident	86	Confident	8 Å²	8	53.8 Å²	53.8	6%	0.056	27%	0.273	C	S	.	.	H	α-helix	trans	-57.6	-33.9	-179.9	-66.1	0	0	0	0	114	S685 R691 E692 G693 E697	S685-S689 PolarHBondContact O-N 3.46Å; S685-S689 PolarHBondContact O-OG 3.33Å; S689-R691 VanDerWaalsContact C-N 3.27Å; S689-R691 PolarHBondContact O-N 3.27Å; S689-E692 PolarHBondContact O-N 2.79Å; S689-G693 PolarHBondContact O-N 2.93Å; S689-E697 VanDerWaalsContact CB-C 3.49Å; S689-E697 WeakPolarHBondContact CB-O 3.39Å; S689-E697 PolarHBondContact OG-O 3.5Å
690	S	85.6	Confident	85.6	Confident	44 Å²	44	52 Å²	52	31%	0.308	27%	0.269	S	S	.	.	H	α-helix	trans	-69.4	-20.5	174.7	53	0	0	0	0	114	L686 L687 R688	L686-S690 VanDerWaalsContact O-CB 3.3Å; L686-S690 WeakPolarHBondContact O-CB 3.23Å; L686-S690 PolarHBondContact O-N 3.47Å; L686-S690 PolarHBondContact O-OG 3.04Å; L687-S690 WeakPolarHBondContact CA-OG 3.29Å; L687-S690 PolarHBondContact O-OG 3Å; R688-S690 VanDerWaalsContact C-N 3.26Å; R688-S690 PolarHBondContact O-N 3.08Å
691	R	82.5	Confident	85.3	Confident	204 Å²	204	48.9 Å²	48.9	77%	0.77	25%	0.25	S	C	*	.	H	α-helix	trans	-89.5	-33.8	171.4	-60.5	168.5	-171.6	-165.5	0.2	112.2	L687 R688 S689 G693	L687-R691 VanDerWaalsContact O-CD 3.27Å; L687-R691 WeakPolarHBondContact O-CD 3.39Å; L687-R691 VanDerWaalsContact O-CG 3.3Å; L687-R691 WeakPolarHBondContact O-CG 3.2Å; L687-R691 PolarHBondContact O-NE 3.38Å; R688-R691 WeakPolarHBondContact O-CA 3.43Å; R688-R691 WeakPolarHBondContact O-CB 3.3Å; R688-R691 PolarHBondContact O-N 3.29Å; S689-R691 VanDerWaalsContact C-N 3.27Å; S689-R691 PolarHBondContact O-N 3.27Å; R691-G693 VanDerWaalsContact C-N 3.33Å; R691-G693 PolarHBondContact O-N 3.39Å
692	E	71.4	Confident	85.2	Confident	126 Å²	126	44.4 Å²	44.4	59%	0.589	23%	0.229	S	C	*	.	H	α-helix	trans	-80	-10.7	-174.1	-72.5	172.8	178	0	0	114	R688 S689	R688-E692 WeakPolarHBondContact CD-OE1 3.49Å; R688-E692 VanDerWaalsContact CG-CD 3.49Å; R688-E692 HydrophobicContact CG-CG 4.4Å; R688-E692 WeakPolarHBondContact CG-OE1 3.39Å; R688-E692 PolarHBondContact O-N 3.18Å; S689-E692 PolarHBondContact O-N 2.79Å
693	G	57.9	Low	84.9	Confident	64 Å²	64	47.5 Å²	47.5	66%	0.66	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	120.6	20.3	142.3	0	0	0	0	0	118.6	S689 R691	S689-G693 PolarHBondContact O-N 2.93Å; R691-G693 VanDerWaalsContact C-N 3.33Å; R691-G693 PolarHBondContact O-N 3.39Å
694	G	70	Confident	84.7	Confident	16 Å²	16	52.9 Å²	52.9	17%	0.165	27%	0.27	C	S	.	.	S	Bend	trans	-174.5	173.4	175.9	0	0	0	0	0	117.9	K696 E697 I698	G694-K696 PolarHBondContact O-N 3.11Å; G694-E697 VanDerWaalsContact C-OE2 3.26Å; G694-E697 WeakPolarHBondContact CA-OE2 3.25Å; G694-E697 PolarHBondContact N-OE2 3.01Å; G694-E697 PolarHBondContact O-N 2.78Å; G694-I698 WeakPolarHBondContact O-CG1 3.36Å; G694-I698 PolarHBondContact O-N 3.41Å
695	A	75.1	Confident	84.6	Confident	7 Å²	7	51.9 Å²	51.9	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-68.6	-20.6	175.1	0	0	0	0	0	112.7	A699 N771 L775	A695-A699 WeakPolarHBondContact O-CB 3.44Å; A695-A699 PolarHBondContact O-N 2.84Å; A695-A699 VanDerWaalsContact O-N 3.08Å; A695-N771 HydrophobicContact CB-CB 4.07Å; A695-N771 WeakPolarHBondContact CB-OD1 3.2Å; A695-L775 HydrophobicContact CB-CD1 4.16Å
696	K	78.5	Confident	84.2	Confident	114 Å²	114	53 Å²	53	50%	0.496	27%	0.273	S	S	.	.	H	α-helix	trans	-71.7	-44.2	175.4	-176.1	-161.6	173.7	-161.1	0	110.4	G694 I698 A699 N700 D802	G694-K696 PolarHBondContact O-N 3.11Å; K696-I698 VanDerWaalsContact C-N 3.32Å; K696-I698 PolarHBondContact O-N 3.23Å; K696-A699 PolarHBondContact O-N 3.43Å; K696-N700 PolarHBondContact O-N 3.15Å; K696-N700 PolarHBondContact O-ND2 3.26Å; K696-N700 VanDerWaalsContact O-ND2 3.12Å; K696-D802 WeakPolarHBondContact CE-OD2 3.28Å; K696-D802 HydrophobicContact CG-CB 4.19Å; K696-D802 WeakPolarHBondContact CG-OD2 3.12Å
697	E	83.3	Confident	83.9	Confident	55 Å²	55	58.7 Å²	58.7	26%	0.257	30%	0.303	S	S	.	.	H	α-helix	trans	-66.4	-37.3	180	-65.9	57	-127.5	0	0	110.3	S689 G694 N700 A701	S689-E697 VanDerWaalsContact CB-C 3.49Å; S689-E697 WeakPolarHBondContact CB-O 3.39Å; S689-E697 PolarHBondContact OG-O 3.5Å; G694-E697 VanDerWaalsContact C-OE2 3.26Å; G694-E697 WeakPolarHBondContact CA-OE2 3.25Å; G694-E697 PolarHBondContact N-OE2 3.01Å; G694-E697 PolarHBondContact O-N 2.78Å; E697-N700 PolarHBondContact O-N 3.16Å; E697-A701 PolarHBondContact O-N 3.42Å; E697-A701 VanDerWaalsContact O-N 3.15Å
698	I	87.5	Confident	83.8	Confident	2 Å²	2	57.5 Å²	57.5	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-45.4	170.9	-68.1	-73.6	0	0	0	111.3	I622 L625 L686 G694 K696 N700 A701 F702	I622-I698 HydrophobicContact CD1-CG1 4.21Å; I622-I698 HydrophobicContact CG1-CG1 4.16Å; I622-I698 HydrophobicContact CG2-CD1 4.01Å; I622-I698 HydrophobicContact CG2-CG1 4.16Å; L625-I698 HydrophobicContact CD2-CD1 4.32Å; L625-I698 HydrophobicContact CD2-CG2 3.54Å; L686-I698 HydrophobicContact CD2-CD1 3.91Å; L686-I698 HydrophobicContact CD2-CG2 4.3Å; G694-I698 WeakPolarHBondContact O-CG1 3.36Å; G694-I698 PolarHBondContact O-N 3.41Å; K696-I698 VanDerWaalsContact C-N 3.32Å; K696-I698 PolarHBondContact O-N 3.23Å; I698-N700 VanDerWaalsContact C-N 3.32Å; I698-N700 PolarHBondContact O-N 3.2Å; I698-A701 WeakPolarHBondContact O-CB 3.26Å; I698-A701 PolarHBondContact O-N 3.19Å; I698-F702 HydrophobicContact CG2-CD2 4.19Å; I698-F702 HydrophobicContact CG2-CE2 4.02Å; I698-F702 WeakPolarHBondContact O-CD2 3.18Å; I698-F702 PolarHBondContact O-N 3.28Å
699	A	86.3	Confident	83.9	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64.2	-35.8	176.3	0	0	0	0	0	112.8	A695 K696 A701 F702 L703 D802 V803 A806	A695-A699 WeakPolarHBondContact O-CB 3.44Å; A695-A699 PolarHBondContact O-N 2.84Å; A695-A699 VanDerWaalsContact O-N 3.08Å; K696-A699 PolarHBondContact O-N 3.43Å; A699-A701 VanDerWaalsContact C-N 3.34Å; A699-A701 PolarHBondContact O-N 3.33Å; A699-F702 WeakPolarHBondContact O-CB 3.2Å; A699-F702 PolarHBondContact O-N 2.74Å; A699-F702 VanDerWaalsContact O-N 3.13Å; A699-L703 WeakPolarHBondContact O-CG 3.48Å; A699-L703 PolarHBondContact O-N 3.29Å; A699-D802 HydrophobicContact CB-CB 4.23Å; A699-V803 HydrophobicContact CB-CB 4.16Å; A699-V803 HydrophobicContact CB-CG2 3.81Å; A699-A806 HydrophobicContact CB-CB 3.78Å
700	N	87.5	Confident	84	Confident	59 Å²	59	57.5 Å²	57.5	32%	0.316	30%	0.303	S	S	.	.	H	α-helix	trans	-65.4	-34.5	174.1	-75.4	-43.4	0	0	0	112.4	K696 E697 I698 L703 E704 D802	K696-N700 PolarHBondContact O-N 3.15Å; K696-N700 PolarHBondContact O-ND2 3.26Å; K696-N700 VanDerWaalsContact O-ND2 3.12Å; E697-N700 PolarHBondContact O-N 3.16Å; I698-N700 VanDerWaalsContact C-N 3.32Å; I698-N700 PolarHBondContact O-N 3.2Å; N700-L703 PolarHBondContact O-N 3.43Å; N700-E704 VanDerWaalsContact O-CB 3.3Å; N700-E704 WeakPolarHBondContact O-CB 3.49Å; N700-E704 PolarHBondContact O-N 2.88Å; N700-D802 PolarHBondContact ND2-OD2 3.3Å; N700-D802 PolarHBondContact OD1-OD2 2.95Å
701	A	90.6	Very high	84.3	Confident	2 Å²	2	55.7 Å²	55.7	2%	0.017	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-36.2	169.7	0	0	0	0	0	112.7	L686 E697 I698 A699 L703 H705	L686-A701 HydrophobicContact CD2-CB 4.3Å; E697-A701 PolarHBondContact O-N 3.42Å; E697-A701 VanDerWaalsContact O-N 3.15Å; I698-A701 WeakPolarHBondContact O-CB 3.26Å; I698-A701 PolarHBondContact O-N 3.19Å; A699-A701 VanDerWaalsContact C-N 3.34Å; A699-A701 PolarHBondContact O-N 3.33Å; A701-L703 VanDerWaalsContact C-N 3.33Å; A701-H705 WeakPolarHBondContact O-CB 3.47Å; A701-H705 PolarHBondContact O-CD2 3.47Å; A701-H705 VanDerWaalsContact O-CD2 3.27Å; A701-H705 PolarHBondContact O-N 2.78Å; A701-H705 VanDerWaalsContact O-N 3.1Å
702	F	92.1	Very high	84.8	Confident	3 Å²	3	46 Å²	46	1%	0.013	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-33.3	172.1	-83.9	-77.8	0	0	0	113.1	L625 F682 L686 I698 A699 G706 L709 Y764 L768 A806 I810	L625-F702 HydrophobicContact CD1-CZ 4.21Å; L625-F702 HydrophobicContact CD2-CE2 4.02Å; L625-F702 HydrophobicContact CD2-CZ 4.47Å; F682-F702 HydrophobicContact CE1-CE1 4.14Å; F682-F702 HydrophobicContact CE1-CZ 4.37Å; F682-F702 HydrophobicContact CE2-CD1 4.28Å; F682-F702 AromaticContact CZ-CD1 3.65Å; F682-F702 HydrophobicContact CZ-CD1 3.65Å; F682-F702 HydrophobicContact CZ-CD2 4.48Å; F682-F702 AromaticContact CZ-CE1 3.51Å; F682-F702 HydrophobicContact CZ-CE1 3.51Å; F682-F702 HydrophobicContact CZ-CE2 4.36Å; F682-F702 HydrophobicContact CZ-CG 4.16Å; F682-F702 AromaticContact CZ-CZ 3.89Å; F682-F702 HydrophobicContact CZ-CZ 3.89Å; L686-F702 HydrophobicContact CD2-CE2 4.43Å; I698-F702 HydrophobicContact CG2-CD2 4.19Å; I698-F702 HydrophobicContact CG2-CE2 4.02Å; I698-F702 WeakPolarHBondContact O-CD2 3.18Å; I698-F702 PolarHBondContact O-N 3.28Å; A699-F702 WeakPolarHBondContact O-CB 3.2Å; A699-F702 PolarHBondContact O-N 2.74Å; A699-F702 VanDerWaalsContact O-N 3.13Å; F702-G706 WeakPolarHBondContact O-CA 3.36Å; F702-G706 PolarHBondContact O-N 3.49Å; F702-L709 HydrophobicContact CD1-CD1 4.22Å; F702-Y764 AromaticContact CE1-CD1 3.68Å; F702-Y764 HydrophobicContact CE1-CD1 3.68Å; F702-Y764 HydrophobicContact CE1-CD2 4.14Å; F702-Y764 HydrophobicContact CE1-CE1 4.28Å; F702-Y764 AromaticContact CE1-CG 3.6Å; F702-Y764 HydrophobicContact CE1-CG 3.6Å; F702-Y764 AromaticContact CZ-CD1 3.57Å; F702-Y764 HydrophobicContact CZ-CD1 3.57Å; F702-Y764 HydrophobicContact CZ-CE1 4.21Å; F702-Y764 AromaticContact CZ-CG 3.93Å; F702-Y764 HydrophobicContact CZ-CG 3.93Å; F702-L768 HydrophobicContact CD1-CD1 4.14Å; F702-L768 HydrophobicContact CD2-CD1 4.07Å; F702-L768 HydrophobicContact CD2-CD2 3.7Å; F702-L768 HydrophobicContact CD2-CG 4.12Å; F702-L768 HydrophobicContact CE1-CD1 4.27Å; F702-L768 HydrophobicContact CE2-CD1 4.21Å; F702-L768 HydrophobicContact CE2-CD2 3.91Å; F702-L768 HydrophobicContact CE2-CG 4Å; F702-L768 HydrophobicContact CG-CD1 4.04Å; F702-L768 HydrophobicContact CG-CD2 4.37Å; F702-L768 HydrophobicContact CZ-CD1 4.31Å; F702-L768 HydrophobicContact CZ-CG 4.36Å; F702-A806 HydrophobicContact CB-CB 3.87Å; F702-I810 HydrophobicContact CD1-CD1 3.88Å; F702-I810 HydrophobicContact CD1-CG1 4.09Å; F702-I810 HydrophobicContact CE1-CD1 4.22Å; F702-I810 HydrophobicContact CE1-CG1 4.42Å
703	L	90.7	Very high	85.6	Confident	64 Å²	64	41 Å²	41	34%	0.335	23%	0.231	S	C	.	.	H	α-helix	trans	-77.2	-45	176.9	-67.8	170.6	0	0	0	112	A699 N700 A701 H705 G706 D802 L805 A806 A809	A699-L703 WeakPolarHBondContact O-CG 3.48Å; A699-L703 PolarHBondContact O-N 3.29Å; N700-L703 PolarHBondContact O-N 3.43Å; A701-L703 VanDerWaalsContact C-N 3.33Å; L703-H705 VanDerWaalsContact C-N 3.3Å; L703-H705 PolarHBondContact O-N 3.37Å; L703-G706 PolarHBondContact O-N 3.22Å; L703-D802 HydrophobicContact CD1-CB 4.41Å; L703-L805 HydrophobicContact CD1-CB 4.03Å; L703-L805 HydrophobicContact CD2-CB 4.04Å; L703-A806 HydrophobicContact CD2-CB 4.48Å; L703-A806 HydrophobicContact CG-CB 4.25Å; L703-A809 HydrophobicContact CD2-CB 4.49Å
704	E	91	Very high	87.1	Confident	124 Å²	124	40 Å²	40	58%	0.579	21%	0.213	S	C	*	.	H	α-helix	trans	-55.1	-44.7	175.1	-179.5	-175.5	-154.3	0	0	111.4	S685 N700	S685-E704 PolarHBondContact OG-OE2 3.34Å; S685-E704 VanDerWaalsContact OG-OE2 3.14Å; N700-E704 VanDerWaalsContact O-CB 3.3Å; N700-E704 WeakPolarHBondContact O-CB 3.49Å; N700-E704 PolarHBondContact O-N 2.88Å
705	H	91.7	Very high	88.2	Confident	29 Å²	29	39.4 Å²	39.4	13%	0.134	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	14.6	-176.8	-62.5	-58.7	0	0	0	114.2	F677 F682 S685 A701 L703 D707 G708 L709	F677-H705 HydrophobicContact CE2-CB 3.91Å; F677-H705 HydrophobicContact CZ-CB 3.87Å; F682-H705 HydrophobicContact CD2-CB 3.67Å; F682-H705 AromaticContact CD2-CD2 3.85Å; F682-H705 AromaticContact CD2-CG 3.95Å; F682-H705 HydrophobicContact CE2-CB 4.03Å; S685-H705 WeakPolarHBondContact CB-NE2 3.46Å; S685-H705 PolarHBondContact OG-NE2 3.33Å; A701-H705 WeakPolarHBondContact O-CB 3.47Å; A701-H705 PolarHBondContact O-CD2 3.47Å; A701-H705 VanDerWaalsContact O-CD2 3.27Å; A701-H705 PolarHBondContact O-N 2.78Å; A701-H705 VanDerWaalsContact O-N 3.1Å; L703-H705 VanDerWaalsContact C-N 3.3Å; L703-H705 PolarHBondContact O-N 3.37Å; H705-D707 VanDerWaalsContact C-N 3.32Å; H705-D707 PolarHBondContact O-N 3.01Å; H705-G708 PolarHBondContact O-N 3.03Å; H705-L709 PolarHBondContact O-N 3.12Å
706	G	86	Confident	89	Confident	25 Å²	25	39.6 Å²	39.6	26%	0.258	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-36.7	-176.3	0	0	0	0	0	114.4	F702 L703	F702-G706 WeakPolarHBondContact O-CA 3.36Å; F702-G706 PolarHBondContact O-N 3.49Å; L703-G706 PolarHBondContact O-N 3.22Å
707	D	85.5	Confident	89.3	Confident	118 Å²	118	36 Å²	36	63%	0.631	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-31.9	174.6	-84	-45.1	0	0	0	112.9	H705 L709 R710	H705-D707 VanDerWaalsContact C-N 3.32Å; H705-D707 PolarHBondContact O-N 3.01Å; D707-L709 VanDerWaalsContact C-N 3.3Å; D707-L709 PolarHBondContact O-N 2.83Å; D707-R710 VanDerWaalsContact O-CB 3.27Å; D707-R710 WeakPolarHBondContact O-CB 3.48Å; D707-R710 VanDerWaalsContact O-CG 3.29Å; D707-R710 WeakPolarHBondContact O-CG 3.48Å; D707-R710 PolarHBondContact O-N 2.99Å; D707-R710 VanDerWaalsContact O-N 3.14Å; D707-R710 WeakPolarHBondContact OD1-CD 3.42Å; D707-R710 IonicContact OD1-CZ 3.44Å; D707-R710 IonicContact OD1-NE 2.77Å; D707-R710 IonicContact OD1-NH1 3.23Å; D707-R710 PolarHBondContact OD1-NH1 3.43Å
708	G	88.9	Confident	89.6	Confident	29 Å²	29	33.9 Å²	33.9	30%	0.299	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-64.1	-35.1	175.4	0	0	0	0	0	112.7	H705 R710 C711	H705-G708 PolarHBondContact O-N 3.03Å; G708-R710 PolarHBondContact O-N 3.18Å; G708-R710 VanDerWaalsContact O-N 3.14Å; G708-C711 PolarHBondContact O-SG 3.32Å
709	L	92.4	Very high	89.8	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-67.4	-8.1	175.3	-70.5	162.4	0	0	0	113.9	F677 F702 H705 D707 C711 Y712 I761 Y764 I810 L813	F677-L709 HydrophobicContact CE1-CD2 3.74Å; F677-L709 HydrophobicContact CE1-CG 3.91Å; F677-L709 HydrophobicContact CZ-CD2 4.24Å; F677-L709 HydrophobicContact CZ-CG 3.97Å; F702-L709 HydrophobicContact CD1-CD1 4.22Å; H705-L709 PolarHBondContact O-N 3.12Å; D707-L709 VanDerWaalsContact C-N 3.3Å; D707-L709 PolarHBondContact O-N 2.83Å; L709-C711 VanDerWaalsContact C-N 3.27Å; L709-C711 PolarHBondContact O-N 3.41Å; L709-Y712 HydrophobicContact CD2-CD2 4.44Å; L709-Y712 HydrophobicContact CD2-CE2 3.98Å; L709-Y712 VanDerWaalsContact O-CD2 3.3Å; L709-Y712 WeakPolarHBondContact O-CD2 3.3Å; L709-Y712 PolarHBondContact O-N 2.84Å; L709-I761 HydrophobicContact CD2-CD1 4.3Å; L709-Y764 HydrophobicContact CD2-CE2 4.02Å; L709-I810 HydrophobicContact CD1-CD1 3.73Å; L709-L813 HydrophobicContact CB-CD2 3.58Å; L709-L813 WeakPolarHBondContact O-CD2 3.45Å
710	R	89.6	Confident	89.8	Confident	122 Å²	122	36.2 Å²	36.2	46%	0.46	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-73.1	-19.7	-177.6	-59.5	175.7	79.7	154.2	8.1	113.3	D707 G708 Y712 V713 L813	D707-R710 VanDerWaalsContact O-CB 3.27Å; D707-R710 WeakPolarHBondContact O-CB 3.48Å; D707-R710 VanDerWaalsContact O-CG 3.29Å; D707-R710 WeakPolarHBondContact O-CG 3.48Å; D707-R710 PolarHBondContact O-N 2.99Å; D707-R710 VanDerWaalsContact O-N 3.14Å; D707-R710 WeakPolarHBondContact OD1-CD 3.42Å; D707-R710 IonicContact OD1-CZ 3.44Å; D707-R710 IonicContact OD1-NE 2.77Å; D707-R710 IonicContact OD1-NH1 3.23Å; D707-R710 PolarHBondContact OD1-NH1 3.43Å; G708-R710 PolarHBondContact O-N 3.18Å; G708-R710 VanDerWaalsContact O-N 3.14Å; R710-Y712 PolarHBondContact O-N 3.19Å; R710-Y712 VanDerWaalsContact O-N 3.1Å; R710-V713 WeakPolarHBondContact O-CB 3.38Å; R710-V713 PolarHBondContact O-N 2.99Å; R710-L813 HydrophobicContact CG-CD1 4.37Å
711	C	91.5	Very high	89.7	Confident	5 Å²	5	35.1 Å²	35.1	3%	0.034	19%	0.189	C	C	.	.	H	α-helix	trans	-54.2	-26.4	172.2	61.5	0	0	0	0	113.3	N670 E673 I674 G708 L709 V713 T714 Y715	N670-C711 PolarHBondContact ND2-O 3.1Å; E673-C711 HydrophobicContact CG-CB 4.1Å; E673-C711 WeakPolarHBondContact OE1-CB 3.4Å; I674-C711 HydrophobicContact CG1-CB 4.21Å; I674-C711 WeakPolarHBondContact CG1-SG 3.48Å; G708-C711 PolarHBondContact O-SG 3.32Å; L709-C711 VanDerWaalsContact C-N 3.27Å; L709-C711 PolarHBondContact O-N 3.41Å; C711-V713 VanDerWaalsContact C-N 3.27Å; C711-V713 PolarHBondContact O-N 3.4Å; C711-T714 WeakPolarHBondContact O-CB 3.47Å; C711-T714 PolarHBondContact O-N 3.42Å; C711-Y715 PolarHBondContact O-N 3.09Å; C711-Y715 VanDerWaalsContact O-N 3.15Å
712	Y	92.9	Very high	89.8	Confident	2 Å²	2	35.1 Å²	35.1	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-26	175.7	-76.1	-97.5	0	0	0	113.8	Y632 I674 H678 L709 R710 Y715 C716 P757 I761	Y632-Y712 WeakPolarHBondContact CE1-OH 3.47Å; Y632-Y712 PolarHBondContact OH-OH 3.36Å; Y632-Y712 VanDerWaalsContact OH-OH 3.07Å; I674-Y712 HydrophobicContact CD1-CD1 4.23Å; I674-Y712 HydrophobicContact CD1-CE1 4.4Å; I674-Y712 HydrophobicContact CD1-CG 4.34Å; I674-Y712 HydrophobicContact CG1-CD2 4.47Å; I674-Y712 HydrophobicContact CG1-CE2 4.42Å; I674-Y712 HydrophobicContact CG2-CE1 4.42Å; I674-Y712 HydrophobicContact CG2-CE2 4.31Å; H678-Y712 PolarHBondContact CD2-OH 2.92Å; H678-Y712 PolarHBondContact CE1-OH 2.96Å; H678-Y712 AromaticContact NE2-CE2 3.28Å; H678-Y712 VanDerWaalsContact NE2-CE2 3.28Å; H678-Y712 WeakPolarHBondContact NE2-CE2 3.32Å; H678-Y712 AromaticContact NE2-CZ 3.42Å; H678-Y712 PolarHBondContact NE2-OH 2.92Å; L709-Y712 HydrophobicContact CD2-CD2 4.44Å; L709-Y712 HydrophobicContact CD2-CE2 3.98Å; L709-Y712 VanDerWaalsContact O-CD2 3.3Å; L709-Y712 WeakPolarHBondContact O-CD2 3.3Å; L709-Y712 PolarHBondContact O-N 2.84Å; R710-Y712 PolarHBondContact O-N 3.19Å; R710-Y712 VanDerWaalsContact O-N 3.1Å; Y712-Y715 PolarHBondContact O-N 3.2Å; Y712-C716 WeakPolarHBondContact O-CB 3.14Å; Y712-C716 PolarHBondContact O-N 3.37Å; Y712-C716 PolarHBondContact O-SG 3.23Å; Y712-P757 HydrophobicContact CD1-CB 4.12Å; Y712-P757 HydrophobicContact CE1-CB 3.77Å; Y712-P757 WeakPolarHBondContact CE1-O 3.23Å; Y712-I761 HydrophobicContact CD1-CB 3.58Å; Y712-I761 HydrophobicContact CD1-CD1 4.31Å; Y712-I761 HydrophobicContact CD1-CG1 4.2Å; Y712-I761 HydrophobicContact CD1-CG2 3.9Å; Y712-I761 HydrophobicContact CD2-CD1 4Å; Y712-I761 HydrophobicContact CE1-CB 3.85Å; Y712-I761 HydrophobicContact CE1-CG2 4.43Å; Y712-I761 HydrophobicContact CE2-CD1 4.36Å; Y712-I761 HydrophobicContact CG-CB 4.05Å; Y712-I761 HydrophobicContact CG-CD1 3.94Å; Y712-I761 HydrophobicContact CG-CG1 4.14Å
713	V	88.3	Confident	89.6	Confident	20 Å²	20	36.8 Å²	36.8	12%	0.121	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-47.2	175	-179.3	0	0	0	0	109.9	R710 C711 Y715 C716 L717 L813 A817	R710-V713 WeakPolarHBondContact O-CB 3.38Å; R710-V713 PolarHBondContact O-N 2.99Å; C711-V713 VanDerWaalsContact C-N 3.27Å; C711-V713 PolarHBondContact O-N 3.4Å; V713-Y715 VanDerWaalsContact C-N 3.31Å; V713-Y715 PolarHBondContact O-N 2.92Å; V713-C716 PolarHBondContact O-N 3.37Å; V713-L717 HydrophobicContact CG1-CD1 4.12Å; V713-L717 WeakPolarHBondContact O-CB 3.31Å; V713-L717 VanDerWaalsContact O-CG 3.31Å; V713-L717 WeakPolarHBondContact O-CG 3.32Å; V713-L717 PolarHBondContact O-N 3.15Å; V713-L813 HydrophobicContact CG2-CD1 3.73Å; V713-A817 HydrophobicContact CG2-CB 4.3Å
714	T	89.8	Confident	89.3	Confident	44 Å²	44	36.1 Å²	36.1	27%	0.27	20%	0.201	S	C	.	.	H	α-helix	trans	-59.2	-41.6	174.6	-55.2	0	0	0	0	111.3	N670 C711 L717 N718	N670-T714 HydrophobicContact CB-CG2 4.39Å; C711-T714 WeakPolarHBondContact O-CB 3.47Å; C711-T714 PolarHBondContact O-N 3.42Å; T714-L717 PolarHBondContact O-N 2.93Å; T714-N718 PolarHBondContact O-N 2.65Å
715	Y	93.2	Very high	89.2	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-66	-48.6	178.5	-164.7	-92	0	0	0	112.7	F668 N670 L671 I674 C711 Y712 V713 L717 N718 K719 L754 P757 V758	F668-Y715 VanDerWaalsContact O-CE2 3.3Å; F668-Y715 WeakPolarHBondContact O-CE2 3.14Å; N670-Y715 VanDerWaalsContact OD1-CA 3.28Å; N670-Y715 WeakPolarHBondContact OD1-CA 3.35Å; N670-Y715 WeakPolarHBondContact OD1-CB 3.33Å; N670-Y715 PolarHBondContact OD1-N 3.4Å; N670-Y715 VanDerWaalsContact OD1-N 3.16Å; L671-Y715 HydrophobicContact CB-CE2 4.01Å; L671-Y715 HydrophobicContact CD1-CE2 3.76Å; L671-Y715 HydrophobicContact CG-CE2 4.49Å; I674-Y715 HydrophobicContact CD1-CD2 3.72Å; I674-Y715 HydrophobicContact CD1-CG 3.67Å; C711-Y715 PolarHBondContact O-N 3.09Å; C711-Y715 VanDerWaalsContact O-N 3.15Å; Y712-Y715 PolarHBondContact O-N 3.2Å; V713-Y715 VanDerWaalsContact C-N 3.31Å; V713-Y715 PolarHBondContact O-N 2.92Å; Y715-L717 VanDerWaalsContact C-N 3.33Å; Y715-L717 PolarHBondContact O-N 3.05Å; Y715-N718 PolarHBondContact O-N 2.94Å; Y715-K719 HydrophobicContact CE1-CD 4.34Å; Y715-K719 PolarHBondContact O-N 2.71Å; Y715-L754 WeakPolarHBondContact CE1-O 3.34Å; Y715-L754 PolarHBondContact OH-O 2.75Å; Y715-P757 HydrophobicContact CD1-CB 3.76Å; Y715-P757 HydrophobicContact CD1-CG 4.14Å; Y715-P757 HydrophobicContact CE1-CB 3.76Å; Y715-P757 HydrophobicContact CE1-CG 3.66Å; Y715-P757 HydrophobicContact CE2-CG 4.3Å; Y715-P757 HydrophobicContact CG-CB 4.32Å; Y715-V758 HydrophobicContact CD1-CG2 4.33Å; Y715-V758 HydrophobicContact CE1-CG2 4.39Å
716	C	90.9	Very high	89	Confident	11 Å²	11	31.1 Å²	31.1	7%	0.074	18%	0.179	C	C	.	.	H	α-helix	trans	-58.6	-43.7	177	-72.9	0	0	0	0	111.4	Y712 V713 N718 K719 P720 A817 L821	Y712-C716 WeakPolarHBondContact O-CB 3.14Å; Y712-C716 PolarHBondContact O-N 3.37Å; Y712-C716 PolarHBondContact O-SG 3.23Å; V713-C716 PolarHBondContact O-N 3.37Å; C716-N718 PolarHBondContact O-N 2.8Å; C716-K719 PolarHBondContact O-N 3.49Å; C716-P720 WeakPolarHBondContact O-CD 3.4Å; C716-A817 HydrophobicContact CB-CB 4.44Å; C716-L821 HydrophobicContact CB-CD1 4.18Å; C716-L821 WeakPolarHBondContact O-CD2 3.43Å
717	L	86.3	Confident	88.9	Confident	40 Å²	40	37.7 Å²	37.7	21%	0.209	20%	0.196	C	C	.	.	H	α-helix	trans	-62.3	-20.8	174.6	-77.2	171.9	0	0	0	114.6	V713 T714 Y715 K721 S820	V713-L717 HydrophobicContact CG1-CD1 4.12Å; V713-L717 WeakPolarHBondContact O-CB 3.31Å; V713-L717 VanDerWaalsContact O-CG 3.31Å; V713-L717 WeakPolarHBondContact O-CG 3.32Å; V713-L717 PolarHBondContact O-N 3.15Å; T714-L717 PolarHBondContact O-N 2.93Å; Y715-L717 VanDerWaalsContact C-N 3.33Å; Y715-L717 PolarHBondContact O-N 3.05Å; L717-K721 PolarHBondContact O-NZ 3.26Å; L717-S820 WeakPolarHBondContact CD2-O 2.74Å
718	N	89.5	Confident	88.8	Confident	10 Å²	10	40.8 Å²	40.8	5%	0.053	20%	0.199	C	C	.	.	H	α-helix	trans	-97.5	-31	178	-171.8	66.4	0	0	0	113.4	I666 G669 T714 Y715 C716 K721 S722	I666-N718 PolarHBondContact O-ND2 2.78Å; G669-N718 VanDerWaalsContact CA-ND2 3.27Å; G669-N718 WeakPolarHBondContact CA-ND2 3.49Å; G669-N718 PolarHBondContact N-ND2 2.72Å; T714-N718 PolarHBondContact O-N 2.65Å; Y715-N718 PolarHBondContact O-N 2.94Å; C716-N718 PolarHBondContact O-N 2.8Å; N718-K721 WeakPolarHBondContact O-CA 3.4Å; N718-K721 VanDerWaalsContact O-CB 3.3Å; N718-K721 WeakPolarHBondContact O-CB 3.42Å; N718-K721 PolarHBondContact O-N 3.39Å; N718-S722 PolarHBondContact O-N 2.96Å; N718-S722 VanDerWaalsContact O-N 3.11Å
719	K	90.9	Very high	88.5	Confident	14 Å²	14	40.3 Å²	40.3	6%	0.061	19%	0.189	C	C	.	.	H	α-helix	trans	-50.9	-42.6	-174.3	-175.4	59.5	165.6	74.7	0	114.8	Y715 C716 K721 S722 D723 L754 V758	Y715-K719 HydrophobicContact CE1-CD 4.34Å; Y715-K719 PolarHBondContact O-N 2.71Å; C716-K719 PolarHBondContact O-N 3.49Å; K719-K721 VanDerWaalsContact C-N 3.26Å; K719-K721 PolarHBondContact O-N 3.09Å; K719-S722 WeakPolarHBondContact O-CB 3.43Å; K719-S722 PolarHBondContact O-N 3.45Å; K719-D723 IonicContact NZ-OD1 2.93Å; K719-D723 PolarHBondContact NZ-OD1 3.39Å; K719-D723 IonicContact NZ-OD2 2.67Å; K719-D723 PolarHBondContact NZ-OD2 2.85Å; K719-D723 PolarHBondContact O-N 3.4Å; K719-L754 WeakPolarHBondContact CE-O 3.27Å; K719-V758 HydrophobicContact CG-CG2 4.28Å
720	P	85.6	Confident	87.8	Confident	37 Å²	37	46.2 Å²	46.2	24%	0.24	22%	0.216	C	C	.	.	H	α-helix	trans	-59.8	-33.2	174.7	-25.3	35	0	0	0	114	C716 A724 L821	C716-P720 WeakPolarHBondContact O-CD 3.4Å; P720-A724 WeakPolarHBondContact O-CB 3.47Å; P720-A724 PolarHBondContact O-N 3.41Å; P720-L821 HydrophobicContact CG-CD2 4.15Å
721	K	87.1	Confident	87.2	Confident	36 Å²	36	49.2 Å²	49.2	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-73.5	-41.8	177.5	-51.1	-172.8	-177.4	84.3	0	111.5	I666 L717 N718 K719 D723 A724 L725 W1021	I666-K721 HydrophobicContact CG2-CB 3.58Å; I666-K721 HydrophobicContact CG2-CD 4.45Å; L717-K721 PolarHBondContact O-NZ 3.26Å; N718-K721 WeakPolarHBondContact O-CA 3.4Å; N718-K721 VanDerWaalsContact O-CB 3.3Å; N718-K721 WeakPolarHBondContact O-CB 3.42Å; N718-K721 PolarHBondContact O-N 3.39Å; K719-K721 VanDerWaalsContact C-N 3.26Å; K719-K721 PolarHBondContact O-N 3.09Å; K721-D723 VanDerWaalsContact C-N 3.33Å; K721-A724 PolarHBondContact O-N 3.43Å; K721-L725 VanDerWaalsContact O-CB 3.32Å; K721-L725 WeakPolarHBondContact O-CB 3.37Å; K721-L725 PolarHBondContact O-N 3.27Å; K721-W1021 HydrophobicContact CD-CH2 4.38Å; K721-W1021 VanDerWaalsContact CE-CH2 3.42Å; K721-W1021 VanDerWaalsContact CE-CZ2 3.41Å; K721-W1021 HydrophobicContact CG-CH2 4.1Å
722	S	91.1	Very high	86.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-56.6	-47	172.1	175.8	0	0	0	0	111.1	I666 L667 N718 K719 A724 L725 L726 L754	I666-S722 WeakPolarHBondContact O-CB 3.32Å; L667-S722 VanDerWaalsContact O-CB 3.31Å; L667-S722 WeakPolarHBondContact O-CB 3.45Å; L667-S722 PolarHBondContact O-OG 2.91Å; N718-S722 PolarHBondContact O-N 2.96Å; N718-S722 VanDerWaalsContact O-N 3.11Å; K719-S722 WeakPolarHBondContact O-CB 3.43Å; K719-S722 PolarHBondContact O-N 3.45Å; S722-A724 PolarHBondContact O-N 2.95Å; S722-L725 PolarHBondContact O-N 3.43Å; S722-L726 PolarHBondContact O-N 3.26Å; S722-L754 WeakPolarHBondContact OG-CD1 3.32Å
723	D	88.3	Confident	86.1	Confident	39 Å²	39	54.4 Å²	54.4	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-36.8	177.6	-69	-31.2	0	0	0	113.1	K719 K721 R727	K719-D723 IonicContact NZ-OD1 2.93Å; K719-D723 PolarHBondContact NZ-OD1 3.39Å; K719-D723 IonicContact NZ-OD2 2.67Å; K719-D723 PolarHBondContact NZ-OD2 2.85Å; K719-D723 PolarHBondContact O-N 3.4Å; K721-D723 VanDerWaalsContact C-N 3.33Å; D723-R727 WeakPolarHBondContact O-CG 3.33Å; D723-R727 PolarHBondContact O-N 3.2Å; D723-R727 VanDerWaalsContact O-N 3.11Å
724	A	85.7	Confident	85.9	Confident	49 Å²	49	57.9 Å²	57.9	41%	0.405	28%	0.275	S	S	.	.	H	α-helix	trans	-68.6	-38.8	174.5	0	0	0	0	0	112.3	P720 K721 S722 R728	P720-A724 WeakPolarHBondContact O-CB 3.47Å; P720-A724 PolarHBondContact O-N 3.41Å; K721-A724 PolarHBondContact O-N 3.43Å; S722-A724 PolarHBondContact O-N 2.95Å; A724-R728 WeakPolarHBondContact O-CB 3.49Å; A724-R728 PolarHBondContact O-N 3.35Å
725	L	87.6	Confident	85.7	Confident	13 Å²	13	60.1 Å²	60.1	7%	0.068	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-46.3	176.2	-175	69.9	0	0	0	111.1	Q663 I666 L667 K721 S722 R728 H729	Q663-L725 HydrophobicContact CB-CD1 4.32Å; Q663-L725 HydrophobicContact CB-CD2 3.96Å; Q663-L725 VanDerWaalsContact OE1-CD1 3.32Å; I666-L725 HydrophobicContact CG2-CD2 4.49Å; L667-L725 HydrophobicContact CB-CD2 3.9Å; L667-L725 HydrophobicContact CD1-CD2 4.4Å; K721-L725 VanDerWaalsContact O-CB 3.32Å; K721-L725 WeakPolarHBondContact O-CB 3.37Å; K721-L725 PolarHBondContact O-N 3.27Å; S722-L725 PolarHBondContact O-N 3.43Å; L725-R728 PolarHBondContact O-N 3.04Å; L725-H729 PolarHBondContact O-N 2.91Å; L725-H729 VanDerWaalsContact O-N 3.1Å
726	L	86.9	Confident	85.5	Confident	35 Å²	35	60.3 Å²	60.3	18%	0.183	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-46.2	176	-80.3	173.6	0	0	0	112.1	L667 S722 E730 L737 L754	L667-L726 HydrophobicContact CD1-CD1 4.21Å; L667-L726 HydrophobicContact CD1-CD2 3.77Å; L667-L726 HydrophobicContact CD1-CG 3.7Å; S722-L726 PolarHBondContact O-N 3.26Å; L726-E730 WeakPolarHBondContact O-CA 3.33Å; L726-E730 WeakPolarHBondContact O-CB 3.4Å; L726-E730 PolarHBondContact O-N 3.08Å; L726-L737 HydrophobicContact CD2-CD1 3.95Å; L726-L754 HydrophobicContact CD1-CD1 3.99Å
727	R	85.5	Confident	85.4	Confident	164 Å²	164	61.3 Å²	61.3	62%	0.619	29%	0.294	S	S	*	.	H	α-helix	trans	-64	-38.4	175.6	-74	-174.5	-63.9	-96.8	-1.6	112.9	D723	D723-R727 WeakPolarHBondContact O-CG 3.33Å; D723-R727 PolarHBondContact O-N 3.2Å; D723-R727 VanDerWaalsContact O-N 3.11Å
728	R	83.6	Confident	85.5	Confident	183 Å²	183	64.3 Å²	64.3	69%	0.691	31%	0.305	S	S	*	.	H	α-helix	trans	-66.6	-37.9	-178.4	-176.4	178	-174.9	129.9	12.9	112.6	A724 L725	A724-R728 WeakPolarHBondContact O-CB 3.49Å; A724-R728 PolarHBondContact O-N 3.35Å; L725-R728 PolarHBondContact O-N 3.04Å
729	H	81.8	Confident	85.5	Confident	19 Å²	19	65.6 Å²	65.6	9%	0.088	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	20.1	-175.6	-62.6	-85.6	0	0	0	112.9	V660 L725 Q731 E732 C733	V660-H729 HydrophobicContact CG2-CB 3.74Å; L725-H729 PolarHBondContact O-N 2.91Å; L725-H729 VanDerWaalsContact O-N 3.1Å; H729-Q731 VanDerWaalsContact C-N 3.31Å; H729-Q731 PolarHBondContact O-N 3.38Å; H729-E732 HydrophobicContact CB-CB 4.49Å; H729-E732 IonicContact CE1-OE2 3.79Å; H729-E732 IonicContact CG-OE2 3.03Å; H729-E732 IonicContact ND1-OE1 3.18Å; H729-E732 IonicContact ND1-OE2 3.27Å; H729-E732 PolarHBondContact ND1-OE2 3.09Å; H729-E732 PolarHBondContact O-N 3.16Å; H729-C733 WeakPolarHBondContact O-CB 3.41Å; H729-C733 PolarHBondContact O-N 3.43Å
730	E	76.7	Confident	85.5	Confident	124 Å²	124	64.9 Å²	64.9	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-57	-42.7	-173.7	-173.1	169.1	-179.9	0	0	112.5	L726 H734	L726-E730 WeakPolarHBondContact O-CA 3.33Å; L726-E730 WeakPolarHBondContact O-CB 3.4Å; L726-E730 PolarHBondContact O-N 3.08Å; E730-H734 WeakPolarHBondContact O-CA 3.33Å; E730-H734 WeakPolarHBondContact O-CB 3.4Å; E730-H734 PolarHBondContact O-N 3.37Å; E730-H734 VanDerWaalsContact O-N 3.1Å
731	Q	77.7	Confident	85.8	Confident	185 Å²	185	65.5 Å²	65.5	86%	0.864	31%	0.31	S	S	*	.	H	α-helix	trans	-70.2	-45.9	176.7	-64.5	-178.7	-7.6	0	0	112.1	H729 C733 H734	H729-Q731 VanDerWaalsContact C-N 3.31Å; H729-Q731 PolarHBondContact O-N 3.38Å; Q731-C733 VanDerWaalsContact C-N 3.35Å; Q731-C733 PolarHBondContact O-N 3.23Å; Q731-H734 PolarHBondContact O-N 2.69Å
732	E	79.1	Confident	86.1	Confident	112 Å²	112	70.4 Å²	70.4	52%	0.523	33%	0.334	S	S	.	.	H	α-helix	trans	-66.3	-35.6	-177.6	-58.1	180	-177.2	0	0	112.6	P657 H729	P657-E732 HydrophobicContact CG-CB 3.64Å; H729-E732 HydrophobicContact CB-CB 4.49Å; H729-E732 IonicContact CE1-OE2 3.79Å; H729-E732 IonicContact CG-OE2 3.03Å; H729-E732 IonicContact ND1-OE1 3.18Å; H729-E732 IonicContact ND1-OE2 3.27Å; H729-E732 PolarHBondContact ND1-OE2 3.09Å; H729-E732 PolarHBondContact O-N 3.16Å
733	C	82.4	Confident	86.1	Confident	5 Å²	5	77 Å²	77	3%	0.034	36%	0.358	C	S	.	.	H	α-helix	trans	-94.4	-3.9	-179.6	-69.7	0	0	0	0	114	H729 Q731 T735 F736 L737	H729-C733 WeakPolarHBondContact O-CB 3.41Å; H729-C733 PolarHBondContact O-N 3.43Å; Q731-C733 VanDerWaalsContact C-N 3.35Å; Q731-C733 PolarHBondContact O-N 3.23Å; C733-T735 PolarHBondContact O-N 3.35Å; C733-F736 PolarHBondContact O-N 2.88Å; C733-L737 HydrophobicContact CB-CD1 3.83Å; C733-L737 HydrophobicContact CB-CG 4.08Å; C733-L737 WeakPolarHBondContact O-CB 3.46Å; C733-L737 WeakPolarHBondContact O-CG 3.32Å; C733-L737 PolarHBondContact O-N 2.84Å
734	H	84.5	Confident	86.2	Confident	92 Å²	92	75.9 Å²	75.9	43%	0.426	36%	0.355	S	S	.	.	H	α-helix	trans	-51.6	-51.9	-171.8	-174	84.3	0	0	0	112.5	E730 Q731 L737 K738	E730-H734 WeakPolarHBondContact O-CA 3.33Å; E730-H734 WeakPolarHBondContact O-CB 3.4Å; E730-H734 PolarHBondContact O-N 3.37Å; E730-H734 VanDerWaalsContact O-N 3.1Å; Q731-H734 PolarHBondContact O-N 2.69Å; H734-L737 PolarHBondContact O-N 2.91Å; H734-K738 PolarHBondContact NE2-NZ 3.28Å; H734-K738 VanDerWaalsContact NE2-NZ 3.19Å; H734-K738 WeakPolarHBondContact O-CB 3.36Å; H734-K738 PolarHBondContact O-N 3.33Å
735	T	85.2	Confident	86.5	Confident	92 Å²	92	76.9 Å²	76.9	56%	0.564	37%	0.37	S	S	*	.	H	α-helix	trans	-61.9	-48.7	-178.1	-51.4	0	0	0	0	111.6	C733 K738 T739	C733-T735 PolarHBondContact O-N 3.35Å; T735-K738 PolarHBondContact O-N 3.02Å; T735-T739 PolarHBondContact O-N 2.92Å; T735-T739 PolarHBondContact O-OG1 3Å
