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Gamma-tubulin complex component

Component of the gamma-tubulin ring complex (gTuRC) which mediates microtubule nucleation. The gTuRC regulates the minus-end nucleation of alpha-beta tubulin heterodimers that grow into microtubule protafilaments, a critical step in centrosome duplication and spindle formation. Plays a role in neuronal migration.

AlphaFold DB , UniProt , Accession E1JJQ4, Species DROME (Drosophila melanogaster, Fruit fly), Gene Grip84, Length 833 aa.

						>E1JJQ4_DROME|E1JJQ4|Grip84
MSKPHALRGVLANLISESQSPLTPESIIREFRATSDRRLPACDLIKVLVSISEKRPNFAEVTKEISHILQNKDPMYALLVFVERYSECKPVSESSSSTSLSAMGLPHGNKTSDVNSAAGSVPTTLAIASTSTILTTSQNVSGSTRLSLTQSQDFPTSTPVNCKKATESDTTPVVFVRRGPMDRNRGAGKDERNDLSVIKERVLNAVSDQSLSGYRSVTNKTGNSPKSMPNDLVTLTDVPDEYRTHLLWEYYKVDGDKVPRAEIAAMPLLSQESMLLDELLHCLTGIRESLLVPQKPIISAVGLAKYDTDFDIHTHLDRSLTHQVREILPLASYFMGVQKIIAATDGLGQVMNSLNEALQELTHDFYLIIVQAEQELRHNRLTLQKLLYYLQPTMWVMHEVWSSLVIIQLSDSRDAEVLTYLHERIKRLEGNKDAQQLIIGLVRKAAKPYMRMLQMWIQKGVIVDRHREFLVVDNEVIHRDELPEHYSDDYWERRYTLRDEQIPSFLAKYSDKILRTGKYLNVIRQCGKRVMPTQEMNLEFDPTSERHVSVINDAYYFAARMLLDVLLTENDLMGHLQSVKRYLLLNQGDFTMQFMDACEDELTKNVDHVLPMTLENLLGLTLRISSARNDPYKDDLHCELLPYDLVTQMSKIMKKEENWQAQPRLDLSGLECFAFTYEVKWPCSLVLNHISISKYQMLFRQLFYCKHVERQLCKIWKENSIARQFEPQAASLYRAAFTLRQRMMNAIQNLEYYMMIEIIEPNWHIFIEKMKTVENVDNVLRLHQDFLDSCLKNCMLTESSHLNRSIFKLCKICLKYCEFIQVSSSYSARVPGG
					

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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	32.8	Very low	58.5	Low	238 Å²	238	84.8 Å²	84.8	100%	1.172	46%	0.462	S	S	*	.				0	78.3	0	-68.9	179.1	166.2	0	0	111.3
2	S	34.2	Very low	59.8	Low	105 Å²	105	81.3 Å²	81.3	73%	0.734	45%	0.452	S	S	*	.			trans	-105	-28	-173.8	172.9	0	0	0	0	115.1
3	K	43.7	Very low	60.8	Low	150 Å²	150	82.5 Å²	82.5	65%	0.652	46%	0.457	S	S	*	.	H	α-helix	trans	-61.9	-30.1	-173.7	-62.8	-163.9	174.2	-161.1	0	118	H5 A6 L7	K3-H5 VanDerWaalsContact C-N 3.34Å; K3-H5 PolarHBondContact O-N 3.33Å; K3-A6 PolarHBondContact O-N 3.29Å; K3-L7 PolarHBondContact O-N 3.23Å
4	P	48.6	Very low	61.4	Low	68 Å²	68	76.9 Å²	76.9	44%	0.442	43%	0.426	S	S	.	.	H	α-helix	trans	-72.9	-20.2	-172	28	-34.7	0	0	0	114.8
5	H	54.4	Low	62.2	Low	147 Å²	147	73.1 Å²	73.1	68%	0.681	41%	0.405	S	S	*	.	H	α-helix	trans	-77.1	-36.7	174.7	-84.3	-78.8	0	0	0	112.6	K3 R8 G9	K3-H5 VanDerWaalsContact C-N 3.34Å; K3-H5 PolarHBondContact O-N 3.33Å; H5-R8 PolarHBondContact O-N 3.36Å; H5-G9 PolarHBondContact O-N 2.86Å; H5-G9 VanDerWaalsContact O-N 3.11Å
6	A	62.7	Low	62.6	Low	58 Å²	58	73.9 Å²	73.9	48%	0.479	42%	0.417	S	S	.	.	H	α-helix	trans	-62.3	-43.3	175.6	0	0	0	0	0	111.8	K3 R8 G9 V10	K3-A6 PolarHBondContact O-N 3.29Å; A6-R8 VanDerWaalsContact C-N 3.34Å; A6-R8 PolarHBondContact O-N 3.33Å; A6-G9 PolarHBondContact O-N 2.6Å; A6-V10 WeakPolarHBondContact O-CG2 3.39Å; A6-V10 PolarHBondContact O-N 3.38Å
7	L	71.8	Confident	62.8	Low	12 Å²	12	73.8 Å²	73.8	6%	0.063	41%	0.412	C	S	.	.	H	α-helix	trans	-54.3	-47.8	176.4	-167.3	93.7	0	0	0	112.4	K3 L11 I28 M75 L78 L79 V82	K3-L7 PolarHBondContact O-N 3.23Å; L7-L11 HydrophobicContact CG-CD1 4.21Å; L7-L11 WeakPolarHBondContact O-CB 3.2Å; L7-L11 VanDerWaalsContact O-CG 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.47Å; L7-L11 PolarHBondContact O-N 3.32Å; L7-I28 HydrophobicContact CD2-CD1 3.8Å; L7-I28 HydrophobicContact CD2-CG1 3.83Å; L7-M75 HydrophobicContact CD1-CE 4.35Å; L7-M75 HydrophobicContact CD2-CE 3.93Å; L7-L78 HydrophobicContact CD1-CG 4.43Å; L7-L79 HydrophobicContact CD1-CD2 3.77Å; L7-L79 HydrophobicContact CD1-CG 4.35Å; L7-V82 HydrophobicContact CD1-CB 3.94Å; L7-V82 HydrophobicContact CD1-CG1 4.19Å; L7-V82 HydrophobicContact CD1-CG2 3.61Å; L7-V82 HydrophobicContact CG-CG2 4.15Å
8	R	76.1	Confident	62.8	Low	100 Å²	100	70.8 Å²	70.8	38%	0.377	40%	0.397	S	S	.	.	H	α-helix	trans	-67.2	-40.9	180	-73.1	171.5	164.4	142.4	-3.2	112.6	H5 A6 A12 E25 I28	H5-R8 PolarHBondContact O-N 3.36Å; A6-R8 VanDerWaalsContact C-N 3.34Å; A6-R8 PolarHBondContact O-N 3.33Å; R8-A12 VanDerWaalsContact O-CB 3.3Å; R8-A12 WeakPolarHBondContact O-CB 3.34Å; R8-A12 PolarHBondContact O-N 3.11Å; R8-E25 IonicContact CZ-OE1 3.07Å; R8-E25 IonicContact NE-OE1 2.69Å; R8-E25 PolarHBondContact NE-OE1 2.83Å; R8-E25 IonicContact NH2-OE1 2.65Å; R8-E25 PolarHBondContact NH2-OE1 3.27Å; R8-E25 IonicContact NH2-OE2 2.65Å; R8-E25 PolarHBondContact NH2-OE2 3.4Å; R8-I28 HydrophobicContact CG-CD1 4.02Å
9	G	72.9	Confident	62.6	Low	34 Å²	34	76.1 Å²	76.1	35%	0.351	42%	0.418	S	S	.	.	H	α-helix	trans	-63.5	-48	179.1	0	0	0	0	0	112.8	H5 A6 A12 N13	H5-G9 PolarHBondContact O-N 2.86Å; H5-G9 VanDerWaalsContact O-N 3.11Å; A6-G9 PolarHBondContact O-N 2.6Å; G9-A12 PolarHBondContact O-N 3.34Å; G9-N13 VanDerWaalsContact O-CG 3.26Å; G9-N13 PolarHBondContact O-N 3.43Å; G9-N13 PolarHBondContact O-OD1 3.17Å
10	V	72.6	Confident	62.8	Low	21 Å²	21	73.3 Å²	73.3	13%	0.127	40%	0.404	C	S	.	.	H	α-helix	trans	-65.1	-43.2	179.2	176.8	0	0	0	0	111.3	A6 N13 L14 V82	A6-V10 WeakPolarHBondContact O-CG2 3.39Å; A6-V10 PolarHBondContact O-N 3.38Å; V10-N13 PolarHBondContact O-N 3.33Å; V10-L14 HydrophobicContact CG1-CD1 3.98Å; V10-L14 HydrophobicContact CG1-CG 4.47Å; V10-L14 WeakPolarHBondContact O-CG 3.28Å; V10-L14 PolarHBondContact O-N 3.26Å; V10-V82 HydrophobicContact CB-CG1 4.03Å; V10-V82 HydrophobicContact CB-CG2 4.42Å; V10-V82 HydrophobicContact CG1-CG1 4.3Å; V10-V82 HydrophobicContact CG1-CG2 4.35Å; V10-V82 HydrophobicContact CG2-CG1 4.12Å