736	F	88.8	Confident	86.8	Confident	5 Å²	5	77.2 Å²	77.2	2%	0.022	37%	0.371	C	S	.	.	H	α-helix	trans	-58.7	-52.3	178.1	172	-92	0	0	0	111.8	A646 I647 P650 C654 L656 C733 K738 T739 C740	A646-F736 HydrophobicContact CB-CE2 4.25Å; A646-F736 HydrophobicContact CB-CZ 3.95Å; A646-F736 VanDerWaalsContact O-CE2 3.23Å; A646-F736 WeakPolarHBondContact O-CE2 3.41Å; A646-F736 WeakPolarHBondContact O-CZ 3.45Å; I647-F736 HydrophobicContact CG1-CE1 4.28Å; I647-F736 HydrophobicContact CG1-CZ 3.98Å; P650-F736 HydrophobicContact CB-CE2 4.23Å; C654-F736 HydrophobicContact CB-CD2 4.2Å; L656-F736 HydrophobicContact CB-CD2 4.24Å; L656-F736 HydrophobicContact CB-CE2 4.45Å; L656-F736 HydrophobicContact CD1-CD1 3.7Å; L656-F736 HydrophobicContact CD1-CD2 4.3Å; L656-F736 HydrophobicContact CD1-CE1 3.9Å; L656-F736 HydrophobicContact CD1-CE2 4.47Å; L656-F736 HydrophobicContact CD1-CG 3.92Å; L656-F736 HydrophobicContact CD1-CZ 4.29Å; L656-F736 HydrophobicContact CD2-CZ 4.41Å; C733-F736 PolarHBondContact O-N 2.88Å; F736-K738 VanDerWaalsContact C-N 3.32Å; F736-K738 PolarHBondContact O-N 3.24Å; F736-T739 PolarHBondContact O-N 3.27Å; F736-C740 PolarHBondContact O-N 2.69Å; F736-C740 PolarHBondContact O-SG 2.85Å
737	L	89.1	Confident	86.9	Confident	33 Å²	33	78.9 Å²	78.9	17%	0.173	40%	0.396	C	S	.	.	H	α-helix	trans	-63	-39.1	-178.3	-69.7	173.9	0	0	0	111.7	L726 C733 H734 C740 Q741 L750	L726-L737 HydrophobicContact CD2-CD1 3.95Å; C733-L737 HydrophobicContact CB-CD1 3.83Å; C733-L737 HydrophobicContact CB-CG 4.08Å; C733-L737 WeakPolarHBondContact O-CB 3.46Å; C733-L737 WeakPolarHBondContact O-CG 3.32Å; C733-L737 PolarHBondContact O-N 2.84Å; H734-L737 PolarHBondContact O-N 2.91Å; L737-C740 PolarHBondContact O-N 2.91Å; L737-Q741 VanDerWaalsContact O-CB 3.29Å; L737-Q741 WeakPolarHBondContact O-CB 3.2Å; L737-Q741 PolarHBondContact O-N 2.93Å; L737-L750 HydrophobicContact CD2-CD2 3.71Å
738	K	88.9	Confident	87.1	Confident	102 Å²	102	74.6 Å²	74.6	44%	0.443	39%	0.385	S	S	.	.	H	α-helix	trans	-67.6	-39.5	177.7	-168.1	176.6	-160.3	163.1	0	112.3	H734 T735 F736 Q741 Q742	H734-K738 PolarHBondContact NE2-NZ 3.28Å; H734-K738 VanDerWaalsContact NE2-NZ 3.19Å; H734-K738 WeakPolarHBondContact O-CB 3.36Å; H734-K738 PolarHBondContact O-N 3.33Å; T735-K738 PolarHBondContact O-N 3.02Å; F736-K738 VanDerWaalsContact C-N 3.32Å; F736-K738 PolarHBondContact O-N 3.24Å; K738-Q741 PolarHBondContact O-N 3.06Å; K738-Q742 WeakPolarHBondContact O-CB 3.36Å; K738-Q742 VanDerWaalsContact O-CG 3.3Å; K738-Q742 WeakPolarHBondContact O-CG 3.46Å; K738-Q742 PolarHBondContact O-N 2.86Å
739	T	90	Very high	87.5	Confident	37 Å²	37	69.6 Å²	69.6	23%	0.227	38%	0.377	C	S	.	.	H	α-helix	trans	-67.2	-40.4	173.5	-63.8	0	0	0	0	111.8	P651 T735 F736 Q742 R743	P651-T739 HydrophobicContact CB-CG2 3.86Å; P651-T739 HydrophobicContact CG-CG2 3.92Å; T735-T739 PolarHBondContact O-N 2.92Å; T735-T739 PolarHBondContact O-OG1 3Å; F736-T739 PolarHBondContact O-N 3.27Å; T739-Q742 PolarHBondContact O-N 3.4Å; T739-R743 WeakPolarHBondContact O-CB 3.22Å; T739-R743 WeakPolarHBondContact O-CG 3.01Å; T739-R743 PolarHBondContact O-N 2.92Å
740	C	90.6	Very high	88	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-44.8	171.6	-70.4	0	0	0	0	111.9	H642 Y643 A646 F736 L737 Q742 R743 A744	H642-C740 PolarHBondContact O-SG 3.11Å; Y643-C740 HydrophobicContact CD1-CB 3.51Å; Y643-C740 HydrophobicContact CE1-CB 3.61Å; Y643-C740 HydrophobicContact CG-CB 4.13Å; A646-C740 VanDerWaalsContact CB-SG 3.59Å; F736-C740 PolarHBondContact O-N 2.69Å; F736-C740 PolarHBondContact O-SG 2.85Å; L737-C740 PolarHBondContact O-N 2.91Å; C740-Q742 PolarHBondContact O-N 3.42Å; C740-R743 PolarHBondContact O-N 3.2Å; C740-A744 WeakPolarHBondContact O-CB 3.41Å; C740-A744 PolarHBondContact O-N 2.72Å
741	Q	92.2	Very high	88.7	Confident	50 Å²	50	64.3 Å²	64.3	23%	0.234	36%	0.358	C	S	.	.	H	α-helix	trans	-61	-41.9	177.5	-170.5	-174.1	-19.3	0	0	112.3	Y643 L737 K738 A744 G745 H746 L748	Y643-Q741 WeakPolarHBondContact OH-CA 3.49Å; L737-Q741 VanDerWaalsContact O-CB 3.29Å; L737-Q741 WeakPolarHBondContact O-CB 3.2Å; L737-Q741 PolarHBondContact O-N 2.93Å; K738-Q741 PolarHBondContact O-N 3.06Å; Q741-A744 PolarHBondContact O-N 3.49Å; Q741-G745 PolarHBondContact O-N 2.92Å; Q741-G745 VanDerWaalsContact O-N 3.15Å; Q741-H746 HydrophobicContact CG-CB 3.72Å; Q741-H746 WeakPolarHBondContact CG-O 3.46Å; Q741-H746 PolarHBondContact NE2-O 3.1Å; Q741-H746 PolarHBondContact O-N 3.49Å; Q741-L748 PolarHBondContact NE2-O 3.22Å
742	Q	91.6	Very high	89.5	Confident	139 Å²	139	57.1 Å²	57.1	65%	0.65	33%	0.33	S	S	*	.	H	α-helix	trans	-65.4	-45.9	173.9	-75.4	174.2	-16.7	0	0	112.2	K738 T739 C740 A744 G745	K738-Q742 WeakPolarHBondContact O-CB 3.36Å; K738-Q742 VanDerWaalsContact O-CG 3.3Å; K738-Q742 WeakPolarHBondContact O-CG 3.46Å; K738-Q742 PolarHBondContact O-N 2.86Å; T739-Q742 PolarHBondContact O-N 3.4Å; C740-Q742 PolarHBondContact O-N 3.42Å; Q742-A744 VanDerWaalsContact C-N 3.26Å; Q742-A744 PolarHBondContact O-N 2.93Å; Q742-G745 PolarHBondContact O-N 3.23Å
743	R	91.5	Very high	90.2	Very high	138 Å²	138	52.9 Å²	52.9	52%	0.521	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-35.7	175.6	-76.3	178.5	65.5	-179.3	-2	112.4	T739 C740	T739-R743 WeakPolarHBondContact O-CB 3.22Å; T739-R743 WeakPolarHBondContact O-CG 3.01Å; T739-R743 PolarHBondContact O-N 2.92Å; C740-R743 PolarHBondContact O-N 3.2Å
744	A	91	Very high	90.8	Very high	17 Å²	17	52.7 Å²	52.7	14%	0.14	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-10	179.5	0	0	0	0	0	114.4	H642 Y643 C740 Q741 Q742 H746	H642-A744 HydrophobicContact CB-CB 3.66Å; Y643-A744 HydrophobicContact CE2-CB 4.03Å; C740-A744 WeakPolarHBondContact O-CB 3.41Å; C740-A744 PolarHBondContact O-N 2.72Å; Q741-A744 PolarHBondContact O-N 3.49Å; Q742-A744 VanDerWaalsContact C-N 3.26Å; Q742-A744 PolarHBondContact O-N 2.93Å; A744-H746 VanDerWaalsContact C-N 3.25Å; A744-H746 HydrophobicContact CB-CB 4.33Å; A744-H746 VanDerWaalsContact CB-CD2 3.5Å; A744-H746 WeakPolarHBondContact CB-CD2 3.49Å; A744-H746 PolarHBondContact O-CD2 3.13Å; A744-H746 PolarHBondContact O-N 3Å
745	G	91.9	Very high	91.3	Very high	69 Å²	69	51.5 Å²	51.5	71%	0.711	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.7	24.7	-172.2	0	0	0	0	0	114	Q741 Q742	Q741-G745 PolarHBondContact O-N 2.92Å; Q741-G745 VanDerWaalsContact O-N 3.15Å; Q742-G745 PolarHBondContact O-N 3.23Å
746	H	93.2	Very high	91.8	Very high	21 Å²	21	48.5 Å²	48.5	10%	0.097	28%	0.284	C	S	.	.			trans	-82.5	118.8	-170.3	-80.1	-170.2	0	0	0	112.7	S638 V639 Y643 Q741 A744 L748 Y753	S638-H746 WeakPolarHBondContact CB-NE2 3Å; S638-H746 PolarHBondContact OG-NE2 3.03Å; V639-H746 WeakPolarHBondContact CG2-CE1 3.44Å; Y643-H746 AromaticContact CE2-CE1 3.4Å; Y643-H746 VanDerWaalsContact CE2-CE1 3.4Å; Y643-H746 WeakPolarHBondContact CE2-CE1 3.47Å; Y643-H746 AromaticContact CE2-ND1 3.4Å; Y643-H746 WeakPolarHBondContact CE2-ND1 3.45Å; Y643-H746 AromaticContact CZ-ND1 3.68Å; Y643-H746 PolarHBondContact OH-ND1 3.23Å; Q741-H746 HydrophobicContact CG-CB 3.72Å; Q741-H746 WeakPolarHBondContact CG-O 3.46Å; Q741-H746 PolarHBondContact NE2-O 3.1Å; Q741-H746 PolarHBondContact O-N 3.49Å; A744-H746 VanDerWaalsContact C-N 3.25Å; A744-H746 HydrophobicContact CB-CB 4.33Å; A744-H746 VanDerWaalsContact CB-CD2 3.5Å; A744-H746 WeakPolarHBondContact CB-CD2 3.49Å; A744-H746 PolarHBondContact O-CD2 3.13Å; A744-H746 PolarHBondContact O-N 3Å; H746-L748 PolarHBondContact O-N 3.29Å; H746-Y753 HydrophobicContact CB-CE2 3.86Å; H746-Y753 AromaticContact CD2-CZ 3.77Å; H746-Y753 PolarHBondContact CD2-OH 2.87Å; H746-Y753 AromaticContact CE1-CD1 3.65Å; H746-Y753 AromaticContact CE1-CE1 3.74Å; H746-Y753 AromaticContact CE1-CG 4Å; H746-Y753 AromaticContact CG-CE2 3.63Å; H746-Y753 AromaticContact CG-CZ 3.42Å; H746-Y753 VanDerWaalsContact CG-CZ 3.42Å; H746-Y753 AromaticContact ND1-CD2 3.72Å; H746-Y753 AromaticContact ND1-CE1 3.75Å; H746-Y753 AromaticContact ND1-CE2 3.33Å; H746-Y753 VanDerWaalsContact ND1-CE2 3.33Å; H746-Y753 WeakPolarHBondContact ND1-CE2 3.29Å; H746-Y753 AromaticContact ND1-CZ 3.36Å
747	G	88.5	Confident	92.1	Very high	69 Å²	69	48.3 Å²	48.3	71%	0.711	28%	0.283	S	S	*	.	S	Bend	trans	-72.2	-11.3	175.8	0	0	0	0	0	115
748	L	91.2	Very high	92.4	Very high	75 Å²	75	48.7 Å²	48.7	39%	0.393	29%	0.287	S	S	.	.	S	Bend	trans	-124.1	153.1	-179.7	-60.7	175.1	0	0	0	110.6	Q741 H746 A752 Y753	Q741-L748 PolarHBondContact NE2-O 3.22Å; H746-L748 PolarHBondContact O-N 3.29Å; L748-A752 HydrophobicContact CB-CB 3.93Å; L748-A752 HydrophobicContact CD1-CB 4.21Å; L748-Y753 HydrophobicContact CB-CD2 4.48Å; L748-Y753 HydrophobicContact CB-CE2 3.87Å; L748-Y753 WeakPolarHBondContact O-CE2 3.27Å
749	P	91.7	Very high	92.6	Very high	78 Å²	78	48.1 Å²	48.1	51%	0.506	29%	0.286	S	S	.	.			trans	-70.4	157.3	176.3	30.2	-36.2	0	0	0	112	G751 A752	P749-G751 PolarHBondContact O-N 3.32Å; P749-A752 WeakPolarHBondContact O-CB 3.41Å; P749-A752 PolarHBondContact O-N 2.89Å
750	L	92.4	Very high	92.9	Very high	8 Å²	8	47.2 Å²	47.2	4%	0.042	28%	0.278	C	S	.	.	H	α-helix	trans	-47.3	-40.9	-177.4	177.3	60.3	0	0	0	113.9	V639 Y643 F668 L737 A752 Y753 L754	V639-L750 HydrophobicContact CG1-CD1 4.06Å; Y643-L750 HydrophobicContact CD1-CB 4.22Å; Y643-L750 HydrophobicContact CD1-CD1 3.84Å; Y643-L750 HydrophobicContact CD1-CD2 3.88Å; Y643-L750 HydrophobicContact CD1-CG 4.18Å; Y643-L750 HydrophobicContact CD2-CD1 4.27Å; Y643-L750 HydrophobicContact CE1-CB 3.85Å; Y643-L750 HydrophobicContact CE1-CD1 4.06Å; Y643-L750 HydrophobicContact CE1-CD2 4.36Å; Y643-L750 HydrophobicContact CE1-CG 4.29Å; Y643-L750 HydrophobicContact CE2-CD1 4.47Å; Y643-L750 HydrophobicContact CG-CD1 3.91Å; Y643-L750 HydrophobicContact CG-CD2 4.49Å; F668-L750 HydrophobicContact CE1-CD1 4.42Å; F668-L750 HydrophobicContact CE1-CD2 4.31Å; L737-L750 HydrophobicContact CD2-CD2 3.71Å; L750-A752 PolarHBondContact O-N 3.37Å; L750-A752 VanDerWaalsContact O-N 3.15Å; L750-Y753 WeakPolarHBondContact O-CA 3.26Å; L750-Y753 PolarHBondContact O-N 3.38Å; L750-L754 HydrophobicContact CD1-CD1 4.37Å; L750-L754 HydrophobicContact CD1-CD2 4.24Å; L750-L754 HydrophobicContact CD1-CG 4.03Å; L750-L754 HydrophobicContact CD2-CD1 4.33Å; L750-L754 HydrophobicContact CG-CD1 3.93Å; L750-L754 HydrophobicContact CG-CG 4.06Å; L750-L754 WeakPolarHBondContact O-CG 3.37Å; L750-L754 PolarHBondContact O-N 3.29Å
751	G	91.5	Very high	93	Very high	23 Å²	23	47.4 Å²	47.4	24%	0.237	28%	0.279	C	S	.	.	H	α-helix	trans	-57.6	-28.4	179.6	0	0	0	0	0	114.6	P749 L755	P749-G751 PolarHBondContact O-N 3.32Å; G751-L755 PolarHBondContact O-N 2.73Å
752	A	93.2	Very high	92.9	Very high	34 Å²	34	48 Å²	48	28%	0.281	29%	0.286	S	S	.	.	H	α-helix	trans	-73	-37.8	173.6	0	0	0	0	0	111.9	L748 P749 L750 L755	L748-A752 HydrophobicContact CB-CB 3.93Å; L748-A752 HydrophobicContact CD1-CB 4.21Å; P749-A752 WeakPolarHBondContact O-CB 3.41Å; P749-A752 PolarHBondContact O-N 2.89Å; L750-A752 PolarHBondContact O-N 3.37Å; L750-A752 VanDerWaalsContact O-N 3.15Å; A752-L755 WeakPolarHBondContact O-CB 3.18Å; A752-L755 PolarHBondContact O-N 2.72Å
753	Y	94.7	Very high	92.9	Very high	24 Å²	24	44 Å²	44	9%	0.094	27%	0.266	C	S	.	.	H	α-helix	trans	-69.9	-37.4	174.8	-71.7	-96.9	0	0	0	111.9	V639 H746 L748 L750 L755 K756	V639-Y753 HydrophobicContact CG2-CD1 3.98Å; V639-Y753 HydrophobicContact CG2-CG 4.08Å; H746-Y753 HydrophobicContact CB-CE2 3.86Å; H746-Y753 AromaticContact CD2-CZ 3.77Å; H746-Y753 PolarHBondContact CD2-OH 2.87Å; H746-Y753 AromaticContact CE1-CD1 3.65Å; H746-Y753 AromaticContact CE1-CE1 3.74Å; H746-Y753 AromaticContact CE1-CG 4Å; H746-Y753 AromaticContact CG-CE2 3.63Å; H746-Y753 AromaticContact CG-CZ 3.42Å; H746-Y753 VanDerWaalsContact CG-CZ 3.42Å; H746-Y753 AromaticContact ND1-CD2 3.72Å; H746-Y753 AromaticContact ND1-CE1 3.75Å; H746-Y753 AromaticContact ND1-CE2 3.33Å; H746-Y753 VanDerWaalsContact ND1-CE2 3.33Å; H746-Y753 WeakPolarHBondContact ND1-CE2 3.29Å; H746-Y753 AromaticContact ND1-CZ 3.36Å; L748-Y753 HydrophobicContact CB-CD2 4.48Å; L748-Y753 HydrophobicContact CB-CE2 3.87Å; L748-Y753 WeakPolarHBondContact O-CE2 3.27Å; L750-Y753 WeakPolarHBondContact O-CA 3.26Å; L750-Y753 PolarHBondContact O-N 3.38Å; Y753-L755 PolarHBondContact O-N 3.29Å; Y753-K756 HydrophobicContact CD1-CD 3.94Å; Y753-K756 HydrophobicContact CG-CD 4.46Å; Y753-K756 VanDerWaalsContact O-CB 3.25Å; Y753-K756 WeakPolarHBondContact O-CB 3.39Å; Y753-K756 WeakPolarHBondContact O-CG 3.42Å; Y753-K756 PolarHBondContact O-N 2.85Å; Y753-K756 VanDerWaalsContact O-N 3.07Å
754	L	95.5	Very high	93	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-14.4	172.8	-60.9	178.4	0	0	0	113.1	L667 F668 L671 Y715 K719 S722 L726 L750	L667-L754 HydrophobicContact CD1-CD1 4.37Å; F668-L754 HydrophobicContact CD1-CD2 3.9Å; F668-L754 HydrophobicContact CE1-CD2 4.34Å; L671-L754 HydrophobicContact CD2-CD2 3.97Å; Y715-L754 WeakPolarHBondContact CE1-O 3.34Å; Y715-L754 PolarHBondContact OH-O 2.75Å; K719-L754 WeakPolarHBondContact CE-O 3.27Å; S722-L754 WeakPolarHBondContact OG-CD1 3.32Å; L726-L754 HydrophobicContact CD1-CD1 3.99Å; L750-L754 HydrophobicContact CD1-CD1 4.37Å; L750-L754 HydrophobicContact CD1-CD2 4.24Å; L750-L754 HydrophobicContact CD1-CG 4.03Å; L750-L754 HydrophobicContact CD2-CD1 4.33Å; L750-L754 HydrophobicContact CG-CD1 3.93Å; L750-L754 HydrophobicContact CG-CG 4.06Å; L750-L754 WeakPolarHBondContact O-CG 3.37Å; L750-L754 PolarHBondContact O-N 3.29Å
755	L	94.7	Very high	92.9	Very high	68 Å²	68	38.6 Å²	38.6	36%	0.356	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.5	172.9	-165.2	59.7	0	0	0	112.8	G751 A752 Y753 V758 Q759	G751-L755 PolarHBondContact O-N 2.73Å; A752-L755 WeakPolarHBondContact O-CB 3.18Å; A752-L755 PolarHBondContact O-N 2.72Å; Y753-L755 PolarHBondContact O-N 3.29Å; L755-V758 HydrophobicContact CD1-CB 4.31Å; L755-V758 PolarHBondContact O-N 3.1Å; L755-V758 VanDerWaalsContact O-N 3.15Å; L755-Q759 HydrophobicContact CG-CG 4.2Å; L755-Q759 WeakPolarHBondContact O-CG 3.36Å; L755-Q759 PolarHBondContact O-N 3.15Å; L755-Q759 VanDerWaalsContact O-N 3.1Å
756	K	95	Very high	92.7	Very high	29 Å²	29	38.9 Å²	38.9	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-39.9	-173	-67.8	174.8	174	-68.1	0	114.7	Y632 E635 Y753 V758 Q759 R760	Y632-K756 HydrophobicContact CD2-CB 4.29Å; Y632-K756 HydrophobicContact CE2-CB 4.03Å; E635-K756 HydrophobicContact CB-CD 4.06Å; E635-K756 VanDerWaalsContact OE1-CE 3.31Å; E635-K756 WeakPolarHBondContact OE1-CE 3.36Å; E635-K756 IonicContact OE1-NZ 2.73Å; E635-K756 PolarHBondContact OE1-NZ 3.39Å; E635-K756 WeakPolarHBondContact OE2-CD 3.27Å; E635-K756 VanDerWaalsContact OE2-CE 3.27Å; E635-K756 WeakPolarHBondContact OE2-CE 3.44Å; E635-K756 IonicContact OE2-NZ 3.17Å; E635-K756 PolarHBondContact OE2-NZ 3.24Å; Y753-K756 HydrophobicContact CD1-CD 3.94Å; Y753-K756 HydrophobicContact CG-CD 4.46Å; Y753-K756 VanDerWaalsContact O-CB 3.25Å; Y753-K756 WeakPolarHBondContact O-CB 3.39Å; Y753-K756 WeakPolarHBondContact O-CG 3.42Å; Y753-K756 PolarHBondContact O-N 2.85Å; Y753-K756 VanDerWaalsContact O-N 3.07Å; K756-V758 PolarHBondContact O-N 2.81Å; K756-Q759 CarbonylContact O-C 3.36Å; K756-Q759 WeakPolarHBondContact O-CB 3.1Å; K756-Q759 PolarHBondContact O-N 3.2Å; K756-R760 WeakPolarHBondContact O-CB 3.41Å; K756-R760 PolarHBondContact O-N 3.2Å
757	P	96.2	Very high	92.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-40.2	176	-23.8	35.6	0	0	0	113.2	Y632 L636 L671 I674 Y712 Y715 Q759 R760 I761	Y632-P757 WeakPolarHBondContact OH-CA 3.4Å; Y632-P757 WeakPolarHBondContact OH-CB 3.2Å; L636-P757 HydrophobicContact CD2-CG 4.5Å; L671-P757 HydrophobicContact CD1-CG 3.72Å; I674-P757 HydrophobicContact CD1-CB 4.17Å; Y712-P757 HydrophobicContact CD1-CB 4.12Å; Y712-P757 HydrophobicContact CE1-CB 3.77Å; Y712-P757 WeakPolarHBondContact CE1-O 3.23Å; Y715-P757 HydrophobicContact CD1-CB 3.76Å; Y715-P757 HydrophobicContact CD1-CG 4.14Å; Y715-P757 HydrophobicContact CE1-CB 3.76Å; Y715-P757 HydrophobicContact CE1-CG 3.66Å; Y715-P757 HydrophobicContact CE2-CG 4.3Å; Y715-P757 HydrophobicContact CG-CB 4.32Å; P757-Q759 VanDerWaalsContact C-N 3.27Å; P757-Q759 PolarHBondContact O-N 3Å; P757-R760 PolarHBondContact O-N 3.07Å; P757-I761 WeakPolarHBondContact O-CG2 3.38Å; P757-I761 PolarHBondContact O-N 2.96Å; P757-I761 VanDerWaalsContact O-N 3.07Å
758	V	93.8	Very high	92.1	Very high	41 Å²	41	35.2 Å²	35.2	25%	0.248	19%	0.194	C	C	.	.	H	α-helix	trans	-64.2	-36.4	176.2	-172.9	0	0	0	0	110.9	Y715 K719 L755 K756 T762	Y715-V758 HydrophobicContact CD1-CG2 4.33Å; Y715-V758 HydrophobicContact CE1-CG2 4.39Å; K719-V758 HydrophobicContact CG-CG2 4.28Å; L755-V758 HydrophobicContact CD1-CB 4.31Å; L755-V758 PolarHBondContact O-N 3.1Å; L755-V758 VanDerWaalsContact O-N 3.15Å; K756-V758 PolarHBondContact O-N 2.81Å; V758-T762 WeakPolarHBondContact O-CG2 3.3Å; V758-T762 PolarHBondContact O-OG1 3.47Å
759	Q	93.6	Very high	91.4	Very high	91 Å²	91	36.5 Å²	36.5	43%	0.425	20%	0.196	S	C	.	.	H	α-helix	trans	-69	-39.3	172.8	-66.3	168.9	-17.7	0	0	112.5	L755 K756 P757 T762 K763	L755-Q759 HydrophobicContact CG-CG 4.2Å; L755-Q759 WeakPolarHBondContact O-CG 3.36Å; L755-Q759 PolarHBondContact O-N 3.15Å; L755-Q759 VanDerWaalsContact O-N 3.1Å; K756-Q759 CarbonylContact O-C 3.36Å; K756-Q759 WeakPolarHBondContact O-CB 3.1Å; K756-Q759 PolarHBondContact O-N 3.2Å; P757-Q759 VanDerWaalsContact C-N 3.27Å; P757-Q759 PolarHBondContact O-N 3Å; Q759-T762 PolarHBondContact O-OG1 3.19Å; Q759-T762 VanDerWaalsContact O-OG1 3.05Å; Q759-K763 WeakPolarHBondContact O-CG 3.49Å; Q759-K763 PolarHBondContact O-N 3.37Å
760	R	96	Very high	90.3	Very high	18 Å²	18	35.2 Å²	35.2	7%	0.068	19%	0.187	C	C	.	.	H	α-helix	trans	-68.1	-50.2	-177.6	-167.9	75.7	-172.7	150.4	1.3	111.8	L625 T628 E629 Y632 K756 P757 T762 K763 Y764	L625-R760 PolarHBondContact O-NH2 3.24Å; L625-R760 VanDerWaalsContact O-NH2 3.09Å; T628-R760 VanDerWaalsContact CB-NH1 3.29Å; T628-R760 PolarHBondContact O-NH1 3.07Å; T628-R760 PolarHBondContact OG1-NH1 3.21Å; E629-R760 VanDerWaalsContact CA-NH2 3.3Å; E629-R760 IonicContact OE2-CZ 2.85Å; E629-R760 IonicContact OE2-NE 2.7Å; E629-R760 PolarHBondContact OE2-NE 2.85Å; E629-R760 IonicContact OE2-NH2 3.88Å; E629-R760 PolarHBondContact OE2-NH2 3.33Å; Y632-R760 HydrophobicContact CD1-CB 4.37Å; Y632-R760 HydrophobicContact CD1-CG 3.71Å; Y632-R760 HydrophobicContact CD2-CB 4.18Å; Y632-R760 HydrophobicContact CD2-CG 4.29Å; Y632-R760 HydrophobicContact CE1-CB 4.06Å; Y632-R760 HydrophobicContact CE1-CG 3.67Å; Y632-R760 HydrophobicContact CE2-CB 3.86Å; Y632-R760 HydrophobicContact CE2-CG 4.26Å; Y632-R760 HydrophobicContact CG-CB 4.43Å; Y632-R760 HydrophobicContact CG-CG 4.03Å; K756-R760 WeakPolarHBondContact O-CB 3.41Å; K756-R760 PolarHBondContact O-N 3.2Å; P757-R760 PolarHBondContact O-N 3.07Å; R760-T762 VanDerWaalsContact C-N 3.27Å; R760-T762 PolarHBondContact O-N 2.98Å; R760-K763 PolarHBondContact O-N 3.1Å; R760-Y764 HydrophobicContact CG-CE1 4.19Å; R760-Y764 HydrophobicContact CG-CE2 3.93Å; R760-Y764 WeakPolarHBondContact CG-OH 3.34Å; R760-Y764 PolarHBondContact NE-OH 3.31Å; R760-Y764 PolarHBondContact O-N 3.48Å
761	I	93.4	Very high	88.8	Confident	4 Å²	4	35 Å²	35	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-62.1	-35.4	-178.1	-166.3	73.2	0	0	0	112.4	L709 Y712 P757 K763 Y764 L813 L814	L709-I761 HydrophobicContact CD2-CD1 4.3Å; Y712-I761 HydrophobicContact CD1-CB 3.58Å; Y712-I761 HydrophobicContact CD1-CD1 4.31Å; Y712-I761 HydrophobicContact CD1-CG1 4.2Å; Y712-I761 HydrophobicContact CD1-CG2 3.9Å; Y712-I761 HydrophobicContact CD2-CD1 4Å; Y712-I761 HydrophobicContact CE1-CB 3.85Å; Y712-I761 HydrophobicContact CE1-CG2 4.43Å; Y712-I761 HydrophobicContact CE2-CD1 4.36Å; Y712-I761 HydrophobicContact CG-CB 4.05Å; Y712-I761 HydrophobicContact CG-CD1 3.94Å; Y712-I761 HydrophobicContact CG-CG1 4.14Å; P757-I761 WeakPolarHBondContact O-CG2 3.38Å; P757-I761 PolarHBondContact O-N 2.96Å; P757-I761 VanDerWaalsContact O-N 3.07Å; I761-K763 VanDerWaalsContact C-N 3.3Å; I761-K763 PolarHBondContact O-N 3.49Å; I761-Y764 HydrophobicContact CD1-CD2 4.13Å; I761-Y764 HydrophobicContact CD1-CE2 4.41Å; I761-L813 HydrophobicContact CD1-CD2 3.73Å; I761-L813 HydrophobicContact CD1-CG 4.43Å; I761-L814 HydrophobicContact CB-CD2 4.37Å; I761-L814 HydrophobicContact CG1-CD2 3.84Å; I761-L814 HydrophobicContact CG1-CG 4.48Å; I761-L814 HydrophobicContact CG2-CD2 3.96Å
762	T	90.8	Very high	87.3	Confident	61 Å²	61	35.6 Å²	35.6	37%	0.374	18%	0.182	S	C	.	.	H	α-helix	trans	-74.2	-16.9	177.4	51.4	0	0	0	0	113.8	V758 Q759 R760 Q765 L814	V758-T762 WeakPolarHBondContact O-CG2 3.3Å; V758-T762 PolarHBondContact O-OG1 3.47Å; Q759-T762 PolarHBondContact O-OG1 3.19Å; Q759-T762 VanDerWaalsContact O-OG1 3.05Å; R760-T762 VanDerWaalsContact C-N 3.27Å; R760-T762 PolarHBondContact O-N 2.98Å; T762-Q765 PolarHBondContact O-NE2 2.91Å; T762-L814 HydrophobicContact CG2-CD2 3.83Å
763	K	91.1	Very high	85.6	Confident	55 Å²	55	37.7 Å²	37.7	24%	0.239	19%	0.188	C	C	.	.	H	α-helix	trans	-85.4	-30.7	177.3	-72.6	-79.6	169.6	178.7	0	113.8	W595 Q759 R760 I761 Q765 L766 L767	W595-K763 HydrophobicContact CZ2-CD 4.32Å; Q759-K763 WeakPolarHBondContact O-CG 3.49Å; Q759-K763 PolarHBondContact O-N 3.37Å; R760-K763 PolarHBondContact O-N 3.1Å; I761-K763 VanDerWaalsContact C-N 3.3Å; I761-K763 PolarHBondContact O-N 3.49Å; K763-Q765 VanDerWaalsContact C-N 3.32Å; K763-Q765 PolarHBondContact O-N 2.88Å; K763-L766 HydrophobicContact CD-CD1 4.26Å; K763-L766 WeakPolarHBondContact O-CB 3.45Å; K763-L766 PolarHBondContact O-N 2.88Å; K763-L767 PolarHBondContact O-N 3.06Å
764	Y	94	Very high	83.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58	-39.8	-177.9	-66.1	-47.2	0	0	0	113.7	L625 E629 H678 F682 F702 L709 R760 I761 L766 L767 L768	L625-Y764 HydrophobicContact CD1-CD1 4.09Å; L625-Y764 HydrophobicContact CD1-CE1 4.12Å; E629-Y764 PolarHBondContact OE2-OH 2.94Å; H678-Y764 PolarHBondContact CE1-OH 2.92Å; F682-Y764 HydrophobicContact CE1-CE1 4.04Å; F682-Y764 AromaticContact CE1-CZ 3.94Å; F702-Y764 AromaticContact CE1-CD1 3.68Å; F702-Y764 HydrophobicContact CE1-CD1 3.68Å; F702-Y764 HydrophobicContact CE1-CD2 4.14Å; F702-Y764 HydrophobicContact CE1-CE1 4.28Å; F702-Y764 AromaticContact CE1-CG 3.6Å; F702-Y764 HydrophobicContact CE1-CG 3.6Å; F702-Y764 AromaticContact CZ-CD1 3.57Å; F702-Y764 HydrophobicContact CZ-CD1 3.57Å; F702-Y764 HydrophobicContact CZ-CE1 4.21Å; F702-Y764 AromaticContact CZ-CG 3.93Å; F702-Y764 HydrophobicContact CZ-CG 3.93Å; L709-Y764 HydrophobicContact CD2-CE2 4.02Å; R760-Y764 HydrophobicContact CG-CE1 4.19Å; R760-Y764 HydrophobicContact CG-CE2 3.93Å; R760-Y764 WeakPolarHBondContact CG-OH 3.34Å; R760-Y764 PolarHBondContact NE-OH 3.31Å; R760-Y764 PolarHBondContact O-N 3.48Å; I761-Y764 HydrophobicContact CD1-CD2 4.13Å; I761-Y764 HydrophobicContact CD1-CE2 4.41Å; Y764-L766 VanDerWaalsContact C-N 3.25Å; Y764-L766 PolarHBondContact O-N 3.28Å; Y764-L767 PolarHBondContact O-N 3.18Å; Y764-L768 WeakPolarHBondContact O-CB 3.49Å; Y764-L768 PolarHBondContact O-N 3.45Å
765	Q	89.3	Confident	81.8	Confident	43 Å²	43	43.3 Å²	43.3	20%	0.201	22%	0.217	C	C	.	.	H	α-helix	trans	-63.8	-28.5	176.1	60.2	89.6	20.5	0	0	113.2	T762 K763 K769 L807 I810 L811 L814	T762-Q765 PolarHBondContact O-NE2 2.91Å; K763-Q765 VanDerWaalsContact C-N 3.32Å; K763-Q765 PolarHBondContact O-N 2.88Å; Q765-K769 WeakPolarHBondContact O-CB 3.25Å; Q765-K769 PolarHBondContact O-N 3.32Å; Q765-L807 HydrophobicContact CB-CD1 3.97Å; Q765-L807 WeakPolarHBondContact O-CD1 3.47Å; Q765-I810 HydrophobicContact CB-CG2 3.92Å; Q765-L811 HydrophobicContact CB-CD2 3.91Å; Q765-L811 HydrophobicContact CB-CG 4.37Å; Q765-L811 HydrophobicContact CG-CD2 4.15Å; Q765-L814 HydrophobicContact CB-CD1 4.29Å; Q765-L814 HydrophobicContact CG-CD1 3.66Å
766	L	86.8	Confident	79.9	Confident	75 Å²	75	41.9 Å²	41.9	39%	0.393	21%	0.208	S	C	.	.	H	α-helix	trans	-71.6	-48.6	173.5	-59.1	-179.7	0	0	0	110.9	K763 Y764 L768 K769 V770	K763-L766 HydrophobicContact CD-CD1 4.26Å; K763-L766 WeakPolarHBondContact O-CB 3.45Å; K763-L766 PolarHBondContact O-N 2.88Å; Y764-L766 VanDerWaalsContact C-N 3.25Å; Y764-L766 PolarHBondContact O-N 3.28Å; L766-L768 VanDerWaalsContact C-N 3.33Å; L766-L768 PolarHBondContact O-N 3.43Å; L766-K769 PolarHBondContact O-N 2.67Å; L766-V770 VanDerWaalsContact O-CG2 3.31Å; L766-V770 WeakPolarHBondContact O-CG2 3.23Å; L766-V770 PolarHBondContact O-N 3.35Å
767	L	85.8	Confident	77.7	Confident	10 Å²	10	49.1 Å²	49.1	5%	0.052	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-38.4	-179.9	-65.1	167.6	0	0	0	112	V621 E624 L625 K763 Y764 N771	V621-L767 HydrophobicContact CG1-CD2 4.12Å; E624-L767 HydrophobicContact CG-CD2 4.26Å; L625-L767 HydrophobicContact CB-CD1 4.18Å; L625-L767 HydrophobicContact CD1-CD1 3.67Å; K763-L767 PolarHBondContact O-N 3.06Å; Y764-L767 PolarHBondContact O-N 3.18Å; L767-N771 PolarHBondContact O-N 3.42Å; L767-N771 PolarHBondContact O-ND2 3.49Å
768	L	83.9	Confident	75.1	Confident	2 Å²	2	61 Å²	61	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-68.7	-45.3	172	-76.6	168.5	0	0	0	112.4	F702 Y764 L766 V770 N771 F772 V803 A806 L807 I810	F702-L768 HydrophobicContact CD1-CD1 4.14Å; F702-L768 HydrophobicContact CD2-CD1 4.07Å; F702-L768 HydrophobicContact CD2-CD2 3.7Å; F702-L768 HydrophobicContact CD2-CG 4.12Å; F702-L768 HydrophobicContact CE1-CD1 4.27Å; F702-L768 HydrophobicContact CE2-CD1 4.21Å; F702-L768 HydrophobicContact CE2-CD2 3.91Å; F702-L768 HydrophobicContact CE2-CG 4Å; F702-L768 HydrophobicContact CG-CD1 4.04Å; F702-L768 HydrophobicContact CG-CD2 4.37Å; F702-L768 HydrophobicContact CZ-CD1 4.31Å; F702-L768 HydrophobicContact CZ-CG 4.36Å; Y764-L768 WeakPolarHBondContact O-CB 3.49Å; Y764-L768 PolarHBondContact O-N 3.45Å; L766-L768 VanDerWaalsContact C-N 3.33Å; L766-L768 PolarHBondContact O-N 3.43Å; L768-V770 VanDerWaalsContact C-N 3.32Å; L768-V770 PolarHBondContact O-N 3Å; L768-N771 PolarHBondContact O-N 3.43Å; L768-F772 WeakPolarHBondContact O-CB 3.48Å; L768-F772 PolarHBondContact O-N 3.33Å; L768-V803 HydrophobicContact CD2-CG1 4.36Å; L768-A806 HydrophobicContact CD1-CB 4.11Å; L768-A806 HydrophobicContact CD2-CB 3.98Å; L768-L807 HydrophobicContact CB-CB 4.38Å; L768-L807 HydrophobicContact CB-CD1 4.06Å; L768-I810 HydrophobicContact CD1-CB 4.4Å; L768-I810 HydrophobicContact CD1-CG1 3.73Å
769	K	76.7	Confident	72.3	Confident	103 Å²	103	63.1 Å²	63.1	45%	0.448	30%	0.296	S	S	.	.	H	α-helix	trans	-63.5	-34.8	179.2	-176.4	177.3	-177.3	-179.8	0	112.8	Q765 L766 N773 L807	Q765-K769 WeakPolarHBondContact O-CB 3.25Å; Q765-K769 PolarHBondContact O-N 3.32Å; L766-K769 PolarHBondContact O-N 2.67Å; K769-N773 WeakPolarHBondContact O-CB 3.13Å; K769-N773 PolarHBondContact O-N 3.15Å; K769-N773 PolarHBondContact O-ND2 3.4Å; K769-L807 HydrophobicContact CB-CD1 4.2Å; K769-L807 HydrophobicContact CB-CD2 4.12Å; K769-L807 HydrophobicContact CG-CD2 4.46Å
770	V	67.8	Low	69.5	Low	50 Å²	50	63.5 Å²	63.5	30%	0.303	30%	0.296	S	S	.	.	H	α-helix	trans	-66.7	-45.5	173.8	173.6	0	0	0	0	110.7	V621 L766 L768 F772 N773 F774	V621-V770 HydrophobicContact CB-CG1 4.48Å; V621-V770 HydrophobicContact CG1-CB 4.33Å; V621-V770 HydrophobicContact CG1-CG1 4.12Å; V621-V770 HydrophobicContact CG2-CG1 3.59Å; L766-V770 VanDerWaalsContact O-CG2 3.31Å; L766-V770 WeakPolarHBondContact O-CG2 3.23Å; L766-V770 PolarHBondContact O-N 3.35Å; L768-V770 VanDerWaalsContact C-N 3.32Å; L768-V770 PolarHBondContact O-N 3Å; V770-F772 PolarHBondContact O-N 2.88Å; V770-N773 PolarHBondContact O-N 3.44Å; V770-F774 HydrophobicContact CG1-CD2 4.01Å; V770-F774 HydrophobicContact CG1-CE2 3.49Å; V770-F774 VanDerWaalsContact CG1-CE2 3.49Å; V770-F774 HydrophobicContact CG1-CZ 4.35Å; V770-F774 WeakPolarHBondContact O-CD2 3.39Å; V770-F774 PolarHBondContact O-N 2.9Å
771	N	60.6	Low	66.4	Low	3 Å²	3	72.3 Å²	72.3	2%	0.016	34%	0.335	C	S	.	.	H	α-helix	trans	-60.2	-44.2	173.6	-84.1	-70.3	0	0	0	112.5	S618 V621 A695 L767 L768 N773 F774 L775 V803	S618-N771 PolarHBondContact OG-OD1 3.06Å; V621-N771 VanDerWaalsContact CG1-ND2 3.31Å; V621-N771 WeakPolarHBondContact CG1-ND2 3.41Å; A695-N771 HydrophobicContact CB-CB 4.07Å; A695-N771 WeakPolarHBondContact CB-OD1 3.2Å; L767-N771 PolarHBondContact O-N 3.42Å; L767-N771 PolarHBondContact O-ND2 3.49Å; L768-N771 PolarHBondContact O-N 3.43Å; N771-N773 PolarHBondContact O-N 2.99Å; N771-F774 PolarHBondContact O-N 3.27Å; N771-L775 PolarHBondContact O-N 2.93Å; N771-L775 VanDerWaalsContact O-N 3.15Å; N771-V803 HydrophobicContact CB-CG1 4.38Å
772	F	59.8	Low	63.6	Low	37 Å²	37	80.1 Å²	80.1	16%	0.162	37%	0.368	C	S	.	.	H	α-helix	trans	-57.1	-47.8	174.6	172.6	-108	0	0	0	112.2	L768 V770 F774 L775 H776 V803 E804	L768-F772 WeakPolarHBondContact O-CB 3.48Å; L768-F772 PolarHBondContact O-N 3.33Å; V770-F772 PolarHBondContact O-N 2.88Å; F772-F774 PolarHBondContact O-N 3.45Å; F772-L775 PolarHBondContact O-N 3.45Å; F772-L775 VanDerWaalsContact O-N 3.11Å; F772-H776 HydrophobicContact CD2-CB 4.39Å; F772-H776 AromaticContact CD2-CD2 3.99Å; F772-H776 HydrophobicContact CE1-CB 4.46Å; F772-H776 HydrophobicContact CE2-CB 3.84Å; F772-H776 AromaticContact CE2-CD2 3.53Å; F772-H776 AromaticContact CE2-CE1 3.56Å; F772-H776 AromaticContact CE2-CG 3.3Å; F772-H776 AromaticContact CE2-ND1 3.4Å; F772-H776 WeakPolarHBondContact CE2-ND1 3.25Å; F772-H776 HydrophobicContact CZ-CB 3.91Å; F772-H776 AromaticContact CZ-CE1 3.38Å; F772-H776 WeakPolarHBondContact CZ-CE1 3.48Å; F772-H776 AromaticContact CZ-CG 3.7Å; F772-H776 AromaticContact CZ-ND1 3.61Å; F772-H776 PolarHBondContact O-N 3.11Å; F772-V803 HydrophobicContact CB-CG1 4.01Å; F772-E804 HydrophobicContact CD2-CG 3.61Å; F772-E804 HydrophobicContact CE2-CG 3.2Å; F772-E804 WeakPolarHBondContact CE2-OE1 3.36Å; F772-E804 HydrophobicContact CZ-CG 4.01Å
773	N	59.2	Low	61.1	Low	77 Å²	77	82.6 Å²	82.6	41%	0.412	39%	0.386	S	S	.	.	H	α-helix	trans	-60.3	-29.8	178.1	-76.2	-20.6	0	0	0	113.3	K769 V770 N771	K769-N773 WeakPolarHBondContact O-CB 3.13Å; K769-N773 PolarHBondContact O-N 3.15Å; K769-N773 PolarHBondContact O-ND2 3.4Å; V770-N773 PolarHBondContact O-N 3.44Å; N771-N773 PolarHBondContact O-N 2.99Å
774	F	56.9	Low	58.6	Low	54 Å²	54	84.9 Å²	84.9	24%	0.237	41%	0.409	C	S	.	.	H	α-helix	trans	-76.9	-35.1	174.6	-71	-51.5	0	0	0	113	L614 R617 V621 V770 N771 F772	L614-F774 HydrophobicContact CD2-CD1 4.3Å; R617-F774 HydrophobicContact CB-CD1 4.4Å; R617-F774 HydrophobicContact CB-CD2 4.47Å; R617-F774 HydrophobicContact CB-CE1 3.98Å; R617-F774 HydrophobicContact CB-CE2 4.03Å; R617-F774 HydrophobicContact CB-CZ 3.79Å; R617-F774 HydrophobicContact CG-CE1 4.5Å; R617-F774 HydrophobicContact CG-CZ 4.4Å; V621-F774 HydrophobicContact CG2-CE2 4.13Å; V770-F774 HydrophobicContact CG1-CD2 4.01Å; V770-F774 HydrophobicContact CG1-CE2 3.49Å; V770-F774 VanDerWaalsContact CG1-CE2 3.49Å; V770-F774 HydrophobicContact CG1-CZ 4.35Å; V770-F774 WeakPolarHBondContact O-CD2 3.39Å; V770-F774 PolarHBondContact O-N 2.9Å; N771-F774 PolarHBondContact O-N 3.27Å; F772-F774 PolarHBondContact O-N 3.45Å
775	L	53.5	Low	55.9	Low	89 Å²	89	91.1 Å²	91.1	47%	0.466	44%	0.436	S	S	.	.	H	α-helix	trans	-73.3	-47.7	175.7	-67.2	172	0	0	0	112.5	A695 N771 F772 R777 V803	A695-L775 HydrophobicContact CB-CD1 4.16Å; N771-L775 PolarHBondContact O-N 2.93Å; N771-L775 VanDerWaalsContact O-N 3.15Å; F772-L775 PolarHBondContact O-N 3.45Å; F772-L775 VanDerWaalsContact O-N 3.11Å; L775-R777 VanDerWaalsContact C-N 3.29Å; L775-R777 PolarHBondContact O-N 3.46Å; L775-V803 HydrophobicContact CD1-CB 4.28Å; L775-V803 HydrophobicContact CD1-CG2 3.48Å; L775-V803 VanDerWaalsContact CD1-CG2 3.48Å
776	H	52.8	Low	53.3	Low	37 Å²	37	93 Å²	93	17%	0.171	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-83.2	6.1	-172.4	-89.8	-130	0	0	0	115.3	F772 R778 C779 F780 E804	F772-H776 HydrophobicContact CD2-CB 4.39Å; F772-H776 AromaticContact CD2-CD2 3.99Å; F772-H776 HydrophobicContact CE1-CB 4.46Å; F772-H776 HydrophobicContact CE2-CB 3.84Å; F772-H776 AromaticContact CE2-CD2 3.53Å; F772-H776 AromaticContact CE2-CE1 3.56Å; F772-H776 AromaticContact CE2-CG 3.3Å; F772-H776 AromaticContact CE2-ND1 3.4Å; F772-H776 WeakPolarHBondContact CE2-ND1 3.25Å; F772-H776 HydrophobicContact CZ-CB 3.91Å; F772-H776 AromaticContact CZ-CE1 3.38Å; F772-H776 WeakPolarHBondContact CZ-CE1 3.48Å; F772-H776 AromaticContact CZ-CG 3.7Å; F772-H776 AromaticContact CZ-ND1 3.61Å; F772-H776 PolarHBondContact O-N 3.11Å; H776-R778 PolarHBondContact O-N 2.92Å; H776-C779 PolarHBondContact O-N 3.38Å; H776-F780 AromaticContact CE1-CD2 3.44Å; H776-F780 VanDerWaalsContact CE1-CD2 3.44Å; H776-F780 WeakPolarHBondContact CE1-CD2 3.21Å; H776-F780 AromaticContact CE1-CE2 2.99Å; H776-F780 WeakPolarHBondContact CE1-CE2 3.45Å; H776-F780 AromaticContact ND1-CE2 3.88Å; H776-E804 IonicContact CE1-OE1 3.22Å; H776-E804 IonicContact ND1-OE1 3.68Å; H776-E804 IonicContact NE2-OE1 2.75Å; H776-E804 PolarHBondContact NE2-OE1 2.83Å; H776-E804 IonicContact NE2-OE2 3.39Å; H776-E804 PolarHBondContact NE2-OE2 2.98Å
777	R	49.7	Very low	51	Low	182 Å²	182	95.1 Å²	95.1	69%	0.687	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-61.9	-4.4	176.7	-117.2	-176.1	-173.6	-128.8	-0.9	114.9	L775	L775-R777 VanDerWaalsContact C-N 3.29Å; L775-R777 PolarHBondContact O-N 3.46Å
778	R	40.9	Very low	48.7	Very low	248 Å²	248	99.7 Å²	99.7	94%	0.936	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-84.8	-17.8	171	-113.9	178.1	171.5	131.6	-2.8	114.9	H776	H776-R778 PolarHBondContact O-N 2.92Å
779	C	36.5	Very low	46.4	Very low	87 Å²	87	104.1 Å²	104.1	59%	0.588	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.9	-28.3	-160.7	-63.3	0	0	0	0	116.8	H776	H776-C779 PolarHBondContact O-N 3.38Å
780	F	34	Very low	44.6	Very low	98 Å²	98	101.8 Å²	101.8	43%	0.43	49%	0.489	S	S	.	.			trans	-118.1	102	-165.9	-74.2	-74.8	0	0	0	116	H776 F786	H776-F780 AromaticContact CE1-CD2 3.44Å; H776-F780 VanDerWaalsContact CE1-CD2 3.44Å; H776-F780 WeakPolarHBondContact CE1-CD2 3.21Å; H776-F780 AromaticContact CE1-CE2 2.99Å; H776-F780 WeakPolarHBondContact CE1-CE2 3.45Å; H776-F780 AromaticContact ND1-CE2 3.88Å; F780-F786 HydrophobicContact CE1-CB 3.92Å; F780-F786 AromaticContact CE1-CD2 3.88Å; F780-F786 HydrophobicContact CE1-CD2 3.88Å; F780-F786 AromaticContact CE1-CG 3.89Å; F780-F786 HydrophobicContact CE1-CG 3.89Å; F780-F786 HydrophobicContact CZ-CB 4.42Å; F780-F786 HydrophobicContact CZ-CD1 4.24Å; F780-F786 AromaticContact CZ-CD2 3.71Å; F780-F786 HydrophobicContact CZ-CD2 3.71Å; F780-F786 HydrophobicContact CZ-CE1 4.4Å; F780-F786 AromaticContact CZ-CE2 3.91Å; F780-F786 HydrophobicContact CZ-CE2 3.91Å; F780-F786 AromaticContact CZ-CG 3.89Å; F780-F786 HydrophobicContact CZ-CG 3.89Å; F780-F786 HydrophobicContact CZ-CZ 4.25Å
781	K	31.5	Very low	43.2	Very low	204 Å²	204	103.4 Å²	103.4	89%	0.887	51%	0.507	S	S	*	.	S	Bend	trans	-95.8	130.9	145.5	-69.9	-177.4	177.8	-178.7	0	107.8
782	K	34	Very low	42.1	Very low	167 Å²	167	111.7 Å²	111.7	73%	0.726	54%	0.538	S	S	*	.			trans	69.2	101.8	-176.7	-53.9	-179.4	178.4	-178.2	0	115.4	S784	K782-S784 PolarHBondContact O-N 2.8Å
783	P	37.7	Very low	40.7	Very low	114 Å²	114	112.2 Å²	112.2	74%	0.74	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-61.4	-25.7	171.3	-24.1	34.8	0	0	0	114.5	F785 F786	P783-F785 PolarHBondContact O-N 3.08Å; P783-F785 VanDerWaalsContact O-N 3.13Å; P783-F786 PolarHBondContact O-N 3.3Å
784	S	38.5	Very low	39.4	Very low	103 Å²	103	115 Å²	115	72%	0.72	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-64.4	-16.2	-171.8	-175.7	0	0	0	0	115.7	K782	K782-S784 PolarHBondContact O-N 2.8Å
785	F	37.1	Very low	38	Very low	130 Å²	130	116.7 Å²	116.7	57%	0.57	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-87.2	-36.3	-177.2	-161.5	-99.3	0	0	0	112.7	P783 L787 Q788 E789	P783-F785 PolarHBondContact O-N 3.08Å; P783-F785 VanDerWaalsContact O-N 3.13Å; F785-L787 PolarHBondContact O-N 3.46Å; F785-Q788 PolarHBondContact O-N 2.88Å; F785-E789 PolarHBondContact O-N 3.44Å
786	F	36.5	Very low	37.1	Very low	83 Å²	83	115.9 Å²	115.9	36%	0.364	59%	0.586	S	S	.	*	H	α-helix	trans	-65.9	-38.9	-169.7	-163.5	-128.7	0	0	0	113.2	F780 P783 Q788 E789 L790	F780-F786 HydrophobicContact CE1-CB 3.92Å; F780-F786 AromaticContact CE1-CD2 3.88Å; F780-F786 HydrophobicContact CE1-CD2 3.88Å; F780-F786 AromaticContact CE1-CG 3.89Å; F780-F786 HydrophobicContact CE1-CG 3.89Å; F780-F786 HydrophobicContact CZ-CB 4.42Å; F780-F786 HydrophobicContact CZ-CD1 4.24Å; F780-F786 AromaticContact CZ-CD2 3.71Å; F780-F786 HydrophobicContact CZ-CD2 3.71Å; F780-F786 HydrophobicContact CZ-CE1 4.4Å; F780-F786 AromaticContact CZ-CE2 3.91Å; F780-F786 HydrophobicContact CZ-CE2 3.91Å; F780-F786 AromaticContact CZ-CG 3.89Å; F780-F786 HydrophobicContact CZ-CG 3.89Å; F780-F786 HydrophobicContact CZ-CZ 4.25Å; P783-F786 PolarHBondContact O-N 3.3Å; F786-Q788 PolarHBondContact O-N 3.48Å; F786-E789 PolarHBondContact O-N 3.49Å; F786-L790 HydrophobicContact CD1-CD1 3.66Å; F786-L790 HydrophobicContact CD1-CG 4.26Å; F786-L790 HydrophobicContact CE1-CD1 3.69Å; F786-L790 HydrophobicContact CE1-CD2 4.38Å; F786-L790 HydrophobicContact CE1-CG 4.2Å; F786-L790 HydrophobicContact CE2-CG 4.45Å; F786-L790 HydrophobicContact CG-CD1 4.23Å; F786-L790 HydrophobicContact CG-CG 4.43Å; F786-L790 HydrophobicContact CZ-CD1 4.27Å; F786-L790 HydrophobicContact CZ-CD2 4.16Å; F786-L790 HydrophobicContact CZ-CG 4.29Å; F786-L790 WeakPolarHBondContact O-CB 3.28Å; F786-L790 VanDerWaalsContact O-CG 3.29Å; F786-L790 WeakPolarHBondContact O-CG 3.22Å; F786-L790 PolarHBondContact O-N 2.72Å
787	L	36.8	Very low	36.4	Very low	119 Å²	119	120.3 Å²	120.3	62%	0.623	62%	0.616	S	S	*	*	H	α-helix	trans	-63.2	-24.5	174.9	-69.5	173.1	0	0	0	113.4	F785	F785-L787 PolarHBondContact O-N 3.46Å
788	Q	38.4	Very low	35.7	Very low	107 Å²	107	121 Å²	121	50%	0.5	63%	0.627	S	S	.	*	H	α-helix	trans	-88.5	-21.7	179.9	-178.2	159.2	77.5	0	0	112.7	F785 F786 R792	F785-Q788 PolarHBondContact O-N 2.88Å; F786-Q788 PolarHBondContact O-N 3.48Å; Q788-R792 VanDerWaalsContact CG-NH1 3.33Å
789	E	36.6	Very low	35.4	Very low	94 Å²	94	112.3 Å²	112.3	44%	0.439	62%	0.615	S	S	.	*	H	α-helix	trans	-84.3	-44.7	172.4	-142.7	66.4	-172.7	0	0	111.3	F785 F786 A791 R792	F785-E789 PolarHBondContact O-N 3.44Å; F786-E789 PolarHBondContact O-N 3.49Å; E789-A791 PolarHBondContact O-N 3.49Å; E789-A791 VanDerWaalsContact O-N 3.11Å; E789-R792 PolarHBondContact O-N 2.94Å
790	L	37.6	Very low	36.2	Very low	54 Å²	54	112.6 Å²	112.6	28%	0.283	60%	0.604	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.6	-25.1	175.3	-74.6	173	0	0	0	113.6	F786 R792 L796	F786-L790 HydrophobicContact CD1-CD1 3.66Å; F786-L790 HydrophobicContact CD1-CG 4.26Å; F786-L790 HydrophobicContact CE1-CD1 3.69Å; F786-L790 HydrophobicContact CE1-CD2 4.38Å; F786-L790 HydrophobicContact CE1-CG 4.2Å; F786-L790 HydrophobicContact CE2-CG 4.45Å; F786-L790 HydrophobicContact CG-CD1 4.23Å; F786-L790 HydrophobicContact CG-CG 4.43Å; F786-L790 HydrophobicContact CZ-CD1 4.27Å; F786-L790 HydrophobicContact CZ-CD2 4.16Å; F786-L790 HydrophobicContact CZ-CG 4.29Å; F786-L790 WeakPolarHBondContact O-CB 3.28Å; F786-L790 VanDerWaalsContact O-CG 3.29Å; F786-L790 WeakPolarHBondContact O-CG 3.22Å; F786-L790 PolarHBondContact O-N 2.72Å; L790-R792 VanDerWaalsContact C-N 3.28Å; L790-R792 PolarHBondContact O-N 3.35Å; L790-L796 HydrophobicContact CD2-CD1 3.77Å; L790-L796 HydrophobicContact CD2-CD2 4.13Å
791	A	38.9	Very low	38	Very low	84 Å²	84	110.2 Å²	110.2	69%	0.694	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	0.6	177.3	0	0	0	0	0	113.9	E789	E789-A791 PolarHBondContact O-N 3.49Å; E789-A791 VanDerWaalsContact O-N 3.11Å
792	R	36.5	Very low	40.2	Very low	178 Å²	178	102.4 Å²	102.4	67%	0.672	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124	-17.5	-171.1	-73.1	-178	168.2	136.2	-4.1	116	Q788 E789 L790	Q788-R792 VanDerWaalsContact CG-NH1 3.33Å; E789-R792 PolarHBondContact O-N 2.94Å; L790-R792 VanDerWaalsContact C-N 3.28Å; L790-R792 PolarHBondContact O-N 3.35Å
793	S	31.2	Very low	42.3	Very low	48 Å²	48	94.5 Å²	94.5	34%	0.336	53%	0.531	S	S	.	.			trans	-109.2	118	-179.9	48.6	0	0	0	0	112.5	S795 L796	S793-S795 PolarHBondContact O-N 3.23Å; S793-S795 VanDerWaalsContact O-N 3.13Å; S793-L796 WeakPolarHBondContact O-CD1 3.46Å
794	S	31	Very low	44.2	Very low	135 Å²	135	90 Å²	90	94%	0.944	50%	0.5	S	S	*	.	S	Bend	trans	-82.6	27.4	178.2	56.1	0	0	0	0	113.7
795	S	29.6	Very low	46.3	Very low	90 Å²	90	88.2 Å²	88.2	63%	0.629	48%	0.482	S	S	*	.			trans	-153.8	88.1	-172.5	55.3	0	0	0	0	109.8	S793	S793-S795 PolarHBondContact O-N 3.23Å; S793-S795 VanDerWaalsContact O-N 3.13Å
796	L	34.1	Very low	48.7	Very low	72 Å²	72	82 Å²	82	38%	0.377	46%	0.455	S	S	.	.			trans	-134.5	24.1	-165.9	-81.6	171.1	0	0	0	114.6	L790 S793	L790-L796 HydrophobicContact CD2-CD1 3.77Å; L790-L796 HydrophobicContact CD2-CD2 4.13Å; S793-L796 WeakPolarHBondContact O-CD1 3.46Å
797	T	36.8	Very low	51.1	Low	130 Å²	130	79 Å²	79	80%	0.798	44%	0.443	S	S	*	.	S	Bend	trans	-87.7	-27.2	174.9	44.3	0	0	0	0	113.9	G799	T797-G799 PolarHBondContact O-N 3.22Å
798	E	36.1	Very low	53.3	Low	195 Å²	195	76.8 Å²	76.8	91%	0.911	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.1	-170	-62.8	-179.7	128.4	0	0	114.9
799	G	35	Very low	55.6	Low	67 Å²	67	73.5 Å²	73.5	69%	0.691	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.8	9	-170.4	0	0	0	0	0	116.1	T797	T797-G799 PolarHBondContact O-N 3.22Å
800	R	51.8	Low	58.1	Low	93 Å²	93	69.2 Å²	69.2	35%	0.351	40%	0.403	S	S	.	.			trans	-100.1	140.4	-179.9	-73.5	175.4	158.6	-129.9	-12.9	110.9	L805 D808	R800-L805 HydrophobicContact CB-CD2 4.24Å; R800-L805 HydrophobicContact CB-CG 4.26Å; R800-D808 IonicContact CZ-OD2 2.77Å; R800-D808 VanDerWaalsContact CZ-OD2 3.27Å; R800-D808 IonicContact NH1-OD2 3.89Å; R800-D808 PolarHBondContact NH1-OD2 2.99Å; R800-D808 IonicContact NH2-OD2 2.75Å; R800-D808 PolarHBondContact NH2-OD2 3.28Å
801	T	72	Confident	60.5	Low	47 Å²	47	70.1 Å²	70.1	29%	0.288	41%	0.407	S	S	.	.			trans	-79.4	150.7	168.7	60	0	0	0	0	111.2	V803 E804 L805	T801-V803 PolarHBondContact O-N 2.94Å; T801-V803 VanDerWaalsContact O-N 3.08Å; T801-E804 PolarHBondContact N-OE2 2.95Å; T801-E804 WeakPolarHBondContact O-CB 3.23Å; T801-E804 PolarHBondContact O-N 3.14Å; T801-E804 WeakPolarHBondContact OG1-CG 3.43Å; T801-E804 PolarHBondContact OG1-N 3.42Å; T801-E804 PolarHBondContact OG1-OE2 3.42Å; T801-L805 PolarHBondContact O-N 3.42Å; T801-L805 VanDerWaalsContact O-N 3.15Å
802	D	77.4	Confident	62.6	Low	40 Å²	40	71.2 Å²	71.2	21%	0.214	39%	0.394	C	S	.	.	H	α-helix	trans	-54.4	-31.6	176.7	-53.8	-10.6	0	0	0	111.8	K696 A699 N700 L703 L805 A806	K696-D802 WeakPolarHBondContact CE-OD2 3.28Å; K696-D802 HydrophobicContact CG-CB 4.19Å; K696-D802 WeakPolarHBondContact CG-OD2 3.12Å; A699-D802 HydrophobicContact CB-CB 4.23Å; N700-D802 PolarHBondContact ND2-OD2 3.3Å; N700-D802 PolarHBondContact OD1-OD2 2.95Å; L703-D802 HydrophobicContact CD1-CB 4.41Å; D802-L805 PolarHBondContact O-N 3.1Å; D802-A806 WeakPolarHBondContact O-CB 3.31Å; D802-A806 PolarHBondContact O-N 3.18Å
803	V	79.1	Confident	65	Low	2 Å²	2	63.3 Å²	63.3	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-70.7	-34.1	177.9	-163.9	0	0	0	0	112.6	A699 L768 N771 F772 L775 T801 L807	A699-V803 HydrophobicContact CB-CB 4.16Å; A699-V803 HydrophobicContact CB-CG2 3.81Å; L768-V803 HydrophobicContact CD2-CG1 4.36Å; N771-V803 HydrophobicContact CB-CG1 4.38Å; F772-V803 HydrophobicContact CB-CG1 4.01Å; L775-V803 HydrophobicContact CD1-CB 4.28Å; L775-V803 HydrophobicContact CD1-CG2 3.48Å; L775-V803 VanDerWaalsContact CD1-CG2 3.48Å; T801-V803 PolarHBondContact O-N 2.94Å; T801-V803 VanDerWaalsContact O-N 3.08Å; V803-L807 VanDerWaalsContact O-CB 3.25Å; V803-L807 WeakPolarHBondContact O-CB 3.44Å; V803-L807 PolarHBondContact O-N 3.14Å
804	E	78.1	Confident	67.7	Low	19 Å²	19	62.8 Å²	62.8	9%	0.089	36%	0.358	C	S	.	.	H	α-helix	trans	-68.1	-40.5	170.7	-72.6	163.5	125.3	0	0	111.2	F772 H776 T801 L807 D808	F772-E804 HydrophobicContact CD2-CG 3.61Å; F772-E804 HydrophobicContact CE2-CG 3.2Å; F772-E804 WeakPolarHBondContact CE2-OE1 3.36Å; F772-E804 HydrophobicContact CZ-CG 4.01Å; H776-E804 IonicContact CE1-OE1 3.22Å; H776-E804 IonicContact ND1-OE1 3.68Å; H776-E804 IonicContact NE2-OE1 2.75Å; H776-E804 PolarHBondContact NE2-OE1 2.83Å; H776-E804 IonicContact NE2-OE2 3.39Å; H776-E804 PolarHBondContact NE2-OE2 2.98Å; T801-E804 PolarHBondContact N-OE2 2.95Å; T801-E804 WeakPolarHBondContact O-CB 3.23Å; T801-E804 PolarHBondContact O-N 3.14Å; T801-E804 WeakPolarHBondContact OG1-CG 3.43Å; T801-E804 PolarHBondContact OG1-N 3.42Å; T801-E804 PolarHBondContact OG1-OE2 3.42Å; E804-L807 PolarHBondContact O-N 3.3Å; E804-D808 WeakPolarHBondContact O-CB 3.25Å; E804-D808 PolarHBondContact O-N 2.72Å
805	L	83	Confident	70.2	Confident	66 Å²	66	60.2 Å²	60.2	35%	0.346	33%	0.332	S	S	.	.	H	α-helix	trans	-64.5	-44	177	-64.5	174.4	0	0	0	111.6	L703 R800 T801 D802 A809	L703-L805 HydrophobicContact CD1-CB 4.03Å; L703-L805 HydrophobicContact CD2-CB 4.04Å; R800-L805 HydrophobicContact CB-CD2 4.24Å; R800-L805 HydrophobicContact CB-CG 4.26Å; T801-L805 PolarHBondContact O-N 3.42Å; T801-L805 VanDerWaalsContact O-N 3.15Å; D802-L805 PolarHBondContact O-N 3.1Å; L805-A809 WeakPolarHBondContact O-CB 3.39Å; L805-A809 PolarHBondContact O-N 2.84Å
806	A	86.7	Confident	72.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-64.2	-41.5	175.2	0	0	0	0	0	112.2	A699 F702 L703 L768 D802 A809 I810	A699-A806 HydrophobicContact CB-CB 3.78Å; F702-A806 HydrophobicContact CB-CB 3.87Å; L703-A806 HydrophobicContact CD2-CB 4.48Å; L703-A806 HydrophobicContact CG-CB 4.25Å; L768-A806 HydrophobicContact CD1-CB 4.11Å; L768-A806 HydrophobicContact CD2-CB 3.98Å; D802-A806 WeakPolarHBondContact O-CB 3.31Å; D802-A806 PolarHBondContact O-N 3.18Å; A806-A809 PolarHBondContact O-N 3.04Å; A806-I810 WeakPolarHBondContact O-CG1 3.3Å; A806-I810 PolarHBondContact O-N 3.29Å
807	L	87.1	Confident	75	Confident	19 Å²	19	54.2 Å²	54.2	10%	0.099	29%	0.293	C	S	.	.	H	α-helix	trans	-65.6	-46.4	177.6	-178.7	59.1	0	0	0	111.6	Q765 L768 K769 V803 E804 A809 I810 L811	Q765-L807 HydrophobicContact CB-CD1 3.97Å; Q765-L807 WeakPolarHBondContact O-CD1 3.47Å; L768-L807 HydrophobicContact CB-CB 4.38Å; L768-L807 HydrophobicContact CB-CD1 4.06Å; K769-L807 HydrophobicContact CB-CD1 4.2Å; K769-L807 HydrophobicContact CB-CD2 4.12Å; K769-L807 HydrophobicContact CG-CD2 4.46Å; V803-L807 VanDerWaalsContact O-CB 3.25Å; V803-L807 WeakPolarHBondContact O-CB 3.44Å; V803-L807 PolarHBondContact O-N 3.14Å; E804-L807 PolarHBondContact O-N 3.3Å; L807-A809 VanDerWaalsContact C-N 3.29Å; L807-A809 PolarHBondContact O-N 3.29Å; L807-I810 PolarHBondContact O-N 3.43Å; L807-L811 HydrophobicContact CD1-CD1 4.05Å; L807-L811 HydrophobicContact CD1-CG 4.18Å; L807-L811 HydrophobicContact CG-CD1 3.94Å; L807-L811 HydrophobicContact CG-CG 4.48Å; L807-L811 WeakPolarHBondContact O-CB 3.31Å; L807-L811 VanDerWaalsContact O-CG 3.26Å; L807-L811 WeakPolarHBondContact O-CG 3.33Å; L807-L811 PolarHBondContact O-N 3.36Å
808	D	82.9	Confident	77.2	Confident	72 Å²	72	52.1 Å²	52.1	39%	0.385	28%	0.277	S	S	.	.	H	α-helix	trans	-59.7	-39.4	174.6	-87.6	3	0	0	0	111.3	R800 E804 L811 Y812	R800-D808 IonicContact CZ-OD2 2.77Å; R800-D808 VanDerWaalsContact CZ-OD2 3.27Å; R800-D808 IonicContact NH1-OD2 3.89Å; R800-D808 PolarHBondContact NH1-OD2 2.99Å; R800-D808 IonicContact NH2-OD2 2.75Å; R800-D808 PolarHBondContact NH2-OD2 3.28Å; E804-D808 WeakPolarHBondContact O-CB 3.25Å; E804-D808 PolarHBondContact O-N 2.72Å; D808-L811 PolarHBondContact O-N 3.02Å; D808-Y812 VanDerWaalsContact O-CB 3.22Å; D808-Y812 WeakPolarHBondContact O-CB 3.36Å; D808-Y812 PolarHBondContact O-N 3.42Å
809	A	86.6	Confident	79.2	Confident	38 Å²	38	42.9 Å²	42.9	31%	0.314	23%	0.234	S	C	.	.	H	α-helix	trans	-63.9	-45.4	177.7	0	0	0	0	0	112.8	L703 L805 A806 L807 Y812 L813	L703-A809 HydrophobicContact CD2-CB 4.49Å; L805-A809 WeakPolarHBondContact O-CB 3.39Å; L805-A809 PolarHBondContact O-N 2.84Å; A806-A809 PolarHBondContact O-N 3.04Å; L807-A809 VanDerWaalsContact C-N 3.29Å; L807-A809 PolarHBondContact O-N 3.29Å; A809-Y812 PolarHBondContact O-N 2.87Å; A809-L813 WeakPolarHBondContact O-CB 3.43Å; A809-L813 PolarHBondContact O-N 3.19Å
810	I	89.3	Confident	81.3	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.21	C	C	.	.	H	α-helix	trans	-68.6	-40.4	176.6	-63.4	-62.7	0	0	0	111.6	F702 L709 Q765 L768 A806 L807 Y812 L813 L814	F702-I810 HydrophobicContact CD1-CD1 3.88Å; F702-I810 HydrophobicContact CD1-CG1 4.09Å; F702-I810 HydrophobicContact CE1-CD1 4.22Å; F702-I810 HydrophobicContact CE1-CG1 4.42Å; L709-I810 HydrophobicContact CD1-CD1 3.73Å; Q765-I810 HydrophobicContact CB-CG2 3.92Å; L768-I810 HydrophobicContact CD1-CB 4.4Å; L768-I810 HydrophobicContact CD1-CG1 3.73Å; A806-I810 WeakPolarHBondContact O-CG1 3.3Å; A806-I810 PolarHBondContact O-N 3.29Å; L807-I810 PolarHBondContact O-N 3.43Å; I810-Y812 VanDerWaalsContact C-N 3.32Å; I810-Y812 PolarHBondContact O-N 3.21Å; I810-L813 PolarHBondContact O-N 3.06Å; I810-L814 HydrophobicContact CG2-CD1 4.06Å; I810-L814 HydrophobicContact CG2-CG 4.46Å; I810-L814 WeakPolarHBondContact O-CB 3.48Å; I810-L814 WeakPolarHBondContact O-CG 3.45Å; I810-L814 PolarHBondContact O-N 3.43Å
811	L	86.6	Confident	82.7	Confident	73 Å²	73	38.6 Å²	38.6	38%	0.382	20%	0.204	S	C	.	.	H	α-helix	trans	-63.6	-39.2	175.9	-70.8	172.6	0	0	0	111.6	Q765 L807 D808 Q815	Q765-L811 HydrophobicContact CB-CD2 3.91Å; Q765-L811 HydrophobicContact CB-CG 4.37Å; Q765-L811 HydrophobicContact CG-CD2 4.15Å; L807-L811 HydrophobicContact CD1-CD1 4.05Å; L807-L811 HydrophobicContact CD1-CG 4.18Å; L807-L811 HydrophobicContact CG-CD1 3.94Å; L807-L811 HydrophobicContact CG-CG 4.48Å; L807-L811 WeakPolarHBondContact O-CB 3.31Å; L807-L811 VanDerWaalsContact O-CG 3.26Å; L807-L811 WeakPolarHBondContact O-CG 3.33Å; L807-L811 PolarHBondContact O-N 3.36Å; D808-L811 PolarHBondContact O-N 3.02Å; L811-Q815 WeakPolarHBondContact O-CB 3.04Å; L811-Q815 PolarHBondContact O-N 3.46Å
812	Y	84.4	Confident	83.1	Confident	107 Å²	107	37.6 Å²	37.6	42%	0.42	20%	0.197	S	C	.	.	H	α-helix	trans	-65.9	-40.7	173.9	179.1	-108.7	0	0	0	112.6	D808 A809 I810 Q815 Q816	D808-Y812 VanDerWaalsContact O-CB 3.22Å; D808-Y812 WeakPolarHBondContact O-CB 3.36Å; D808-Y812 PolarHBondContact O-N 3.42Å; A809-Y812 PolarHBondContact O-N 2.87Å; I810-Y812 VanDerWaalsContact C-N 3.32Å; I810-Y812 PolarHBondContact O-N 3.21Å; Y812-Q815 WeakPolarHBondContact O-CB 3.32Å; Y812-Q815 PolarHBondContact O-N 2.83Å; Y812-Q816 HydrophobicContact CE1-CG 4.21Å; Y812-Q816 HydrophobicContact CE2-CG 4.46Å; Y812-Q816 WeakPolarHBondContact O-CG 3.27Å; Y812-Q816 PolarHBondContact O-N 3.36Å; Y812-Q816 PolarHBondContact OH-NE2 3.01Å
813	L	87.1	Confident	83.2	Confident	13 Å²	13	37 Å²	37	7%	0.068	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-43.4	175.6	174.3	58.8	0	0	0	112	L709 R710 V713 I761 A809 I810 Q815 Q816 A817	L709-L813 HydrophobicContact CB-CD2 3.58Å; L709-L813 WeakPolarHBondContact O-CD2 3.45Å; R710-L813 HydrophobicContact CG-CD1 4.37Å; V713-L813 HydrophobicContact CG2-CD1 3.73Å; I761-L813 HydrophobicContact CD1-CD2 3.73Å; I761-L813 HydrophobicContact CD1-CG 4.43Å; A809-L813 WeakPolarHBondContact O-CB 3.43Å; A809-L813 PolarHBondContact O-N 3.19Å; I810-L813 PolarHBondContact O-N 3.06Å; L813-Q815 VanDerWaalsContact C-N 3.32Å; L813-Q815 PolarHBondContact O-N 2.92Å; L813-Q816 PolarHBondContact O-N 2.91Å; L813-A817 PolarHBondContact O-N 3.33Å
814	L	88	Confident	82.9	Confident	36 Å²	36	37.7 Å²	37.7	19%	0.188	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-39.6	172.8	-73	170.1	0	0	0	111.7	I761 T762 Q765 I810 A817 N818	I761-L814 HydrophobicContact CB-CD2 4.37Å; I761-L814 HydrophobicContact CG1-CD2 3.84Å; I761-L814 HydrophobicContact CG1-CG 4.48Å; I761-L814 HydrophobicContact CG2-CD2 3.96Å; T762-L814 HydrophobicContact CG2-CD2 3.83Å; Q765-L814 HydrophobicContact CB-CD1 4.29Å; Q765-L814 HydrophobicContact CG-CD1 3.66Å; I810-L814 HydrophobicContact CG2-CD1 4.06Å; I810-L814 HydrophobicContact CG2-CG 4.46Å; I810-L814 WeakPolarHBondContact O-CB 3.48Å; I810-L814 WeakPolarHBondContact O-CG 3.45Å; I810-L814 PolarHBondContact O-N 3.43Å; L814-A817 PolarHBondContact O-N 2.94Å; L814-N818 WeakPolarHBondContact O-CB 3.34Å; L814-N818 PolarHBondContact O-N 3.05Å
815	Q	82.8	Confident	83	Confident	82 Å²	82	39.5 Å²	39.5	38%	0.383	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-41.5	173.4	-172.8	-179	9.1	0	0	111.8	L811 Y812 L813 A819	L811-Q815 WeakPolarHBondContact O-CB 3.04Å; L811-Q815 PolarHBondContact O-N 3.46Å; Y812-Q815 WeakPolarHBondContact O-CB 3.32Å; Y812-Q815 PolarHBondContact O-N 2.83Å; L813-Q815 VanDerWaalsContact C-N 3.32Å; L813-Q815 PolarHBondContact O-N 2.92Å; Q815-A819 VanDerWaalsContact O-CB 3.23Å; Q815-A819 WeakPolarHBondContact O-CB 3.45Å; Q815-A819 PolarHBondContact O-N 3.17Å
816	Q	81.7	Confident	83	Confident	27 Å²	27	36.9 Å²	36.9	13%	0.126	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-46.4	174.5	-71.4	-150.1	-26.8	0	0	111.7	Y812 L813 N818 A819 S820	Y812-Q816 HydrophobicContact CE1-CG 4.21Å; Y812-Q816 HydrophobicContact CE2-CG 4.46Å; Y812-Q816 WeakPolarHBondContact O-CG 3.27Å; Y812-Q816 PolarHBondContact O-N 3.36Å; Y812-Q816 PolarHBondContact OH-NE2 3.01Å; L813-Q816 PolarHBondContact O-N 2.91Å; Q816-N818 VanDerWaalsContact C-N 3.33Å; Q816-N818 PolarHBondContact O-N 2.81Å; Q816-A819 PolarHBondContact O-N 3.07Å; Q816-S820 VanDerWaalsContact O-CB 3.31Å; Q816-S820 WeakPolarHBondContact O-CB 3.39Å; Q816-S820 PolarHBondContact O-N 2.73Å; Q816-S820 PolarHBondContact O-OG 3.04Å; Q816-S820 VanDerWaalsContact O-OG 3.11Å
817	A	82.5	Confident	82.8	Confident	9 Å²	9	39.6 Å²	39.6	7%	0.074	21%	0.21	C	C	.	.	H	α-helix	trans	-58.8	-43.5	178	0	0	0	0	0	112.3	V713 C716 L813 L814 L821	V713-A817 HydrophobicContact CG2-CB 4.3Å; C716-A817 HydrophobicContact CB-CB 4.44Å; L813-A817 PolarHBondContact O-N 3.33Å; L814-A817 PolarHBondContact O-N 2.94Å; A817-L821 WeakPolarHBondContact O-CB 3.31Å; A817-L821 WeakPolarHBondContact O-CG 3.4Å; A817-L821 PolarHBondContact O-N 3.44Å
818	N	83.3	Confident	82.4	Confident	85 Å²	85	41.1 Å²	41.1	46%	0.455	23%	0.23	S	C	.	.	H	α-helix	trans	-66.5	-45.8	177.3	-164.3	87	0	0	0	112.4	L814 Q816 L821 N822 E860	L814-N818 WeakPolarHBondContact O-CB 3.34Å; L814-N818 PolarHBondContact O-N 3.05Å; Q816-N818 VanDerWaalsContact C-N 3.33Å; Q816-N818 PolarHBondContact O-N 2.81Å; N818-L821 WeakPolarHBondContact O-CB 3.39Å; N818-L821 PolarHBondContact O-N 3.36Å; N818-N822 PolarHBondContact ND2-ND2 3.34Å; N818-N822 PolarHBondContact O-N 3.07Å; N818-E860 PolarHBondContact ND2-OE1 3.2Å
819	A	78.7	Confident	82.3	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	22%	0.216	C	C	.	.	H	α-helix	trans	-70.1	-32.9	-179.1	0	0	0	0	0	112.6	Q815 Q816 Q823 V857 E860	Q815-A819 VanDerWaalsContact O-CB 3.23Å; Q815-A819 WeakPolarHBondContact O-CB 3.45Å; Q815-A819 PolarHBondContact O-N 3.17Å; Q816-A819 PolarHBondContact O-N 3.07Å; A819-Q823 VanDerWaalsContact O-CB 3.27Å; A819-Q823 WeakPolarHBondContact O-CB 3.33Å; A819-Q823 PolarHBondContact O-N 3.23Å; A819-V857 HydrophobicContact CB-CB 3.9Å; A819-V857 HydrophobicContact CB-CG1 3.85Å; A819-E860 WeakPolarHBondContact CA-OE2 3.03Å; A819-E860 HydrophobicContact CB-CG 4.5Å
820	S	78.1	Confident	81.6	Confident	24 Å²	24	39.4 Å²	39.4	17%	0.168	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-38.1	170.9	-66.9	0	0	0	0	112.2	L717 Q816 Q823 G824	L717-S820 WeakPolarHBondContact CD2-O 2.74Å; Q816-S820 VanDerWaalsContact O-CB 3.31Å; Q816-S820 WeakPolarHBondContact O-CB 3.39Å; Q816-S820 PolarHBondContact O-N 2.73Å; Q816-S820 PolarHBondContact O-OG 3.04Å; Q816-S820 VanDerWaalsContact O-OG 3.11Å; S820-Q823 PolarHBondContact O-N 3.41Å; S820-G824 PolarHBondContact O-N 3.47Å; S820-G824 VanDerWaalsContact O-N 3.08Å
821	L	80.4	Confident	80.3	Confident	46 Å²	46	42.3 Å²	42.3	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-59.4	-51.3	170.6	-85.8	167.4	0	0	0	111.3	C716 P720 A817 N818 Q823 G824 Y825	C716-L821 HydrophobicContact CB-CD1 4.18Å; C716-L821 WeakPolarHBondContact O-CD2 3.43Å; P720-L821 HydrophobicContact CG-CD2 4.15Å; A817-L821 WeakPolarHBondContact O-CB 3.31Å; A817-L821 WeakPolarHBondContact O-CG 3.4Å; A817-L821 PolarHBondContact O-N 3.44Å; N818-L821 WeakPolarHBondContact O-CB 3.39Å; N818-L821 PolarHBondContact O-N 3.36Å; L821-Q823 VanDerWaalsContact C-N 3.31Å; L821-Q823 PolarHBondContact O-N 2.91Å; L821-G824 PolarHBondContact O-N 3.48Å; L821-Y825 WeakPolarHBondContact O-CD2 3.5Å; L821-Y825 PolarHBondContact O-N 3.29Å
822	N	80.9	Confident	78.5	Confident	25 Å²	25	45.4 Å²	45.4	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-62	-35.7	176.9	-76.8	-38.5	0	0	0	113	N818 G824 Y825 E860 F890 Y913	N818-N822 PolarHBondContact ND2-ND2 3.34Å; N818-N822 PolarHBondContact O-N 3.07Å; N822-G824 VanDerWaalsContact C-N 3.29Å; N822-G824 PolarHBondContact O-N 2.91Å; N822-Y825 PolarHBondContact O-N 2.94Å; N822-Y825 VanDerWaalsContact O-N 3.09Å; N822-E860 WeakPolarHBondContact CB-OE2 3.45Å; N822-E860 PolarHBondContact ND2-OE1 3.47Å; N822-E860 PolarHBondContact ND2-OE2 3.45Å; N822-F890 HydrophobicContact CB-CE1 3.8Å; N822-F890 HydrophobicContact CB-CZ 4.13Å; N822-Y913 HydrophobicContact CB-CE2 3.88Å; N822-Y913 WeakPolarHBondContact O-CD2 3.38Å; N822-Y913 WeakPolarHBondContact OD1-CE2 3.18Å; N822-Y913 PolarHBondContact OD1-OH 3.41Å; N822-Y913 VanDerWaalsContact OD1-OH 3.13Å
823	Q	80.2	Confident	76.4	Confident	28 Å²	28	45.4 Å²	45.4	13%	0.131	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-35.9	172.2	179.4	174.1	2.4	0	0	112.3	A819 S820 L821 Y825 I826 L851 V857	A819-Q823 VanDerWaalsContact O-CB 3.27Å; A819-Q823 WeakPolarHBondContact O-CB 3.33Å; A819-Q823 PolarHBondContact O-N 3.23Å; S820-Q823 PolarHBondContact O-N 3.41Å; L821-Q823 VanDerWaalsContact C-N 3.31Å; L821-Q823 PolarHBondContact O-N 2.91Å; Q823-Y825 PolarHBondContact O-N 3.24Å; Q823-I826 HydrophobicContact CB-CD1 4.43Å; Q823-I826 HydrophobicContact CG-CD1 4.42Å; Q823-I826 WeakPolarHBondContact O-CB 3.41Å; Q823-I826 PolarHBondContact O-N 3.13Å; Q823-L851 HydrophobicContact CG-CB 4.39Å; Q823-L851 HydrophobicContact CG-CD1 4.5Å; Q823-L851 PolarHBondContact NE2-O 3.49Å; Q823-L851 VanDerWaalsContact NE2-O 3.13Å; Q823-V857 HydrophobicContact CB-CG2 4.2Å; Q823-V857 HydrophobicContact CG-CG2 4.5Å
824	G	73.6	Confident	74.2	Confident	17 Å²	17	53.4 Å²	53.4	18%	0.175	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-23.7	173.8	0	0	0	0	0	114.1	S820 L821 N822	S820-G824 PolarHBondContact O-N 3.47Å; S820-G824 VanDerWaalsContact O-N 3.08Å; L821-G824 PolarHBondContact O-N 3.48Å; N822-G824 VanDerWaalsContact C-N 3.29Å; N822-G824 PolarHBondContact O-N 2.91Å
825	Y	80.1	Confident	71.9	Confident	57 Å²	57	56.4 Å²	56.4	22%	0.224	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	4.7	176.4	-60.8	-61.2	0	0	0	113.8	L821 N822 Q823 E910 E911 Y913	L821-Y825 WeakPolarHBondContact O-CD2 3.5Å; L821-Y825 PolarHBondContact O-N 3.29Å; N822-Y825 PolarHBondContact O-N 2.94Å; N822-Y825 VanDerWaalsContact O-N 3.09Å; Q823-Y825 PolarHBondContact O-N 3.24Å; Y825-E910 HydrophobicContact CE1-CB 4.48Å; Y825-E911 WeakPolarHBondContact CB-O 3.29Å; Y825-E911 WeakPolarHBondContact CD1-O 3.46Å; Y825-Y913 PolarHBondContact O-N 3.26Å
826	I	83.1	Confident	69.8	Low	11 Å²	11	59.6 Å²	59.6	6%	0.056	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	128.9	175.3	-61.8	174.1	0	0	0	110.6	Q823 L851 F890 Y913 V915	Q823-I826 HydrophobicContact CB-CD1 4.43Å; Q823-I826 HydrophobicContact CG-CD1 4.42Å; Q823-I826 WeakPolarHBondContact O-CB 3.41Å; Q823-I826 PolarHBondContact O-N 3.13Å; I826-L851 HydrophobicContact CB-CD1 3.71Å; I826-L851 HydrophobicContact CG2-CD1 3.84Å; I826-L851 HydrophobicContact CG2-CD2 4.26Å; I826-F890 HydrophobicContact CD1-CD1 4.01Å; I826-F890 HydrophobicContact CD1-CD2 3.71Å; I826-F890 HydrophobicContact CD1-CE1 4.07Å; I826-F890 HydrophobicContact CD1-CE2 3.77Å; I826-F890 HydrophobicContact CD1-CG 3.83Å; I826-F890 HydrophobicContact CD1-CZ 3.96Å; I826-F890 HydrophobicContact CG1-CD2 4.31Å; I826-F890 HydrophobicContact CG1-CE2 3.89Å; I826-F890 HydrophobicContact CG1-CZ 4.01Å; I826-Y913 CarbonylContact C-O 3.59Å; I826-Y913 WeakPolarHBondContact CA-O 3.12Å; I826-V915 HydrophobicContact CG2-CG2 3.56Å
827	V	81.7	Confident	67.6	Low	56 Å²	56	64.6 Å²	64.6	34%	0.339	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	145.4	-179.5	-61.4	0	0	0	0	112.1	R912 Y913 E914 V915	V827-R912 HydrophobicContact CG2-CB 4.47Å; V827-Y913 PolarHBondContact N-O 2.89Å; V827-E914 HydrophobicContact CG2-CB 4.34Å; V827-V915 PolarHBondContact O-N 2.91Å
828	G	79	Confident	65.4	Low	51 Å²	51	74.8 Å²	74.8	53%	0.526	38%	0.38	S	S	.	.			trans	86.5	10.7	176.8	0	0	0	0	0	116
829	Y	80.8	Confident	62.9	Low	25 Å²	25	75.1 Å²	75.1	10%	0.098	40%	0.395	C	S	.	.			trans	-68.1	132.3	166.6	-178.9	-125.6	0	0	0	110	V831 G849 L851 L854 L895 L897 E918	Y829-V831 HydrophobicContact CE1-CG2 4.13Å; Y829-G849 WeakPolarHBondContact CD1-O 3.4Å; Y829-G849 PolarHBondContact O-N 2.88Å; Y829-L851 HydrophobicContact CD1-CD2 3.42Å; Y829-L851 VanDerWaalsContact CD1-CD2 3.42Å; Y829-L851 HydrophobicContact CD1-CG 3.75Å; Y829-L851 HydrophobicContact CD2-CD2 4.46Å; Y829-L851 HydrophobicContact CE1-CD2 4.07Å; Y829-L851 HydrophobicContact CE1-CG 4.49Å; Y829-L851 HydrophobicContact CG-CD2 3.66Å; Y829-L851 HydrophobicContact CG-CG 4.3Å; Y829-L854 HydrophobicContact CE1-CD1 4.24Å; Y829-L854 HydrophobicContact CE2-CD1 4.46Å; Y829-L895 HydrophobicContact CE2-CD2 4.38Å; Y829-L897 HydrophobicContact CD2-CD1 4.48Å; Y829-L897 HydrophobicContact CD2-CD2 4.32Å; Y829-L897 HydrophobicContact CE2-CD2 4.37Å; Y829-E918 WeakPolarHBondContact CD2-OE1 3.44Å
830	T	71.9	Confident	60.7	Low	49 Å²	49	83.9 Å²	83.9	30%	0.301	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	136.6	-176.5	53.9	0	0	0	0	111.6	F846 V847	T830-F846 HydrophobicContact CG2-CB 4.21Å; T830-F846 WeakPolarHBondContact OG1-CD1 3.34Å; T830-V847 CarbonylContact C-O 3.47Å; T830-V847 VanDerWaalsContact CA-O 3.26Å; T830-V847 WeakPolarHBondContact CA-O 3.34Å
831	V	61.7	Low	58.6	Low	65 Å²	65	88.1 Å²	88.1	39%	0.394	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.2	177.9	173.3	0	0	0	0	109.2	Y829 Q833 V847	Y829-V831 HydrophobicContact CE1-CG2 4.13Å; V831-Q833 PolarHBondContact O-N 3.29Å; V831-Q833 VanDerWaalsContact O-N 3.12Å; V831-V847 PolarHBondContact N-O 2.85Å; V831-V847 PolarHBondContact O-N 3.05Å
832	R	49.4	Very low	56.3	Low	138 Å²	138	89.9 Å²	89.9	52%	0.521	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	96.2	169.3	-70.5	-175.9	179.4	177.2	1	109.1	K834 F846 S934	R832-K834 PolarHBondContact O-N 2.92Å; R832-F846 HydrophobicContact CG-CD1 4.33Å; R832-F846 HydrophobicContact CG-CE1 3.93Å; R832-F846 HydrophobicContact CG-CZ 4.46Å; R832-S934 PolarHBondContact NH1-OG 2.98Å
833	Q	40.5	Very low	53.8	Low	107 Å²	107	97.2 Å²	97.2	50%	0.5	51%	0.508	S	S	.	.			trans	-69.4	125.6	169	-173.9	162.9	-40.6	0	0	109	V831 D835 V847	V831-Q833 PolarHBondContact O-N 3.29Å; V831-Q833 VanDerWaalsContact O-N 3.12Å; Q833-D835 PolarHBondContact NE2-OD1 3.37Å; Q833-V847 HydrophobicContact CB-CG2 4.1Å
834	K	40.9	Very low	51.9	Low	181 Å²	181	102.7 Å²	102.7	79%	0.787	53%	0.532	S	S	*	.			trans	-89.8	103.4	161.5	-88.9	-169.2	172.3	-172.5	0	107.2	R832 N836	R832-K834 PolarHBondContact O-N 2.92Å; K834-N836 PolarHBondContact O-N 3.46Å
835	D	38.3	Very low	50.1	Low	100 Å²	100	108.2 Å²	108.2	54%	0.535	55%	0.551	S	S	.	*			trans	-70.2	113.7	163.2	-67.6	-41.7	0	0	0	108	Q833 N837	Q833-D835 PolarHBondContact NE2-OD1 3.37Å; D835-N837 PolarHBondContact O-N 3.32Å; D835-N837 VanDerWaalsContact O-N 3.14Å
836	N	38.9	Very low	48.4	Very low	148 Å²	148	111 Å²	111	79%	0.791	57%	0.565	S	S	*	*	S	Bend	trans	-77.1	8.8	-175.5	-73.4	-28.6	0	0	0	113.3	K834	K834-N836 PolarHBondContact O-N 3.46Å
837	N	34.9	Very low	46.7	Very low	132 Å²	132	113.5 Å²	113.5	71%	0.706	58%	0.58	S	S	*	*	S	Bend	trans	-119.6	145.9	173.1	-69.3	-32	0	0	0	108.9	D835	D835-N837 PolarHBondContact O-N 3.32Å; D835-N837 VanDerWaalsContact O-N 3.14Å
838	Y	37.1	Very low	45.6	Very low	223 Å²	223	115.5 Å²	115.5	88%	0.875	59%	0.586	S	S	*	*			trans	68.4	57.8	-175.9	-60.8	-78.2	0	0	0	116.5	Q840	Y838-Q840 PolarHBondContact O-N 3.31Å