11	L	73.4	Confident	62.7	Low	0 Å²	0	76.1 Å²	76.1	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-63.3	-42.3	176.3	-71.3	172.7	0	0	0	112.3	L7 N13 L14 I15 P24 I28 L78 F81 V82	L7-L11 HydrophobicContact CG-CD1 4.21Å; L7-L11 WeakPolarHBondContact O-CB 3.2Å; L7-L11 VanDerWaalsContact O-CG 3.31Å; L7-L11 WeakPolarHBondContact O-CG 3.47Å; L7-L11 PolarHBondContact O-N 3.32Å; L11-N13 VanDerWaalsContact C-N 3.33Å; L11-N13 PolarHBondContact O-N 3.29Å; L11-L14 PolarHBondContact O-N 2.88Å; L11-I15 WeakPolarHBondContact O-CB 3.5Å; L11-I15 WeakPolarHBondContact O-CD1 3.44Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 2.74Å; L11-P24 HydrophobicContact CB-CB 4.22Å; L11-I28 HydrophobicContact CD1-CD1 4.33Å; L11-I28 HydrophobicContact CD1-CG1 4.11Å; L11-L78 HydrophobicContact CD2-CD1 4.4Å; L11-F81 HydrophobicContact CD2-CD1 4.41Å; L11-F81 HydrophobicContact CD2-CE1 4.04Å; L11-V82 HydrophobicContact CD2-CG2 4.31Å; L11-V82 HydrophobicContact CG-CG2 4.1Å
12	A	74.8	Confident	64.5	Low	42 Å²	42	67.3 Å²	67.3	35%	0.347	38%	0.383	S	S	.	.	H	α-helix	trans	-62	-39.6	177	0	0	0	0	0	112.6	R8 G9 S16 P24	R8-A12 VanDerWaalsContact O-CB 3.3Å; R8-A12 WeakPolarHBondContact O-CB 3.34Å; R8-A12 PolarHBondContact O-N 3.11Å; G9-A12 PolarHBondContact O-N 3.34Å; A12-S16 PolarHBondContact O-N 3.07Å; A12-S16 PolarHBondContact O-OG 3.33Å; A12-P24 HydrophobicContact CB-CG 4.15Å
13	N	72.9	Confident	66.4	Low	97 Å²	97	66.2 Å²	66.2	52%	0.519	37%	0.372	S	S	.	.	H	α-helix	trans	-66.2	-45.5	176.3	-68.1	-11.1	0	0	0	111.9	G9 V10 L11 I15 S16 E17	G9-N13 VanDerWaalsContact O-CG 3.26Å; G9-N13 PolarHBondContact O-N 3.43Å; G9-N13 PolarHBondContact O-OD1 3.17Å; V10-N13 PolarHBondContact O-N 3.33Å; L11-N13 VanDerWaalsContact C-N 3.33Å; L11-N13 PolarHBondContact O-N 3.29Å; N13-I15 VanDerWaalsContact C-N 3.34Å; N13-I15 PolarHBondContact O-N 3.22Å; N13-S16 PolarHBondContact O-N 3.22Å; N13-S16 PolarHBondContact O-OG 3.08Å; N13-E17 WeakPolarHBondContact O-CG 3.24Å; N13-E17 PolarHBondContact O-N 3.02Å