839	A	30.2	Very low	44.7	Very low	93 Å²	93	113.5 Å²	113.5	77%	0.769	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	67.6	166.7	0	0	0	0	0	113.2
840	Q	32.7	Very low	44.2	Very low	185 Å²	185	116.8 Å²	116.8	86%	0.864	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.2	-11.8	167	-121.8	167.9	55.9	0	0	116.8	Y838	Y838-Q840 PolarHBondContact O-N 3.31Å
841	V	35	Very low	44.4	Very low	113 Å²	113	115.6 Å²	115.6	69%	0.685	58%	0.576	S	S	*	*			trans	-125.8	114.1	174.4	-170.9	0	0	0	0	110.1	Y843	V841-Y843 HydrophobicContact CG1-CD2 3.9Å; V841-Y843 PolarHBondContact O-N 3.46Å
842	A	30.7	Very low	44.8	Very low	84 Å²	84	115.6 Å²	115.6	69%	0.694	58%	0.579	S	S	*	*			trans	-80.6	51.8	-174.7	0	0	0	0	0	113.9	F844	A842-F844 HydrophobicContact CB-CE2 4.18Å; A842-F844 PolarHBondContact O-N 2.85Å
843	Y	30	Very low	45.8	Very low	179 Å²	179	113.1 Å²	113.1	70%	0.702	59%	0.588	S	S	*	*			trans	-72.3	90.4	166.6	-105.9	-84.9	0	0	0	109.3	V841 F845	V841-Y843 HydrophobicContact CG1-CD2 3.9Å; V841-Y843 PolarHBondContact O-N 3.46Å; Y843-F845 VanDerWaalsContact C-N 3.29Å; Y843-F845 AromaticContact CD1-CE2 3.91Å; Y843-F845 HydrophobicContact CD1-CE2 3.91Å; Y843-F845 HydrophobicContact CD1-CZ 4.04Å; Y843-F845 HydrophobicContact CG-CE2 4.13Å; Y843-F845 PolarHBondContact O-N 2.9Å
844	F	39.2	Very low	47.5	Very low	142 Å²	142	108.7 Å²	108.7	62%	0.623	57%	0.568	S	S	*	*			trans	-70.9	83.4	172.6	-74.3	-76.8	0	0	0	110.6	A842 F846	A842-F844 HydrophobicContact CB-CE2 4.18Å; A842-F844 PolarHBondContact O-N 2.85Å; F844-F846 WeakPolarHBondContact O-CD2 3.34Å; F844-F846 PolarHBondContact O-N 3.13Å; F844-F846 VanDerWaalsContact O-N 3.15Å
845	F	36.2	Very low	49.1	Very low	134 Å²	134	101.4 Å²	101.4	59%	0.588	54%	0.544	S	S	*	.			trans	-66.3	109.7	168.6	-78.4	-81.6	0	0	0	110	Y843 V847	Y843-F845 VanDerWaalsContact C-N 3.29Å; Y843-F845 AromaticContact CD1-CE2 3.91Å; Y843-F845 HydrophobicContact CD1-CE2 3.91Å; Y843-F845 HydrophobicContact CD1-CZ 4.04Å; Y843-F845 HydrophobicContact CG-CE2 4.13Å; Y843-F845 PolarHBondContact O-N 2.9Å; F845-V847 PolarHBondContact O-N 2.96Å
846	F	45.4	Very low	50.9	Low	115 Å²	115	99.9 Å²	99.9	50%	0.504	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	97.5	166.4	-76.1	-89.5	0	0	0	108.4	T830 R832 F844	T830-F846 HydrophobicContact CG2-CB 4.21Å; T830-F846 WeakPolarHBondContact OG1-CD1 3.34Å; R832-F846 HydrophobicContact CG-CD1 4.33Å; R832-F846 HydrophobicContact CG-CE1 3.93Å; R832-F846 HydrophobicContact CG-CZ 4.46Å; F844-F846 WeakPolarHBondContact O-CD2 3.34Å; F844-F846 PolarHBondContact O-N 3.13Å; F844-F846 VanDerWaalsContact O-N 3.15Å
847	V	45.5	Very low	53	Low	64 Å²	64	93.2 Å²	93.2	39%	0.388	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	140.6	174.6	-176.4	0	0	0	0	108.3	T830 V831 Q833 F845 G849	T830-V847 CarbonylContact C-O 3.47Å; T830-V847 VanDerWaalsContact CA-O 3.26Å; T830-V847 WeakPolarHBondContact CA-O 3.34Å; V831-V847 PolarHBondContact N-O 2.85Å; V831-V847 PolarHBondContact O-N 3.05Å; Q833-V847 HydrophobicContact CB-CG2 4.1Å; F845-V847 PolarHBondContact O-N 2.96Å; V847-G849 PolarHBondContact O-N 2.79Å; V847-G849 VanDerWaalsContact O-N 3.14Å
848	Q	58.7	Low	55.4	Low	98 Å²	98	88.5 Å²	88.5	46%	0.458	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	121.5	174.3	-176.1	173.5	-13.5	0	0	108.9	W1021	Q848-W1021 PolarHBondContact NE2-O 3.08Å
849	G	61	Low	57.7	Low	9 Å²	9	78.5 Å²	78.5	9%	0.093	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-75.5	138.6	-171.7	0	0	0	0	0	111.7	Y829 V847 L851	Y829-G849 WeakPolarHBondContact CD1-O 3.4Å; Y829-G849 PolarHBondContact O-N 2.88Å; V847-G849 PolarHBondContact O-N 2.79Å; V847-G849 VanDerWaalsContact O-N 3.14Å; G849-L851 PolarHBondContact O-N 2.71Å
850	D	69.9	Low	60.5	Low	93 Å²	93	75.3 Å²	75.3	50%	0.497	41%	0.409	S	S	.	.			trans	-74.5	111.5	167.7	-174.9	3.2	0	0	0	109.8	S852 A853	D850-S852 PolarHBondContact O-N 2.63Å; D850-S852 WeakPolarHBondContact OD1-CB 3.3Å; D850-S852 PolarHBondContact OD1-N 3.16Å; D850-S852 PolarHBondContact OD1-OG 2.89Å; D850-S852 VanDerWaalsContact OD1-OG 3.05Å; D850-S852 PolarHBondContact OD2-OG 3.44Å; D850-A853 PolarHBondContact O-N 3.26Å
851	L	76.2	Confident	63.1	Low	24 Å²	24	66.5 Å²	66.5	13%	0.126	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-66.9	-21.1	175.4	-71.4	165.4	0	0	0	112.4	Q823 I826 Y829 G849 A853 L854 L897	Q823-L851 HydrophobicContact CG-CB 4.39Å; Q823-L851 HydrophobicContact CG-CD1 4.5Å; Q823-L851 PolarHBondContact NE2-O 3.49Å; Q823-L851 VanDerWaalsContact NE2-O 3.13Å; I826-L851 HydrophobicContact CB-CD1 3.71Å; I826-L851 HydrophobicContact CG2-CD1 3.84Å; I826-L851 HydrophobicContact CG2-CD2 4.26Å; Y829-L851 HydrophobicContact CD1-CD2 3.42Å; Y829-L851 VanDerWaalsContact CD1-CD2 3.42Å; Y829-L851 HydrophobicContact CD1-CG 3.75Å; Y829-L851 HydrophobicContact CD2-CD2 4.46Å; Y829-L851 HydrophobicContact CE1-CD2 4.07Å; Y829-L851 HydrophobicContact CE1-CG 4.49Å; Y829-L851 HydrophobicContact CG-CD2 3.66Å; Y829-L851 HydrophobicContact CG-CG 4.3Å; G849-L851 PolarHBondContact O-N 2.71Å; L851-A853 VanDerWaalsContact C-N 3.26Å; L851-A853 PolarHBondContact O-N 3.41Å; L851-L854 HydrophobicContact CD2-CD1 4.04Å; L851-L854 WeakPolarHBondContact O-CB 3.21Å; L851-L854 PolarHBondContact O-N 3.06Å; L851-L897 HydrophobicContact CD2-CD1 3.87Å
852	S	69.5	Low	65.7	Low	66 Å²	66	64.5 Å²	64.5	46%	0.462	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-66.5	-30.2	177.6	90.1	0	0	0	0	112	D850 L854 G855	D850-S852 PolarHBondContact O-N 2.63Å; D850-S852 WeakPolarHBondContact OD1-CB 3.3Å; D850-S852 PolarHBondContact OD1-N 3.16Å; D850-S852 PolarHBondContact OD1-OG 2.89Å; D850-S852 VanDerWaalsContact OD1-OG 3.05Å; D850-S852 PolarHBondContact OD2-OG 3.44Å; S852-L854 PolarHBondContact O-N 3.03Å; S852-G855 PolarHBondContact O-N 2.84Å
853	A	71.6	Confident	68.6	Low	86 Å²	86	60.6 Å²	60.6	71%	0.711	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-67	-14.3	176.9	0	0	0	0	0	114	D850 L851 G855	D850-A853 PolarHBondContact O-N 3.26Å; L851-A853 VanDerWaalsContact C-N 3.26Å; L851-A853 PolarHBondContact O-N 3.41Å; A853-G855 VanDerWaalsContact C-N 3.28Å
854	L	75.7	Confident	71.4	Confident	14 Å²	14	56.2 Å²	56.2	7%	0.073	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-80.2	-10.6	171.3	-60.6	177.3	0	0	0	112.9	Y829 L851 S852 Y892 L895 L897	Y829-L854 HydrophobicContact CE1-CD1 4.24Å; Y829-L854 HydrophobicContact CE2-CD1 4.46Å; L851-L854 HydrophobicContact CD2-CD1 4.04Å; L851-L854 WeakPolarHBondContact O-CB 3.21Å; L851-L854 PolarHBondContact O-N 3.06Å; S852-L854 PolarHBondContact O-N 3.03Å; L854-Y892 HydrophobicContact CB-CD1 3.42Å; L854-Y892 VanDerWaalsContact CB-CD1 3.42Å; L854-Y892 HydrophobicContact CB-CD2 4.33Å; L854-Y892 HydrophobicContact CB-CE1 3.73Å; L854-Y892 HydrophobicContact CB-CG 3.74Å; L854-Y892 HydrophobicContact CD1-CD1 4.38Å; L854-Y892 HydrophobicContact CD1-CD2 3.98Å; L854-Y892 HydrophobicContact CD1-CE1 4.23Å; L854-Y892 HydrophobicContact CD1-CE2 3.84Å; L854-Y892 HydrophobicContact CD1-CG 4.25Å; L854-L895 HydrophobicContact CD1-CD2 3.99Å; L854-L895 HydrophobicContact CD2-CB 4.24Å; L854-L895 HydrophobicContact CD2-CD2 3.65Å; L854-L897 HydrophobicContact CD1-CD1 3.98Å; L854-L897 HydrophobicContact CD1-CG 4.47Å
855	G	75.1	Confident	73.7	Confident	27 Å²	27	49.5 Å²	49.5	28%	0.278	28%	0.279	S	S	.	.			trans	78.5	-168.1	-171.6	0	0	0	0	0	112.9	S852 A853 Y892	S852-G855 PolarHBondContact O-N 2.84Å; A853-G855 VanDerWaalsContact C-N 3.28Å; G855-Y892 WeakPolarHBondContact O-CD1 3.12Å; G855-Y892 WeakPolarHBondContact O-CE1 3.28Å
856	P	75.6	Confident	76	Confident	69 Å²	69	44.8 Å²	44.8	45%	0.448	26%	0.263	S	S	.	.	S	Bend	trans	-69.3	143	179.2	29.1	-34.8	0	0	0	111.5	L858	P856-L858 PolarHBondContact O-N 3.25Å
857	V	83.8	Confident	77.7	Confident	7 Å²	7	41.5 Å²	41.5	4%	0.042	25%	0.251	C	S	.	.			trans	-60.1	122.5	165.6	176.3	0	0	0	0	108.7	A819 Q823 M859 E860 F890 Y892	A819-V857 HydrophobicContact CB-CB 3.9Å; A819-V857 HydrophobicContact CB-CG1 3.85Å; Q823-V857 HydrophobicContact CB-CG2 4.2Å; Q823-V857 HydrophobicContact CG-CG2 4.5Å; V857-M859 WeakPolarHBondContact CG1-O 3.39Å; V857-E860 HydrophobicContact CG1-CB 4.21Å; V857-F890 HydrophobicContact CG1-CD1 4.17Å; V857-F890 HydrophobicContact CG2-CD1 4.14Å; V857-Y892 HydrophobicContact CG2-CD1 4.35Å; V857-Y892 HydrophobicContact CG2-CE1 3.57Å; V857-Y892 HydrophobicContact CG2-CE2 4.38Å
858	L	84.3	Confident	78.8	Confident	33 Å²	33	41.2 Å²	41.2	17%	0.173	25%	0.251	C	S	.	.			trans	-87.4	-31.6	-178.7	-57.3	179.8	0	0	0	112.2	P856 L891 L985	P856-L858 PolarHBondContact O-N 3.25Å; L858-L891 WeakPolarHBondContact CB-O 3.21Å; L858-L891 PolarHBondContact N-O 3.33Å; L858-L985 HydrophobicContact CD1-CD1 3.93Å; L858-L985 HydrophobicContact CD1-CD2 3.83Å; L858-L985 HydrophobicContact CD1-CG 4.4Å
859	M	85.6	Confident	79.2	Confident	13 Å²	13	43.1 Å²	43.1	6%	0.064	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	152.1	173.2	-72.8	-165.1	75.3	0	0	110.3	V857 L891 Q977 F978 K981	V857-M859 WeakPolarHBondContact CG1-O 3.39Å; M859-L891 HydrophobicContact CB-CB 4.28Å; M859-L891 HydrophobicContact CB-CD2 4.4Å; M859-L891 PolarHBondContact O-N 2.96Å; M859-Q977 HydrophobicContact CE-CB 3.51Å; M859-Q977 HydrophobicContact SD-CB 4.36Å; M859-F978 HydrophobicContact CB-CD2 4.2Å; M859-F978 HydrophobicContact CB-CE1 4.44Å; M859-F978 HydrophobicContact CB-CE2 3.64Å; M859-F978 HydrophobicContact CB-CZ 3.77Å; M859-F978 HydrophobicContact CE-CD2 3.41Å; M859-F978 VanDerWaalsContact CE-CD2 3.41Å; M859-F978 HydrophobicContact CE-CE2 3.82Å; M859-F978 HydrophobicContact CE-CG 4.27Å; M859-F978 HydrophobicContact SD-CD2 3.86Å; M859-F978 HydrophobicContact SD-CE2 4.26Å; M859-F978 HydrophobicContact SD-CG 4.22Å; M859-K981 HydrophobicContact CG-CB 4.3Å; M859-K981 HydrophobicContact CG-CG 4.08Å; M859-K981 HydrophobicContact SD-CB 3.55Å; M859-K981 VanDerWaalsContact SD-CB 3.55Å; M859-K981 HydrophobicContact SD-CG 4.01Å
860	E	88.3	Confident	78.9	Confident	26 Å²	26	51.4 Å²	51.4	12%	0.121	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	157.8	175.3	67.6	-179	176.3	0	0	112.6	N818 A819 N822 V857 V889 F890 K974	N818-E860 PolarHBondContact ND2-OE1 3.2Å; A819-E860 WeakPolarHBondContact CA-OE2 3.03Å; A819-E860 HydrophobicContact CB-CG 4.5Å; N822-E860 WeakPolarHBondContact CB-OE2 3.45Å; N822-E860 PolarHBondContact ND2-OE1 3.47Å; N822-E860 PolarHBondContact ND2-OE2 3.45Å; V857-E860 HydrophobicContact CG1-CB 4.21Å; E860-V889 CarbonylContact C-O 3.56Å; E860-V889 VanDerWaalsContact CA-O 3.23Å; E860-V889 WeakPolarHBondContact CA-O 3.32Å; E860-F890 HydrophobicContact CB-CD1 3.98Å; E860-F890 HydrophobicContact CB-CE1 4.14Å; E860-F890 WeakPolarHBondContact OE2-CE1 3.5Å; E860-K974 WeakPolarHBondContact O-CE 3.45Å
861	G	88.1	Confident	77.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162	163.9	162.6	0	0	0	0	0	118.2	F863 H888 V889	G861-F863 WeakPolarHBondContact O-CD2 3.35Å; G861-H888 WeakPolarHBondContact CA-NE2 3.48Å; G861-H888 PolarHBondContact N-CD2 2.99Å; G861-H888 PolarHBondContact N-NE2 2.84Å; G861-H888 VanDerWaalsContact N-NE2 3.11Å; G861-H888 WeakPolarHBondContact O-CA 3.47Å; G861-V889 PolarHBondContact N-O 3.42Å; G861-V889 PolarHBondContact O-N 3.38Å
862	S	90.4	Very high	76.3	Confident	71 Å²	71	55.6 Å²	55.6	50%	0.497	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	128.5	172.3	-49.4	0	0	0	0	113.2	R887 S970	S862-R887 CarbonylContact C-O 3.57Å; S862-R887 WeakPolarHBondContact CA-O 3.34Å; S862-S970 PolarHBondContact O-OG 2.96Å; S862-S970 VanDerWaalsContact O-OG 3.12Å
863	F	90.8	Very high	74.8	Confident	3 Å²	3	61.7 Å²	61.7	1%	0.013	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	150.1	172	-67	-90.1	0	0	0	110.7	G861 V865 R887 V889 F955 F968 S969 K974 V975 F978	G861-F863 WeakPolarHBondContact O-CD2 3.35Å; F863-V865 HydrophobicContact CB-CG2 4.12Å; F863-R887 PolarHBondContact N-O 3.47Å; F863-R887 PolarHBondContact O-N 3.4Å; F863-V889 HydrophobicContact CB-CG2 4.43Å; F863-V889 HydrophobicContact CD2-CB 3.86Å; F863-V889 HydrophobicContact CD2-CG2 3.6Å; F863-V889 HydrophobicContact CE2-CB 4.13Å; F863-V889 HydrophobicContact CE2-CG2 4.33Å; F863-V889 HydrophobicContact CG-CG2 4.36Å; F863-F955 HydrophobicContact CD1-CE1 4.22Å; F863-F955 AromaticContact CE1-CE1 3.82Å; F863-F955 HydrophobicContact CE1-CE1 3.82Å; F863-F955 HydrophobicContact CZ-CE1 4.36Å; F863-F968 HydrophobicContact CB-CD1 4.11Å; F863-F968 HydrophobicContact CD1-CB 4.16Å; F863-F968 HydrophobicContact CG-CD1 4.24Å; F863-S969 WeakPolarHBondContact CA-O 3.47Å; F863-K974 HydrophobicContact CZ-CG 4.28Å; F863-V975 HydrophobicContact CE1-CG2 4.19Å; F863-F978 HydrophobicContact CE2-CD1 4.31Å; F863-F978 AromaticContact CE2-CD2 3.94Å; F863-F978 HydrophobicContact CE2-CD2 3.94Å; F863-F978 HydrophobicContact CE2-CE1 4.12Å; F863-F978 AromaticContact CE2-CE2 3.72Å; F863-F978 HydrophobicContact CE2-CE2 3.72Å; F863-F978 HydrophobicContact CE2-CG 4.23Å; F863-F978 AromaticContact CE2-CZ 3.82Å; F863-F978 HydrophobicContact CE2-CZ 3.82Å; F863-F978 HydrophobicContact CZ-CB 4.23Å; F863-F978 HydrophobicContact CZ-CD1 4.15Å; F863-F978 AromaticContact CZ-CD2 3.52Å; F863-F978 HydrophobicContact CZ-CD2 3.52Å; F863-F978 HydrophobicContact CZ-CE1 4.4Å; F863-F978 AromaticContact CZ-CE2 3.81Å; F863-F978 HydrophobicContact CZ-CE2 3.81Å; F863-F978 AromaticContact CZ-CG 3.7Å; F863-F978 HydrophobicContact CZ-CG 3.7Å; F863-F978 HydrophobicContact CZ-CZ 4.25Å
864	R	88.7	Confident	73.3	Confident	87 Å²	87	66.6 Å²	66.6	33%	0.328	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	127.1	158.3	-77.8	-178.9	-82.3	-173	-1.4	108.1	L884 Y886 E952 F968 S969	R864-L884 HydrophobicContact CB-CD1 4.22Å; R864-L884 HydrophobicContact CB-CG 4.39Å; R864-L884 HydrophobicContact CG-CD2 4.37Å; R864-Y886 HydrophobicContact CG-CD1 3.87Å; R864-Y886 HydrophobicContact CG-CD2 4.49Å; R864-Y886 HydrophobicContact CG-CE1 3.49Å; R864-Y886 VanDerWaalsContact CG-CE1 3.49Å; R864-Y886 HydrophobicContact CG-CE2 4.14Å; R864-Y886 HydrophobicContact CG-CG 4.37Å; R864-E952 IonicContact CZ-OE1 3.34Å; R864-E952 IonicContact CZ-OE2 2.9Å; R864-E952 IonicContact NE-OE1 2.64Å; R864-E952 PolarHBondContact NE-OE1 3.21Å; R864-E952 IonicContact NH1-OE2 2.74Å; R864-E952 IonicContact NH2-OE1 2.87Å; R864-E952 PolarHBondContact NH2-OE1 2.87Å; R864-E952 IonicContact NH2-OE2 3.04Å; R864-E952 PolarHBondContact NH2-OE2 3.48Å; R864-F968 CarbonylContact O-C 3.6Å; R864-F968 WeakPolarHBondContact O-CA 3.36Å; R864-S969 WeakPolarHBondContact CB-OG 3.43Å; R864-S969 PolarHBondContact N-O 1.9Å; R864-S969 PolarHBondContact O-N 3.39Å
865	V	88.5	Confident	71.7	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	130	-174.7	-169.3	0	0	0	0	109.8	F863 R885 R887 M898 L966 T967 F968	F863-V865 HydrophobicContact CB-CG2 4.12Å; V865-R885 HydrophobicContact CB-CB 4.45Å; V865-R885 PolarHBondContact N-O 3.14Å; V865-R885 WeakPolarHBondContact O-CB 3.41Å; V865-R885 PolarHBondContact O-N 3.4Å; V865-R887 HydrophobicContact CG2-CB 4Å; V865-R887 HydrophobicContact CG2-CG 4.04Å; V865-M898 HydrophobicContact CG1-SD 4.33Å; V865-M898 HydrophobicContact CG2-SD 4.49Å; V865-L966 HydrophobicContact CG1-CD2 3.87Å; V865-T967 CarbonylContact C-O 3.51Å; V865-T967 VanDerWaalsContact CA-O 3.29Å; V865-T967 WeakPolarHBondContact CA-O 3.31Å; V865-F968 HydrophobicContact CG1-CD1 4.29Å; V865-F968 HydrophobicContact CG1-CE1 4.1Å; V865-F968 HydrophobicContact CG1-CZ 4.22Å; V865-F968 HydrophobicContact CG2-CD1 3.61Å; V865-F968 HydrophobicContact CG2-CE1 3.76Å; V865-F968 HydrophobicContact CG2-CG 4.4Å
866	S	83.1	Confident	69.9	Low	35 Å²	35	73 Å²	73	25%	0.245	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	138.3	173.7	60	0	0	0	0	111.5	L966 T967	S866-L966 CarbonylContact O-C 3.54Å; S866-L966 WeakPolarHBondContact O-CA 3.45Å; S866-T967 PolarHBondContact N-O 3.18Å; S866-T967 PolarHBondContact O-N 3.35Å
867	L	80.6	Confident	68	Low	47 Å²	47	81.1 Å²	81.1	25%	0.246	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.4	176.9	-176.3	68.4	0	0	0	109.5	E964 L966	L867-E964 HydrophobicContact CD1-CB 4.04Å; L867-L966 HydrophobicContact CB-CD2 4.17Å; L867-L966 HydrophobicContact CD1-CD2 3.68Å; L867-L966 HydrophobicContact CD1-CG 3.99Å
868	S	70.1	Confident	65.8	Low	58 Å²	58	87.4 Å²	87.4	41%	0.406	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	147.1	172.8	59.7	0	0	0	0	109.9	E964 T965	S868-E964 CarbonylContact O-C 3.44Å; S868-E964 WeakPolarHBondContact O-CA 3.31Å; S868-T965 PolarHBondContact N-O 3.04Å; S868-T965 PolarHBondContact O-N 2.97Å; S868-T965 PolarHBondContact OG-O 2.89Å
869	K	66.8	Low	63.5	Low	138 Å²	138	95.7 Å²	95.7	60%	0.6	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	143.8	178.9	-56	-159.6	-176.3	-159.3	0	111.9	N963 E964	K869-N963 CarbonylContact C-O 3.55Å; K869-N963 WeakPolarHBondContact CA-O 3.4Å; K869-N963 WeakPolarHBondContact CB-O 3.3Å; K869-E964 HydrophobicContact CD-CG 4.1Å; K869-E964 VanDerWaalsContact CE-OE1 3.26Å; K869-E964 WeakPolarHBondContact CE-OE1 3.43Å; K869-E964 WeakPolarHBondContact CE-OE2 3.39Å; K869-E964 HydrophobicContact CG-CB 4.47Å; K869-E964 HydrophobicContact CG-CG 4.15Å; K869-E964 IonicContact NZ-OE1 2.72Å; K869-E964 PolarHBondContact NZ-OE1 3.02Å; K869-E964 IonicContact NZ-OE2 3.63Å; K869-E964 PolarHBondContact NZ-OE2 2.86Å
870	R	54.7	Low	61.2	Low	183 Å²	183	105.9 Å²	105.9	69%	0.691	50%	0.502	S	S	*	.			trans	-109	128.9	-171.5	-158.1	169.8	-173.8	165	1.6	111.8	N963	R870-N963 PolarHBondContact N-O 2.95Å
871	N	49	Very low	58.8	Low	151 Å²	151	107.5 Å²	107.5	81%	0.807	53%	0.525	S	S	*	.			trans	70.6	150.5	171.5	-60.8	-5.9	0	0	0	118.6
872	G	41.4	Very low	57	Low	53 Å²	53	110.9 Å²	110.9	55%	0.546	55%	0.554	S	S	.	*			trans	111.1	117.6	-176.9	0	0	0	0	0	112.4	K874 A875	G872-K874 PolarHBondContact O-N 3.24Å; G872-A875 WeakPolarHBondContact O-CB 3.44Å; G872-A875 PolarHBondContact O-N 3.25Å
873	E	38.7	Very low	55.6	Low	195 Å²	195	113.5 Å²	113.5	91%	0.911	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-60.6	-24.4	-168.2	-66.1	171.3	107.1	0	0	114.8	A875 L876	E873-A875 PolarHBondContact O-N 3.48Å; E873-A875 VanDerWaalsContact O-N 3.12Å; E873-L876 PolarHBondContact O-N 3.23Å
874	K	40.5	Very low	54.8	Low	189 Å²	189	117.4 Å²	117.4	82%	0.822	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-61.1	-17.7	172.1	-67.9	-176.5	178.2	179.5	0	113.3	G872 L876 R877	G872-K874 PolarHBondContact O-N 3.24Å; K874-L876 PolarHBondContact O-N 3.13Å; K874-R877 PolarHBondContact O-N 3.04Å
875	A	42.4	Very low	54.6	Low	52 Å²	52	117.6 Å²	117.6	43%	0.43	58%	0.577	S	S	.	*	G	3₁₀ helix	trans	-58.4	-27.6	176.1	0	0	0	0	0	113.4	G872 E873 R877 M878 R879	G872-A875 WeakPolarHBondContact O-CB 3.44Å; G872-A875 PolarHBondContact O-N 3.25Å; E873-A875 PolarHBondContact O-N 3.48Å; E873-A875 VanDerWaalsContact O-N 3.12Å; A875-R877 VanDerWaalsContact C-N 3.29Å; A875-R877 PolarHBondContact O-N 3.47Å; A875-M878 CarbonylContact O-C 3.53Å; A875-M878 PolarHBondContact O-N 3.38Å; A875-R879 PolarHBondContact O-N 3.13Å
876	L	36.1	Very low	54.6	Low	124 Å²	124	125 Å²	125	65%	0.649	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-65.8	-32.2	-179.7	-153	72.7	0	0	0	112.4	E873 K874	E873-L876 PolarHBondContact O-N 3.23Å; K874-L876 PolarHBondContact O-N 3.13Å
877	R	36	Very low	55	Low	238 Å²	238	124.8 Å²	124.8	90%	0.898	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-15.4	171	-78.1	-176	169.9	174.7	-3.2	113.5	K874 A875	K874-R877 PolarHBondContact O-N 3.04Å; A875-R877 VanDerWaalsContact C-N 3.29Å; A875-R877 PolarHBondContact O-N 3.47Å
878	M	36.9	Very low	55.5	Low	140 Å²	140	123.4 Å²	123.4	69%	0.69	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	9.2	178.3	-66	-68.3	-80.8	0	0	113.9	A875 R880 G881	A875-M878 CarbonylContact O-C 3.53Å; A875-M878 PolarHBondContact O-N 3.38Å; M878-R880 PolarHBondContact O-N 2.94Å; M878-G881 PolarHBondContact O-N 3.25Å
879	R	36.3	Very low	56.5	Low	207 Å²	207	120.7 Å²	120.7	78%	0.781	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-10.6	178.9	-86	-174	168	-175.1	-2.1	115.5	A875 G881	A875-R879 PolarHBondContact O-N 3.13Å; R879-G881 VanDerWaalsContact C-N 3.27Å; R879-G881 PolarHBondContact O-N 2.94Å
880	R	37.9	Very low	57.6	Low	226 Å²	226	114.1 Å²	114.1	85%	0.853	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-2.7	169.8	-67.5	-177.2	174.8	177.3	-2	114.1	M878	M878-R880 PolarHBondContact O-N 2.94Å
881	G	37.8	Very low	59.3	Low	60 Å²	60	105.4 Å²	105.4	62%	0.619	51%	0.512	S	S	*	.			trans	-87	-8.9	-166.9	0	0	0	0	0	118.4	M878 R879 K883	M878-G881 PolarHBondContact O-N 3.25Å; R879-G881 VanDerWaalsContact C-N 3.27Å; R879-G881 PolarHBondContact O-N 2.94Å; G881-K883 PolarHBondContact O-N 2.69Å
882	A	50.8	Low	61.1	Low	72 Å²	72	98.2 Å²	98.2	60%	0.595	47%	0.473	S	S	*	.			trans	-81.3	47.9	-173.8	0	0	0	0	0	113.7	L884	A882-L884 PolarHBondContact O-N 3.37Å
883	K	61.2	Low	62.9	Low	125 Å²	125	98.7 Å²	98.7	54%	0.543	47%	0.469	S	S	.	.			trans	-65.9	117	-178.5	-170.6	159.9	-174.8	167.3	0	110.3	E402 G881	E402-K883 IonicContact OE1-NZ 2.75Å; E402-K883 PolarHBondContact OE1-NZ 2.97Å; E402-K883 IonicContact OE2-NZ 2.76Å; E402-K883 PolarHBondContact OE2-NZ 3.41Å; G881-K883 PolarHBondContact O-N 2.69Å
884	L	74.3	Confident	64.7	Low	85 Å²	85	91.6 Å²	91.6	45%	0.445	44%	0.441	S	S	.	.			trans	-63.6	130.2	177.5	-165.8	66	0	0	0	109.9	R864 A882	R864-L884 HydrophobicContact CB-CD1 4.22Å; R864-L884 HydrophobicContact CB-CG 4.39Å; R864-L884 HydrophobicContact CG-CD2 4.37Å; A882-L884 PolarHBondContact O-N 3.37Å
885	R	84.2	Confident	66.7	Low	92 Å²	92	83.4 Å²	83.4	35%	0.347	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	116	-175	-65.2	171.5	-177.3	-160.1	0.8	109.4	V865 R887 E917	V865-R885 HydrophobicContact CB-CB 4.45Å; V865-R885 PolarHBondContact N-O 3.14Å; V865-R885 WeakPolarHBondContact O-CB 3.41Å; V865-R885 PolarHBondContact O-N 3.4Å; R885-R887 HydrophobicContact CB-CG 4.45Å; R885-E917 IonicContact CZ-OE1 3.74Å; R885-E917 IonicContact NH1-OE1 3.51Å; R885-E917 PolarHBondContact NH1-OE1 3.44Å; R885-E917 IonicContact NH1-OE2 3.77Å; R885-E917 PolarHBondContact NH1-OE2 2.89Å
886	Y	88.5	Confident	68.8	Low	156 Å²	156	81 Å²	81	61%	0.612	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	131.8	162.6	-70.4	-102.2	0	0	0	108.6	R864	R864-Y886 HydrophobicContact CG-CD1 3.87Å; R864-Y886 HydrophobicContact CG-CD2 4.49Å; R864-Y886 HydrophobicContact CG-CE1 3.49Å; R864-Y886 VanDerWaalsContact CG-CE1 3.49Å; R864-Y886 HydrophobicContact CG-CE2 4.14Å; R864-Y886 HydrophobicContact CG-CG 4.37Å
887	R	90.9	Very high	71.3	Confident	30 Å²	30	75.1 Å²	75.1	11%	0.113	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	138.6	178.2	-69.1	-67.3	-178.4	-98.1	5.5	109.8	S862 F863 V865 R885 V889 M898 C899 E917	S862-R887 CarbonylContact C-O 3.57Å; S862-R887 WeakPolarHBondContact CA-O 3.34Å; F863-R887 PolarHBondContact N-O 3.47Å; F863-R887 PolarHBondContact O-N 3.4Å; V865-R887 HydrophobicContact CG2-CB 4Å; V865-R887 HydrophobicContact CG2-CG 4.04Å; R885-R887 HydrophobicContact CB-CG 4.45Å; R887-V889 HydrophobicContact CB-CG2 4.4Å; R887-M898 HydrophobicContact CB-CB 4.38Å; R887-M898 HydrophobicContact CG-CB 4.15Å; R887-C899 CarbonylContact C-O 3.35Å; R887-C899 VanDerWaalsContact CA-O 3.26Å; R887-C899 WeakPolarHBondContact CA-O 3.45Å; R887-C899 WeakPolarHBondContact CD-O 3.18Å; R887-E917 IonicContact CZ-OE1 2.72Å; R887-E917 IonicContact NE-OE1 3.64Å; R887-E917 PolarHBondContact NE-OE1 2.97Å; R887-E917 IonicContact NH2-OE1 2.71Å; R887-E917 PolarHBondContact NH2-OE1 2.98Å
888	H	91.3	Very high	73.8	Confident	17 Å²	17	63.8 Å²	63.8	8%	0.079	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	125.1	157	-154.3	116.2	0	0	0	107.3	G861 F890 C899 Y913	G861-H888 WeakPolarHBondContact CA-NE2 3.48Å; G861-H888 PolarHBondContact N-CD2 2.99Å; G861-H888 PolarHBondContact N-NE2 2.84Å; G861-H888 VanDerWaalsContact N-NE2 3.11Å; G861-H888 WeakPolarHBondContact O-CA 3.47Å; H888-F890 HydrophobicContact CB-CE2 4.4Å; H888-F890 AromaticContact CD2-CE2 3.79Å; H888-F890 AromaticContact CD2-CZ 3.73Å; H888-C899 PolarHBondContact N-O 3.03Å; H888-C899 PolarHBondContact O-N 3.18Å; H888-Y913 HydrophobicContact CB-CD1 3.7Å; H888-Y913 HydrophobicContact CB-CE1 3.7Å; H888-Y913 AromaticContact CG-CD1 3.96Å; H888-Y913 AromaticContact CG-CE1 3.51Å; H888-Y913 AromaticContact ND1-CE1 3.36Å; H888-Y913 WeakPolarHBondContact ND1-CE1 3.5Å; H888-Y913 AromaticContact ND1-CZ 3.95Å
889	V	90.9	Very high	76.4	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	130.1	-176.4	176.6	0	0	0	0	108.8	E860 G861 F863 R887 L896 L897 M898 F968 F978	E860-V889 CarbonylContact C-O 3.56Å; E860-V889 VanDerWaalsContact CA-O 3.23Å; E860-V889 WeakPolarHBondContact CA-O 3.32Å; G861-V889 PolarHBondContact N-O 3.42Å; G861-V889 PolarHBondContact O-N 3.38Å; F863-V889 HydrophobicContact CB-CG2 4.43Å; F863-V889 HydrophobicContact CD2-CB 3.86Å; F863-V889 HydrophobicContact CD2-CG2 3.6Å; F863-V889 HydrophobicContact CE2-CB 4.13Å; F863-V889 HydrophobicContact CE2-CG2 4.33Å; F863-V889 HydrophobicContact CG-CG2 4.36Å; R887-V889 HydrophobicContact CB-CG2 4.4Å; V889-L896 HydrophobicContact CG1-CD1 4.06Å; V889-L896 HydrophobicContact CG1-CD2 3.5Å; V889-L896 VanDerWaalsContact CG1-CD2 3.5Å; V889-L896 HydrophobicContact CG1-CG 3.6Å; V889-L897 WeakPolarHBondContact CA-O 3.25Å; V889-M898 HydrophobicContact CG2-CG 4.26Å; V889-F968 HydrophobicContact CG2-CD1 4.33Å; V889-F968 HydrophobicContact CG2-CE1 3.98Å; V889-F978 HydrophobicContact CB-CE1 4.47Å; V889-F978 HydrophobicContact CB-CZ 4.44Å; V889-F978 HydrophobicContact CG1-CE1 3.78Å; V889-F978 HydrophobicContact CG1-CZ 4.13Å
890	F	90.5	Very high	78.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121	171.3	-63.6	-89.8	0	0	0	108.8	N822 I826 V857 E860 H888 Y892 L896 L897 C899 Y913	N822-F890 HydrophobicContact CB-CE1 3.8Å; N822-F890 HydrophobicContact CB-CZ 4.13Å; I826-F890 HydrophobicContact CD1-CD1 4.01Å; I826-F890 HydrophobicContact CD1-CD2 3.71Å; I826-F890 HydrophobicContact CD1-CE1 4.07Å; I826-F890 HydrophobicContact CD1-CE2 3.77Å; I826-F890 HydrophobicContact CD1-CG 3.83Å; I826-F890 HydrophobicContact CD1-CZ 3.96Å; I826-F890 HydrophobicContact CG1-CD2 4.31Å; I826-F890 HydrophobicContact CG1-CE2 3.89Å; I826-F890 HydrophobicContact CG1-CZ 4.01Å; V857-F890 HydrophobicContact CG1-CD1 4.17Å; V857-F890 HydrophobicContact CG2-CD1 4.14Å; E860-F890 HydrophobicContact CB-CD1 3.98Å; E860-F890 HydrophobicContact CB-CE1 4.14Å; E860-F890 WeakPolarHBondContact OE2-CE1 3.5Å; H888-F890 HydrophobicContact CB-CE2 4.4Å; H888-F890 AromaticContact CD2-CE2 3.79Å; H888-F890 AromaticContact CD2-CZ 3.73Å; F890-Y892 HydrophobicContact CB-CE2 3.81Å; F890-L896 WeakPolarHBondContact O-CA 3.32Å; F890-L897 HydrophobicContact CB-CB 4.37Å; F890-L897 PolarHBondContact N-O 3.24Å; F890-L897 PolarHBondContact O-N 3.29Å; F890-C899 HydrophobicContact CE2-CB 4.26Å; F890-Y913 HydrophobicContact CE2-CD1 4.07Å; F890-Y913 HydrophobicContact CE2-CD2 4.34Å; F890-Y913 AromaticContact CE2-CG 3.89Å; F890-Y913 HydrophobicContact CE2-CG 3.89Å; F890-Y913 HydrophobicContact CZ-CD1 4.1Å; F890-Y913 AromaticContact CZ-CD2 3.82Å; F890-Y913 HydrophobicContact CZ-CD2 3.82Å; F890-Y913 HydrophobicContact CZ-CE1 4.34Å; F890-Y913 HydrophobicContact CZ-CE2 4.08Å; F890-Y913 AromaticContact CZ-CG 3.83Å; F890-Y913 HydrophobicContact CZ-CG 3.83Å
891	L	89.4	Confident	81.2	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	117.4	-179.9	178.3	59.7	0	0	0	110.3	L858 M859 L896 F978 K981 L982 L985	L858-L891 WeakPolarHBondContact CB-O 3.21Å; L858-L891 PolarHBondContact N-O 3.33Å; M859-L891 HydrophobicContact CB-CB 4.28Å; M859-L891 HydrophobicContact CB-CD2 4.4Å; M859-L891 PolarHBondContact O-N 2.96Å; L891-L896 HydrophobicContact CD1-CB 4.29Å; L891-F978 HydrophobicContact CB-CE1 4Å; L891-F978 HydrophobicContact CB-CZ 4.35Å; L891-F978 HydrophobicContact CD2-CD1 4.43Å; L891-F978 HydrophobicContact CD2-CE1 4.31Å; L891-K981 HydrophobicContact CD2-CB 4.34Å; L891-K981 HydrophobicContact CD2-CG 4.15Å; L891-L982 HydrophobicContact CD1-CD2 3.62Å; L891-L982 HydrophobicContact CD2-CD2 3.94Å; L891-L982 HydrophobicContact CD2-CG 4.03Å; L891-L982 HydrophobicContact CG-CD2 4.46Å; L891-L985 HydrophobicContact CD1-CD1 4.06Å; L891-L985 HydrophobicContact CD2-CD1 4.09Å; L891-L985 HydrophobicContact CG-CD1 4.16Å
892	Y	87	Confident	83.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.			trans	-104.1	179.3	171.7	-61.5	-91.3	0	0	0	110.6	L854 G855 V857 F890 S894 L895 L897	L854-Y892 HydrophobicContact CB-CD1 3.42Å; L854-Y892 VanDerWaalsContact CB-CD1 3.42Å; L854-Y892 HydrophobicContact CB-CD2 4.33Å; L854-Y892 HydrophobicContact CB-CE1 3.73Å; L854-Y892 HydrophobicContact CB-CG 3.74Å; L854-Y892 HydrophobicContact CD1-CD1 4.38Å; L854-Y892 HydrophobicContact CD1-CD2 3.98Å; L854-Y892 HydrophobicContact CD1-CE1 4.23Å; L854-Y892 HydrophobicContact CD1-CE2 3.84Å; L854-Y892 HydrophobicContact CD1-CG 4.25Å; G855-Y892 WeakPolarHBondContact O-CD1 3.12Å; G855-Y892 WeakPolarHBondContact O-CE1 3.28Å; V857-Y892 HydrophobicContact CG2-CD1 4.35Å; V857-Y892 HydrophobicContact CG2-CE1 3.57Å; V857-Y892 HydrophobicContact CG2-CE2 4.38Å; F890-Y892 HydrophobicContact CB-CE2 3.81Å; Y892-S894 PolarHBondContact O-N 3.44Å; Y892-L895 WeakPolarHBondContact CA-O 3.49Å; Y892-L895 WeakPolarHBondContact CB-O 3.06Å; Y892-L895 PolarHBondContact N-O 3.36Å; Y892-L897 HydrophobicContact CD2-CG 4.41Å; Y892-L897 HydrophobicContact CE2-CD1 3.79Å; Y892-L897 HydrophobicContact CE2-CG 4.02Å
893	S	79.9	Confident	83.8	Confident	64 Å²	64	46.1 Å²	46.1	45%	0.448	21%	0.207	S	C	.	.	S	Bend	trans	-62.8	-27.4	179.1	60.6	0	0	0	0	114.5
894	S	75.9	Confident	83.6	Confident	46 Å²	46	43.5 Å²	43.5	32%	0.322	20%	0.2	S	C	.	.	S	Bend	trans	-135.6	-2	-171.6	59.8	0	0	0	0	114.4	Y892 V921	Y892-S894 PolarHBondContact O-N 3.44Å; S894-V921 PolarHBondContact O-N 3.39Å
895	L	82.6	Confident	82.2	Confident	16 Å²	16	41.6 Å²	41.6	8%	0.084	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	141.9	-172.6	-164.4	64.5	0	0	0	110.7	Y829 L854 Y892 L897 E918 P920	Y829-L895 HydrophobicContact CE2-CD2 4.38Å; L854-L895 HydrophobicContact CD1-CD2 3.99Å; L854-L895 HydrophobicContact CD2-CB 4.24Å; L854-L895 HydrophobicContact CD2-CD2 3.65Å; Y892-L895 WeakPolarHBondContact CA-O 3.49Å; Y892-L895 WeakPolarHBondContact CB-O 3.06Å; Y892-L895 PolarHBondContact N-O 3.36Å; L895-L897 HydrophobicContact CD2-CD2 3.55Å; L895-L897 HydrophobicContact CD2-CG 4.15Å; L895-L897 HydrophobicContact CG-CD2 4.07Å; L895-L897 HydrophobicContact CG-CG 4.49Å; L895-E918 HydrophobicContact CD1-CB 4.23Å; L895-P920 HydrophobicContact CD1-CG 4.27Å
896	L	86.4	Confident	80	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.01	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	110.6	167.7	-179	167.7	0	0	0	107.5	V889 F890 L891 M898 L919	V889-L896 HydrophobicContact CG1-CD1 4.06Å; V889-L896 HydrophobicContact CG1-CD2 3.5Å; V889-L896 VanDerWaalsContact CG1-CD2 3.5Å; V889-L896 HydrophobicContact CG1-CG 3.6Å; F890-L896 WeakPolarHBondContact O-CA 3.32Å; L891-L896 HydrophobicContact CD1-CB 4.29Å; L896-M898 HydrophobicContact CD2-CG 3.47Å; L896-M898 VanDerWaalsContact CD2-CG 3.47Å; L896-M898 HydrophobicContact CD2-SD 4.27Å; L896-L919 HydrophobicContact CB-CB 4.28Å; L896-L919 HydrophobicContact CD2-CD1 3.94Å; L896-L919 HydrophobicContact CD2-CG 4.2Å; L896-L919 PolarHBondContact N-O 3.48Å; L896-L919 PolarHBondContact O-N 3.06Å
897	L	88.3	Confident	77.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	132.6	175.4	-66.4	-175.3	0	0	0	109.9	Y829 L851 L854 V889 F890 Y892 L895 E918	Y829-L897 HydrophobicContact CD2-CD1 4.48Å; Y829-L897 HydrophobicContact CD2-CD2 4.32Å; Y829-L897 HydrophobicContact CE2-CD2 4.37Å; L851-L897 HydrophobicContact CD2-CD1 3.87Å; L854-L897 HydrophobicContact CD1-CD1 3.98Å; L854-L897 HydrophobicContact CD1-CG 4.47Å; V889-L897 WeakPolarHBondContact CA-O 3.25Å; F890-L897 HydrophobicContact CB-CB 4.37Å; F890-L897 PolarHBondContact N-O 3.24Å; F890-L897 PolarHBondContact O-N 3.29Å; Y892-L897 HydrophobicContact CD2-CG 4.41Å; Y892-L897 HydrophobicContact CE2-CD1 3.79Å; Y892-L897 HydrophobicContact CE2-CG 4.02Å; L895-L897 HydrophobicContact CD2-CD2 3.55Å; L895-L897 HydrophobicContact CD2-CG 4.15Å; L895-L897 HydrophobicContact CG-CD2 4.07Å; L895-L897 HydrophobicContact CG-CG 4.49Å; L897-E918 HydrophobicContact CD2-CB 4.11Å; L897-E918 HydrophobicContact CD2-CG 3.67Å
898	M	89.7	Confident	75.3	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	109.2	172.5	-60.7	-163.1	-72.5	0	0	110	V865 R887 V889 L896 K916 E917 L919 L966 F968	V865-M898 HydrophobicContact CG1-SD 4.33Å; V865-M898 HydrophobicContact CG2-SD 4.49Å; R887-M898 HydrophobicContact CB-CB 4.38Å; R887-M898 HydrophobicContact CG-CB 4.15Å; V889-M898 HydrophobicContact CG2-CG 4.26Å; L896-M898 HydrophobicContact CD2-CG 3.47Å; L896-M898 VanDerWaalsContact CD2-CG 3.47Å; L896-M898 HydrophobicContact CD2-SD 4.27Å; M898-K916 PolarHBondContact O-N 3.1Å; M898-E917 HydrophobicContact CB-CB 4.16Å; M898-E917 HydrophobicContact CE-CB 3.54Å; M898-E917 HydrophobicContact CE-CG 4.29Å; M898-E917 PolarHBondContact N-O 2.92Å; M898-E917 PolarHBondContact O-N 3.46Å; M898-L919 HydrophobicContact CE-CD1 3.95Å; M898-L919 HydrophobicContact CE-CD2 3.94Å; M898-L919 HydrophobicContact CE-CG 4.07Å; M898-L919 HydrophobicContact SD-CD1 4.3Å; M898-L966 HydrophobicContact CE-CD1 4.07Å; M898-F968 HydrophobicContact SD-CE1 3.57Å; M898-F968 VanDerWaalsContact SD-CE1 3.57Å; M898-F968 HydrophobicContact SD-CZ 3.59Å; M898-F968 VanDerWaalsContact SD-CZ 3.59Å
899	C	90.5	Very high	73.3	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	148.8	-178.3	-58.5	0	0	0	0	111.4	R887 H888 F890 E914	R887-C899 CarbonylContact C-O 3.35Å; R887-C899 VanDerWaalsContact CA-O 3.26Å; R887-C899 WeakPolarHBondContact CA-O 3.45Å; R887-C899 WeakPolarHBondContact CD-O 3.18Å; H888-C899 PolarHBondContact N-O 3.03Å; H888-C899 PolarHBondContact O-N 3.18Å; F890-C899 HydrophobicContact CE2-CB 4.26Å; C899-E914 CarbonylContact C-O 3.54Å; C899-E914 VanDerWaalsContact CA-O 3.29Å; C899-E914 WeakPolarHBondContact CA-O 3.49Å
900	K	89.4	Confident	71.7	Confident	82 Å²	82	51.6 Å²	51.6	36%	0.357	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122.1	163.8	-179.6	-177.6	174.3	-170.9	0	108.1	E914 K916	K900-E914 PolarHBondContact N-O 2.98Å; K900-E914 PolarHBondContact O-N 2.95Å; K900-K916 HydrophobicContact CB-CG 3.99Å
901	H	85.4	Confident	70.6	Confident	47 Å²	47	55.5 Å²	55.5	22%	0.218	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	140.4	169.8	-168.9	-126.9	0	0	0	110.4	E911 Y913	H901-E911 IonicContact CE1-OE1 3.02Å; H901-E911 PolarHBondContact CE1-OE1 2.86Å; H901-E911 VanDerWaalsContact CE1-OE1 3.29Å; H901-E911 IonicContact NE2-OE1 2.59Å; H901-E911 IonicContact NE2-OE2 3.41Å; H901-Y913 HydrophobicContact CB-CD1 4.45Å; H901-Y913 HydrophobicContact CB-CE1 4.45Å; H901-Y913 AromaticContact CD2-CD1 3.7Å; H901-Y913 AromaticContact CD2-CE1 3.33Å; H901-Y913 WeakPolarHBondContact CD2-CE1 3.42Å; H901-Y913 AromaticContact CD2-CZ 3.91Å
902	R	78.7	Confident	70.1	Confident	72 Å²	72	58.6 Å²	58.6	27%	0.272	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	106.1	177	-65.8	-65.4	-165	139.8	12.7	108.4	N250 R912 E914	N250-R902 PolarHBondContact OD1-NH1 3.43Å; R902-R912 PolarHBondContact N-O 3.39Å; R902-R912 PolarHBondContact O-N 2.69Å; R902-E914 HydrophobicContact CG-CB 4.24Å; R902-E914 IonicContact CZ-OE2 2.63Å; R902-E914 IonicContact NE-OE2 3.27Å; R902-E914 PolarHBondContact NE-OE2 3.31Å; R902-E914 IonicContact NH2-OE1 2.69Å; R902-E914 IonicContact NH2-OE2 2.94Å; R902-E914 PolarHBondContact NH2-OE2 3.28Å
903	R	65.6	Low	70	Confident	133 Å²	133	59.2 Å²	59.2	50%	0.502	31%	0.312	S	S	.	.			trans	-82.5	145.4	155.6	-62.2	-165.5	177.7	126.3	-16.8	109	E247 N250 E911	E247-R903 WeakPolarHBondContact OE1-CD 3.4Å; E247-R903 IonicContact OE1-CZ 3.74Å; E247-R903 IonicContact OE1-NE 3.64Å; E247-R903 IonicContact OE1-NH1 2.68Å; E247-R903 PolarHBondContact OE1-NH1 3.27Å; N250-R903 PolarHBondContact ND2-O 2.93Å; R903-E911 IonicContact CZ-OE1 3.84Å; R903-E911 IonicContact NE-OE1 3.65Å; R903-E911 PolarHBondContact NE-OE1 3.42Å; R903-E911 IonicContact NH2-OE1 2.77Å
904	N	55.8	Low	70.3	Confident	71 Å²	71	58.4 Å²	58.4	38%	0.38	30%	0.301	S	S	.	.			trans	-102	146.9	169.4	-72.4	-43.2	0	0	0	108.8	V906 A909	N904-V906 PolarHBondContact O-N 3.49Å; N904-A909 HydrophobicContact CB-CB 3.71Å
905	S	45	Very low	70.9	Confident	44 Å²	44	56.9 Å²	56.9	31%	0.308	29%	0.289	S	S	.	.	S	Bend	trans	-70.2	-5.9	179.2	31.4	0	0	0	0	114.1	P249 D251	P249-S905 WeakPolarHBondContact CB-OG 3.22Å; D251-S905 PolarHBondContact OD1-OG 3.18Å; D251-S905 VanDerWaalsContact OD1-OG 3.11Å
906	V	38.3	Very low	71	Confident	85 Å²	85	60.4 Å²	60.4	52%	0.515	30%	0.304	S	S	.	.	S	Bend	trans	-99.4	125.4	-172.9	-175	0	0	0	0	109.7	N904 A909	N904-V906 PolarHBondContact O-N 3.49Å; V906-A909 HydrophobicContact CB-CB 4.15Å; V906-A909 WeakPolarHBondContact O-CB 3.26Å; V906-A909 PolarHBondContact O-N 2.68Å
907	P	37.8	Very low	70.8	Confident	114 Å²	114	62.4 Å²	62.4	74%	0.74	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	140.4	171.3	-26.4	35.3	0	0	0	111.9	A909	P907-A909 VanDerWaalsContact C-N 3.26Å; P907-A909 PolarHBondContact O-N 3.03Å
908	N	43.9	Very low	70.5	Confident	174 Å²	174	66 Å²	66	93%	0.93	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	5.7	-176	-51.9	-35.9	0	0	0	116.9
909	A	48	Very low	69.8	Low	44 Å²	44	66.1 Å²	66.1	36%	0.364	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-78.2	131.7	170.9	0	0	0	0	0	111.9	N904 V906 P907	N904-A909 HydrophobicContact CB-CB 3.71Å; V906-A909 HydrophobicContact CB-CB 4.15Å; V906-A909 WeakPolarHBondContact O-CB 3.26Å; V906-A909 PolarHBondContact O-N 2.68Å; P907-A909 VanDerWaalsContact C-N 3.26Å; P907-A909 PolarHBondContact O-N 3.03Å
910	E	57.6	Low	69	Low	89 Å²	89	67.9 Å²	67.9	42%	0.416	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-60	137	-177.7	-57.6	171.4	142	0	0	112.9	Y825 R912	Y825-E910 HydrophobicContact CE1-CB 4.48Å; E910-R912 IonicContact OE2-CZ 3.78Å; E910-R912 IonicContact OE2-NE 3.67Å; E910-R912 IonicContact OE2-NH2 2.74Å; E910-R912 PolarHBondContact OE2-NH2 3.19Å
911	E	67.2	Low	68.1	Low	83 Å²	83	64.3 Å²	64.3	39%	0.388	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-66.9	142	167.7	-70.1	-165.4	133.5	0	0	110.3	Y825 H901 R903	Y825-E911 WeakPolarHBondContact CB-O 3.29Å; Y825-E911 WeakPolarHBondContact CD1-O 3.46Å; H901-E911 IonicContact CE1-OE1 3.02Å; H901-E911 PolarHBondContact CE1-OE1 2.86Å; H901-E911 VanDerWaalsContact CE1-OE1 3.29Å; H901-E911 IonicContact NE2-OE1 2.59Å; H901-E911 IonicContact NE2-OE2 3.41Å; R903-E911 IonicContact CZ-OE1 3.84Å; R903-E911 IonicContact NE-OE1 3.65Å; R903-E911 PolarHBondContact NE-OE1 3.42Å; R903-E911 IonicContact NH2-OE1 2.77Å
912	R	79	Confident	66.8	Low	65 Å²	65	70.5 Å²	70.5	25%	0.245	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	144.9	-175.5	-64.4	-179.2	-178.7	-175	-4.4	113.5	V827 R902 E910 H1024	V827-R912 HydrophobicContact CG2-CB 4.47Å; R902-R912 PolarHBondContact N-O 3.39Å; R902-R912 PolarHBondContact O-N 2.69Å; E910-R912 IonicContact OE2-CZ 3.78Å; E910-R912 IonicContact OE2-NE 3.67Å; E910-R912 IonicContact OE2-NH2 2.74Å; E910-R912 PolarHBondContact OE2-NH2 3.19Å; R912-H1024 PolarHBondContact NH1-O 3.3Å
913	Y	86	Confident	65.2	Low	13 Å²	13	69.9 Å²	69.9	5%	0.051	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	98.3	179.7	-63	-74.5	0	0	0	110.7	N822 Y825 I826 V827 H888 F890 H901 V915	N822-Y913 HydrophobicContact CB-CE2 3.88Å; N822-Y913 WeakPolarHBondContact O-CD2 3.38Å; N822-Y913 WeakPolarHBondContact OD1-CE2 3.18Å; N822-Y913 PolarHBondContact OD1-OH 3.41Å; N822-Y913 VanDerWaalsContact OD1-OH 3.13Å; Y825-Y913 PolarHBondContact O-N 3.26Å; I826-Y913 CarbonylContact C-O 3.59Å; I826-Y913 WeakPolarHBondContact CA-O 3.12Å; V827-Y913 PolarHBondContact N-O 2.89Å; H888-Y913 HydrophobicContact CB-CD1 3.7Å; H888-Y913 HydrophobicContact CB-CE1 3.7Å; H888-Y913 AromaticContact CG-CD1 3.96Å; H888-Y913 AromaticContact CG-CE1 3.51Å; H888-Y913 AromaticContact ND1-CE1 3.36Å; H888-Y913 WeakPolarHBondContact ND1-CE1 3.5Å; H888-Y913 AromaticContact ND1-CZ 3.95Å; F890-Y913 HydrophobicContact CE2-CD1 4.07Å; F890-Y913 HydrophobicContact CE2-CD2 4.34Å; F890-Y913 AromaticContact CE2-CG 3.89Å; F890-Y913 HydrophobicContact CE2-CG 3.89Å; F890-Y913 HydrophobicContact CZ-CD1 4.1Å; F890-Y913 AromaticContact CZ-CD2 3.82Å; F890-Y913 HydrophobicContact CZ-CD2 3.82Å; F890-Y913 HydrophobicContact CZ-CE1 4.34Å; F890-Y913 HydrophobicContact CZ-CE2 4.08Å; F890-Y913 AromaticContact CZ-CG 3.83Å; F890-Y913 HydrophobicContact CZ-CG 3.83Å; H901-Y913 HydrophobicContact CB-CD1 4.45Å; H901-Y913 HydrophobicContact CB-CE1 4.45Å; H901-Y913 AromaticContact CD2-CD1 3.7Å; H901-Y913 AromaticContact CD2-CE1 3.33Å; H901-Y913 WeakPolarHBondContact CD2-CE1 3.42Å; H901-Y913 AromaticContact CD2-CZ 3.91Å; Y913-V915 PolarHBondContact O-N 3.4Å
914	E	86.4	Confident	63.9	Low	47 Å²	47	69.5 Å²	69.5	22%	0.22	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	112.5	-175.3	-170.8	-161.4	169.9	0	0	110.8	V827 C899 K900 R902 K916	V827-E914 HydrophobicContact CG2-CB 4.34Å; C899-E914 CarbonylContact C-O 3.54Å; C899-E914 VanDerWaalsContact CA-O 3.29Å; C899-E914 WeakPolarHBondContact CA-O 3.49Å; K900-E914 PolarHBondContact N-O 2.98Å; K900-E914 PolarHBondContact O-N 2.95Å; R902-E914 HydrophobicContact CG-CB 4.24Å; R902-E914 IonicContact CZ-OE2 2.63Å; R902-E914 IonicContact NE-OE2 3.27Å; R902-E914 PolarHBondContact NE-OE2 3.31Å; R902-E914 IonicContact NH2-OE1 2.69Å; R902-E914 IonicContact NH2-OE2 2.94Å; R902-E914 PolarHBondContact NH2-OE2 3.28Å; E914-K916 WeakPolarHBondContact OE1-CE 3.4Å; E914-K916 IonicContact OE1-NZ 3.5Å; E914-K916 PolarHBondContact OE1-NZ 2.91Å; E914-K916 WeakPolarHBondContact OE2-CE 3.34Å; E914-K916 IonicContact OE2-NZ 3.53Å
915	V	86.9	Confident	62.8	Low	13 Å²	13	72.3 Å²	72.3	8%	0.079	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	139.6	-179.6	-179.3	0	0	0	0	111.2	I826 V827 Y913 E918	I826-V915 HydrophobicContact CG2-CG2 3.56Å; V827-V915 PolarHBondContact O-N 2.91Å; Y913-V915 PolarHBondContact O-N 3.4Å; V915-E918 HydrophobicContact CG1-CG 4.36Å
916	K	85.9	Confident	62	Low	91 Å²	91	78.8 Å²	78.8	40%	0.396	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	-45	178.4	-65.2	-67	139.3	-122.6	0	114.1	M898 K900 E914	M898-K916 PolarHBondContact O-N 3.1Å; K900-K916 HydrophobicContact CB-CG 3.99Å; E914-K916 WeakPolarHBondContact OE1-CE 3.4Å; E914-K916 IonicContact OE1-NZ 3.5Å; E914-K916 PolarHBondContact OE1-NZ 2.91Å; E914-K916 WeakPolarHBondContact OE2-CE 3.34Å; E914-K916 IonicContact OE2-NZ 3.53Å
917	E	82.6	Confident	61.6	Low	43 Å²	43	85.2 Å²	85.2	20%	0.201	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	140.2	-170.5	-70.6	153.3	-102.4	0	0	108.8	R885 R887 M898	R885-E917 IonicContact CZ-OE1 3.74Å; R885-E917 IonicContact NH1-OE1 3.51Å; R885-E917 PolarHBondContact NH1-OE1 3.44Å; R885-E917 IonicContact NH1-OE2 3.77Å; R885-E917 PolarHBondContact NH1-OE2 2.89Å; R887-E917 IonicContact CZ-OE1 2.72Å; R887-E917 IonicContact NE-OE1 3.64Å; R887-E917 PolarHBondContact NE-OE1 2.97Å; R887-E917 IonicContact NH2-OE1 2.71Å; R887-E917 PolarHBondContact NH2-OE1 2.98Å; M898-E917 HydrophobicContact CB-CB 4.16Å; M898-E917 HydrophobicContact CE-CB 3.54Å; M898-E917 HydrophobicContact CE-CG 4.29Å; M898-E917 PolarHBondContact N-O 2.92Å; M898-E917 PolarHBondContact O-N 3.46Å
918	E	80.3	Confident	61.1	Low	75 Å²	75	83.8 Å²	83.8	35%	0.35	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.1	-177.2	-48.3	-172.3	173.5	0	0	109.5	Y829 L895 L897 V915	Y829-E918 WeakPolarHBondContact CD2-OE1 3.44Å; L895-E918 HydrophobicContact CD1-CB 4.23Å; L897-E918 HydrophobicContact CD2-CB 4.11Å; L897-E918 HydrophobicContact CD2-CG 3.67Å; V915-E918 HydrophobicContact CG1-CG 4.36Å
919	L	76.8	Confident	60.3	Low	4 Å²	4	85.7 Å²	85.7	2%	0.021	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	106.9	-178.2	-43.2	-178.3	0	0	0	110.3	L896 M898 V921 V937 V957 L966 F968	L896-L919 HydrophobicContact CB-CB 4.28Å; L896-L919 HydrophobicContact CD2-CD1 3.94Å; L896-L919 HydrophobicContact CD2-CG 4.2Å; L896-L919 PolarHBondContact N-O 3.48Å; L896-L919 PolarHBondContact O-N 3.06Å; M898-L919 HydrophobicContact CE-CD1 3.95Å; M898-L919 HydrophobicContact CE-CD2 3.94Å; M898-L919 HydrophobicContact CE-CG 4.07Å; M898-L919 HydrophobicContact SD-CD1 4.3Å; L919-V921 PolarHBondContact O-N 3.29Å; L919-V937 HydrophobicContact CD2-CB 3.75Å; L919-V937 HydrophobicContact CD2-CG1 3.84Å; L919-V937 HydrophobicContact CD2-CG2 3.99Å; L919-V957 HydrophobicContact CD1-CG1 4.48Å; L919-L966 HydrophobicContact CD1-CD1 3.67Å; L919-L966 HydrophobicContact CD2-CD1 3.93Å; L919-L966 HydrophobicContact CG-CD1 4.49Å; L919-F968 HydrophobicContact CD1-CZ 4.16Å
920	P	73.2	Confident	59.4	Low	37 Å²	37	87.8 Å²	87.8	24%	0.24	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	128.5	178.9	-24.7	36.7	0	0	0	113.1	L895 R922 V936	L895-P920 HydrophobicContact CD1-CG 4.27Å; P920-R922 PolarHBondContact O-N 3.18Å; P920-R922 VanDerWaalsContact O-N 3.16Å; P920-V936 HydrophobicContact CG-CG1 4.31Å
921	V	69	Low	58.2	Low	6 Å²	6	88.6 Å²	88.6	4%	0.036	44%	0.444	C	S	.	.			trans	-88.7	79.5	176.7	-173.2	0	0	0	0	108.6	S894 L919	S894-V921 PolarHBondContact O-N 3.39Å; L919-V921 PolarHBondContact O-N 3.29Å
922	R	58.2	Low	56.5	Low	177 Å²	177	93.1 Å²	93.1	67%	0.668	47%	0.465	S	S	*	.			trans	-143.3	147.8	177.8	-64.1	-173.5	-176.8	179.8	1.3	111.5	P920	P920-R922 PolarHBondContact O-N 3.18Å; P920-R922 VanDerWaalsContact O-N 3.16Å
923	F	46.4	Very low	54.2	Low	60 Å²	60	95 Å²	95	26%	0.263	49%	0.486	S	S	.	.			trans	-128.9	136.2	172.4	-76.7	-109.7	0	0	0	108.8	V939 I986	F923-V939 WeakPolarHBondContact CE1-O 2.99Å; F923-V939 VanDerWaalsContact CE2-O 3.25Å; F923-V939 WeakPolarHBondContact CE2-O 3.47Å; F923-V939 WeakPolarHBondContact CZ-O 3.39Å; F923-I986 HydrophobicContact CD2-CG2 4.33Å; F923-I986 HydrophobicContact CE2-CB 4.28Å; F923-I986 HydrophobicContact CE2-CD1 3.96Å; F923-I986 HydrophobicContact CE2-CG1 3.76Å; F923-I986 HydrophobicContact CE2-CG2 3.65Å; F923-I986 HydrophobicContact CZ-CD1 4.11Å; F923-I986 HydrophobicContact CZ-CG1 4.32Å; F923-I986 HydrophobicContact CZ-CG2 3.76Å
924	H	37.6	Very low	51.5	Low	124 Å²	124	97.7 Å²	97.7	57%	0.574	51%	0.507	S	S	*	.			trans	-150.1	136.3	164.3	-105	49.5	0	0	0	110	F993	H924-F993 AromaticContact CE1-CE1 3.55Å; H924-F993 AromaticContact CE1-CE2 3.73Å; H924-F993 AromaticContact CE1-CZ 3.28Å; H924-F993 WeakPolarHBondContact CE1-CZ 3.38Å; H924-F993 AromaticContact NE2-CE1 3.69Å; H924-F993 AromaticContact NE2-CZ 3.58Å
925	N	32.2	Very low	48.8	Very low	131 Å²	131	100.2 Å²	100.2	70%	0.701	54%	0.535	S	S	*	.			trans	-102	128.4	166.8	-82.9	-28.5	0	0	0	109.4
926	H	28.8	Very low	46.4	Very low	180 Å²	180	103.5 Å²	103.5	83%	0.833	56%	0.555	S	S	*	*			trans	32.6	95.3	164.6	-62.8	-45.8	0	0	0	118.8
927	F	29.8	Very low	44.1	Very low	220 Å²	220	100.3 Å²	100.3	97%	0.965	54%	0.543	S	S	*	.				-150.5	150.5	125.2	-115.1	-78.2	0	0	0	109.7
928	A	26.7	Very low	42.5	Very low	83 Å²	83	99.5 Å²	99.5	69%	0.686	54%	0.54	S	S	*	.			trans	-112.2	126.7	-166.8	0	0	0	0	0	113
929	F	28.5	Very low	41.1	Very low	215 Å²	215	96.2 Å²	96.2	94%	0.943	52%	0.524	S	S	*	.			trans	-154.2	140.1	153.9	-100.5	-74	0	0	0	111
930	A	28.8	Very low	39.7	Very low	87 Å²	87	99.8 Å²	99.8	72%	0.719	54%	0.538	S	S	*	.	S	Bend	trans	54.4	110.7	163.3	0	0	0	0	0	121
931	S	31.9	Very low	38.5	Very low	106 Å²	106	99.9 Å²	99.9	74%	0.741	54%	0.54	S	S	*	.			trans	42.2	97.7	141.8	59.1	0	0	0	0	119.1
932	Q	32.8	Very low	38	Very low	179 Å²	179	100.6 Å²	100.6	84%	0.836	54%	0.543	S	S	*	.				89.4	144.1	84.3	-77	-97.8	-8.2	0	0	113.9
933	P	29.6	Very low	37.9	Very low	105 Å²	105	97.3 Å²	97.3	68%	0.682	54%	0.536	S	S	*	.				-124.4	164.8	-121.7	41.9	-33.7	0	0	0	117.4
934	S	29.7	Very low	38.6	Very low	69 Å²	69	99.6 Å²	99.6	48%	0.483	55%	0.547	S	S	.	.	S	Bend	trans	-150.2	107.4	159.5	-67	0	0	0	0	109.5	R832 V936	R832-S934 PolarHBondContact NH1-OG 2.98Å; S934-V936 PolarHBondContact O-N 3.08Å
935	A	29.9	Very low	39.6	Very low	100 Å²	100	95.8 Å²	95.8	83%	0.826	53%	0.532	S	S	*	.			trans	24.9	61.8	164.6	0	0	0	0	0	118.5	V937	A935-V937 PolarHBondContact O-N 3.09Å
936	V	35.6	Very low	40.7	Very low	82 Å²	82	97.6 Å²	97.6	50%	0.497	54%	0.536	S	S	.	.			trans	-77.9	105	173	-177.2	0	0	0	0	109.8	P920 S934 Q938	P920-V936 HydrophobicContact CG-CG1 4.31Å; S934-V936 PolarHBondContact O-N 3.08Å; V936-Q938 VanDerWaalsContact C-N 3.33Å; V936-Q938 HydrophobicContact CG1-CG 3.87Å; V936-Q938 PolarHBondContact O-N 2.67Å
937	V	38.3	Very low	41.9	Very low	24 Å²	24	92.5 Å²	92.5	15%	0.145	52%	0.518	C	S	.	.			trans	-79.7	82.5	170.4	-177.6	0	0	0	0	109.2	L919 A935 V957 T959 L966	L919-V937 HydrophobicContact CD2-CB 3.75Å; L919-V937 HydrophobicContact CD2-CG1 3.84Å; L919-V937 HydrophobicContact CD2-CG2 3.99Å; A935-V937 PolarHBondContact O-N 3.09Å; V937-V957 HydrophobicContact CG1-CG1 4.36Å; V937-T959 HydrophobicContact CB-CG2 4.27Å; V937-T959 HydrophobicContact CG1-CG2 3.83Å; V937-T959 HydrophobicContact CG2-CG2 4.02Å; V937-L966 HydrophobicContact CG1-CD1 4.5Å
938	Q	49	Very low	42.8	Very low	26 Å²	26	86.8 Å²	86.8	12%	0.121	50%	0.501	C	S	.	.			trans	-67.1	138	164.8	-52.6	-175.3	14.5	0	0	109.3	V936 Y940 T959 E960	V936-Q938 VanDerWaalsContact C-N 3.33Å; V936-Q938 HydrophobicContact CG1-CG 3.87Å; V936-Q938 PolarHBondContact O-N 2.67Å; Q938-Y940 PolarHBondContact O-N 2.93Å; Q938-T959 WeakPolarHBondContact O-CA 3.41Å; Q938-E960 HydrophobicContact CB-CB 4.07Å; Q938-E960 VanDerWaalsContact CD-CD 3.45Å; Q938-E960 HydrophobicContact CG-CB 4.04Å; Q938-E960 PolarHBondContact NE2-OE1 3.49Å; Q938-E960 PolarHBondContact NE2-OE2 2.82Å
939	V	51.1	Low	43.9	Very low	5 Å²	5	92.4 Å²	92.4	3%	0.03	51%	0.51	C	S	.	.			trans	-83.3	95.6	178.4	-179.1	0	0	0	0	109.6	F923 I942 V957 I986	F923-V939 WeakPolarHBondContact CE1-O 2.99Å; F923-V939 VanDerWaalsContact CE2-O 3.25Å; F923-V939 WeakPolarHBondContact CE2-O 3.47Å; F923-V939 WeakPolarHBondContact CZ-O 3.39Å; V939-I942 HydrophobicContact CG1-CD1 4.1Å; V939-I942 HydrophobicContact CG1-CG1 3.85Å; V939-V957 HydrophobicContact CB-CG1 4.24Å; V939-V957 HydrophobicContact CG1-CG1 4.07Å; V939-V957 HydrophobicContact CG1-CG2 4.15Å; V939-V957 HydrophobicContact CG2-CG1 3.84Å; V939-I986 HydrophobicContact CG1-CD1 4.46Å
940	Y	46.5	Very low	45	Very low	79 Å²	79	85 Å²	85	31%	0.31	49%	0.494	S	S	.	.			trans	-81.7	-30.7	-170.6	-132.1	-95.3	0	0	0	115.3	Q938 I958 E960	Q938-Y940 PolarHBondContact O-N 2.93Å; Y940-I958 WeakPolarHBondContact CB-O 3.45Å; Y940-I958 PolarHBondContact N-O 3.18Å; Y940-E960 HydrophobicContact CD2-CB 4.47Å; Y940-E960 HydrophobicContact CE2-CG 4.38Å
941	S	49.2	Very low	46.5	Very low	39 Å²	39	89.9 Å²	89.9	27%	0.273	50%	0.499	S	S	.	.			trans	-152.6	160	172.6	66.5	0	0	0	0	110.4	I958	S941-I958 WeakPolarHBondContact OG-CD1 3.09Å
942	I	57	Low	48.3	Very low	21 Å²	21	87 Å²	87	11%	0.108	47%	0.474	C	S	.	.			trans	-129.3	97.7	172.7	-56.7	178.3	0	0	0	108.8	V939 F955 Q956 V979 L982 I986	V939-I942 HydrophobicContact CG1-CD1 4.1Å; V939-I942 HydrophobicContact CG1-CG1 3.85Å; I942-F955 HydrophobicContact CG2-CB 4.28Å; I942-F955 HydrophobicContact CG2-CD2 4.17Å; I942-Q956 WeakPolarHBondContact CA-O 3.4Å; I942-V979 HydrophobicContact CG2-CB 4.49Å; I942-V979 HydrophobicContact CG2-CG1 4.04Å; I942-V979 HydrophobicContact CG2-CG2 3.98Å; I942-L982 HydrophobicContact CD1-CB 3.47Å; I942-L982 VanDerWaalsContact CD1-CB 3.47Å; I942-L982 HydrophobicContact CD1-CD1 3.97Å; I942-L982 HydrophobicContact CD1-CG 4.24Å; I942-I986 HydrophobicContact CD1-CD1 3.71Å; I942-I986 HydrophobicContact CG1-CD1 4.35Å
943	E	57.7	Low	50.3	Low	109 Å²	109	78.7 Å²	78.7	51%	0.509	44%	0.436	S	S	.	.	P	Polyproline II helix	trans	-95.3	127.8	175.4	-72.3	167.6	-139.9	0	0	109.6	F955 Q956	E943-F955 VanDerWaalsContact O-CA 3.31Å; E943-F955 WeakPolarHBondContact O-CA 3.25Å; E943-Q956 PolarHBondContact O-N 2.67Å; E943-Q956 VanDerWaalsContact O-N 3.12Å
944	Q	60.4	Low	52.8	Low	108 Å²	108	77.5 Å²	77.5	51%	0.505	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.5	169.5	177.8	179.1	-13.7	0	0	107.8
945	V	57.8	Low	55.3	Low	43 Å²	43	74.3 Å²	74.3	26%	0.261	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	134.8	-177.2	-169.7	0	0	0	0	109.2	R954 Q956	V945-R954 HydrophobicContact CB-CB 4.07Å; V945-R954 PolarHBondContact N-O 3.33Å; V945-Q956 HydrophobicContact CG2-CG 4.1Å
946	E	56.3	Low	57.8	Low	169 Å²	169	71.6 Å²	71.6	79%	0.79	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-49.2	144.2	-168.1	-63.6	-176.6	131	0	0	115.1	V948 R954	E946-V948 PolarHBondContact O-N 2.99Å; E946-R954 PolarHBondContact O-NH2 2.96Å
947	T	52.8	Low	59.7	Low	73 Å²	73	67.8 Å²	67.8	45%	0.448	34%	0.343	S	S	.	.			trans	-72.8	98.7	179.9	32.4	0	0	0	0	111.2	K949 P972	T947-K949 PolarHBondContact O-N 3.44Å; T947-P972 HydrophobicContact CG2-CG 4.38Å
948	V	48.8	Very low	61.2	Low	100 Å²	100	68 Å²	68	61%	0.606	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-63.8	109.3	178.3	-176.3	0	0	0	0	109.9	E946 G950 K951	E946-V948 PolarHBondContact O-N 2.99Å; V948-G950 PolarHBondContact O-N 3.02Å; V948-G950 VanDerWaalsContact O-N 3.1Å; V948-K951 PolarHBondContact O-N 2.94Å
949	K	50	Low	61.8	Low	202 Å²	202	67.3 Å²	67.3	88%	0.878	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	46.9	38.8	179.1	-63.1	-170.8	175.3	-174.5	0	114.1	T947 K951	T947-K949 PolarHBondContact O-N 3.44Å; K949-K951 VanDerWaalsContact C-N 3.27Å; K949-K951 PolarHBondContact O-N 3.48Å; K949-K951 VanDerWaalsContact O-N 3.13Å
950	G	51.7	Low	61.9	Low	58 Å²	58	71.6 Å²	71.6	60%	0.598	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	70.6	2.2	169.3	0	0	0	0	0	117.5	V948	V948-G950 PolarHBondContact O-N 3.02Å; V948-G950 VanDerWaalsContact O-N 3.1Å
951	K	61.6	Low	62.4	Low	190 Å²	190	72.2 Å²	72.2	83%	0.826	37%	0.368	S	S	*	.	S	Bend	trans	-94.8	-22.5	-174.1	-69.7	-165.6	174.9	-168.8	0	115.9	V948 K949	V948-K951 PolarHBondContact O-N 2.94Å; K949-K951 VanDerWaalsContact C-N 3.27Å; K949-K951 PolarHBondContact O-N 3.48Å; K949-K951 VanDerWaalsContact O-N 3.13Å
952	E	67.7	Low	62.8	Low	47 Å²	47	78.1 Å²	78.1	22%	0.22	39%	0.385	C	S	.	.			trans	-150.9	136.5	-174.7	-168.8	165.6	-161.2	0	0	112.5	R864 S969 S970	R864-E952 IonicContact CZ-OE1 3.34Å; R864-E952 IonicContact CZ-OE2 2.9Å; R864-E952 IonicContact NE-OE1 2.64Å; R864-E952 PolarHBondContact NE-OE1 3.21Å; R864-E952 IonicContact NH1-OE2 2.74Å; R864-E952 IonicContact NH2-OE1 2.87Å; R864-E952 PolarHBondContact NH2-OE1 2.87Å; R864-E952 IonicContact NH2-OE2 3.04Å; R864-E952 PolarHBondContact NH2-OE2 3.48Å; E952-S969 WeakPolarHBondContact OE1-CB 3.39Å; E952-S969 PolarHBondContact OE1-OG 3.22Å; E952-S970 WeakPolarHBondContact CG-O 3.41Å
953	G	75.8	Confident	63.1	Low	4 Å²	4	80.9 Å²	80.9	4%	0.041	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	155.5	172.9	0	0	0	0	0	111.8	S969 S970	G953-S969 WeakPolarHBondContact O-CA 3.37Å; G953-S970 PolarHBondContact N-O 3.44Å; G953-S970 PolarHBondContact O-N 3.08Å
954	R	81.5	Confident	63.7	Low	80 Å²	80	78.3 Å²	78.3	30%	0.302	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.8	179.2	-70.4	178.9	-65.7	168.6	1.3	112.7	V945 E946 F968	V945-R954 HydrophobicContact CB-CB 4.07Å; V945-R954 PolarHBondContact N-O 3.33Å; E946-R954 PolarHBondContact O-NH2 2.96Å; R954-F968 VanDerWaalsContact CA-O 3.28Å; R954-F968 WeakPolarHBondContact CA-O 3.43Å
955	F	83.7	Confident	64.5	Low	1 Å²	1	74.2 Å²	74.2	0%	0.004	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	157.9	165.7	75.2	-90	0	0	0	111.7	F863 I942 E943 V957 F968 V975 F978 V979 L982	F863-F955 HydrophobicContact CD1-CE1 4.22Å; F863-F955 AromaticContact CE1-CE1 3.82Å; F863-F955 HydrophobicContact CE1-CE1 3.82Å; F863-F955 HydrophobicContact CZ-CE1 4.36Å; I942-F955 HydrophobicContact CG2-CB 4.28Å; I942-F955 HydrophobicContact CG2-CD2 4.17Å; E943-F955 VanDerWaalsContact O-CA 3.31Å; E943-F955 WeakPolarHBondContact O-CA 3.25Å; F955-V957 HydrophobicContact CD2-CG2 4.36Å; F955-V957 HydrophobicContact CE2-CG2 4.05Å; F955-F968 HydrophobicContact CD1-CB 3.76Å; F955-F968 HydrophobicContact CD2-CB 4.32Å; F955-F968 HydrophobicContact CD2-CD2 4.14Å; F955-F968 HydrophobicContact CD2-CG 4.48Å; F955-F968 HydrophobicContact CE1-CB 3.41Å; F955-F968 VanDerWaalsContact CE1-CB 3.41Å; F955-F968 AromaticContact CE1-CG 3.95Å; F955-F968 HydrophobicContact CE1-CG 3.95Å; F955-F968 HydrophobicContact CE2-CB 4.01Å; F955-F968 AromaticContact CE2-CD2 3.58Å; F955-F968 HydrophobicContact CE2-CD2 3.58Å; F955-F968 HydrophobicContact CE2-CE2 4.17Å; F955-F968 AromaticContact CE2-CG 3.82Å; F955-F968 HydrophobicContact CE2-CG 3.82Å; F955-F968 HydrophobicContact CG-CB 4.22Å; F955-F968 HydrophobicContact CZ-CB 3.55Å; F955-F968 AromaticContact CZ-CD1 3.99Å; F955-F968 HydrophobicContact CZ-CD1 3.99Å; F955-F968 AromaticContact CZ-CD2 3.81Å; F955-F968 HydrophobicContact CZ-CD2 3.81Å; F955-F968 AromaticContact CZ-CG 3.52Å; F955-F968 HydrophobicContact CZ-CG 3.52Å; F955-F968 PolarHBondContact N-O 3.25Å; F955-F968 PolarHBondContact O-N 2.58Å; F955-V975 HydrophobicContact CB-CG1 4.37Å; F955-V975 HydrophobicContact CD1-CG1 4.07Å; F955-V975 HydrophobicContact CD1-CG2 4.35Å; F955-F978 HydrophobicContact CE1-CB 4.3Å; F955-F978 HydrophobicContact CZ-CD1 4.48Å; F955-V979 HydrophobicContact CB-CG2 3.46Å; F955-V979 VanDerWaalsContact CB-CG2 3.46Å; F955-V979 HydrophobicContact CD1-CG2 4.05Å; F955-V979 HydrophobicContact CD2-CG2 4.39Å; F955-V979 HydrophobicContact CG-CG2 3.75Å; F955-L982 HydrophobicContact CE2-CD1 3.98Å; F955-L982 HydrophobicContact CZ-CD1 4.31Å
956	Q	80.7	Confident	65.7	Low	44 Å²	44	72.6 Å²	72.6	21%	0.206	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	155.2	178.4	-67.5	-166.6	-22.9	0	0	113.1	I942 E943 V945 T965 L966 T967	I942-Q956 WeakPolarHBondContact CA-O 3.4Å; E943-Q956 PolarHBondContact O-N 2.67Å; E943-Q956 VanDerWaalsContact O-N 3.12Å; V945-Q956 HydrophobicContact CG2-CG 4.1Å; Q956-T965 HydrophobicContact CB-CG2 4.09Å; Q956-T965 HydrophobicContact CG-CG2 4.22Å; Q956-L966 CarbonylContact C-O 3.56Å; Q956-L966 WeakPolarHBondContact CA-O 3.41Å; Q956-T967 HydrophobicContact CG-CG2 4.04Å; Q956-T967 PolarHBondContact NE2-OG1 3.02Å
957	V	76.2	Confident	67	Low	2 Å²	2	65.5 Å²	65.5	1%	0.012	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	118.6	172.1	167.2	0	0	0	0	107.3	L919 V937 V939 F955 T965 L966 F968	L919-V957 HydrophobicContact CD1-CG1 4.48Å; V937-V957 HydrophobicContact CG1-CG1 4.36Å; V939-V957 HydrophobicContact CB-CG1 4.24Å; V939-V957 HydrophobicContact CG1-CG1 4.07Å; V939-V957 HydrophobicContact CG1-CG2 4.15Å; V939-V957 HydrophobicContact CG2-CG1 3.84Å; F955-V957 HydrophobicContact CD2-CG2 4.36Å; F955-V957 HydrophobicContact CE2-CG2 4.05Å; V957-T965 WeakPolarHBondContact O-CA 3.21Å; V957-L966 HydrophobicContact CB-CB 4.32Å; V957-L966 PolarHBondContact N-O 2.71Å; V957-L966 PolarHBondContact O-N 3.32Å; V957-F968 HydrophobicContact CB-CE2 4.1Å; V957-F968 HydrophobicContact CG2-CD2 4.33Å; V957-F968 HydrophobicContact CG2-CE2 3.83Å
958	I	68.9	Low	68.7	Low	29 Å²	29	62 Å²	62	15%	0.149	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.4	-177.5	-50.9	-175.7	0	0	0	109.4	Y940 S941 R962 T965	Y940-I958 WeakPolarHBondContact CB-O 3.45Å; Y940-I958 PolarHBondContact N-O 3.18Å; S941-I958 WeakPolarHBondContact OG-CD1 3.09Å; I958-R962 HydrophobicContact CG2-CG 4.48Å; I958-T965 HydrophobicContact CG1-CG2 3.98Å
959	T	62	Low	70.5	Confident	11 Å²	11	58 Å²	58	7%	0.067	28%	0.283	C	S	.	.			trans	-64.8	152.8	175.1	49.6	0	0	0	0	113.6	V937 Q938 N961 R962 E964	V937-T959 HydrophobicContact CB-CG2 4.27Å; V937-T959 HydrophobicContact CG1-CG2 3.83Å; V937-T959 HydrophobicContact CG2-CG2 4.02Å; Q938-T959 WeakPolarHBondContact O-CA 3.41Å; T959-N961 VanDerWaalsContact C-N 3.31Å; T959-N961 PolarHBondContact O-N 3.36Å; T959-N961 PolarHBondContact OG1-OD1 3.19Å; T959-R962 WeakPolarHBondContact O-CA 3.46Å; T959-R962 PolarHBondContact O-N 2.94Å; T959-E964 HydrophobicContact CG2-CB 3.81Å; T959-E964 HydrophobicContact CG2-CG 4.32Å; T959-E964 PolarHBondContact N-O 3.1Å; T959-E964 PolarHBondContact OG1-N 3.48Å; T959-E964 VanDerWaalsContact OG1-N 3.08Å; T959-E964 PolarHBondContact OG1-O 2.88Å
960	E	54.2	Low	72.3	Confident	94 Å²	94	49.4 Å²	49.4	44%	0.439	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-40.3	-51.4	169.9	-179.3	175.5	-147.9	0	0	114.5	Q938 Y940 R962	Q938-E960 HydrophobicContact CB-CB 4.07Å; Q938-E960 VanDerWaalsContact CD-CD 3.45Å; Q938-E960 HydrophobicContact CG-CB 4.04Å; Q938-E960 PolarHBondContact NE2-OE1 3.49Å; Q938-E960 PolarHBondContact NE2-OE2 2.82Å; Y940-E960 HydrophobicContact CD2-CB 4.47Å; Y940-E960 HydrophobicContact CE2-CG 4.38Å; E960-R962 PolarHBondContact O-N 3.12Å; E960-R962 VanDerWaalsContact O-N 3.17Å
961	N	55.5	Low	73.7	Confident	92 Å²	92	49.3 Å²	49.3	49%	0.492	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	2.5	-177.9	67.3	15	0	0	0	114.1	T959 N963	T959-N961 VanDerWaalsContact C-N 3.31Å; T959-N961 PolarHBondContact O-N 3.36Å; T959-N961 PolarHBondContact OG1-OD1 3.19Å; N961-N963 PolarHBondContact O-N 2.95Å; N961-N963 PolarHBondContact O-ND2 2.69Å; N961-N963 PolarHBondContact O-OD1 2.92Å; N961-N963 WeakPolarHBondContact OD1-CB 3.44Å; N961-N963 PolarHBondContact OD1-N 2.88Å
962	R	58.3	Low	74.5	Confident	164 Å²	164	42 Å²	42	62%	0.619	21%	0.211	S	C	*	.	S	Bend	trans	52.6	13.7	-175.3	-59.5	-177.2	177.9	-173.8	-2.1	115.6	I958 T959 E960	I958-R962 HydrophobicContact CG2-CG 4.48Å; T959-R962 WeakPolarHBondContact O-CA 3.46Å; T959-R962 PolarHBondContact O-N 2.94Å; E960-R962 PolarHBondContact O-N 3.12Å; E960-R962 VanDerWaalsContact O-N 3.17Å
963	N	63.9	Low	74.9	Confident	79 Å²	79	44 Å²	44	42%	0.422	22%	0.223	S	C	.	.	S	Bend	trans	-88.4	-18	-177.9	-65.2	-37.9	0	0	0	112.4	K869 R870 N961	K869-N963 CarbonylContact C-O 3.55Å; K869-N963 WeakPolarHBondContact CA-O 3.4Å; K869-N963 WeakPolarHBondContact CB-O 3.3Å; R870-N963 PolarHBondContact N-O 2.95Å; N961-N963 PolarHBondContact O-N 2.95Å; N961-N963 PolarHBondContact O-ND2 2.69Å; N961-N963 PolarHBondContact O-OD1 2.92Å; N961-N963 WeakPolarHBondContact OD1-CB 3.44Å; N961-N963 PolarHBondContact OD1-N 2.88Å
964	E	70.8	Confident	75.2	Confident	54 Å²	54	46.9 Å²	46.9	25%	0.252	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	139.1	178.2	-35.8	-163.9	173.2	0	0	112.4	L867 S868 K869 T959	L867-E964 HydrophobicContact CD1-CB 4.04Å; S868-E964 CarbonylContact O-C 3.44Å; S868-E964 WeakPolarHBondContact O-CA 3.31Å; K869-E964 HydrophobicContact CD-CG 4.1Å; K869-E964 VanDerWaalsContact CE-OE1 3.26Å; K869-E964 WeakPolarHBondContact CE-OE1 3.43Å; K869-E964 WeakPolarHBondContact CE-OE2 3.39Å; K869-E964 HydrophobicContact CG-CB 4.47Å; K869-E964 HydrophobicContact CG-CG 4.15Å; K869-E964 IonicContact NZ-OE1 2.72Å; K869-E964 PolarHBondContact NZ-OE1 3.02Å; K869-E964 IonicContact NZ-OE2 3.63Å; K869-E964 PolarHBondContact NZ-OE2 2.86Å; T959-E964 HydrophobicContact CG2-CB 3.81Å; T959-E964 HydrophobicContact CG2-CG 4.32Å; T959-E964 PolarHBondContact N-O 3.1Å; T959-E964 PolarHBondContact OG1-N 3.48Å; T959-E964 VanDerWaalsContact OG1-N 3.08Å; T959-E964 PolarHBondContact OG1-O 2.88Å
965	T	76.2	Confident	75.2	Confident	22 Å²	22	43.2 Å²	43.2	14%	0.135	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.7	176.4	-61.4	0	0	0	0	109.8	S868 Q956 V957 I958	S868-T965 PolarHBondContact N-O 3.04Å; S868-T965 PolarHBondContact O-N 2.97Å; S868-T965 PolarHBondContact OG-O 2.89Å; Q956-T965 HydrophobicContact CB-CG2 4.09Å; Q956-T965 HydrophobicContact CG-CG2 4.22Å; V957-T965 WeakPolarHBondContact O-CA 3.21Å; I958-T965 HydrophobicContact CG1-CG2 3.98Å
966	L	82.6	Confident	75	Confident	10 Å²	10	47 Å²	47	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	125.8	170.1	-71.2	165.5	0	0	0	109.2	V865 S866 L867 M898 L919 V937 Q956 V957 F968	V865-L966 HydrophobicContact CG1-CD2 3.87Å; S866-L966 CarbonylContact O-C 3.54Å; S866-L966 WeakPolarHBondContact O-CA 3.45Å; L867-L966 HydrophobicContact CB-CD2 4.17Å; L867-L966 HydrophobicContact CD1-CD2 3.68Å; L867-L966 HydrophobicContact CD1-CG 3.99Å; M898-L966 HydrophobicContact CE-CD1 4.07Å; L919-L966 HydrophobicContact CD1-CD1 3.67Å; L919-L966 HydrophobicContact CD2-CD1 3.93Å; L919-L966 HydrophobicContact CG-CD1 4.49Å; V937-L966 HydrophobicContact CG1-CD1 4.5Å; Q956-L966 CarbonylContact C-O 3.56Å; Q956-L966 WeakPolarHBondContact CA-O 3.41Å; V957-L966 HydrophobicContact CB-CB 4.32Å; V957-L966 PolarHBondContact N-O 2.71Å; V957-L966 PolarHBondContact O-N 3.32Å; L966-F968 HydrophobicContact CB-CD2 4.45Å; L966-F968 HydrophobicContact CB-CE2 3.78Å; L966-F968 HydrophobicContact CB-CZ 4.46Å
967	T	84.8	Confident	75	Confident	20 Å²	20	50.3 Å²	50.3	12%	0.123	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125.9	170.8	-53.5	0	0	0	0	109.5	V865 S866 Q956	V865-T967 CarbonylContact C-O 3.51Å; V865-T967 VanDerWaalsContact CA-O 3.29Å; V865-T967 WeakPolarHBondContact CA-O 3.31Å; S866-T967 PolarHBondContact N-O 3.18Å; S866-T967 PolarHBondContact O-N 3.35Å; Q956-T967 HydrophobicContact CG-CG2 4.04Å; Q956-T967 PolarHBondContact NE2-OG1 3.02Å
968	F	88.2	Confident	75.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.1	177.5	-65.3	-103.6	0	0	0	109.6	F863 R864 V865 V889 M898 L919 R954 F955 V957 L966	F863-F968 HydrophobicContact CB-CD1 4.11Å; F863-F968 HydrophobicContact CD1-CB 4.16Å; F863-F968 HydrophobicContact CG-CD1 4.24Å; R864-F968 CarbonylContact O-C 3.6Å; R864-F968 WeakPolarHBondContact O-CA 3.36Å; V865-F968 HydrophobicContact CG1-CD1 4.29Å; V865-F968 HydrophobicContact CG1-CE1 4.1Å; V865-F968 HydrophobicContact CG1-CZ 4.22Å; V865-F968 HydrophobicContact CG2-CD1 3.61Å; V865-F968 HydrophobicContact CG2-CE1 3.76Å; V865-F968 HydrophobicContact CG2-CG 4.4Å; V889-F968 HydrophobicContact CG2-CD1 4.33Å; V889-F968 HydrophobicContact CG2-CE1 3.98Å; M898-F968 HydrophobicContact SD-CE1 3.57Å; M898-F968 VanDerWaalsContact SD-CE1 3.57Å; M898-F968 HydrophobicContact SD-CZ 3.59Å; M898-F968 VanDerWaalsContact SD-CZ 3.59Å; L919-F968 HydrophobicContact CD1-CZ 4.16Å; R954-F968 VanDerWaalsContact CA-O 3.28Å; R954-F968 WeakPolarHBondContact CA-O 3.43Å; F955-F968 HydrophobicContact CD1-CB 3.76Å; F955-F968 HydrophobicContact CD2-CB 4.32Å; F955-F968 HydrophobicContact CD2-CD2 4.14Å; F955-F968 HydrophobicContact CD2-CG 4.48Å; F955-F968 HydrophobicContact CE1-CB 3.41Å; F955-F968 VanDerWaalsContact CE1-CB 3.41Å; F955-F968 AromaticContact CE1-CG 3.95Å; F955-F968 HydrophobicContact CE1-CG 3.95Å; F955-F968 HydrophobicContact CE2-CB 4.01Å; F955-F968 AromaticContact CE2-CD2 3.58Å; F955-F968 HydrophobicContact CE2-CD2 3.58Å; F955-F968 HydrophobicContact CE2-CE2 4.17Å; F955-F968 AromaticContact CE2-CG 3.82Å; F955-F968 HydrophobicContact CE2-CG 3.82Å; F955-F968 HydrophobicContact CG-CB 4.22Å; F955-F968 HydrophobicContact CZ-CB 3.55Å; F955-F968 AromaticContact CZ-CD1 3.99Å; F955-F968 HydrophobicContact CZ-CD1 3.99Å; F955-F968 AromaticContact CZ-CD2 3.81Å; F955-F968 HydrophobicContact CZ-CD2 3.81Å; F955-F968 AromaticContact CZ-CG 3.52Å; F955-F968 HydrophobicContact CZ-CG 3.52Å; F955-F968 PolarHBondContact N-O 3.25Å; F955-F968 PolarHBondContact O-N 2.58Å; V957-F968 HydrophobicContact CB-CE2 4.1Å; V957-F968 HydrophobicContact CG2-CD2 4.33Å; V957-F968 HydrophobicContact CG2-CE2 3.83Å; L966-F968 HydrophobicContact CB-CD2 4.45Å; L966-F968 HydrophobicContact CB-CE2 3.78Å; L966-F968 HydrophobicContact CB-CZ 4.46Å
969	S	85.4	Confident	76.1	Confident	15 Å²	15	49 Å²	49	11%	0.105	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.2	175.8	81.8	0	0	0	0	112.9	F863 R864 E952 G953	F863-S969 WeakPolarHBondContact CA-O 3.47Å; R864-S969 WeakPolarHBondContact CB-OG 3.43Å; R864-S969 PolarHBondContact N-O 1.9Å; R864-S969 PolarHBondContact O-N 3.39Å; E952-S969 WeakPolarHBondContact OE1-CB 3.39Å; E952-S969 PolarHBondContact OE1-OG 3.22Å; G953-S969 WeakPolarHBondContact O-CA 3.37Å
970	S	88	Confident	76.9	Confident	22 Å²	22	51.3 Å²	51.3	15%	0.154	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	-169.5	-178.6	-158.7	0	0	0	0	109.2	S862 E952 G953	S862-S970 PolarHBondContact O-OG 2.96Å; S862-S970 VanDerWaalsContact O-OG 3.12Å; E952-S970 WeakPolarHBondContact CG-O 3.41Å; G953-S970 PolarHBondContact N-O 3.44Å; G953-S970 PolarHBondContact O-N 3.08Å
971	S	81.9	Confident	78.3	Confident	55 Å²	55	49.8 Å²	49.8	39%	0.385	26%	0.258	S	S	.	.			trans	-58.2	147.5	176.1	65.1	0	0	0	0	111.8	D973 K974 V975	S971-D973 VanDerWaalsContact C-N 3.32Å; S971-D973 PolarHBondContact O-N 2.92Å; S971-K974 PolarHBondContact O-N 2.91Å; S971-K974 WeakPolarHBondContact OG-CB 3.43Å; S971-V975 PolarHBondContact O-N 3.25Å
972	P	77.6	Confident	79.4	Confident	38 Å²	38	45.5 Å²	45.5	25%	0.247	24%	0.235	C	C	.	.	H	α-helix	trans	-53.1	-45.7	-176.8	-28.6	36.3	0	0	0	113.6	T947 K974 V975 L976	T947-P972 HydrophobicContact CG2-CG 4.38Å; P972-K974 PolarHBondContact O-N 2.75Å; P972-V975 PolarHBondContact O-N 2.86Å; P972-L976 WeakPolarHBondContact O-CG 3.5Å; P972-L976 PolarHBondContact O-N 2.87Å
973	D	77.1	Confident	80.3	Confident	89 Å²	89	42.2 Å²	42.2	48%	0.476	23%	0.225	S	C	.	.	H	α-helix	trans	-63.8	-41.9	-179	-47.3	-66.5	0	0	0	112	S971 V975 L976 Q977	S971-D973 VanDerWaalsContact C-N 3.32Å; S971-D973 PolarHBondContact O-N 2.92Å; D973-V975 VanDerWaalsContact C-N 3.33Å; D973-V975 PolarHBondContact O-N 3.04Å; D973-L976 PolarHBondContact O-N 3.33Å; D973-Q977 VanDerWaalsContact O-CG 3.26Å; D973-Q977 WeakPolarHBondContact O-CG 3.33Å; D973-Q977 PolarHBondContact O-N 3.15Å
974	K	81.8	Confident	81	Confident	64 Å²	64	42.2 Å²	42.2	28%	0.278	22%	0.223	S	C	.	.	H	α-helix	trans	-67.6	-36	179.9	-166.7	162.2	-165.1	163.8	0	111.9	E860 F863 S971 P972 F978	E860-K974 WeakPolarHBondContact O-CE 3.45Å; F863-K974 HydrophobicContact CZ-CG 4.28Å; S971-K974 PolarHBondContact O-N 2.91Å; S971-K974 WeakPolarHBondContact OG-CB 3.43Å; P972-K974 PolarHBondContact O-N 2.75Å; K974-F978 PolarHBondContact O-N 3.43Å; K974-F978 VanDerWaalsContact O-N 3.08Å
975	V	81.4	Confident	81.3	Confident	2 Å²	2	40.5 Å²	40.5	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-67.3	-45.2	172	165.1	0	0	0	0	111.3	F863 F955 S971 P972 D973 Q977 F978 V979	F863-V975 HydrophobicContact CE1-CG2 4.19Å; F955-V975 HydrophobicContact CB-CG1 4.37Å; F955-V975 HydrophobicContact CD1-CG1 4.07Å; F955-V975 HydrophobicContact CD1-CG2 4.35Å; S971-V975 PolarHBondContact O-N 3.25Å; P972-V975 PolarHBondContact O-N 2.86Å; D973-V975 VanDerWaalsContact C-N 3.33Å; D973-V975 PolarHBondContact O-N 3.04Å; V975-Q977 PolarHBondContact O-N 2.79Å; V975-F978 PolarHBondContact O-N 2.78Å; V975-V979 HydrophobicContact CG1-CG2 4.25Å; V975-V979 WeakPolarHBondContact O-CB 3.39Å; V975-V979 VanDerWaalsContact O-CG2 3.27Å; V975-V979 WeakPolarHBondContact O-CG2 3.21Å; V975-V979 PolarHBondContact O-N 2.77Å
976	L	79.5	Confident	80.9	Confident	82 Å²	82	40.6 Å²	40.6	43%	0.429	22%	0.215	S	C	.	.	H	α-helix	trans	-59.8	-44.4	176.9	-74.5	167.7	0	0	0	111.9	P972 D973 S980	P972-L976 WeakPolarHBondContact O-CG 3.5Å; P972-L976 PolarHBondContact O-N 2.87Å; D973-L976 PolarHBondContact O-N 3.33Å; L976-S980 VanDerWaalsContact O-CB 3.25Å; L976-S980 WeakPolarHBondContact O-CB 3.21Å; L976-S980 PolarHBondContact O-N 3.39Å
977	Q	81	Confident	80.3	Confident	112 Å²	112	45.4 Å²	45.4	52%	0.523	24%	0.237	S	C	.	.	H	α-helix	trans	-61.7	-48.9	176	-69	169.8	5.3	0	0	111.9	M859 D973 V975 S980 K981	M859-Q977 HydrophobicContact CE-CB 3.51Å; M859-Q977 HydrophobicContact SD-CB 4.36Å; D973-Q977 VanDerWaalsContact O-CG 3.26Å; D973-Q977 WeakPolarHBondContact O-CG 3.33Å; D973-Q977 PolarHBondContact O-N 3.15Å; V975-Q977 PolarHBondContact O-N 2.79Å; Q977-S980 PolarHBondContact O-N 3.26Å; Q977-K981 PolarHBondContact O-N 2.96Å
978	F	85.4	Confident	79.5	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-44.4	178.4	-109	-99.5	0	0	0	112.5	M859 F863 V889 L891 F955 K974 V975 K981 L982	M859-F978 HydrophobicContact CB-CD2 4.2Å; M859-F978 HydrophobicContact CB-CE1 4.44Å; M859-F978 HydrophobicContact CB-CE2 3.64Å; M859-F978 HydrophobicContact CB-CZ 3.77Å; M859-F978 HydrophobicContact CE-CD2 3.41Å; M859-F978 VanDerWaalsContact CE-CD2 3.41Å; M859-F978 HydrophobicContact CE-CE2 3.82Å; M859-F978 HydrophobicContact CE-CG 4.27Å; M859-F978 HydrophobicContact SD-CD2 3.86Å; M859-F978 HydrophobicContact SD-CE2 4.26Å; M859-F978 HydrophobicContact SD-CG 4.22Å; F863-F978 HydrophobicContact CE2-CD1 4.31Å; F863-F978 AromaticContact CE2-CD2 3.94Å; F863-F978 HydrophobicContact CE2-CD2 3.94Å; F863-F978 HydrophobicContact CE2-CE1 4.12Å; F863-F978 AromaticContact CE2-CE2 3.72Å; F863-F978 HydrophobicContact CE2-CE2 3.72Å; F863-F978 HydrophobicContact CE2-CG 4.23Å; F863-F978 AromaticContact CE2-CZ 3.82Å; F863-F978 HydrophobicContact CE2-CZ 3.82Å; F863-F978 HydrophobicContact CZ-CB 4.23Å; F863-F978 HydrophobicContact CZ-CD1 4.15Å; F863-F978 AromaticContact CZ-CD2 3.52Å; F863-F978 HydrophobicContact CZ-CD2 3.52Å; F863-F978 HydrophobicContact CZ-CE1 4.4Å; F863-F978 AromaticContact CZ-CE2 3.81Å; F863-F978 HydrophobicContact CZ-CE2 3.81Å; F863-F978 AromaticContact CZ-CG 3.7Å; F863-F978 HydrophobicContact CZ-CG 3.7Å; F863-F978 HydrophobicContact CZ-CZ 4.25Å; V889-F978 HydrophobicContact CB-CE1 4.47Å; V889-F978 HydrophobicContact CB-CZ 4.44Å; V889-F978 HydrophobicContact CG1-CE1 3.78Å; V889-F978 HydrophobicContact CG1-CZ 4.13Å; L891-F978 HydrophobicContact CB-CE1 4Å; L891-F978 HydrophobicContact CB-CZ 4.35Å; L891-F978 HydrophobicContact CD2-CD1 4.43Å; L891-F978 HydrophobicContact CD2-CE1 4.31Å; F955-F978 HydrophobicContact CE1-CB 4.3Å; F955-F978 HydrophobicContact CZ-CD1 4.48Å; K974-F978 PolarHBondContact O-N 3.43Å; K974-F978 VanDerWaalsContact O-N 3.08Å; V975-F978 PolarHBondContact O-N 2.78Å; F978-K981 PolarHBondContact O-N 2.98Å; F978-L982 HydrophobicContact CD1-CD1 4.38Å; F978-L982 WeakPolarHBondContact O-CB 3.48Å; F978-L982 VanDerWaalsContact O-CG 3.31Å; F978-L982 WeakPolarHBondContact O-CG 3.42Å; F978-L982 PolarHBondContact O-N 3.05Å
979	V	82	Confident	78.1	Confident	5 Å²	5	55 Å²	55	3%	0.03	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-42.1	177.4	170	0	0	0	0	111	I942 F955 V975 K983	I942-V979 HydrophobicContact CG2-CB 4.49Å; I942-V979 HydrophobicContact CG2-CG1 4.04Å; I942-V979 HydrophobicContact CG2-CG2 3.98Å; F955-V979 HydrophobicContact CB-CG2 3.46Å; F955-V979 VanDerWaalsContact CB-CG2 3.46Å; F955-V979 HydrophobicContact CD1-CG2 4.05Å; F955-V979 HydrophobicContact CD2-CG2 4.39Å; F955-V979 HydrophobicContact CG-CG2 3.75Å; V975-V979 HydrophobicContact CG1-CG2 4.25Å; V975-V979 WeakPolarHBondContact O-CB 3.39Å; V975-V979 VanDerWaalsContact O-CG2 3.27Å; V975-V979 WeakPolarHBondContact O-CG2 3.21Å; V975-V979 PolarHBondContact O-N 2.77Å; V979-K983 HydrophobicContact CG1-CD 4.19Å; V979-K983 WeakPolarHBondContact O-CB 3.42Å; V979-K983 WeakPolarHBondContact O-CG 3.29Å; V979-K983 PolarHBondContact O-N 3.08Å
980	S	79.9	Confident	76.6	Confident	59 Å²	59	58.5 Å²	58.5	41%	0.413	30%	0.295	S	S	.	.	H	α-helix	trans	-60.9	-48.9	175.3	-177.2	0	0	0	0	111.5	L976 Q977 L982 K983 Q984	L976-S980 VanDerWaalsContact O-CB 3.25Å; L976-S980 WeakPolarHBondContact O-CB 3.21Å; L976-S980 PolarHBondContact O-N 3.39Å; Q977-S980 PolarHBondContact O-N 3.26Å; S980-L982 PolarHBondContact O-N 3.41Å; S980-K983 PolarHBondContact O-N 3.31Å; S980-Q984 WeakPolarHBondContact O-CG 3.26Å; S980-Q984 PolarHBondContact O-N 2.85Å
981	K	82	Confident	74.8	Confident	61 Å²	61	60.9 Å²	60.9	27%	0.265	31%	0.311	S	S	.	.	H	α-helix	trans	-65.5	-40.2	-179.7	-161.2	69.6	168.7	-173.2	0	112.8	M859 L891 Q977 F978 Q984 L985	M859-K981 HydrophobicContact CG-CB 4.3Å; M859-K981 HydrophobicContact CG-CG 4.08Å; M859-K981 HydrophobicContact SD-CB 3.55Å; M859-K981 VanDerWaalsContact SD-CB 3.55Å; M859-K981 HydrophobicContact SD-CG 4.01Å; L891-K981 HydrophobicContact CD2-CB 4.34Å; L891-K981 HydrophobicContact CD2-CG 4.15Å; Q977-K981 PolarHBondContact O-N 2.96Å; F978-K981 PolarHBondContact O-N 2.98Å; K981-Q984 PolarHBondContact O-N 2.97Å; K981-L985 WeakPolarHBondContact O-CG 3.41Å; K981-L985 PolarHBondContact O-N 3.33Å; K981-L985 VanDerWaalsContact O-N 3.09Å
982	L	79.7	Confident	73	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-44	174.9	-76	166.4	0	0	0	111.6	L891 I942 F955 F978 S980 Q984 L985 I986	L891-L982 HydrophobicContact CD1-CD2 3.62Å; L891-L982 HydrophobicContact CD2-CD2 3.94Å; L891-L982 HydrophobicContact CD2-CG 4.03Å; L891-L982 HydrophobicContact CG-CD2 4.46Å; I942-L982 HydrophobicContact CD1-CB 3.47Å; I942-L982 VanDerWaalsContact CD1-CB 3.47Å; I942-L982 HydrophobicContact CD1-CD1 3.97Å; I942-L982 HydrophobicContact CD1-CG 4.24Å; F955-L982 HydrophobicContact CE2-CD1 3.98Å; F955-L982 HydrophobicContact CZ-CD1 4.31Å; F978-L982 HydrophobicContact CD1-CD1 4.38Å; F978-L982 WeakPolarHBondContact O-CB 3.48Å; F978-L982 VanDerWaalsContact O-CG 3.31Å; F978-L982 WeakPolarHBondContact O-CG 3.42Å; F978-L982 PolarHBondContact O-N 3.05Å; S980-L982 PolarHBondContact O-N 3.41Å; L982-Q984 PolarHBondContact O-N 2.95Å; L982-L985 PolarHBondContact O-N 3.34Å; L982-I986 VanDerWaalsContact O-CG1 3.28Å; L982-I986 WeakPolarHBondContact O-CG1 3.24Å; L982-I986 PolarHBondContact O-N 2.96Å
983	K	76.9	Confident	71	Confident	95 Å²	95	65.9 Å²	65.9	41%	0.413	33%	0.331	S	S	.	.	H	α-helix	trans	-59.1	-46.6	174.6	-76.3	179	177.8	-175.1	0	111.9	V979 S980 L985 I986 E987	V979-K983 HydrophobicContact CG1-CD 4.19Å; V979-K983 WeakPolarHBondContact O-CB 3.42Å; V979-K983 WeakPolarHBondContact O-CG 3.29Å; V979-K983 PolarHBondContact O-N 3.08Å; S980-K983 PolarHBondContact O-N 3.31Å; K983-L985 VanDerWaalsContact C-N 3.28Å; K983-L985 PolarHBondContact O-N 3.47Å; K983-I986 PolarHBondContact O-N 3.21Å; K983-I986 VanDerWaalsContact O-N 3.14Å; K983-E987 WeakPolarHBondContact O-CB 3.36Å; K983-E987 VanDerWaalsContact O-CG 3.3Å; K983-E987 WeakPolarHBondContact O-CG 3.32Å; K983-E987 PolarHBondContact O-N 3.39Å
984	Q	79.2	Confident	68.9	Low	78 Å²	78	64.8 Å²	64.8	36%	0.364	34%	0.341	S	S	.	.	H	α-helix	trans	-57.8	-36.4	175.4	-71.1	175.3	8.8	0	0	113.2	S980 K981 L982 R988	S980-Q984 WeakPolarHBondContact O-CG 3.26Å; S980-Q984 PolarHBondContact O-N 2.85Å; K981-Q984 PolarHBondContact O-N 2.97Å; L982-Q984 PolarHBondContact O-N 2.95Å; Q984-R988 WeakPolarHBondContact O-CB 3.09Å; Q984-R988 WeakPolarHBondContact O-CD 3.31Å; Q984-R988 WeakPolarHBondContact O-CG 3.4Å; Q984-R988 PolarHBondContact O-N 3.22Å; Q984-R988 VanDerWaalsContact O-N 3.09Å
985	L	75.9	Confident	66.5	Low	19 Å²	19	70.8 Å²	70.8	10%	0.099	37%	0.367	C	S	.	.	H	α-helix	trans	-69	-45.8	175.3	-72.2	168.2	0	0	0	111.5	L858 L891 K981 L982 K983 R988 C989	L858-L985 HydrophobicContact CD1-CD1 3.93Å; L858-L985 HydrophobicContact CD1-CD2 3.83Å; L858-L985 HydrophobicContact CD1-CG 4.4Å; L891-L985 HydrophobicContact CD1-CD1 4.06Å; L891-L985 HydrophobicContact CD2-CD1 4.09Å; L891-L985 HydrophobicContact CG-CD1 4.16Å; K981-L985 WeakPolarHBondContact O-CG 3.41Å; K981-L985 PolarHBondContact O-N 3.33Å; K981-L985 VanDerWaalsContact O-N 3.09Å; L982-L985 PolarHBondContact O-N 3.34Å; K983-L985 VanDerWaalsContact C-N 3.28Å; K983-L985 PolarHBondContact O-N 3.47Å; L985-R988 PolarHBondContact O-N 3.13Å; L985-C989 PolarHBondContact O-N 3.18Å; L985-C989 PolarHBondContact O-SG 3.48Å; L985-C989 VanDerWaalsContact O-SG 3.37Å
986	I	69.2	Low	64.1	Low	24 Å²	24	75 Å²	75	12%	0.123	40%	0.396	C	S	.	.	H	α-helix	trans	-62.4	-44.9	178.7	-65	171.9	0	0	0	110.9	F923 V939 I942 L982 K983 R988 C989 N990	F923-I986 HydrophobicContact CD2-CG2 4.33Å; F923-I986 HydrophobicContact CE2-CB 4.28Å; F923-I986 HydrophobicContact CE2-CD1 3.96Å; F923-I986 HydrophobicContact CE2-CG1 3.76Å; F923-I986 HydrophobicContact CE2-CG2 3.65Å; F923-I986 HydrophobicContact CZ-CD1 4.11Å; F923-I986 HydrophobicContact CZ-CG1 4.32Å; F923-I986 HydrophobicContact CZ-CG2 3.76Å; V939-I986 HydrophobicContact CG1-CD1 4.46Å; I942-I986 HydrophobicContact CD1-CD1 3.71Å; I942-I986 HydrophobicContact CG1-CD1 4.35Å; L982-I986 VanDerWaalsContact O-CG1 3.28Å; L982-I986 WeakPolarHBondContact O-CG1 3.24Å; L982-I986 PolarHBondContact O-N 2.96Å; K983-I986 PolarHBondContact O-N 3.21Å; K983-I986 VanDerWaalsContact O-N 3.14Å; I986-R988 VanDerWaalsContact C-N 3.34Å; I986-R988 PolarHBondContact O-N 2.97Å; I986-C989 PolarHBondContact O-N 3.21Å; I986-N990 PolarHBondContact O-N 3.48Å; I986-N990 PolarHBondContact O-ND2 2.82Å
987	E	69	Low	61.7	Low	110 Å²	110	79.3 Å²	79.3	51%	0.514	42%	0.417	S	S	.	.	H	α-helix	trans	-60.5	-40.6	174.9	-73.4	161.5	-163.3	0	0	111.9	K983 N990 S991	K983-E987 WeakPolarHBondContact O-CB 3.36Å; K983-E987 VanDerWaalsContact O-CG 3.3Å; K983-E987 WeakPolarHBondContact O-CG 3.32Å; K983-E987 PolarHBondContact O-N 3.39Å; E987-N990 PolarHBondContact O-N 3.1Å; E987-S991 WeakPolarHBondContact O-CB 3.23Å; E987-S991 PolarHBondContact O-N 3Å; E987-S991 PolarHBondContact O-OG 2.94Å
988	R	67.9	Low	59	Low	179 Å²	179	82.2 Å²	82.2	68%	0.675	43%	0.43	S	S	*	.	H	α-helix	trans	-65.3	-42.2	174.3	-77.5	172.3	179.8	-154.8	-1.7	112.5	Q984 L985 I986 S991 S992	Q984-R988 WeakPolarHBondContact O-CB 3.09Å; Q984-R988 WeakPolarHBondContact O-CD 3.31Å; Q984-R988 WeakPolarHBondContact O-CG 3.4Å; Q984-R988 PolarHBondContact O-N 3.22Å; Q984-R988 VanDerWaalsContact O-N 3.09Å; L985-R988 PolarHBondContact O-N 3.13Å; I986-R988 VanDerWaalsContact C-N 3.34Å; I986-R988 PolarHBondContact O-N 2.97Å; R988-S991 PolarHBondContact O-N 3.27Å; R988-S992 PolarHBondContact O-N 3.13Å; R988-S992 PolarHBondContact O-OG 3.16Å
989	C	60	Low	56.2	Low	44 Å²	44	91.8 Å²	91.8	30%	0.297	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-42	175.4	-69.9	0	0	0	0	112.4	L985 I986 S992 F993	L985-C989 PolarHBondContact O-N 3.18Å; L985-C989 PolarHBondContact O-SG 3.48Å; L985-C989 VanDerWaalsContact O-SG 3.37Å; I986-C989 PolarHBondContact O-N 3.21Å; C989-S992 PolarHBondContact O-OG 2.94Å; C989-F993 PolarHBondContact O-N 2.93Å
990	N	53.9	Low	53.6	Low	88 Å²	88	99.5 Å²	99.5	47%	0.471	51%	0.507	S	S	.	.	H	α-helix	trans	-67.3	-40.5	175.5	-67.5	-24.5	0	0	0	111.4	I986 E987 G994	I986-N990 PolarHBondContact O-N 3.48Å; I986-N990 PolarHBondContact O-ND2 2.82Å; E987-N990 PolarHBondContact O-N 3.1Å; N990-G994 PolarHBondContact O-N 3.46Å
991	S	48.8	Very low	50.9	Low	72 Å²	72	107.1 Å²	107.1	50%	0.503	53%	0.533	S	S	.	.	H	α-helix	trans	-71.3	-33.4	-178.1	-60.8	0	0	0	0	113.8	E987 R988	E987-S991 WeakPolarHBondContact O-CB 3.23Å; E987-S991 PolarHBondContact O-N 3Å; E987-S991 PolarHBondContact O-OG 2.94Å; R988-S991 PolarHBondContact O-N 3.27Å
992	S	44.5	Very low	48.2	Very low	72 Å²	72	115.4 Å²	115.4	50%	0.503	56%	0.563	S	S	.	*	H	α-helix	trans	-71.6	-40.4	176	62.6	0	0	0	0	111.3	R988 C989 K995 S996	R988-S992 PolarHBondContact O-N 3.13Å; R988-S992 PolarHBondContact O-OG 3.16Å; C989-S992 PolarHBondContact O-OG 2.94Å; S992-K995 PolarHBondContact O-N 3.27Å; S992-S996 WeakPolarHBondContact O-CB 3.29Å; S992-S996 PolarHBondContact O-N 3.29Å
993	F	36.8	Very low	45.6	Very low	126 Å²	126	123.7 Å²	123.7	55%	0.553	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-44	174.9	-112.1	-101.2	0	0	0	112.6	H924 C989 K995 S996	H924-F993 AromaticContact CE1-CE1 3.55Å; H924-F993 AromaticContact CE1-CE2 3.73Å; H924-F993 AromaticContact CE1-CZ 3.28Å; H924-F993 WeakPolarHBondContact CE1-CZ 3.38Å; H924-F993 AromaticContact NE2-CE1 3.69Å; H924-F993 AromaticContact NE2-CZ 3.58Å; C989-F993 PolarHBondContact O-N 2.93Å; F993-K995 PolarHBondContact O-N 2.71Å; F993-K995 VanDerWaalsContact O-N 3.08Å; F993-S996 PolarHBondContact O-N 2.88Å; F993-S996 VanDerWaalsContact O-N 3.16Å
994	G	32.2	Very low	43.1	Very low	66 Å²	66	126 Å²	126	68%	0.68	62%	0.624	S	S	*	*	H	α-helix	trans	-61.7	-15.9	178.2	0	0	0	0	0	115.3	N990	N990-G994 PolarHBondContact O-N 3.46Å
995	K	32.1	Very low	40.5	Very low	190 Å²	190	126.5 Å²	126.5	83%	0.826	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	1.8	178.6	-68.4	-174.5	177.1	-176.3	0	114.5	S992 F993	S992-K995 PolarHBondContact O-N 3.27Å; F993-K995 PolarHBondContact O-N 2.71Å; F993-K995 VanDerWaalsContact O-N 3.08Å
996	S	31.3	Very low	38.1	Very low	89 Å²	89	134 Å²	134	62%	0.622	67%	0.67	S	S	*	*			trans	-113	6.4	-172	-154	0	0	0	0	115	S992 F993 H998	S992-S996 WeakPolarHBondContact O-CB 3.29Å; S992-S996 PolarHBondContact O-N 3.29Å; F993-S996 PolarHBondContact O-N 2.88Å; F993-S996 VanDerWaalsContact O-N 3.16Å; S996-H998 PolarHBondContact O-N 3.29Å
997	M	27.3	Very low	36	Very low	174 Å²	174	141.3 Å²	141.3	86%	0.857	71%	0.709	S	S	*	*	S	Bend	trans	-77	-1.3	177	-73.1	-146.8	-57.3	0	0	115
998	H	25.2	Very low	33.9	Very low	172 Å²	172	143.3 Å²	143.3	80%	0.796	72%	0.722	S	S	*	*	S	Bend	trans	-129.3	91.1	168.6	-89.6	-94.2	0	0	0	109.5	S996	S996-H998 PolarHBondContact O-N 3.29Å
999	F	27.5	Very low	31.7	Very low	202 Å²	202	143.8 Å²	143.8	89%	0.886	73%	0.729	S	S	*	*	S	Bend	trans	-169.2	162.5	136.7	-105.4	-66.6	0	0	0	111.4
1000	H	26.1	Very low	30.1	Very low	166 Å²	166	150.5 Å²	150.5	77%	0.769	76%	0.761	S	S	*	*			trans	-66.5	150.4	-160.3	-75	-83.7	0	0	0	117	R1002	H1000-R1002 PolarHBondContact O-N 3.18Å
1001	F	22.9	Very low	28.7	Very low	219 Å²	219	150 Å²	150	96%	0.961	78%	0.777	S	S	*	*			trans	-50.3	115.9	151.5	-77.1	-103.5	0	0	0	111.1
1002	R	25.7	Very low	27.5	Very low	235 Å²	235	152.4 Å²	152.4	89%	0.887	79%	0.793	S	S	*	*			trans	-139.9	161.9	156.6	-88.6	-165.1	172.7	-170	-1.3	110.7	H1000	H1000-R1002 PolarHBondContact O-N 3.18Å
1003	K	25	Very low	26.5	Very low	177 Å²	177	153.2 Å²	153.2	77%	0.77	80%	0.799	S	S	*	*			trans	-70.5	148	-163.9	-63	178	178.5	-179.6	0	112.8	S1005	K1003-S1005 PolarHBondContact O-N 2.89Å
1004	P	24.6	Very low	25.9	Very low	145 Å²	145	154.9 Å²	154.9	94%	0.942	81%	0.808	S	S	*	*	S	Bend	trans	-77.3	68.1	172.8	34.2	-35.9	0	0	0	111
1005	S	25.2	Very low	25.5	Very low	87 Å²	87	161 Å²	161	61%	0.608	82%	0.819	S	S	*	*			trans	-151.4	25.5	-176.8	65.8	0	0	0	0	114.3	K1003	K1003-S1005 PolarHBondContact O-N 2.89Å
1006	E	25.5	Very low	25.2	Very low	177 Å²	177	157.5 Å²	157.5	83%	0.827	81%	0.805	S	S	*	*			trans	-158.6	91.4	179	-113	159.9	-140.8	0	0	110.3
1007	L	25.6	Very low	24.8	Very low	178 Å²	178	164.1 Å²	164.1	93%	0.932	82%	0.816	S	S	*	*			trans	-160.1	57.5	166.2	-120.7	169.8	0	0	0	110.9
1008	L	23.4	Very low	24.7	Very low	152 Å²	152	160.7 Å²	160.7	80%	0.796	81%	0.808	S	S	*	*			trans	-112.1	149.2	171.8	-83.5	168	0	0	0	109.7
1009	F	23	Very low	24.7	Very low	188 Å²	188	157 Å²	157	83%	0.825	79%	0.793	S	S	*	*			trans	62.2	108	174.6	-61.2	-77	0	0	0	118
1010	L	25.4	Very low	24.7	Very low	186 Å²	186	152 Å²	152	97%	0.974	78%	0.782	S	S	*	*				-170.2	119.9	122.5	-100.6	165.4	0	0	0	108.6
1011	G	24.2	Very low	24.7	Very low	78 Å²	78	149.1 Å²	149.1	80%	0.804	77%	0.765	S	S	*	*			trans	139.4	99	-177.7	0	0	0	0	0	112.6
1012	S	23.6	Very low	24.9	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	74%	0.741	S	S	*	*			trans	-89.5	156.9	-165.8	-56.8	0	0	0	0	115.3
1013	S	23.1	Very low	24.9	Very low	89 Å²	89	135.8 Å²	135.8	62%	0.622	73%	0.732	S	S	*	*			trans	59.4	90.4	152.9	-155.5	0	0	0	0	118.9
1014	H	25.2	Very low	25	Very low	161 Å²	161	135 Å²	135	75%	0.745	73%	0.731	S	S	*	*				-176	156.9	96.9	-90.3	-67.9	0	0	0	110.4	H1016	H1014-H1016 PolarHBondContact O-N 3.12Å; H1014-H1016 VanDerWaalsContact O-N 3.13Å
1015	H	23.9	Very low	25	Very low	195 Å²	195	133 Å²	133	90%	0.903	72%	0.72	S	S	*	*			trans	-82.9	86.8	-175.2	-75.1	-26.6	0	0	0	113
1016	H	25.3	Very low	25.1	Very low	116 Å²	116	133.8 Å²	133.8	54%	0.537	73%	0.725	S	S	.	*			trans	-95.8	108.4	159.9	-68.8	-26.5	0	0	0	110.3	H1014	H1014-H1016 PolarHBondContact O-N 3.12Å; H1014-H1016 VanDerWaalsContact O-N 3.13Å
1017	R	23.4	Very low	25.2	Very low	228 Å²	228	132.8 Å²	132.8	86%	0.86	73%	0.726	S	S	*	*			trans	-68	133.6	161	-75.1	-175.5	174.3	-172.5	-0.1	108.2	I1019	R1017-I1019 PolarHBondContact O-N 2.83Å
1018	P	24.5	Very low	25.2	Very low	103 Å²	103	132.6 Å²	132.6	67%	0.669	72%	0.72	S	S	*	*			trans	-63.2	127.1	170	27.3	-33	0	0	0	108.9	S1020	P1018-S1020 PolarHBondContact O-N 3.25Å; P1018-S1020 VanDerWaalsContact O-N 3.15Å
1019	I	26.2	Very low	25.4	Very low	94 Å²	94	132.2 Å²	132.2	48%	0.482	72%	0.724	S	S	.	*			trans	-78.6	102.3	176.4	-53.9	176.8	0	0	0	107.7	R1017 W1021	R1017-I1019 PolarHBondContact O-N 2.83Å; I1019-W1021 VanDerWaalsContact O-CD1 3.28Å; I1019-W1021 PolarHBondContact O-N 2.89Å
1020	S	26.4	Very low	25.5	Very low	96 Å²	96	126.8 Å²	126.8	67%	0.671	72%	0.721	S	S	*	*			trans	-68.1	98.4	178.9	54.9	0	0	0	0	111.2	P1018 T1022	P1018-S1020 PolarHBondContact O-N 3.25Å; P1018-S1020 VanDerWaalsContact O-N 3.15Å; S1020-T1022 VanDerWaalsContact C-N 3.31Å; S1020-T1022 PolarHBondContact O-N 3.16Å
1021	W	27.3	Very low	25.5	Very low	106 Å²	106	123.4 Å²	123.4	40%	0.402	71%	0.712	S	S	.	*			trans	-77.7	80.1	172.6	-67.6	99	0	0	0	110.7	K721 Q848 I1019	K721-W1021 HydrophobicContact CD-CH2 4.38Å; K721-W1021 VanDerWaalsContact CE-CH2 3.42Å; K721-W1021 VanDerWaalsContact CE-CZ2 3.41Å; K721-W1021 HydrophobicContact CG-CH2 4.1Å; Q848-W1021 PolarHBondContact NE2-O 3.08Å; I1019-W1021 VanDerWaalsContact O-CD1 3.28Å; I1019-W1021 PolarHBondContact O-N 2.89Å
1022	T	26.3	Very low	25.6	Very low	76 Å²	76	127 Å²	127	47%	0.466	71%	0.711	S	S	.	*			trans	-120.9	154.2	174.3	56.1	0	0	0	0	110.4	S1020	S1020-T1022 VanDerWaalsContact C-N 3.31Å; S1020-T1022 PolarHBondContact O-N 3.16Å
1023	S	26	Very low	25.6	Very low	98 Å²	98	133 Å²	133	69%	0.685	72%	0.715	S	S	*	*			trans	52.8	90.8	177	61.7	0	0	0	0	117.6
1024	H	26.5	Very low	25.9	Very low	162 Å²	162	135.3 Å²	135.3	75%	0.75	73%	0.725	S	S	*	*			trans	-144.2	71.7	145.7	-96.8	-63.1	0	0	0	110.7	R912	R912-H1024 PolarHBondContact NH1-O 3.3Å
1025	S	25.5	Very low	25.9	Very low	103 Å²	103	130.6 Å²	130.6	72%	0.72	72%	0.72	S	S	*	*			trans	-139.4	131.4	167.7	-174.8	0	0	0	0	108.6
1026	S	27.2	Very low	26	Very low	102 Å²	102	128.3 Å²	128.3	71%	0.713	71%	0.71	S	S	*	*	S	Bend	trans	71.1	115.6	172.1	-49	0	0	0	0	117.3
1027	N	28.4	Very low	25.9	Very low	156 Å²	156	133 Å²	133	83%	0.834	72%	0.723	S	S	*	*			trans	62.5	110.6	147	-53.7	6.7	0	0	0	119.5
1028	E	23.7	Very low	26.2	Very low	175 Å²	175	132.4 Å²	132.4	82%	0.818	73%	0.726	S	S	*	*			trans	-82.3	110.6	155.5	-69.1	-172.5	131.4	0	0	110.6
1029	T	28.1	Very low	26.1	Very low	144 Å²	144	137.3 Å²	137.3	88%	0.883	73%	0.731	S	S	*	*			trans	-173.5	133.3	144.1	42.4	0	0	0	0	108.7
1030	G	26	Very low	26.2	Very low	73 Å²	73	140.5 Å²	140.5	75%	0.753	74%	0.744	S	S	*	*			trans	117.6	83.6	161.6	0	0	0	0	0	117.8
1031	C	24.5	Very low	26.2	Very low	116 Å²	116	139.8 Å²	139.8	78%	0.784	74%	0.739	S	S	*	*			trans	63.8	118.4	134.7	-67.6	0	0	0	0	123.4
1032	I	27.6	Very low	26.1	Very low	152 Å²	152	142.2 Å²	142.2	78%	0.779	76%	0.755	S	S	*	*				81.3	118.9	128.4	-61.4	168.1	0	0	0	118.6	V1034	I1032-V1034 HydrophobicContact CG2-CG2 4.23Å
1033	R	22.5	Very low	26.2	Very low	247 Å²	247	144 Å²	144	93%	0.932	77%	0.766	S	S	*	*			trans	-82.4	131.2	161.6	-57.4	169.6	178.8	165.4	-2.6	109.9
1034	V	28.6	Very low	26.5	Very low	139 Å²	139	145.4 Å²	145.4	84%	0.842	77%	0.765	S	S	*	*			trans	-137.3	142.1	145.6	-176.5	0	0	0	0	107.1	I1032	I1032-V1034 HydrophobicContact CG2-CG2 4.23Å
1035	G	25	Very low	26.5	Very low	61 Å²	61	144 Å²	144	63%	0.629	76%	0.763	S	S	*	*			trans	-125.4	-168.2	179.6	0	0	0	0	0	112.7
1036	E	26.9	Very low	26.5	Very low	148 Å²	148	146.9 Å²	146.9	69%	0.692	77%	0.769	S	S	*	*			trans	75.3	102	170.3	-56.7	-132.2	93.4	0	0	118.9
1037	R	24.1	Very low	26.6	Very low	214 Å²	214	147.4 Å²	147.4	81%	0.808	77%	0.773	S	S	*	*				49	112.2	120.6	-60.5	169.8	173.9	160.9	-12.7	118.3
1038	K	28	Very low	26.5	Very low	215 Å²	215	147.7 Å²	147.7	94%	0.935	76%	0.762	S	S	*	*				-150.1	167.3	115.6	-113.7	157.6	-172.4	174.2	0	112.1
1039	R	23.7	Very low	26.7	Very low	207 Å²	207	144.3 Å²	144.3	78%	0.781	76%	0.758	S	S	*	*			trans	-115.6	161.1	-168.8	-50.9	173.6	178.3	168.6	-5.7	110.5
1040	H	27.4	Very low	26.7	Very low	161 Å²	161	143 Å²	143	75%	0.745	75%	0.75	S	S	*	*			trans	68.8	147.9	156.8	-53.9	-45.6	0	0	0	115.6
1041	S	26.5	Very low	26.8	Very low	81 Å²	81	146.6 Å²	146.6	57%	0.566	75%	0.751	S	S	*	*			cis	-163.7	-179.4	-13.1	41.7	0	0	0	0	109.8
1042	E	26.5	Very low	26.9	Very low	156 Å²	156	144.6 Å²	144.6	73%	0.729	75%	0.751	S	S	*	*			trans	63.3	105.3	143.9	-80.9	142.4	172.5	0	0	118.2
1043	T	28.4	Very low	27	Very low	115 Å²	115	144.4 Å²	144.4	71%	0.706	76%	0.757	S	S	*	*				73.1	132.1	98.7	56	0	0	0	0	113.1
1044	D	30.4	Very low	27.4	Very low	126 Å²	126	137 Å²	137	67%	0.674	75%	0.748	S	S	*	*			cis	-148	143.3	45.4	-96.1	-42.8	0	0	0	113.4
1045	L	27.1	Very low	27.5	Very low	134 Å²	134	134.3 Å²	134.3	70%	0.702	75%	0.748	S	S	*	*				53.7	107.5	104.4	-55.6	178.6	0	0	0	115.4
1046	L	26.5	Very low	27.8	Very low	163 Å²	163	135.2 Å²	135.2	85%	0.853	76%	0.758	S	S	*	*				62.4	83.4	82.7	-67.3	-177.1	0	0	0	115.3
1047	S	27.7	Very low	27.8	Very low	112 Å²	112	132 Å²	132	78%	0.783	77%	0.765	S	S	*	*				-158.1	137.6	123.4	39.1	0	0	0	0	110.8
1048	R	27.7	Very low	28.1	Very low	162 Å²	162	126.6 Å²	126.6	61%	0.611	77%	0.765	S	S	*	*			cis	89.2	144.3	44.5	-114.2	171.1	162.1	-109.6	-2.3	113.8	A1210 G1211	R1048-A1210 PolarHBondContact NH1-O 3.27Å; R1048-A1210 PolarHBondContact NH2-O 3.49Å; R1048-G1211 PolarHBondContact NH2-O 3.33Å
1049	S	27.6	Very low	28.1	Very low	104 Å²	104	122.5 Å²	122.5	73%	0.727	76%	0.759	S	S	*	*			trans	69.8	155	173.8	-69.7	0	0	0	0	118.1
1050	V	28	Very low	28.2	Very low	118 Å²	118	117 Å²	117	72%	0.715	75%	0.752	S	S	*	*			cis	-176.6	134.8	-41.6	124.3	0	0	0	0	108.5
1051	N	27	Very low	28.2	Very low	147 Å²	147	121.1 Å²	121.1	79%	0.786	76%	0.761	S	S	*	*			trans	37.4	84.9	155.1	-53.3	-30.5	0	0	0	121.9
1052	G	28	Very low	28.2	Very low	75 Å²	75	123.7 Å²	123.7	77%	0.773	76%	0.759	S	S	*	*				58.5	-152	118	0	0	0	0	0	121.5
1053	V	29.1	Very low	28.3	Very low	148 Å²	148	120.7 Å²	120.7	90%	0.897	75%	0.753	S	S	*	*			trans	78.5	127.5	-170.8	-173.8	0	0	0	0	113
1054	A	31.3	Very low	28.3	Very low	92 Å²	92	121.2 Å²	121.2	76%	0.76	75%	0.751	S	S	*	*			cis	-165.2	162.7	-12.5	0	0	0	0	0	109.9
1055	G	30.9	Very low	28.4	Very low	81 Å²	81	118.7 Å²	118.7	84%	0.835	75%	0.748	S	S	*	*			cis	125.6	72.9	-0.6	0	0	0	0	0	115.4
1056	G	30.4	Very low	28.6	Very low	81 Å²	81	121.8 Å²	121.8	84%	0.835	75%	0.75	S	S	*	*			trans	-131.1	89.5	-170.8	0	0	0	0	0	117.8
1057	G	28.5	Very low	28.9	Very low	81 Å²	81	117 Å²	117	84%	0.835	73%	0.731	S	S	*	*			trans	70.6	154.2	162.4	0	0	0	0	0	117.9
1058	A	30.5	Very low	29.3	Very low	99 Å²	99	118.4 Å²	118.4	82%	0.818	73%	0.725	S	S	*	*			cis	-156.5	147.1	-24.5	0	0	0	0	0	106.3
1059	T	27.8	Very low	29.8	Very low	130 Å²	130	117.2 Å²	117.2	80%	0.798	73%	0.726	S	S	*	*	S	Bend	cis	-142.1	159.5	22.3	49.7	0	0	0	0	113
1060	S	25.1	Very low	30.2	Very low	92 Å²	92	117 Å²	117	64%	0.643	72%	0.716	S	S	*	*			trans	67.7	43.7	159.1	-162.9	0	0	0	0	119.6
1061	R	27.6	Very low	30.6	Very low	247 Å²	247	117 Å²	117	93%	0.932	71%	0.712	S	S	*	*			trans	-80.1	138.6	158.4	-64.7	-175.8	-176.8	179.8	2.1	110.5
1062	Y	27.3	Very low	31.1	Very low	134 Å²	134	114.4 Å²	114.4	53%	0.525	70%	0.698	S	S	.	*			trans	-126.5	118.6	178.4	-86.5	-87.4	0	0	0	113.2	R1150	Y1062-R1150 HydrophobicContact CD1-CG 4.19Å; Y1062-R1150 HydrophobicContact CE1-CG 3.88Å; Y1062-R1150 VanDerWaalsContact CZ-NE 3.33Å; Y1062-R1150 VanDerWaalsContact CZ-NH2 3.32Å
1063	P	27.7	Very low	31.6	Very low	93 Å²	93	119.2 Å²	119.2	60%	0.604	69%	0.692	S	S	*	*			trans	-92.5	108.6	-173.9	33.6	-33	0	0	0	113.5	A1065	P1063-A1065 PolarHBondContact O-N 3.4Å
1064	L	28.1	Very low	32	Very low	126 Å²	126	116.5 Å²	116.5	66%	0.66	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	65.3	165.7	-86.9	76.1	0	0	0	110.9
1065	A	31.6	Very low	32.3	Very low	74 Å²	74	119.2 Å²	119.2	61%	0.612	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.7	-7.1	172.7	0	0	0	0	0	113.8	P1063	P1063-A1065 PolarHBondContact O-N 3.4Å
1066	R	31.3	Very low	32.7	Very low	198 Å²	198	120.8 Å²	120.8	75%	0.747	66%	0.66	S	S	*	*	S	Bend	trans	-108.8	1.5	-178.9	-82.3	-176.6	168.6	177.1	-3	114.8	N1070	R1066-N1070 PolarHBondContact O-ND2 3.03Å
1067	S	34.8	Very low	33.2	Very low	64 Å²	64	119.4 Å²	119.4	45%	0.448	64%	0.637	S	S	.	*	H	α-helix	trans	-78.5	-39.1	178.4	42	0	0	0	0	113.1	L1071	S1067-L1071 PolarHBondContact O-N 3.27Å
1068	E	35.3	Very low	33.6	Very low	140 Å²	140	118.2 Å²	118.2	65%	0.654	62%	0.619	S	S	*	*	H	α-helix	trans	-71	-45.1	-174.3	-63	176.3	144.7	0	0	111.4	N1070 L1071 L1072	E1068-N1070 PolarHBondContact O-N 3.22Å; E1068-L1071 WeakPolarHBondContact O-CB 3.38Å; E1068-L1071 PolarHBondContact O-N 3.44Å; E1068-L1072 WeakPolarHBondContact O-CD1 3.31Å; E1068-L1072 PolarHBondContact O-N 3.27Å
1069	H	38.7	Very low	34	Very low	138 Å²	138	117.2 Å²	117.2	64%	0.639	60%	0.599	S	S	*	*	H	α-helix	trans	-63.7	-28	179.9	-138.3	-41.9	0	0	0	113.8	R1073	H1069-R1073 PolarHBondContact O-N 2.95Å; H1069-R1073 VanDerWaalsContact O-N 3.16Å
1070	N	35.8	Very low	34.5	Very low	99 Å²	99	118.3 Å²	118.3	53%	0.529	60%	0.595	S	S	.	*	H	α-helix	trans	-79.7	-33.5	173.7	-78.3	-42.6	0	0	0	112.3	R1066 E1068 R1073 C1074	R1066-N1070 PolarHBondContact O-ND2 3.03Å; E1068-N1070 PolarHBondContact O-N 3.22Å; N1070-R1073 PolarHBondContact O-N 3.43Å; N1070-C1074 PolarHBondContact O-N 2.93Å; N1070-C1074 PolarHBondContact O-SG 3.14Å; N1070-C1074 VanDerWaalsContact O-SG 3.38Å
1071	L	35	Very low	35.2	Very low	117 Å²	117	122.7 Å²	122.7	61%	0.613	60%	0.597	S	S	*	*	H	α-helix	trans	-64.5	-43.9	170.8	-80.1	165.5	0	0	0	111.2	S1067 E1068 C1074 F1075	S1067-L1071 PolarHBondContact O-N 3.27Å; E1068-L1071 WeakPolarHBondContact O-CB 3.38Å; E1068-L1071 PolarHBondContact O-N 3.44Å; L1071-C1074 PolarHBondContact O-N 2.92Å; L1071-F1075 PolarHBondContact O-N 3.1Å
1072	L	38.4	Very low	35.5	Very low	94 Å²	94	115.5 Å²	115.5	49%	0.492	59%	0.585	S	S	.	*	H	α-helix	trans	-57.9	-50.6	172	-90.6	95.9	0	0	0	111.5	E1068 C1074 F1075 E1076	E1068-L1072 WeakPolarHBondContact O-CD1 3.31Å; E1068-L1072 PolarHBondContact O-N 3.27Å; L1072-C1074 VanDerWaalsContact C-N 3.29Å; L1072-C1074 PolarHBondContact O-N 2.89Å; L1072-F1075 CarbonylContact O-C 3.59Å; L1072-F1075 WeakPolarHBondContact O-CA 3.46Å; L1072-F1075 WeakPolarHBondContact O-CB 2.82Å; L1072-F1075 PolarHBondContact O-N 3Å; L1072-E1076 WeakPolarHBondContact O-CG 3.42Å; L1072-E1076 PolarHBondContact O-N 2.92Å
1073	R	39.6	Very low	35.9	Very low	175 Å²	175	119 Å²	119	66%	0.66	60%	0.597	S	S	*	*	H	α-helix	trans	-60	-35	178.8	-99.5	-176	170.5	178.2	-2.1	113.9	H1069 N1070 S1077	H1069-R1073 PolarHBondContact O-N 2.95Å; H1069-R1073 VanDerWaalsContact O-N 3.16Å; N1070-R1073 PolarHBondContact O-N 3.43Å; R1073-S1077 WeakPolarHBondContact O-CB 3.46Å; R1073-S1077 PolarHBondContact O-N 3.44Å
1074	C	36.2	Very low	36.3	Very low	91 Å²	91	118.9 Å²	118.9	62%	0.615	60%	0.599	S	S	*	*	H	α-helix	trans	-67.3	-36	171.9	-73.6	0	0	0	0	112.3	N1070 L1071 L1072 A1078	N1070-C1074 PolarHBondContact O-N 2.93Å; N1070-C1074 PolarHBondContact O-SG 3.14Å; N1070-C1074 VanDerWaalsContact O-SG 3.38Å; L1071-C1074 PolarHBondContact O-N 2.92Å; L1072-C1074 VanDerWaalsContact C-N 3.29Å; L1072-C1074 PolarHBondContact O-N 2.89Å; C1074-A1078 WeakPolarHBondContact O-CB 3.47Å; C1074-A1078 PolarHBondContact O-N 3.16Å; C1074-A1078 VanDerWaalsContact O-N 3.14Å
1075	F	37.6	Very low	36.5	Very low	150 Å²	150	121.6 Å²	121.6	66%	0.658	61%	0.61	S	S	*	*	H	α-helix	trans	-71.3	-46.9	177.1	-134.2	-101.3	0	0	0	112	L1071 L1072 S1077 A1078 I1079	L1071-F1075 PolarHBondContact O-N 3.1Å; L1072-F1075 CarbonylContact O-C 3.59Å; L1072-F1075 WeakPolarHBondContact O-CA 3.46Å; L1072-F1075 WeakPolarHBondContact O-CB 2.82Å; L1072-F1075 PolarHBondContact O-N 3Å; F1075-S1077 PolarHBondContact O-N 3.3Å; F1075-A1078 WeakPolarHBondContact O-CB 3.45Å; F1075-A1078 PolarHBondContact O-N 3.28Å; F1075-A1078 VanDerWaalsContact O-N 3.15Å; F1075-I1079 HydrophobicContact CD1-CD1 3.71Å; F1075-I1079 HydrophobicContact CD1-CG1 4.49Å; F1075-I1079 HydrophobicContact CE1-CD1 4.13Å; F1075-I1079 WeakPolarHBondContact O-CG1 3.07Å; F1075-I1079 PolarHBondContact O-N 3.46Å
1076	E	39	Very low	36.6	Very low	114 Å²	114	126.2 Å²	126.2	53%	0.533	62%	0.624	S	S	.	*	H	α-helix	trans	-57.6	-47.6	172.8	-68.5	175.5	135.9	0	0	111	L1072 A1078 I1079 H1080	L1072-E1076 WeakPolarHBondContact O-CG 3.42Å; L1072-E1076 PolarHBondContact O-N 2.92Å; E1076-A1078 PolarHBondContact O-N 3.05Å; E1076-I1079 PolarHBondContact O-N 2.81Å; E1076-H1080 VanDerWaalsContact O-CB 3.29Å; E1076-H1080 WeakPolarHBondContact O-CB 3.38Å; E1076-H1080 PolarHBondContact O-N 2.95Å
1077	S	40.7	Very low	36.7	Very low	51 Å²	51	120 Å²	120	36%	0.357	62%	0.622	S	S	.	*	H	α-helix	trans	-69.7	-14.8	179.6	-162.3	0	0	0	0	113.7	R1073 F1075 R1081	R1073-S1077 WeakPolarHBondContact O-CB 3.46Å; R1073-S1077 PolarHBondContact O-N 3.44Å; F1075-S1077 PolarHBondContact O-N 3.3Å; S1077-R1081 PolarHBondContact O-NE 3.17Å; S1077-R1081 PolarHBondContact OG-NH2 3.09Å
1078	A	37.4	Very low	36.7	Very low	56 Å²	56	125.8 Å²	125.8	46%	0.463	64%	0.642	S	S	.	*	H	α-helix	trans	-83.8	-49.8	167.3	0	0	0	0	0	111.2	C1074 F1075 E1076 H1080 R1081 S1082	C1074-A1078 WeakPolarHBondContact O-CB 3.47Å; C1074-A1078 PolarHBondContact O-N 3.16Å; C1074-A1078 VanDerWaalsContact O-N 3.14Å; F1075-A1078 WeakPolarHBondContact O-CB 3.45Å; F1075-A1078 PolarHBondContact O-N 3.28Å; F1075-A1078 VanDerWaalsContact O-N 3.15Å; E1076-A1078 PolarHBondContact O-N 3.05Å; A1078-H1080 VanDerWaalsContact C-N 3.29Å; A1078-H1080 PolarHBondContact O-N 3.49Å; A1078-R1081 PolarHBondContact O-N 2.66Å; A1078-S1082 PolarHBondContact O-N 2.91Å; A1078-S1082 PolarHBondContact O-OG 2.94Å
1079	I	39.3	Very low	36.6	Very low	79 Å²	79	126.8 Å²	126.8	41%	0.405	65%	0.652	S	S	.	*	H	α-helix	trans	-59.9	-39.5	179.3	-70	169.8	0	0	0	111.5	F1075 E1076 R1081 S1082 R1083	F1075-I1079 HydrophobicContact CD1-CD1 3.71Å; F1075-I1079 HydrophobicContact CD1-CG1 4.49Å; F1075-I1079 HydrophobicContact CE1-CD1 4.13Å; F1075-I1079 WeakPolarHBondContact O-CG1 3.07Å; F1075-I1079 PolarHBondContact O-N 3.46Å; E1076-I1079 PolarHBondContact O-N 2.81Å; I1079-R1081 VanDerWaalsContact C-N 3.27Å; I1079-R1081 PolarHBondContact O-N 3.5Å; I1079-S1082 WeakPolarHBondContact CA-OG 3.45Å; I1079-S1082 PolarHBondContact O-N 2.94Å; I1079-S1082 PolarHBondContact O-OG 3.49Å; I1079-R1083 PolarHBondContact O-N 2.99Å
1080	H	38.6	Very low	36.2	Very low	152 Å²	152	127.2 Å²	127.2	70%	0.704	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-17.1	178.1	-145	-53.1	0	0	0	113.3	E1076 A1078	E1076-H1080 VanDerWaalsContact O-CB 3.29Å; E1076-H1080 WeakPolarHBondContact O-CB 3.38Å; E1076-H1080 PolarHBondContact O-N 2.95Å; A1078-H1080 VanDerWaalsContact C-N 3.29Å; A1078-H1080 PolarHBondContact O-N 3.49Å
1081	R	38.6	Very low	36.2	Very low	185 Å²	185	129.7 Å²	129.7	70%	0.698	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-27.6	170.4	-85.1	-176.9	-99.1	-152.4	-7.4	113	S1077 A1078 I1079 R1083	S1077-R1081 PolarHBondContact O-NE 3.17Å; S1077-R1081 PolarHBondContact OG-NH2 3.09Å; A1078-R1081 PolarHBondContact O-N 2.66Å; I1079-R1081 VanDerWaalsContact C-N 3.27Å; I1079-R1081 PolarHBondContact O-N 3.5Å; R1081-R1083 PolarHBondContact O-N 3.14Å
1082	S	35.8	Very low	35.9	Very low	95 Å²	95	133.6 Å²	133.6	66%	0.664	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	-1.9	171.3	53.5	0	0	0	0	114.7	A1078 I1079	A1078-S1082 PolarHBondContact O-N 2.91Å; A1078-S1082 PolarHBondContact O-OG 2.94Å; I1079-S1082 WeakPolarHBondContact CA-OG 3.45Å; I1079-S1082 PolarHBondContact O-N 2.94Å; I1079-S1082 PolarHBondContact O-OG 3.49Å
1083	R	34.8	Very low	35.5	Very low	208 Å²	208	138.8 Å²	138.8	79%	0.785	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	14.5	178.6	-78.7	-176.2	171.3	-171.6	-2.3	114.2	I1079 R1081	I1079-R1083 PolarHBondContact O-N 2.99Å; R1081-R1083 PolarHBondContact O-N 3.14Å
1084	S	35.4	Very low	35	Very low	91 Å²	91	138.9 Å²	138.9	64%	0.636	72%	0.716	S	S	*	*			trans	-138.3	77.7	178.6	-167.2	0	0	0	0	111.3
1085	M	33.9	Very low	34.6	Very low	182 Å²	182	141 Å²	141	90%	0.897	73%	0.725	S	S	*	*			trans	-163.3	116	157	-109.3	-176.1	-69.1	0	0	107.9
1086	D	33.8	Very low	34.1	Very low	171 Å²	171	142.8 Å²	142.8	91%	0.914	73%	0.733	S	S	*	*			trans	-79.5	162.2	-177.6	-60.5	-80.4	0	0	0	113.1
1087	G	32.7	Very low	33.5	Very low	68 Å²	68	146.6 Å²	146.6	70%	0.701	75%	0.751	S	S	*	*			trans	132.3	99.6	152.5	0	0	0	0	0	118.1
1088	Q	35	Very low	32.8	Very low	185 Å²	185	150.6 Å²	150.6	86%	0.864	77%	0.773	S	S	*	*			trans	60.7	94.3	139.4	-56.9	-173.2	3.6	0	0	120.9
1089	N	31.7	Very low	32.2	Very low	161 Å²	161	154.2 Å²	154.2	86%	0.861	79%	0.789	S	S	*	*				59.3	79.5	107.2	-166	32.2	0	0	0	119.3
1090	V	32.1	Very low	31.6	Very low	147 Å²	147	157.8 Å²	157.8	89%	0.891	81%	0.808	S	S	*	*			trans	-131.5	161.2	163.5	-175.6	0	0	0	0	111
1091	N	34.7	Very low	30.8	Very low	152 Å²	152	156.2 Å²	156.2	81%	0.813	81%	0.814	S	S	*	*			trans	-87.9	162.1	-151	-122.9	-46.9	0	0	0	117.4	K1093	N1091-K1093 PolarHBondContact O-N 2.92Å
1092	K	28.3	Very low	30.1	Very low	198 Å²	198	151.5 Å²	151.5	86%	0.861	81%	0.808	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.1	88	-178.1	-65.9	175	-180	174.1	0	113.4
1093	K	31.3	Very low	29.6	Very low	203 Å²	203	157.4 Å²	157.4	88%	0.883	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157	-18	154.1	-117.9	165.2	-174.1	176	0	116.1	N1091	N1091-K1093 PolarHBondContact O-N 2.92Å
1094	E	28.3	Very low	29.3	Very low	178 Å²	178	153.6 Å²	153.6	83%	0.832	81%	0.81	S	S	*	*			trans	-109.8	78.6	-179.4	-66.4	-179.8	140.6	0	0	111.5
1095	V	27.2	Very low	29	Very low	134 Å²	134	156.5 Å²	156.5	81%	0.812	81%	0.813	S	S	*	*			trans	-124.2	53.8	162.2	-165.3	0	0	0	0	109.1
1096	K	27.4	Very low	29	Very low	188 Å²	188	158.1 Å²	158.1	82%	0.817	81%	0.809	S	S	*	*	S	Bend	trans	-120.8	143	157.5	-67.4	-179.9	179.1	178.9	0	105.4
1097	E	26.6	Very low	29.4	Very low	195 Å²	195	152.4 Å²	152.4	91%	0.911	78%	0.783	S	S	*	*	S	Bend	trans	65.2	49.7	179.6	-51.9	-162.6	125.8	0	0	117
1098	V	25	Very low	30.6	Very low	134 Å²	134	154.1 Å²	154.1	81%	0.812	77%	0.772	S	S	*	*			trans	-119.8	49.7	152.7	-162.3	0	0	0	0	110.6
1099	T	26.1	Very low	32.4	Very low	132 Å²	132	148.1 Å²	148.1	81%	0.81	75%	0.748	S	S	*	*	S	Bend	trans	-103.3	119.6	162.9	-54.1	0	0	0	0	107.3	S1101	T1099-S1101 PolarHBondContact O-N 3.29Å
1100	I	25.6	Very low	34.8	Very low	155 Å²	155	140.6 Å²	140.6	80%	0.795	71%	0.708	S	S	*	*			trans	-36.6	115.5	-170.6	-58.4	170.1	0	0	0	112.1	C1102	I1100-C1102 HydrophobicContact CG2-CB 4.08Å; I1100-C1102 PolarHBondContact O-N 2.88Å
1101	S	23.2	Very low	37.4	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	69%	0.689	S	S	*	*			trans	-75	36.4	-176	54.6	0	0	0	0	114.1	T1099 R1103	T1099-S1101 PolarHBondContact O-N 3.29Å; S1101-R1103 PolarHBondContact O-N 3.36Å
1102	C	24.2	Very low	40.1	Very low	85 Å²	85	132.6 Å²	132.6	57%	0.574	65%	0.651	S	S	*	*			trans	-71.9	100.8	173	-161.5	0	0	0	0	109.1	I1100 L1104	I1100-C1102 HydrophobicContact CG2-CB 4.08Å; I1100-C1102 PolarHBondContact O-N 2.88Å; C1102-L1104 HydrophobicContact CB-CD1 4.48Å; C1102-L1104 PolarHBondContact O-N 3.12Å
1103	R	23.8	Very low	42.9	Very low	220 Å²	220	125.3 Å²	125.3	83%	0.83	62%	0.624	S	S	*	*			trans	-69.1	63.3	174.6	-67.5	-177.6	176.7	171.1	-1.1	111.5	S1101 H1105	S1101-R1103 PolarHBondContact O-N 3.36Å; R1103-H1105 PolarHBondContact O-N 2.85Å
1104	L	28	Very low	45.5	Very low	128 Å²	128	123.8 Å²	123.8	67%	0.67	61%	0.613	S	S	*	*			trans	-71.8	78.5	172.5	-80.5	161.8	0	0	0	109.8	C1102 R1106	C1102-L1104 HydrophobicContact CB-CD1 4.48Å; C1102-L1104 PolarHBondContact O-N 3.12Å; L1104-R1106 PolarHBondContact O-N 2.77Å
1105	H	29.9	Very low	48.5	Very low	151 Å²	151	120.3 Å²	120.3	70%	0.699	60%	0.6	S	S	*	*			trans	-56.1	95.7	174.8	-90.1	-99.5	0	0	0	111	R1103 C1107	R1103-H1105 PolarHBondContact O-N 2.85Å; H1105-C1107 VanDerWaalsContact C-N 3.27Å; H1105-C1107 PolarHBondContact O-N 3.32Å
1106	R	33.9	Very low	51.6	Low	216 Å²	216	114.8 Å²	114.8	82%	0.815	57%	0.565	S	S	*	*			trans	43.5	49.5	162.9	-72.1	-175.4	173.1	179.7	-0.7	113.5	L1104 H1108	L1104-R1106 PolarHBondContact O-N 2.77Å; R1106-H1108 VanDerWaalsContact C-N 3.25Å; R1106-H1108 PolarHBondContact O-N 3.46Å; R1106-H1108 PolarHBondContact O-ND1 3.22Å
1107	C	42.5	Very low	54.7	Low	52 Å²	52	111.1 Å²	111.1	35%	0.351	56%	0.558	S	S	.	*			trans	-70.2	78.9	178.8	-60.2	0	0	0	0	110.8	H1105 T1109 I1133	H1105-C1107 VanDerWaalsContact C-N 3.27Å; H1105-C1107 PolarHBondContact O-N 3.32Å; C1107-T1109 PolarHBondContact O-N 3Å; C1107-I1133 HydrophobicContact CB-CG2 3.76Å
1108	H	58.4	Low	57.6	Low	104 Å²	104	103.5 Å²	103.5	48%	0.481	53%	0.529	S	S	.	.			trans	-70.5	125	178.2	-68.3	71	0	0	0	109	R1106 I1134	R1106-H1108 VanDerWaalsContact C-N 3.25Å; R1106-H1108 PolarHBondContact O-N 3.46Å; R1106-H1108 PolarHBondContact O-ND1 3.22Å; H1108-I1134 HydrophobicContact CB-CB 4.41Å; H1108-I1134 HydrophobicContact CB-CD1 4.28Å; H1108-I1134 WeakPolarHBondContact O-CB 3.48Å; H1108-I1134 PolarHBondContact O-N 2.9Å
1109	T	72.4	Confident	60.5	Low	59 Å²	59	105.9 Å²	105.9	36%	0.362	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	142.6	166.3	45.4	0	0	0	0	109.9	C1107 T1165	C1107-T1109 PolarHBondContact O-N 3Å; T1109-T1165 PolarHBondContact O-N 3.06Å
1110	A	81.8	Confident	63.4	Low	2 Å²	2	102 Å²	102	2%	0.017	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	156.9	-179	0	0	0	0	0	110	V1132 I1134 V1162 Q1163	A1110-V1132 HydrophobicContact CB-CG2 3.97Å; A1110-V1132 PolarHBondContact N-O 2.83Å; A1110-V1132 PolarHBondContact O-N 3.23Å; A1110-I1134 HydrophobicContact CB-CD1 4.02Å; A1110-I1134 HydrophobicContact CB-CG1 4.07Å; A1110-V1162 HydrophobicContact CB-CG1 3.56Å; A1110-Q1163 CarbonylContact C-O 3.5Å; A1110-Q1163 VanDerWaalsContact CA-O 3.3Å; A1110-Q1163 WeakPolarHBondContact CA-O 3.47Å; A1110-Q1163 WeakPolarHBondContact CB-O 3.34Å
1111	R	86.3	Confident	66.2	Low	130 Å²	130	106.6 Å²	106.6	49%	0.491	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	141.7	162.5	-88.9	-177.9	166.3	147.9	-0.1	109.8	E1130 Q1163	R1111-E1130 WeakPolarHBondContact CA-O 3.41Å; R1111-Q1163 PolarHBondContact N-O 2.68Å; R1111-Q1163 PolarHBondContact O-N 3.07Å
1112	I	91.3	Very high	69.2	Low	1 Å²	1	106.2 Å²	106.2	1%	0.005	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.8	165.4	-61.2	-56	0	0	0	108	R1114 V1126 V1127 G1129 E1130 V1132 V1157 H1161 V1162	I1112-R1114 WeakPolarHBondContact CG2-O 3.33Å; I1112-V1126 HydrophobicContact CB-CG2 4.46Å; I1112-V1126 HydrophobicContact CD1-CB 4.49Å; I1112-V1126 HydrophobicContact CD1-CG2 3.98Å; I1112-V1126 HydrophobicContact CG1-CB 3.97Å; I1112-V1126 HydrophobicContact CG1-CG1 4.39Å; I1112-V1126 HydrophobicContact CG1-CG2 3.89Å; I1112-V1126 HydrophobicContact CG2-CB 4.28Å; I1112-V1126 HydrophobicContact CG2-CG2 3.8Å; I1112-V1127 WeakPolarHBondContact CB-O 3.49Å; I1112-V1127 WeakPolarHBondContact CG2-O 3.33Å; I1112-G1129 PolarHBondContact O-N 3.22Å; I1112-E1130 HydrophobicContact CB-CB 4.33Å; I1112-E1130 HydrophobicContact CG1-CB 4.29Å; I1112-E1130 PolarHBondContact N-O 3.11Å; I1112-V1132 HydrophobicContact CD1-CG1 3.99Å; I1112-V1132 HydrophobicContact CD1-CG2 3.94Å; I1112-V1132 HydrophobicContact CG1-CG1 3.72Å; I1112-V1132 HydrophobicContact CG1-CG2 4.35Å; I1112-V1157 HydrophobicContact CD1-CG1 4.16Å; I1112-H1161 CarbonylContact C-O 3.58Å; I1112-H1161 VanDerWaalsContact CA-O 3.26Å; I1112-H1161 WeakPolarHBondContact CA-O 3.44Å; I1112-V1162 HydrophobicContact CD1-CG2 3.91Å
1113	C	87.6	Confident	72.5	Confident	45 Å²	45	104.3 Å²	104.3	30%	0.304	49%	0.485	S	S	.	.			trans	-98.3	-12.7	-175.8	62.7	0	0	0	0	113.8	S1128 H1161 Q1163	C1113-S1128 PolarHBondContact O-OG 3.15Å; C1113-H1161 PolarHBondContact N-O 2.87Å; C1113-H1161 VanDerWaalsContact SG-C 3.51Å; C1113-H1161 PolarHBondContact SG-O 3.36Å; C1113-H1161 VanDerWaalsContact SG-O 3.42Å; C1113-Q1163 HydrophobicContact CB-CB 4.21Å
1114	R	86.6	Confident	75.7	Confident	172 Å²	172	94.5 Å²	94.5	65%	0.649	45%	0.448	S	S	*	.	S	Bend	trans	-149.7	146.3	175.2	-66.9	-176.2	-178.3	151.2	1	109.9	I1112	I1112-R1114 WeakPolarHBondContact CG2-O 3.33Å
1115	D	90.9	Very high	78.7	Confident	104 Å²	104	91.4 Å²	91.4	56%	0.556	44%	0.438	S	S	*	.			trans	-56.6	138.7	173.3	-67.8	18.2	0	0	0	111.2	V1127 S1128	D1115-V1127 WeakPolarHBondContact OD1-CA 3.47Å; D1115-S1128 WeakPolarHBondContact OD1-CB 3.44Å; D1115-S1128 PolarHBondContact OD1-N 3.14Å
1116	F	91.8	Very high	81.6	Confident	19 Å²	19	84.4 Å²	84.4	8%	0.083	41%	0.405	C	S	.	.	B	Isolated β-bridge	trans	-138.9	130	175.1	171.9	-103.3	0	0	0	109.8	H1123 L1124 S1125 V1126 W1143 V1157 P1158	F1116-H1123 HydrophobicContact CE1-CB 4.14Å; F1116-H1123 HydrophobicContact CZ-CB 4.3Å; F1116-L1124 VanDerWaalsContact CD1-O 3.27Å; F1116-L1124 WeakPolarHBondContact CD1-O 3.34Å; F1116-S1125 CarbonylContact O-C 3.55Å; F1116-S1125 VanDerWaalsContact O-CA 3.28Å; F1116-S1125 WeakPolarHBondContact O-CA 3.38Å; F1116-V1126 HydrophobicContact CB-CG2 4.02Å; F1116-V1126 HydrophobicContact CD1-CG2 4.48Å; F1116-V1126 PolarHBondContact N-O 3.24Å; F1116-V1126 PolarHBondContact O-N 3.17Å; F1116-V1126 VanDerWaalsContact O-O 3.11Å; F1116-W1143 HydrophobicContact CE1-CZ3 4.11Å; F1116-W1143 HydrophobicContact CE2-CH2 4.13Å; F1116-W1143 HydrophobicContact CE2-CZ3 4.27Å; F1116-W1143 AromaticContact CZ-CH2 3.7Å; F1116-W1143 HydrophobicContact CZ-CH2 3.7Å; F1116-W1143 AromaticContact CZ-CZ3 3.57Å; F1116-W1143 HydrophobicContact CZ-CZ3 3.57Å; F1116-V1157 HydrophobicContact CB-CG1 4.45Å; F1116-V1157 HydrophobicContact CD1-CB 4.39Å; F1116-V1157 HydrophobicContact CD1-CG1 4.11Å; F1116-V1157 HydrophobicContact CD1-CG2 4.13Å; F1116-V1157 HydrophobicContact CG-CG1 4.41Å; F1116-P1158 HydrophobicContact CD2-CG 3.71Å; F1116-P1158 HydrophobicContact CE2-CG 3.52Å; F1116-P1158 HydrophobicContact CG-CG 4.34Å; F1116-P1158 HydrophobicContact CZ-CG 4Å
1117	V	91.9	Very high	84.3	Confident	110 Å²	110	76.4 Å²	76.4	67%	0.667	38%	0.381	S	S	*	.			trans	-105.8	131	179.6	-177.4	0	0	0	0	109.5	K1119	V1117-K1119 PolarHBondContact O-N 3.21Å
1118	A	89	Confident	86.5	Confident	36 Å²	36	77 Å²	77	30%	0.298	39%	0.385	S	S	.	.			trans	-57.5	129.8	178.9	0	0	0	0	0	112.2	H1123 S1125	A1118-H1123 HydrophobicContact CB-CB 3.87Å; A1118-H1123 VanDerWaalsContact CB-O 3.23Å; A1118-H1123 WeakPolarHBondContact CB-O 3.48Å; A1118-S1125 WeakPolarHBondContact CB-OG 3.44Å; A1118-S1125 PolarHBondContact N-OG 2.85Å
1119	K	86.3	Confident	87.6	Confident	184 Å²	184	73.7 Å²	73.7	80%	0.8	38%	0.379	S	S	*	.	S	Bend	trans	-105.4	-3.9	177	-61.9	-171	177.5	-175.2	0	113.8	V1117	V1117-K1119 PolarHBondContact O-N 3.21Å
1120	S	86.3	Confident	88.3	Confident	50 Å²	50	71.3 Å²	71.3	35%	0.35	36%	0.364	S	S	.	.	S	Bend	trans	-151.6	172.1	178.4	77	0	0	0	0	109	D1122 H1123	S1120-D1122 PolarHBondContact O-N 3.15Å; S1120-D1122 PolarHBondContact OG-N 3.44Å; S1120-H1123 PolarHBondContact O-N 3.19Å; S1120-H1123 PolarHBondContact OG-CD2 3.08Å; S1120-H1123 VanDerWaalsContact OG-CG 3.26Å; S1120-H1123 PolarHBondContact OG-N 3.39Å; S1120-H1123 PolarHBondContact OG-NE2 3.22Å
1121	R	83.6	Confident	88.4	Confident	252 Å²	252	72.8 Å²	72.8	95%	0.951	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.7	175	-71.9	-174.9	175.9	-178.2	-0.7	113.6
1122	D	87.1	Confident	88.5	Confident	110 Å²	110	66.6 Å²	66.6	59%	0.588	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-12.2	-177.9	-51.7	-24.3	0	0	0	112.2	S1120 G1155 W1156	S1120-D1122 PolarHBondContact O-N 3.15Å; S1120-D1122 PolarHBondContact OG-N 3.44Å; D1122-G1155 CarbonylContact O-C 3.55Å; D1122-G1155 WeakPolarHBondContact O-CA 3.24Å; D1122-W1156 PolarHBondContact O-N 3.48Å
1123	H	92.4	Very high	88.1	Confident	46 Å²	46	68.6 Å²	68.6	21%	0.213	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-91.3	143.6	-178.1	-62.3	178.7	0	0	0	110.6	F1116 A1118 S1120 W1143 W1156	F1116-H1123 HydrophobicContact CE1-CB 4.14Å; F1116-H1123 HydrophobicContact CZ-CB 4.3Å; A1118-H1123 HydrophobicContact CB-CB 3.87Å; A1118-H1123 VanDerWaalsContact CB-O 3.23Å; A1118-H1123 WeakPolarHBondContact CB-O 3.48Å; S1120-H1123 PolarHBondContact O-N 3.19Å; S1120-H1123 PolarHBondContact OG-CD2 3.08Å; S1120-H1123 VanDerWaalsContact OG-CG 3.26Å; S1120-H1123 PolarHBondContact OG-N 3.39Å; S1120-H1123 PolarHBondContact OG-NE2 3.22Å; H1123-W1143 AromaticContact CD2-CZ3 3.98Å; H1123-W1143 AromaticContact CE1-CH2 3.35Å; H1123-W1143 WeakPolarHBondContact CE1-CH2 3.31Å; H1123-W1143 AromaticContact CE1-CZ2 3.88Å; H1123-W1143 AromaticContact CE1-CZ3 3.87Å; H1123-W1143 AromaticContact CG-CZ3 3.94Å; H1123-W1143 AromaticContact ND1-CH2 3.55Å; H1123-W1143 AromaticContact ND1-CZ3 3.85Å; H1123-W1143 AromaticContact NE2-CH2 3.8Å; H1123-W1143 AromaticContact NE2-CZ3 3.97Å; H1123-W1156 VanDerWaalsContact CA-O 3.31Å; H1123-W1156 WeakPolarHBondContact CA-O 3.41Å
1124	L	91.1	Very high	88.1	Confident	13 Å²	13	67 Å²	67	7%	0.068	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-102.8	122.8	177.6	-174.6	65.1	0	0	0	110.7	F1116 V1126 V1146 R1153 W1156 V1157	F1116-L1124 VanDerWaalsContact CD1-O 3.27Å; F1116-L1124 WeakPolarHBondContact CD1-O 3.34Å; L1124-V1126 HydrophobicContact CD2-CG1 3.91Å; L1124-V1126 HydrophobicContact CG-CG1 3.93Å; L1124-V1146 HydrophobicContact CD2-CG2 4.14Å; L1124-R1153 HydrophobicContact CD1-CB 3.64Å; L1124-W1156 PolarHBondContact N-O 2.84Å; L1124-W1156 VanDerWaalsContact N-O 3.08Å; L1124-V1157 HydrophobicContact CB-CG2 4.09Å; L1124-V1157 WeakPolarHBondContact O-CG2 3.49Å
1125	S	92.6	Very high	87.9	Confident	63 Å²	63	61.7 Å²	61.7	44%	0.441	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-70.3	129.4	168.2	-62.8	0	0	0	0	110	F1116 A1118	F1116-S1125 CarbonylContact O-C 3.55Å; F1116-S1125 VanDerWaalsContact O-CA 3.28Å; F1116-S1125 WeakPolarHBondContact O-CA 3.38Å; A1118-S1125 WeakPolarHBondContact CB-OG 3.44Å; A1118-S1125 PolarHBondContact N-OG 2.85Å
1126	V	90	Very high	87.5	Confident	4 Å²	4	60.9 Å²	60.9	2%	0.024	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-143.7	153.3	-178.4	-69.7	0	0	0	0	110.7	I1112 F1116 L1124 E1130 V1157	I1112-V1126 HydrophobicContact CB-CG2 4.46Å; I1112-V1126 HydrophobicContact CD1-CB 4.49Å; I1112-V1126 HydrophobicContact CD1-CG2 3.98Å; I1112-V1126 HydrophobicContact CG1-CB 3.97Å; I1112-V1126 HydrophobicContact CG1-CG1 4.39Å; I1112-V1126 HydrophobicContact CG1-CG2 3.89Å; I1112-V1126 HydrophobicContact CG2-CB 4.28Å; I1112-V1126 HydrophobicContact CG2-CG2 3.8Å; F1116-V1126 HydrophobicContact CB-CG2 4.02Å; F1116-V1126 HydrophobicContact CD1-CG2 4.48Å; F1116-V1126 PolarHBondContact N-O 3.24Å; F1116-V1126 PolarHBondContact O-N 3.17Å; F1116-V1126 VanDerWaalsContact O-O 3.11Å; L1124-V1126 HydrophobicContact CD2-CG1 3.91Å; L1124-V1126 HydrophobicContact CG-CG1 3.93Å; V1126-E1130 WeakPolarHBondContact CA-OE2 3.35Å; V1126-V1157 HydrophobicContact CG1-CG2 4.22Å; V1126-V1157 HydrophobicContact CG2-CG1 3.97Å; V1126-V1157 HydrophobicContact CG2-CG2 3.84Å
1127	V	89.9	Confident	86.5	Confident	49 Å²	49	65.5 Å²	65.5	30%	0.297	35%	0.352	S	S	.	.			trans	-112.7	160	176	-57.3	0	0	0	0	112.6	I1112 D1115 E1130 R1150	I1112-V1127 WeakPolarHBondContact CB-O 3.49Å; I1112-V1127 WeakPolarHBondContact CG2-O 3.33Å; D1115-V1127 WeakPolarHBondContact OD1-CA 3.47Å; V1127-E1130 HydrophobicContact CG2-CB 4.35Å; V1127-E1130 PolarHBondContact N-OE2 2.81Å; V1127-E1130 WeakPolarHBondContact O-CB 3.21Å; V1127-E1130 PolarHBondContact O-N 3.47Å; V1127-E1130 VanDerWaalsContact O-N 3.11Å; V1127-R1150 VanDerWaalsContact CG2-NH2 3.3Å
1128	S	88.6	Confident	85.3	Confident	63 Å²	63	67.1 Å²	67.1	44%	0.441	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	142.7	176.3	-164.6	0	0	0	0	112.1	C1113 D1115 E1130	C1113-S1128 PolarHBondContact O-OG 3.15Å; D1115-S1128 WeakPolarHBondContact OD1-CB 3.44Å; D1115-S1128 PolarHBondContact OD1-N 3.14Å; S1128-E1130 PolarHBondContact O-N 3.4Å
1129	G	81.6	Confident	83.6	Confident	35 Å²	35	72.6 Å²	72.6	36%	0.361	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-11.2	-172.5	0	0	0	0	0	115.1	I1112 A1131	I1112-G1129 PolarHBondContact O-N 3.22Å; G1129-A1131 PolarHBondContact O-N 2.98Å
1130	E	87.3	Confident	82.2	Confident	9 Å²	9	74 Å²	74	4%	0.042	38%	0.376	C	S	.	.			trans	-63.3	130.2	179.6	-173.5	166	175	0	0	111.6	R1111 I1112 V1126 V1127 S1128 V1132 S1148 R1150	R1111-E1130 WeakPolarHBondContact CA-O 3.41Å; I1112-E1130 HydrophobicContact CB-CB 4.33Å; I1112-E1130 HydrophobicContact CG1-CB 4.29Å; I1112-E1130 PolarHBondContact N-O 3.11Å; V1126-E1130 WeakPolarHBondContact CA-OE2 3.35Å; V1127-E1130 HydrophobicContact CG2-CB 4.35Å; V1127-E1130 PolarHBondContact N-OE2 2.81Å; V1127-E1130 WeakPolarHBondContact O-CB 3.21Å; V1127-E1130 PolarHBondContact O-N 3.47Å; V1127-E1130 VanDerWaalsContact O-N 3.11Å; S1128-E1130 PolarHBondContact O-N 3.4Å; E1130-V1132 HydrophobicContact CG-CG1 4.41Å; E1130-S1148 VanDerWaalsContact OE1-CB 3.32Å; E1130-S1148 WeakPolarHBondContact OE1-CB 3.48Å; E1130-S1148 PolarHBondContact OE1-OG 3.36Å; E1130-R1150 HydrophobicContact CG-CB 4.35Å; E1130-R1150 IonicContact OE2-NH1 3.98Å
1131	A	85.2	Confident	81.1	Confident	34 Å²	34	74.4 Å²	74.4	28%	0.281	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128.9	179.7	0	0	0	0	0	110.5	G1129 L1149	G1129-A1131 PolarHBondContact O-N 2.98Å; A1131-L1149 HydrophobicContact CB-CD1 3.87Å; A1131-L1149 WeakPolarHBondContact O-CB 3.37Å; A1131-L1149 PolarHBondContact O-N 2.92Å; A1131-L1149 VanDerWaalsContact O-N 3.14Å
1132	V	87.5	Confident	81	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	151.5	-176.2	-53.4	0	0	0	0	111.2	A1110 I1112 E1130 V1146 K1147 V1162	A1110-V1132 HydrophobicContact CB-CG2 3.97Å; A1110-V1132 PolarHBondContact N-O 2.83Å; A1110-V1132 PolarHBondContact O-N 3.23Å; I1112-V1132 HydrophobicContact CD1-CG1 3.99Å; I1112-V1132 HydrophobicContact CD1-CG2 3.94Å; I1112-V1132 HydrophobicContact CG1-CG1 3.72Å; I1112-V1132 HydrophobicContact CG1-CG2 4.35Å; E1130-V1132 HydrophobicContact CG-CG1 4.41Å; V1132-V1146 HydrophobicContact CB-CB 4.04Å; V1132-V1146 HydrophobicContact CB-CG2 4.48Å; V1132-V1146 HydrophobicContact CG2-CB 4Å; V1132-V1146 HydrophobicContact CG2-CG1 3.93Å; V1132-K1147 CarbonylContact C-O 3.6Å; V1132-K1147 VanDerWaalsContact CA-O 3.24Å; V1132-K1147 WeakPolarHBondContact CA-O 3.42Å; V1132-K1147 WeakPolarHBondContact CB-O 3.48Å; V1132-V1162 HydrophobicContact CG2-CG1 4.38Å
1133	I	83.7	Confident	81.1	Confident	43 Å²	43	67 Å²	67	22%	0.221	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	126.6	168	-54.3	177	0	0	0	107.9	C1107 L1135 V1146 K1147 L1149	C1107-I1133 HydrophobicContact CB-CG2 3.76Å; I1133-L1135 HydrophobicContact CG2-CD2 4.18Å; I1133-L1135 PolarHBondContact O-N 3.45Å; I1133-V1146 CarbonylContact O-C 3.55Å; I1133-V1146 VanDerWaalsContact O-CA 3.25Å; I1133-V1146 WeakPolarHBondContact O-CA 3.46Å; I1133-K1147 HydrophobicContact CB-CB 4.38Å; I1133-K1147 PolarHBondContact N-O 3.01Å; I1133-K1147 PolarHBondContact O-N 3.33Å; I1133-L1149 HydrophobicContact CD1-CD2 3.82Å; I1133-L1149 HydrophobicContact CG1-CD2 3.85Å; I1133-L1149 HydrophobicContact CG1-CG 4.24Å
1134	I	86.5	Confident	80.8	Confident	11 Å²	11	64.9 Å²	64.9	6%	0.056	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	113.3	167.5	-62.5	179.5	0	0	0	108.1	H1108 A1110 K1137 T1144 V1146 V1162	H1108-I1134 HydrophobicContact CB-CB 4.41Å; H1108-I1134 HydrophobicContact CB-CD1 4.28Å; H1108-I1134 WeakPolarHBondContact O-CB 3.48Å; H1108-I1134 PolarHBondContact O-N 2.9Å; A1110-I1134 HydrophobicContact CB-CD1 4.02Å; A1110-I1134 HydrophobicContact CB-CG1 4.07Å; I1134-K1137 HydrophobicContact CG2-CG 4.17Å; I1134-T1144 HydrophobicContact CB-CG2 4.3Å; I1134-T1144 HydrophobicContact CD1-CG2 4.3Å; I1134-T1144 HydrophobicContact CG1-CG2 3.97Å; I1134-T1144 HydrophobicContact CG2-CG2 3.68Å; I1134-V1146 HydrophobicContact CG1-CG1 4.39Å; I1134-V1162 HydrophobicContact CD1-CG1 3.93Å; I1134-V1162 HydrophobicContact CG1-CG1 4.07Å
1135	L	83.5	Confident	80.8	Confident	61 Å²	61	66 Å²	66	32%	0.319	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-40.7	176.2	-61.7	-178.3	0	0	0	111.5	I1133 L1145 K1147 E1154	I1133-L1135 HydrophobicContact CG2-CD2 4.18Å; I1133-L1135 PolarHBondContact O-N 3.45Å; L1135-L1145 HydrophobicContact CB-CD2 4.11Å; L1135-L1145 HydrophobicContact CB-CG 4.1Å; L1135-L1145 HydrophobicContact CD1-CD2 4.44Å; L1135-L1145 HydrophobicContact CD1-CG 4.33Å; L1135-L1145 PolarHBondContact N-O 2.86Å; L1135-K1147 HydrophobicContact CD1-CB 4.02Å; L1135-K1147 HydrophobicContact CD2-CB 4.29Å; L1135-K1147 HydrophobicContact CG-CB 4.15Å; L1135-E1154 HydrophobicContact CD1-CB 4.21Å; L1135-E1154 VanDerWaalsContact CD1-CD 3.44Å; L1135-E1154 HydrophobicContact CD1-CG 3.69Å; L1135-E1154 WeakPolarHBondContact CD1-OE2 3.49Å
1136	N	80.8	Confident	80.7	Confident	87 Å²	87	63 Å²	63	47%	0.465	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	150.8	178.6	-160.7	-6.2	0	0	0	110.9	L1145	N1136-L1145 HydrophobicContact CB-CB 3.97Å; N1136-L1145 HydrophobicContact CB-CD2 4.1Å; N1136-L1145 PolarHBondContact N-O 3.03Å; N1136-L1145 PolarHBondContact O-N 3.49Å
1137	K	71.8	Confident	80.7	Confident	116 Å²	116	65.3 Å²	65.3	50%	0.504	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	121.3	164.5	-73.9	-173.3	174.5	-169.4	0	107.1	I1134 D1139 T1144	I1134-K1137 HydrophobicContact CG2-CG 4.17Å; K1137-D1139 PolarHBondContact O-N 2.9Å; K1137-D1139 VanDerWaalsContact O-N 3.16Å; K1137-T1144 HydrophobicContact CG-CG2 3.98Å
1138	R	66.9	Low	80.6	Confident	144 Å²	144	63 Å²	63	54%	0.543	32%	0.321	S	S	.	.			trans	-72.9	109	173.2	-106.6	174.8	176.6	175.3	0.5	108.3	K1140 T1141 W1143 W1156	R1138-K1140 PolarHBondContact O-N 3.44Å; R1138-T1141 WeakPolarHBondContact CB-OG1 3.48Å; R1138-T1141 PolarHBondContact O-N 3Å; R1138-T1141 VanDerWaalsContact O-N 3.15Å; R1138-T1141 VanDerWaalsContact O-O 3.09Å; R1138-W1143 PolarHBondContact N-O 3.28Å; R1138-W1156 HydrophobicContact CB-CH2 4.15Å; R1138-W1156 HydrophobicContact CB-CZ3 3.97Å; R1138-W1156 HydrophobicContact CG-CH2 3.57Å; R1138-W1156 HydrophobicContact CG-CZ2 4.4Å; R1138-W1156 HydrophobicContact CG-CZ3 3.89Å
1139	D	51.9	Low	80.3	Confident	150 Å²	150	63.3 Å²	63.3	80%	0.802	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.2	135.8	165.7	-70.3	-40.8	0	0	0	109.6	K1137 T1141	K1137-D1139 PolarHBondContact O-N 2.9Å; K1137-D1139 VanDerWaalsContact O-N 3.16Å; D1139-T1141 PolarHBondContact O-N 3.29Å
1140	K	58.4	Low	80.2	Confident	213 Å²	213	65.8 Å²	65.8	93%	0.926	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.1	12.3	-175.8	-47.7	-179.2	-178.8	-179.9	0	117.3	R1138	R1138-K1140 PolarHBondContact O-N 3.44Å
1141	T	61.9	Low	80.1	Confident	60 Å²	60	68.5 Å²	68.5	37%	0.368	33%	0.333	S	S	.	.	S	Bend	trans	-135.4	143	165.6	73.7	0	0	0	0	111.8	R1138 D1139 W1143	R1138-T1141 WeakPolarHBondContact CB-OG1 3.48Å; R1138-T1141 PolarHBondContact O-N 3Å; R1138-T1141 VanDerWaalsContact O-N 3.15Å; R1138-T1141 VanDerWaalsContact O-O 3.09Å; D1139-T1141 PolarHBondContact O-N 3.29Å; T1141-W1143 PolarHBondContact O-N 3.41Å
1142	D	81.6	Confident	80.1	Confident	132 Å²	132	72.2 Å²	72.2	71%	0.706	35%	0.345	S	S	*	.	S	Bend	trans	-72.1	42.8	176.4	-70.5	-53.1	0	0	0	113.7	P1158 A1159	D1142-P1158 CarbonylContact O-C 3.48Å; D1142-P1158 WeakPolarHBondContact O-CA 3.28Å; D1142-A1159 PolarHBondContact O-N 3.31Å
1143	W	89.1	Confident	80.1	Confident	73 Å²	73	80.9 Å²	80.9	28%	0.277	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	129.5	-177.2	-66.5	90	0	0	0	111.2	F1116 H1123 R1138 T1141 W1156 P1158	F1116-W1143 HydrophobicContact CE1-CZ3 4.11Å; F1116-W1143 HydrophobicContact CE2-CH2 4.13Å; F1116-W1143 HydrophobicContact CE2-CZ3 4.27Å; F1116-W1143 AromaticContact CZ-CH2 3.7Å; F1116-W1143 HydrophobicContact CZ-CH2 3.7Å; F1116-W1143 AromaticContact CZ-CZ3 3.57Å; F1116-W1143 HydrophobicContact CZ-CZ3 3.57Å; H1123-W1143 AromaticContact CD2-CZ3 3.98Å; H1123-W1143 AromaticContact CE1-CH2 3.35Å; H1123-W1143 WeakPolarHBondContact CE1-CH2 3.31Å; H1123-W1143 AromaticContact CE1-CZ2 3.88Å; H1123-W1143 AromaticContact CE1-CZ3 3.87Å; H1123-W1143 AromaticContact CG-CZ3 3.94Å; H1123-W1143 AromaticContact ND1-CH2 3.55Å; H1123-W1143 AromaticContact ND1-CZ3 3.85Å; H1123-W1143 AromaticContact NE2-CH2 3.8Å; H1123-W1143 AromaticContact NE2-CZ3 3.97Å; R1138-W1143 PolarHBondContact N-O 3.28Å; T1141-W1143 PolarHBondContact O-N 3.41Å; W1143-W1156 HydrophobicContact CB-CE3 3.77Å; W1143-W1156 HydrophobicContact CB-CZ3 4.46Å; W1143-W1156 HydrophobicContact CE3-CB 3.76Å; W1143-W1156 HydrophobicContact CZ3-CB 4.39Å; W1143-P1158 HydrophobicContact CE3-CB 4.47Å; W1143-P1158 HydrophobicContact CE3-CG 4.07Å; W1143-P1158 HydrophobicContact CH2-CG 3.83Å; W1143-P1158 HydrophobicContact CZ2-CG 4.36Å; W1143-P1158 HydrophobicContact CZ3-CG 3.68Å
1144	T	87.7	Confident	80.5	Confident	3 Å²	3	83.9 Å²	83.9	2%	0.018	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	127.7	174.6	-58	0	0	0	0	108.5	I1134 K1137 V1146 V1157	I1134-T1144 HydrophobicContact CB-CG2 4.3Å; I1134-T1144 HydrophobicContact CD1-CG2 4.3Å; I1134-T1144 HydrophobicContact CG1-CG2 3.97Å; I1134-T1144 HydrophobicContact CG2-CG2 3.68Å; K1137-T1144 HydrophobicContact CG-CG2 3.98Å; T1144-V1146 HydrophobicContact CG2-CG1 3.63Å; T1144-V1146 PolarHBondContact O-N 3.39Å; T1144-V1157 PolarHBondContact N-O 3.35Å; T1144-V1157 PolarHBondContact O-N 3.37Å
1145	L	90.7	Very high	80.6	Confident	36 Å²	36	83.6 Å²	83.6	19%	0.188	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	118.2	170.5	-179.2	66.7	0	0	0	107.4	L1135 N1136 W1156	L1135-L1145 HydrophobicContact CB-CD2 4.11Å; L1135-L1145 HydrophobicContact CB-CG 4.1Å; L1135-L1145 HydrophobicContact CD1-CD2 4.44Å; L1135-L1145 HydrophobicContact CD1-CG 4.33Å; L1135-L1145 PolarHBondContact N-O 2.86Å; N1136-L1145 HydrophobicContact CB-CB 3.97Å; N1136-L1145 HydrophobicContact CB-CD2 4.1Å; N1136-L1145 PolarHBondContact N-O 3.03Å; N1136-L1145 PolarHBondContact O-N 3.49Å; L1145-W1156 HydrophobicContact CB-CD2 4.1Å; L1145-W1156 HydrophobicContact CB-CE3 3.84Å; L1145-W1156 HydrophobicContact CB-CH2 3.75Å; L1145-W1156 HydrophobicContact CB-CZ2 4.02Å; L1145-W1156 HydrophobicContact CB-CZ3 3.68Å; L1145-W1156 HydrophobicContact CD1-CD2 4.24Å; L1145-W1156 HydrophobicContact CD1-CG 4.44Å; L1145-W1156 HydrophobicContact CD1-CZ2 4.38Å; L1145-W1156 HydrophobicContact CD2-CZ2 4.44Å; L1145-W1156 VanDerWaalsContact N-CE3 3.31Å
1146	V	90.7	Very high	81.1	Confident	0 Å²	0	82.6 Å²	82.6	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.1	-176.6	-62.1	0	0	0	0	111.5	L1124 V1132 I1133 I1134 T1144 E1154 G1155 V1157 V1162	L1124-V1146 HydrophobicContact CD2-CG2 4.14Å; V1132-V1146 HydrophobicContact CB-CB 4.04Å; V1132-V1146 HydrophobicContact CB-CG2 4.48Å; V1132-V1146 HydrophobicContact CG2-CB 4Å; V1132-V1146 HydrophobicContact CG2-CG1 3.93Å; I1133-V1146 CarbonylContact O-C 3.55Å; I1133-V1146 VanDerWaalsContact O-CA 3.25Å; I1133-V1146 WeakPolarHBondContact O-CA 3.46Å; I1134-V1146 HydrophobicContact CG1-CG1 4.39Å; T1144-V1146 HydrophobicContact CG2-CG1 3.63Å; T1144-V1146 PolarHBondContact O-N 3.39Å; V1146-E1154 WeakPolarHBondContact O-CA 3.36Å; V1146-G1155 PolarHBondContact N-O 3.48Å; V1146-G1155 PolarHBondContact O-N 3.08Å; V1146-V1157 HydrophobicContact CG2-CB 3.96Å; V1146-V1157 HydrophobicContact CG2-CG2 3.47Å; V1146-V1157 VanDerWaalsContact CG2-CG2 3.47Å; V1146-V1162 HydrophobicContact CG1-CG1 4.33Å; V1146-V1162 HydrophobicContact CG1-CG2 4.28Å
1147	K	89.6	Confident	81.6	Confident	52 Å²	52	78.4 Å²	78.4	23%	0.226	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	120.3	165.9	-166.8	164.2	-164	149.7	0	109.3	V1132 I1133 L1135 L1149 Q1152 R1153 E1154	V1132-K1147 CarbonylContact C-O 3.6Å; V1132-K1147 VanDerWaalsContact CA-O 3.24Å; V1132-K1147 WeakPolarHBondContact CA-O 3.42Å; V1132-K1147 WeakPolarHBondContact CB-O 3.48Å; I1133-K1147 HydrophobicContact CB-CB 4.38Å; I1133-K1147 PolarHBondContact N-O 3.01Å; I1133-K1147 PolarHBondContact O-N 3.33Å; L1135-K1147 HydrophobicContact CD1-CB 4.02Å; L1135-K1147 HydrophobicContact CD2-CB 4.29Å; L1135-K1147 HydrophobicContact CG-CB 4.15Å; K1147-L1149 PolarHBondContact O-N 3.3Å; K1147-Q1152 VanDerWaalsContact CE-O 3.22Å; K1147-Q1152 WeakPolarHBondContact CE-O 3.46Å; K1147-R1153 WeakPolarHBondContact CA-O 3.33Å; K1147-E1154 HydrophobicContact CB-CG 3.94Å; K1147-E1154 HydrophobicContact CD-CG 3.81Å; K1147-E1154 WeakPolarHBondContact CD-OE1 3.28Å; K1147-E1154 VanDerWaalsContact CE-OE1 3.32Å; K1147-E1154 WeakPolarHBondContact CE-OE1 3.37Å; K1147-E1154 HydrophobicContact CG-CG 3.7Å; K1147-E1154 IonicContact NZ-OE1 3.95Å; K1147-E1154 PolarHBondContact NZ-OE1 3.48Å
1148	S	87.8	Confident	82.4	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	122.8	172	158.5	0	0	0	0	109.6	E1130 R1150 T1151 Q1152 R1153	E1130-S1148 VanDerWaalsContact OE1-CB 3.32Å; E1130-S1148 WeakPolarHBondContact OE1-CB 3.48Å; E1130-S1148 PolarHBondContact OE1-OG 3.36Å; S1148-R1150 PolarHBondContact O-N 3.2Å; S1148-R1150 PolarHBondContact OG-N 2.9Å; S1148-T1151 WeakPolarHBondContact CB-OG1 3.3Å; S1148-T1151 PolarHBondContact OG-N 2.87Å; S1148-T1151 PolarHBondContact OG-OG1 3.48Å; S1148-Q1152 WeakPolarHBondContact O-CA 3.33Å; S1148-Q1152 PolarHBondContact O-N 3.03Å; S1148-R1153 PolarHBondContact N-O 3.49Å
1149	L	81.4	Confident	83.4	Confident	70 Å²	70	68.7 Å²	68.7	37%	0.366	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-18.8	174.7	-69.6	169.8	0	0	0	112.2	A1131 I1133 K1147 Q1152	A1131-L1149 HydrophobicContact CB-CD1 3.87Å; A1131-L1149 WeakPolarHBondContact O-CB 3.37Å; A1131-L1149 PolarHBondContact O-N 2.92Å; A1131-L1149 VanDerWaalsContact O-N 3.14Å; I1133-L1149 HydrophobicContact CD1-CD2 3.82Å; I1133-L1149 HydrophobicContact CG1-CD2 3.85Å; I1133-L1149 HydrophobicContact CG1-CG 4.24Å; K1147-L1149 PolarHBondContact O-N 3.3Å; L1149-Q1152 PolarHBondContact O-NE2 3.29Å
1150	R	80.2	Confident	85	Confident	87 Å²	87	64.5 Å²	64.5	33%	0.328	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-33.3	-172.8	163.6	175.2	164.1	178.5	-5.4	113.6	Y1062 V1127 E1130 S1148	Y1062-R1150 HydrophobicContact CD1-CG 4.19Å; Y1062-R1150 HydrophobicContact CE1-CG 3.88Å; Y1062-R1150 VanDerWaalsContact CZ-NE 3.33Å; Y1062-R1150 VanDerWaalsContact CZ-NH2 3.32Å; V1127-R1150 VanDerWaalsContact CG2-NH2 3.3Å; E1130-R1150 HydrophobicContact CG-CB 4.35Å; E1130-R1150 IonicContact OE2-NH1 3.98Å; S1148-R1150 PolarHBondContact O-N 3.2Å; S1148-R1150 PolarHBondContact OG-N 2.9Å
1151	T	85.2	Confident	86.5	Confident	66 Å²	66	56.5 Å²	56.5	41%	0.405	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	-11.2	176.6	66.5	0	0	0	0	113.4	S1148 R1153	S1148-T1151 WeakPolarHBondContact CB-OG1 3.3Å; S1148-T1151 PolarHBondContact OG-N 2.87Å; S1148-T1151 PolarHBondContact OG-OG1 3.48Å; T1151-R1153 PolarHBondContact O-N 3.43Å; T1151-R1153 PolarHBondContact OG1-N 2.95Å
1152	Q	84.8	Confident	87.7	Confident	113 Å²	113	54.3 Å²	54.3	53%	0.528	28%	0.275	S	S	.	.			trans	56.8	7.3	-172.3	-64.8	-63.6	-36.3	0	0	115.2	K1147 S1148 L1149	K1147-Q1152 VanDerWaalsContact CE-O 3.22Å; K1147-Q1152 WeakPolarHBondContact CE-O 3.46Å; S1148-Q1152 WeakPolarHBondContact O-CA 3.33Å; S1148-Q1152 PolarHBondContact O-N 3.03Å; L1149-Q1152 PolarHBondContact O-NE2 3.29Å
1153	R	88.1	Confident	87.7	Confident	182 Å²	182	54 Å²	54	69%	0.687	27%	0.27	S	S	*	.			trans	-81.7	152.2	173.1	-66.8	-173.5	178.7	-162.6	-0.3	111.2	L1124 K1147 S1148 T1151	L1124-R1153 HydrophobicContact CD1-CB 3.64Å; K1147-R1153 WeakPolarHBondContact CA-O 3.33Å; S1148-R1153 PolarHBondContact N-O 3.49Å; T1151-R1153 PolarHBondContact O-N 3.43Å; T1151-R1153 PolarHBondContact OG1-N 2.95Å
1154	E	91	Very high	86.6	Confident	106 Å²	106	53 Å²	53	50%	0.495	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	145.2	176.7	-62.4	177.4	-163.1	0	0	109.1	L1135 V1146 K1147	L1135-E1154 HydrophobicContact CD1-CB 4.21Å; L1135-E1154 VanDerWaalsContact CD1-CD 3.44Å; L1135-E1154 HydrophobicContact CD1-CG 3.69Å; L1135-E1154 WeakPolarHBondContact CD1-OE2 3.49Å; V1146-E1154 WeakPolarHBondContact O-CA 3.36Å; K1147-E1154 HydrophobicContact CB-CG 3.94Å; K1147-E1154 HydrophobicContact CD-CG 3.81Å; K1147-E1154 WeakPolarHBondContact CD-OE1 3.28Å; K1147-E1154 VanDerWaalsContact CE-OE1 3.32Å; K1147-E1154 WeakPolarHBondContact CE-OE1 3.37Å; K1147-E1154 HydrophobicContact CG-CG 3.7Å; K1147-E1154 IonicContact NZ-OE1 3.95Å; K1147-E1154 PolarHBondContact NZ-OE1 3.48Å
1155	G	90.4	Very high	85.1	Confident	5 Å²	5	55.8 Å²	55.8	5%	0.052	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.9	173.3	174.9	0	0	0	0	0	112.8	D1122 V1146	D1122-G1155 CarbonylContact O-C 3.55Å; D1122-G1155 WeakPolarHBondContact O-CA 3.24Å; V1146-G1155 PolarHBondContact N-O 3.48Å; V1146-G1155 PolarHBondContact O-N 3.08Å
1156	W	92.3	Very high	82.6	Confident	39 Å²	39	60.7 Å²	60.7	15%	0.148	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.2	-176	-61.8	94.3	0	0	0	111.5	D1122 H1123 L1124 R1138 W1143 L1145	D1122-W1156 PolarHBondContact O-N 3.48Å; H1123-W1156 VanDerWaalsContact CA-O 3.31Å; H1123-W1156 WeakPolarHBondContact CA-O 3.41Å; L1124-W1156 PolarHBondContact N-O 2.84Å; L1124-W1156 VanDerWaalsContact N-O 3.08Å; R1138-W1156 HydrophobicContact CB-CH2 4.15Å; R1138-W1156 HydrophobicContact CB-CZ3 3.97Å; R1138-W1156 HydrophobicContact CG-CH2 3.57Å; R1138-W1156 HydrophobicContact CG-CZ2 4.4Å; R1138-W1156 HydrophobicContact CG-CZ3 3.89Å; W1143-W1156 HydrophobicContact CB-CE3 3.77Å; W1143-W1156 HydrophobicContact CB-CZ3 4.46Å; W1143-W1156 HydrophobicContact CE3-CB 3.76Å; W1143-W1156 HydrophobicContact CZ3-CB 4.39Å; L1145-W1156 HydrophobicContact CB-CD2 4.1Å; L1145-W1156 HydrophobicContact CB-CE3 3.84Å; L1145-W1156 HydrophobicContact CB-CH2 3.75Å; L1145-W1156 HydrophobicContact CB-CZ2 4.02Å; L1145-W1156 HydrophobicContact CB-CZ3 3.68Å; L1145-W1156 HydrophobicContact CD1-CD2 4.24Å; L1145-W1156 HydrophobicContact CD1-CG 4.44Å; L1145-W1156 HydrophobicContact CD1-CZ2 4.38Å; L1145-W1156 HydrophobicContact CD2-CZ2 4.44Å; L1145-W1156 VanDerWaalsContact N-CE3 3.31Å
1157	V	91.7	Very high	80	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.2	172.4	175.4	0	0	0	0	107.7	I1112 F1116 L1124 V1126 T1144 V1146 A1159 H1161 V1162	I1112-V1157 HydrophobicContact CD1-CG1 4.16Å; F1116-V1157 HydrophobicContact CB-CG1 4.45Å; F1116-V1157 HydrophobicContact CD1-CB 4.39Å; F1116-V1157 HydrophobicContact CD1-CG1 4.11Å; F1116-V1157 HydrophobicContact CD1-CG2 4.13Å; F1116-V1157 HydrophobicContact CG-CG1 4.41Å; L1124-V1157 HydrophobicContact CB-CG2 4.09Å; L1124-V1157 WeakPolarHBondContact O-CG2 3.49Å; V1126-V1157 HydrophobicContact CG1-CG2 4.22Å; V1126-V1157 HydrophobicContact CG2-CG1 3.97Å; V1126-V1157 HydrophobicContact CG2-CG2 3.84Å; T1144-V1157 PolarHBondContact N-O 3.35Å; T1144-V1157 PolarHBondContact O-N 3.37Å; V1146-V1157 HydrophobicContact CG2-CB 3.96Å; V1146-V1157 HydrophobicContact CG2-CG2 3.47Å; V1146-V1157 VanDerWaalsContact CG2-CG2 3.47Å; V1157-A1159 PolarHBondContact O-N 2.9Å; V1157-H1161 HydrophobicContact CG1-CB 3.96Å; V1157-V1162 HydrophobicContact CB-CG2 4.22Å; V1157-V1162 HydrophobicContact CG1-CG2 3.84Å
1158	P	90	Very high	77.4	Confident	21 Å²	21	64.6 Å²	64.6	14%	0.136	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	136.9	-177.4	-16	28	0	0	0	110.8	F1116 D1142 W1143 G1160 H1161	F1116-P1158 HydrophobicContact CD2-CG 3.71Å; F1116-P1158 HydrophobicContact CE2-CG 3.52Å; F1116-P1158 HydrophobicContact CG-CG 4.34Å; F1116-P1158 HydrophobicContact CZ-CG 4Å; D1142-P1158 CarbonylContact O-C 3.48Å; D1142-P1158 WeakPolarHBondContact O-CA 3.28Å; W1143-P1158 HydrophobicContact CE3-CB 4.47Å; W1143-P1158 HydrophobicContact CE3-CG 4.07Å; W1143-P1158 HydrophobicContact CH2-CG 3.83Å; W1143-P1158 HydrophobicContact CZ2-CG 4.36Å; W1143-P1158 HydrophobicContact CZ3-CG 3.68Å; P1158-G1160 PolarHBondContact O-N 2.74Å; P1158-G1160 VanDerWaalsContact O-N 3.1Å; P1158-H1161 WeakPolarHBondContact O-CB 3.08Å; P1158-H1161 PolarHBondContact O-N 2.98Å
1159	A	86.4	Confident	75	Confident	35 Å²	35	70.6 Å²	70.6	29%	0.289	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-56.4	-34.8	-170.7	0	0	0	0	0	113.2	D1142 V1157 H1161 V1162	D1142-A1159 PolarHBondContact O-N 3.31Å; V1157-A1159 PolarHBondContact O-N 2.9Å; A1159-H1161 PolarHBondContact O-N 3.41Å; A1159-H1161 VanDerWaalsContact O-N 3.16Å; A1159-V1162 PolarHBondContact O-N 3.38Å
1160	G	85.6	Confident	72.8	Confident	61 Å²	61	71.8 Å²	71.8	63%	0.629	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-66.6	-6.3	174.7	0	0	0	0	0	115.9	P1158	P1158-G1160 PolarHBondContact O-N 2.74Å; P1158-G1160 VanDerWaalsContact O-N 3.1Å
1161	H	90.9	Very high	70.8	Confident	45 Å²	45	74.4 Å²	74.4	21%	0.208	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-99.6	-3.9	172	-58.9	63.5	0	0	0	112.1	I1112 C1113 V1157 P1158 A1159	I1112-H1161 CarbonylContact C-O 3.58Å; I1112-H1161 VanDerWaalsContact CA-O 3.26Å; I1112-H1161 WeakPolarHBondContact CA-O 3.44Å; C1113-H1161 PolarHBondContact N-O 2.87Å; C1113-H1161 VanDerWaalsContact SG-C 3.51Å; C1113-H1161 PolarHBondContact SG-O 3.36Å; C1113-H1161 VanDerWaalsContact SG-O 3.42Å; V1157-H1161 HydrophobicContact CG1-CB 3.96Å; P1158-H1161 WeakPolarHBondContact O-CB 3.08Å; P1158-H1161 PolarHBondContact O-N 2.98Å; A1159-H1161 PolarHBondContact O-N 3.41Å; A1159-H1161 VanDerWaalsContact O-N 3.16Å
1162	V	86.9	Confident	68.5	Low	15 Å²	15	78.5 Å²	78.5	9%	0.091	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	96	-171.8	-172.6	0	0	0	0	110.8	A1110 I1112 V1132 I1134 V1146 V1157 A1159 A1164	A1110-V1162 HydrophobicContact CB-CG1 3.56Å; I1112-V1162 HydrophobicContact CD1-CG2 3.91Å; V1132-V1162 HydrophobicContact CG2-CG1 4.38Å; I1134-V1162 HydrophobicContact CD1-CG1 3.93Å; I1134-V1162 HydrophobicContact CG1-CG1 4.07Å; V1146-V1162 HydrophobicContact CG1-CG1 4.33Å; V1146-V1162 HydrophobicContact CG1-CG2 4.28Å; V1157-V1162 HydrophobicContact CB-CG2 4.22Å; V1157-V1162 HydrophobicContact CG1-CG2 3.84Å; A1159-V1162 PolarHBondContact O-N 3.38Å; V1162-A1164 PolarHBondContact O-N 3.12Å
1163	Q	81.8	Confident	66.6	Low	126 Å²	126	77.3 Å²	77.3	59%	0.589	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	106.9	176.6	-172.6	173.5	3.5	0	0	110.1	A1110 R1111 C1113 T1165	A1110-Q1163 CarbonylContact C-O 3.5Å; A1110-Q1163 VanDerWaalsContact CA-O 3.3Å; A1110-Q1163 WeakPolarHBondContact CA-O 3.47Å; A1110-Q1163 WeakPolarHBondContact CB-O 3.34Å; R1111-Q1163 PolarHBondContact N-O 2.68Å; R1111-Q1163 PolarHBondContact O-N 3.07Å; C1113-Q1163 HydrophobicContact CB-CB 4.21Å; Q1163-T1165 PolarHBondContact O-N 3.39Å
1164	A	65.5	Low	64.4	Low	51 Å²	51	73 Å²	73	42%	0.421	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	123.6	177.5	0	0	0	0	0	110.9	V1162	V1162-A1164 PolarHBondContact O-N 3.12Å
1165	T	56	Low	62	Low	61 Å²	61	73.3 Å²	73.3	37%	0.374	42%	0.416	S	S	.	.			trans	-91.8	118.1	179.9	-44.2	0	0	0	0	108.3	T1109 Q1163 V1167	T1109-T1165 PolarHBondContact O-N 3.06Å; Q1163-T1165 PolarHBondContact O-N 3.39Å; T1165-V1167 HydrophobicContact CG2-CG2 3.98Å; T1165-V1167 PolarHBondContact O-N 3.4Å
1166	V	38.4	Very low	59.7	Low	140 Å²	140	77.8 Å²	77.8	85%	0.848	44%	0.439	S	S	*	.			trans	-76.9	76	170.6	-173.8	0	0	0	0	108.6	S1168	V1166-S1168 PolarHBondContact O-N 2.75Å
1167	V	35.9	Very low	57.5	Low	85 Å²	85	80.2 Å²	80.2	52%	0.515	46%	0.458	S	S	.	.			trans	-68.2	109.5	161.1	-176.1	0	0	0	0	105.9	T1165 L1169	T1165-V1167 HydrophobicContact CG2-CG2 3.98Å; T1165-V1167 PolarHBondContact O-N 3.4Å; V1167-L1169 PolarHBondContact O-N 2.81Å
1168	S	34.3	Very low	55.3	Low	48 Å²	48	85.5 Å²	85.5	34%	0.336	48%	0.481	S	S	.	.			trans	-62	129.2	173.9	114.9	0	0	0	0	108	V1166 D1170 H1171	V1166-S1168 PolarHBondContact O-N 2.75Å; S1168-D1170 VanDerWaalsContact CB-OD2 3.25Å; S1168-D1170 WeakPolarHBondContact CB-OD2 3.48Å; S1168-D1170 PolarHBondContact O-N 3.03Å; S1168-D1170 VanDerWaalsContact O-N 3.1Å; S1168-D1170 WeakPolarHBondContact OG-CB 3.06Å; S1168-D1170 PolarHBondContact OG-N 3.22Å; S1168-D1170 PolarHBondContact OG-OD2 2.74Å; S1168-H1171 PolarHBondContact O-N 2.6Å
1169	L	37.4	Very low	53.1	Low	126 Å²	126	90.4 Å²	90.4	66%	0.66	50%	0.502	S	S	*	.	H	α-helix	trans	-61.1	-22	-179.6	-115.2	103.4	0	0	0	111.3	V1167 H1171 F1172 L1173	V1167-L1169 PolarHBondContact O-N 2.81Å; L1169-H1171 VanDerWaalsContact C-N 3.27Å; L1169-H1171 PolarHBondContact O-N 3.32Å; L1169-F1172 PolarHBondContact O-N 3.49Å; L1169-F1172 VanDerWaalsContact O-N 3.15Å; L1169-L1173 HydrophobicContact CB-CD1 4.34Å; L1169-L1173 HydrophobicContact CD2-CD1 4.07Å; L1169-L1173 WeakPolarHBondContact O-CB 3.37Å; L1169-L1173 PolarHBondContact O-N 2.72Å
1170	D	35.5	Very low	51.3	Low	95 Å²	95	92.9 Å²	92.9	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-59.7	-33.1	-179.3	-37.1	-72.8	0	0	0	112.3	S1168 T1174	S1168-D1170 VanDerWaalsContact CB-OD2 3.25Å; S1168-D1170 WeakPolarHBondContact CB-OD2 3.48Å; S1168-D1170 PolarHBondContact O-N 3.03Å; S1168-D1170 VanDerWaalsContact O-N 3.1Å; S1168-D1170 WeakPolarHBondContact OG-CB 3.06Å; S1168-D1170 PolarHBondContact OG-N 3.22Å; S1168-D1170 PolarHBondContact OG-OD2 2.74Å; D1170-T1174 WeakPolarHBondContact O-CA 3.19Å; D1170-T1174 WeakPolarHBondContact O-CB 3.39Å; D1170-T1174 PolarHBondContact O-N 3.49Å; D1170-T1174 PolarHBondContact O-OG1 2.93Å
1171	H	38.2	Very low	49.2	Very low	143 Å²	143	92.2 Å²	92.2	66%	0.662	50%	0.502	S	S	*	.	H	α-helix	trans	-69.2	-43.5	174.3	-98	81.1	0	0	0	112.3	S1168 L1169 T1174 L1175	S1168-H1171 PolarHBondContact O-N 2.6Å; L1169-H1171 VanDerWaalsContact C-N 3.27Å; L1169-H1171 PolarHBondContact O-N 3.32Å; H1171-T1174 PolarHBondContact O-N 2.86Å; H1171-L1175 WeakPolarHBondContact O-CG 3.44Å; H1171-L1175 PolarHBondContact O-N 3.44Å
1172	F	37.7	Very low	47	Very low	152 Å²	152	92.8 Å²	92.8	67%	0.667	51%	0.509	S	S	*	.	H	α-helix	trans	-73.8	-37	-179.6	-153.3	-91	0	0	0	111.7	L1169 L1176	L1169-F1172 PolarHBondContact O-N 3.49Å; L1169-F1172 VanDerWaalsContact O-N 3.15Å; F1172-L1176 WeakPolarHBondContact O-CB 3.15Å; F1172-L1176 PolarHBondContact O-N 3.03Å
1173	L	43.7	Very low	44.8	Very low	88 Å²	88	98.7 Å²	98.7	46%	0.461	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-41.8	169.5	-87.2	161.3	0	0	0	111.6	L1169 L1176 T1177	L1169-L1173 HydrophobicContact CB-CD1 4.34Å; L1169-L1173 HydrophobicContact CD2-CD1 4.07Å; L1169-L1173 WeakPolarHBondContact O-CB 3.37Å; L1169-L1173 PolarHBondContact O-N 2.72Å; L1173-L1176 PolarHBondContact O-N 3.41Å; L1173-T1177 WeakPolarHBondContact O-CB 3.38Å; L1173-T1177 PolarHBondContact O-N 3.41Å; L1173-T1177 PolarHBondContact O-OG1 3.28Å
1174	T	42.5	Very low	42.7	Very low	92 Å²	92	100.6 Å²	100.6	56%	0.564	54%	0.54	S	S	*	.	H	α-helix	trans	-62.9	-45.7	177	-62.2	0	0	0	0	110.4	D1170 H1171 L1176 T1177 F1178	D1170-T1174 WeakPolarHBondContact O-CA 3.19Å; D1170-T1174 WeakPolarHBondContact O-CB 3.39Å; D1170-T1174 PolarHBondContact O-N 3.49Å; D1170-T1174 PolarHBondContact O-OG1 2.93Å; H1171-T1174 PolarHBondContact O-N 2.86Å; T1174-L1176 PolarHBondContact O-N 2.77Å; T1174-T1177 PolarHBondContact O-N 3.23Å; T1174-F1178 WeakPolarHBondContact O-CB 3.33Å; T1174-F1178 PolarHBondContact O-N 3.39Å
1175	L	41.3	Very low	41.6	Very low	112 Å²	112	102.7 Å²	102.7	59%	0.586	55%	0.547	S	S	*	.	H	α-helix	trans	-60.3	-44.4	174.5	-76.8	166.8	0	0	0	112.5	H1171 F1178 H1179	H1171-L1175 WeakPolarHBondContact O-CG 3.44Å; H1171-L1175 PolarHBondContact O-N 3.44Å; L1175-F1178 PolarHBondContact O-N 3Å; L1175-H1179 PolarHBondContact O-N 3.18Å
1176	L	42.3	Very low	40.9	Very low	99 Å²	99	103 Å²	103	52%	0.518	55%	0.551	S	S	.	*	H	α-helix	trans	-67	-40.8	178.2	-168.4	70.4	0	0	0	112.2	F1172 L1173 T1174 F1178 H1179 V1180	F1172-L1176 WeakPolarHBondContact O-CB 3.15Å; F1172-L1176 PolarHBondContact O-N 3.03Å; L1173-L1176 PolarHBondContact O-N 3.41Å; T1174-L1176 PolarHBondContact O-N 2.77Å; L1176-F1178 VanDerWaalsContact C-N 3.32Å; L1176-H1179 PolarHBondContact O-N 2.76Å; L1176-V1180 WeakPolarHBondContact O-CB 3.46Å; L1176-V1180 VanDerWaalsContact O-CG2 3.3Å; L1176-V1180 WeakPolarHBondContact O-CG2 3.3Å; L1176-V1180 PolarHBondContact O-N 2.76Å
1177	T	45.5	Very low	41.1	Very low	89 Å²	89	100 Å²	100	55%	0.546	53%	0.534	S	S	.	.	H	α-helix	trans	-68.6	-34.3	175.8	-37.2	0	0	0	0	110.6	L1173 T1174 A1181	L1173-T1177 WeakPolarHBondContact O-CB 3.38Å; L1173-T1177 PolarHBondContact O-N 3.41Å; L1173-T1177 PolarHBondContact O-OG1 3.28Å; T1174-T1177 PolarHBondContact O-N 3.23Å; T1177-A1181 WeakPolarHBondContact O-CB 3.49Å; T1177-A1181 PolarHBondContact O-N 3.38Å
1178	F	45.5	Very low	41.3	Very low	111 Å²	111	99.1 Å²	99.1	49%	0.487	53%	0.529	S	S	.	.	H	α-helix	trans	-67.7	-45.1	175.6	-160.9	-88.2	0	0	0	111	T1174 L1175 L1176 A1181 T1182	T1174-F1178 WeakPolarHBondContact O-CB 3.33Å; T1174-F1178 PolarHBondContact O-N 3.39Å; L1175-F1178 PolarHBondContact O-N 3Å; L1176-F1178 VanDerWaalsContact C-N 3.32Å; F1178-A1181 PolarHBondContact O-N 2.93Å; F1178-T1182 HydrophobicContact CD1-CG2 4.01Å; F1178-T1182 HydrophobicContact CE1-CG2 3.82Å; F1178-T1182 WeakPolarHBondContact O-CG2 3.25Å; F1178-T1182 PolarHBondContact O-N 3.16Å; F1178-T1182 PolarHBondContact O-OG1 3.37Å; F1178-T1182 VanDerWaalsContact O-OG1 3.06Å
1179	H	44.3	Very low	41.7	Very low	124 Å²	124	99.4 Å²	99.4	57%	0.574	53%	0.534	S	S	*	.	H	α-helix	trans	-63.5	-42.3	174	-103.7	52.7	0	0	0	113.2	L1175 L1176 T1182 M1183	L1175-H1179 PolarHBondContact O-N 3.18Å; L1176-H1179 PolarHBondContact O-N 2.76Å; H1179-T1182 WeakPolarHBondContact CA-OG1 3.49Å; H1179-T1182 PolarHBondContact O-OG1 3.47Å; H1179-T1182 VanDerWaalsContact O-OG1 3.13Å; H1179-M1183 WeakPolarHBondContact O-CB 3.49Å; H1179-M1183 WeakPolarHBondContact O-CG 3.11Å; H1179-M1183 PolarHBondContact O-N 2.95Å
1180	V	47.2	Very low	41.8	Very low	87 Å²	87	97.3 Å²	97.3	53%	0.527	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-39.1	175.9	172	0	0	0	0	110.6	L1176 Y1184	L1176-V1180 WeakPolarHBondContact O-CB 3.46Å; L1176-V1180 VanDerWaalsContact O-CG2 3.3Å; L1176-V1180 WeakPolarHBondContact O-CG2 3.3Å; L1176-V1180 PolarHBondContact O-N 2.76Å; V1180-Y1184 WeakPolarHBondContact O-CB 2.9Å; V1180-Y1184 PolarHBondContact O-N 3.12Å
1181	A	42.5	Very low	41.9	Very low	47 Å²	47	99.9 Å²	99.9	39%	0.388	54%	0.535	S	S	.	.	H	α-helix	trans	-69.1	-40.2	176.7	0	0	0	0	0	112.7	T1177 F1178 Y1184 V1185	T1177-A1181 WeakPolarHBondContact O-CB 3.49Å; T1177-A1181 PolarHBondContact O-N 3.38Å; F1178-A1181 PolarHBondContact O-N 2.93Å; A1181-Y1184 PolarHBondContact O-N 3.04Å; A1181-V1185 WeakPolarHBondContact O-CB 3.48Å; A1181-V1185 VanDerWaalsContact O-CG2 3.26Å; A1181-V1185 WeakPolarHBondContact O-CG2 3.3Å; A1181-V1185 PolarHBondContact O-N 3.38Å
1182	T	44.6	Very low	41.8	Very low	58 Å²	58	99.6 Å²	99.6	36%	0.356	54%	0.538	S	S	.	.	H	α-helix	trans	-65.6	-44	173.5	51	0	0	0	0	110.7	F1178 H1179 Y1184 V1185 S1186	F1178-T1182 HydrophobicContact CD1-CG2 4.01Å; F1178-T1182 HydrophobicContact CE1-CG2 3.82Å; F1178-T1182 WeakPolarHBondContact O-CG2 3.25Å; F1178-T1182 PolarHBondContact O-N 3.16Å; F1178-T1182 PolarHBondContact O-OG1 3.37Å; F1178-T1182 VanDerWaalsContact O-OG1 3.06Å; H1179-T1182 WeakPolarHBondContact CA-OG1 3.49Å; H1179-T1182 PolarHBondContact O-OG1 3.47Å; H1179-T1182 VanDerWaalsContact O-OG1 3.13Å; T1182-Y1184 VanDerWaalsContact C-N 3.31Å; T1182-Y1184 PolarHBondContact O-N 3.34Å; T1182-V1185 PolarHBondContact O-N 3.42Å; T1182-S1186 WeakPolarHBondContact O-CB 3.27Å; T1182-S1186 PolarHBondContact O-N 3.44Å; T1182-S1186 PolarHBondContact O-OG 3.31Å; T1182-S1186 VanDerWaalsContact O-OG 3.06Å
1183	M	40.8	Very low	42	Very low	139 Å²	139	97.7 Å²	97.7	69%	0.685	54%	0.539	S	S	*	.	H	α-helix	trans	-57.6	-42.7	172.9	-77.2	-153	74.6	0	0	112.6	H1179 T1187	H1179-M1183 WeakPolarHBondContact O-CB 3.49Å; H1179-M1183 WeakPolarHBondContact O-CG 3.11Å; H1179-M1183 PolarHBondContact O-N 2.95Å; M1183-T1187 PolarHBondContact O-N 3.26Å; M1183-T1187 VanDerWaalsContact O-N 3.08Å; M1183-T1187 PolarHBondContact O-OG1 2.83Å
1184	Y	38.1	Very low	41.7	Very low	165 Å²	165	100.2 Å²	100.2	65%	0.647	55%	0.552	S	S	*	*	H	α-helix	trans	-71.1	-41.4	-178.6	-145.4	-83.6	0	0	0	112.6	V1180 A1181 T1182 T1187 V1188	V1180-Y1184 WeakPolarHBondContact O-CB 2.9Å; V1180-Y1184 PolarHBondContact O-N 3.12Å; A1181-Y1184 PolarHBondContact O-N 3.04Å; T1182-Y1184 VanDerWaalsContact C-N 3.31Å; T1182-Y1184 PolarHBondContact O-N 3.34Å; Y1184-T1187 WeakPolarHBondContact CA-OG1 3.44Å; Y1184-T1187 PolarHBondContact O-N 3.29Å; Y1184-T1187 PolarHBondContact O-OG1 3.11Å; Y1184-V1188 HydrophobicContact CD1-CG2 3.98Å; Y1184-V1188 HydrophobicContact CE1-CG2 4Å; Y1184-V1188 WeakPolarHBondContact O-CG2 3.46Å; Y1184-V1188 PolarHBondContact O-N 3.39Å
1185	V	42.5	Very low	41.8	Very low	96 Å²	96	101.1 Å²	101.1	58%	0.582	56%	0.557	S	S	*	*	H	α-helix	trans	-67.8	-40.5	175.6	171.6	0	0	0	0	110.6	A1181 T1182 T1187 V1188 A1189	A1181-V1185 WeakPolarHBondContact O-CB 3.48Å; A1181-V1185 VanDerWaalsContact O-CG2 3.26Å; A1181-V1185 WeakPolarHBondContact O-CG2 3.3Å; A1181-V1185 PolarHBondContact O-N 3.38Å; T1182-V1185 PolarHBondContact O-N 3.42Å; V1185-T1187 VanDerWaalsContact C-N 3.27Å; V1185-T1187 PolarHBondContact O-N 3.01Å; V1185-V1188 PolarHBondContact O-N 2.89Å; V1185-A1189 WeakPolarHBondContact O-CB 3.38Å; V1185-A1189 PolarHBondContact O-N 3.2Å
1186	S	41.6	Very low	41.6	Very low	66 Å²	66	102 Å²	102	46%	0.462	56%	0.563	S	S	.	*	H	α-helix	trans	-70.3	-15.5	175.5	-66.8	0	0	0	0	114.3	T1182 V1190	T1182-S1186 WeakPolarHBondContact O-CB 3.27Å; T1182-S1186 PolarHBondContact O-N 3.44Å; T1182-S1186 PolarHBondContact O-OG 3.31Å; T1182-S1186 VanDerWaalsContact O-OG 3.06Å; S1186-V1190 WeakPolarHBondContact O-CG2 3.48Å
1187	T	41.2	Very low	41.3	Very low	79 Å²	79	105.1 Å²	105.1	49%	0.485	58%	0.58	S	S	.	*	H	α-helix	trans	-86.4	-49	166.4	41.1	0	0	0	0	112.3	M1183 Y1184 V1185 A1189 V1190 E1191	M1183-T1187 PolarHBondContact O-N 3.26Å; M1183-T1187 VanDerWaalsContact O-N 3.08Å; M1183-T1187 PolarHBondContact O-OG1 2.83Å; Y1184-T1187 WeakPolarHBondContact CA-OG1 3.44Å; Y1184-T1187 PolarHBondContact O-N 3.29Å; Y1184-T1187 PolarHBondContact O-OG1 3.11Å; V1185-T1187 VanDerWaalsContact C-N 3.27Å; V1185-T1187 PolarHBondContact O-N 3.01Å; T1187-A1189 PolarHBondContact O-N 3.38Å; T1187-V1190 PolarHBondContact O-N 2.94Å; T1187-E1191 PolarHBondContact O-N 3.1Å
1188	V	40	Very low	40.7	Very low	66 Å²	66	104.3 Å²	104.3	40%	0.4	59%	0.589	S	S	.	*	H	α-helix	trans	-67.9	-39.4	-176.4	176.4	0	0	0	0	111.9	Y1184 V1185 V1190 E1191 D1192	Y1184-V1188 HydrophobicContact CD1-CG2 3.98Å; Y1184-V1188 HydrophobicContact CE1-CG2 4Å; Y1184-V1188 WeakPolarHBondContact O-CG2 3.46Å; Y1184-V1188 PolarHBondContact O-N 3.39Å; V1185-V1188 PolarHBondContact O-N 2.89Å; V1188-V1190 PolarHBondContact O-N 3.31Å; V1188-E1191 PolarHBondContact O-N 3.42Å; V1188-D1192 PolarHBondContact O-N 3.09Å
1189	A	42.3	Very low	40.2	Very low	54 Å²	54	109.8 Å²	109.8	45%	0.446	61%	0.608	S	S	.	*	H	α-helix	trans	-72.3	-8.9	177.3	0	0	0	0	0	114	V1185 T1187 V1193	V1185-A1189 WeakPolarHBondContact O-CB 3.38Å; V1185-A1189 PolarHBondContact O-N 3.2Å; T1187-A1189 PolarHBondContact O-N 3.38Å; A1189-V1193 WeakPolarHBondContact O-CG2 3.5Å
1190	V	39.6	Very low	39.8	Very low	81 Å²	81	110 Å²	110	49%	0.491	62%	0.618	S	S	.	*	H	α-helix	trans	-90.2	-33.7	173.2	168.8	0	0	0	0	111	S1186 T1187 V1188 L1194	S1186-V1190 WeakPolarHBondContact O-CG2 3.48Å; T1187-V1190 PolarHBondContact O-N 2.94Å; V1188-V1190 PolarHBondContact O-N 3.31Å; V1190-L1194 HydrophobicContact CG1-CD1 3.75Å; V1190-L1194 WeakPolarHBondContact O-CD1 3.35Å; V1190-L1194 VanDerWaalsContact O-CG 3.25Å; V1190-L1194 WeakPolarHBondContact O-CG 3.17Å; V1190-L1194 PolarHBondContact O-N 2.57Å
1191	E	37.6	Very low	39	Very low	149 Å²	149	110.9 Å²	110.9	70%	0.696	63%	0.634	S	S	*	*	H	α-helix	trans	-70.4	-44.1	176.4	-66.1	-172.5	142.5	0	0	112.3	T1187 V1188 V1193 L1194	T1187-E1191 PolarHBondContact O-N 3.1Å; V1188-E1191 PolarHBondContact O-N 3.42Å; E1191-V1193 VanDerWaalsContact C-N 3.29Å; E1191-V1193 PolarHBondContact O-N 3.19Å; E1191-L1194 PolarHBondContact O-N 3.22Å
1192	D	37.2	Very low	38.8	Very low	138 Å²	138	112.6 Å²	112.6	74%	0.738	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-19.8	-179.8	-93.5	-25.6	0	0	0	114.3	V1188	V1188-D1192 PolarHBondContact O-N 3.09Å
1193	V	42.5	Very low	38.5	Very low	111 Å²	111	115.1 Å²	115.1	67%	0.673	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-17.7	-177.6	175.9	0	0	0	0	112.7	A1189 E1191 V1195	A1189-V1193 WeakPolarHBondContact O-CG2 3.5Å; E1191-V1193 VanDerWaalsContact C-N 3.29Å; E1191-V1193 PolarHBondContact O-N 3.19Å; V1193-V1195 PolarHBondContact O-N 3.32Å
1194	L	37.1	Very low	38.2	Very low	142 Å²	142	112 Å²	112	74%	0.743	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.3	4.6	-176.6	-76.5	173.3	0	0	0	115.2	V1190 E1191	V1190-L1194 HydrophobicContact CG1-CD1 3.75Å; V1190-L1194 WeakPolarHBondContact O-CD1 3.35Å; V1190-L1194 VanDerWaalsContact O-CG 3.25Å; V1190-L1194 WeakPolarHBondContact O-CG 3.17Å; V1190-L1194 PolarHBondContact O-N 2.57Å; E1191-L1194 PolarHBondContact O-N 3.22Å
1195	V	43	Very low	38.1	Very low	110 Å²	110	107.3 Å²	107.3	67%	0.667	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-15	-170.7	-179.9	0	0	0	0	114.4	V1193	V1193-V1195 PolarHBondContact O-N 3.32Å
1196	N	38.2	Very low	37.8	Very low	132 Å²	132	110 Å²	110	71%	0.706	66%	0.657	S	S	*	*	S	Bend	trans	-135.3	128.9	-179.5	-77.4	-77.4	0	0	0	113.7
1197	N	36.8	Very low	37.6	Very low	163 Å²	163	110.1 Å²	110.1	87%	0.872	66%	0.661	S	S	*	*			trans	54.7	82.9	168.6	-62.7	-18.5	0	0	0	116.6
1198	G	31.9	Very low	37.5	Very low	73 Å²	73	112.6 Å²	112.6	75%	0.753	67%	0.671	S	S	*	*			trans	-82.1	132.3	167.9	0	0	0	0	0	113.4
1199	Y	34.8	Very low	37.3	Very low	225 Å²	225	113.8 Å²	113.8	88%	0.882	69%	0.687	S	S	*	*			trans	-160.6	147.6	142	-117	-83.3	0	0	0	108.5
1200	V	36.4	Very low	37.1	Very low	128 Å²	128	113.6 Å²	113.6	78%	0.776	69%	0.685	S	S	*	*			trans	61.7	63.1	177.9	-159.8	0	0	0	0	115.4
1201	A	31.3	Very low	36.9	Very low	106 Å²	106	114.5 Å²	114.5	88%	0.876	71%	0.712	S	S	*	*			trans	-102	109	167.5	0	0	0	0	0	111.7
1202	S	37.3	Very low	36.8	Very low	83 Å²	83	112.8 Å²	112.8	58%	0.58	71%	0.712	S	S	*	*	S	Bend	trans	-161.1	-42.5	165.9	60.4	0	0	0	0	114
1203	T	37.8	Very low	36.8	Very low	112 Å²	112	111.5 Å²	111.5	69%	0.687	71%	0.711	S	S	*	*	H	α-helix	trans	-73.8	-40.3	-167.6	-23.6	0	0	0	0	114.2	A1205 H1206	T1203-A1205 VanDerWaalsContact C-N 3.33Å; T1203-A1205 PolarHBondContact O-N 3.4Å; T1203-H1206 PolarHBondContact O-N 3.04Å
1204	A	35	Very low	36.5	Very low	72 Å²	72	111.5 Å²	111.5	60%	0.595	71%	0.713	S	S	*	*	H	α-helix	trans	-65.7	-32.3	-173.6	0	0	0	0	0	113.8	H1206 A1207 I1208	A1204-H1206 VanDerWaalsContact C-N 3.31Å; A1204-H1206 PolarHBondContact O-N 2.76Å; A1204-A1207 PolarHBondContact O-N 3.12Å; A1204-I1208 PolarHBondContact O-N 2.71Å
1205	A	35.4	Very low	36.5	Very low	67 Å²	67	109.7 Å²	109.7	55%	0.554	71%	0.711	S	S	*	*	H	α-helix	trans	-64.2	-34.1	-178.4	0	0	0	0	0	112.8	T1203 A1209	T1203-A1205 VanDerWaalsContact C-N 3.33Å; T1203-A1205 PolarHBondContact O-N 3.4Å; A1205-A1209 WeakPolarHBondContact O-CB 3.18Å; A1205-A1209 PolarHBondContact O-N 3.11Å; A1205-A1209 VanDerWaalsContact O-N 3.1Å
1206	H	37.3	Very low	36.1	Very low	153 Å²	153	109.7 Å²	109.7	71%	0.708	71%	0.714	S	S	*	*	H	α-helix	trans	-73.8	-31.3	178.6	-83.4	83.7	0	0	0	113	T1203 A1204 A1210	T1203-H1206 PolarHBondContact O-N 3.04Å; A1204-H1206 VanDerWaalsContact C-N 3.31Å; A1204-H1206 PolarHBondContact O-N 2.76Å; H1206-A1210 WeakPolarHBondContact O-CB 3.23Å; H1206-A1210 PolarHBondContact O-N 3.17Å
1207	A	37.4	Very low	35.9	Very low	68 Å²	68	108.2 Å²	108.2	56%	0.562	72%	0.715	S	S	*	*	H	α-helix	trans	-68.5	-41	176.5	0	0	0	0	0	111.8	A1204 A1210 G1211	A1204-A1207 PolarHBondContact O-N 3.12Å; A1207-A1210 PolarHBondContact O-N 3.03Å; A1207-G1211 PolarHBondContact O-N 3.04Å; A1207-G1211 VanDerWaalsContact O-N 3.11Å
1208	I	37.8	Very low	35.8	Very low	132 Å²	132	104.3 Å²	104.3	68%	0.677	70%	0.703	S	S	*	*	H	α-helix	trans	-73.4	-33.3	179.1	-61.1	170.8	0	0	0	111.5	A1204 A1210	A1204-I1208 PolarHBondContact O-N 2.71Å; I1208-A1210 VanDerWaalsContact C-N 3.28Å
1209	A	37.2	Very low	36.1	Very low	90 Å²	90	106.7 Å²	106.7	74%	0.744	70%	0.7	S	S	*	*	H	α-helix	trans	-75.4	-14.7	171.7	0	0	0	0	0	113.6	A1205	A1205-A1209 WeakPolarHBondContact O-CB 3.18Å; A1205-A1209 PolarHBondContact O-N 3.11Å; A1205-A1209 VanDerWaalsContact O-N 3.1Å
1210	A	36.6	Very low	36.3	Very low	50 Å²	50	96.8 Å²	96.8	41%	0.413	68%	0.684	S	S	.	*	H	α-helix	trans	-83.7	-53.2	174	0	0	0	0	0	111.9	R1048 H1206 A1207 I1208	R1048-A1210 PolarHBondContact NH1-O 3.27Å; R1048-A1210 PolarHBondContact NH2-O 3.49Å; H1206-A1210 WeakPolarHBondContact O-CB 3.23Å; H1206-A1210 PolarHBondContact O-N 3.17Å; A1207-A1210 PolarHBondContact O-N 3.03Å; I1208-A1210 VanDerWaalsContact C-N 3.28Å
1211	G	35.8	Very low	36.2	Very low	101 Å²	101	94 Å²	94	100%	1.041	68%	0.676	S	S	*	*			trans	-50.1	0	-162.5	0	0	0	0	0	118.3	R1048 A1207	R1048-G1211 PolarHBondContact NH2-O 3.33Å; A1207-G1211 PolarHBondContact O-N 3.04Å; A1207-G1211 VanDerWaalsContact O-N 3.11Å

Retrieved 1,211 of 1,211 residues in 5343.5 ms (Link to these results)

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