14	L	68.7	Low	67.8	Low	4 Å²	4	60.5 Å²	60.5	2%	0.021	35%	0.351	C	S	.	.	H	α-helix	trans	-65.3	-36.9	178.7	-67.4	168.8	0	0	0	112.3	V10 L11 E17 S18 I51 R55 F81 Y85	V10-L14 HydrophobicContact CG1-CD1 3.98Å; V10-L14 HydrophobicContact CG1-CG 4.47Å; V10-L14 WeakPolarHBondContact O-CG 3.28Å; V10-L14 PolarHBondContact O-N 3.26Å; L11-L14 PolarHBondContact O-N 2.88Å; L14-E17 PolarHBondContact O-N 2.94Å; L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.19Å; L14-S18 PolarHBondContact O-OG 3.27Å; L14-I51 HydrophobicContact CB-CG2 3.42Å; L14-I51 VanDerWaalsContact CB-CG2 3.42Å; L14-I51 HydrophobicContact CD1-CG2 4.3Å; L14-I51 HydrophobicContact CG-CG2 4.47Å; L14-R55 HydrophobicContact CD2-CG 4.22Å; L14-F81 HydrophobicContact CD1-CE1 3.8Å; L14-F81 HydrophobicContact CD1-CZ 4.1Å; L14-Y85 HydrophobicContact CD1-CD2 4.17Å; L14-Y85 HydrophobicContact CD1-CG 4.11Å; L14-Y85 HydrophobicContact CD2-CD1 4.35Å; L14-Y85 HydrophobicContact CD2-CG 4.35Å
15	I	73.2	Confident	68.9	Low	21 Å²	21	61.8 Å²	61.8	11%	0.108	35%	0.351	C	S	.	.	H	α-helix	trans	-66.5	-40.4	175.9	-69.9	160.6	0	0	0	111.5	L11 N13 S18 Q19 L22 P24 I27 I51	L11-I15 WeakPolarHBondContact O-CB 3.5Å; L11-I15 WeakPolarHBondContact O-CD1 3.44Å; L11-I15 WeakPolarHBondContact O-CG1 3.45Å; L11-I15 PolarHBondContact O-N 2.74Å; N13-I15 VanDerWaalsContact C-N 3.34Å; N13-I15 PolarHBondContact O-N 3.22Å; I15-S18 PolarHBondContact O-N 3.05Å; I15-S18 PolarHBondContact O-OG 2.69Å; I15-Q19 PolarHBondContact O-N 2.79Å; I15-L22 VanDerWaalsContact CG2-O 3.28Å; I15-L22 WeakPolarHBondContact CG2-O 3.36Å; I15-P24 HydrophobicContact CD1-CG 3.82Å; I15-I27 HydrophobicContact CD1-CD1 3.57Å; I15-I27 HydrophobicContact CG1-CD1 4.28Å; I15-I51 HydrophobicContact CG1-CD1 4.25Å; I15-I51 HydrophobicContact CG1-CG1 4.32Å; I15-I51 HydrophobicContact CG1-CG2 4.29Å
16	S	68.9	Low	69.8	Low	85 Å²	85	56.9 Å²	56.9	59%	0.594	33%	0.333	S	S	*	.	H	α-helix	trans	-69.4	-35.3	176.7	72	0	0	0	0	112.1	A12 N13	A12-S16 PolarHBondContact O-N 3.07Å; A12-S16 PolarHBondContact O-OG 3.33Å; N13-S16 PolarHBondContact O-N 3.22Å; N13-S16 PolarHBondContact O-OG 3.08Å
17	E	65.2	Low	70.4	Confident	72 Å²	72	54.2 Å²	54.2	34%	0.336	31%	0.311	S	S	.	.	H	α-helix	trans	-65.4	-45.1	171.2	-75	174.4	-159.9	0	0	111.7	N13 L14 K54 R55	N13-E17 WeakPolarHBondContact O-CG 3.24Å; N13-E17 PolarHBondContact O-N 3.02Å; L14-E17 PolarHBondContact O-N 2.94Å; E17-K54 VanDerWaalsContact O-CD 3.26Å; E17-K54 WeakPolarHBondContact O-CD 3.32Å; E17-K54 WeakPolarHBondContact O-CE 3.18Å; E17-K54 PolarHBondContact O-NZ 2.76Å; E17-R55 VanDerWaalsContact CD-NH2 3.35Å; E17-R55 IonicContact OE1-CZ 2.76Å; E17-R55 IonicContact OE1-NE 2.96Å; E17-R55 IonicContact OE1-NH2 3.93Å; E17-R55 PolarHBondContact OE1-NH2 2.86Å; E17-R55 IonicContact OE2-CZ 2.74Å; E17-R55 IonicContact OE2-NE 3.45Å; E17-R55 PolarHBondContact OE2-NE 3.36Å; E17-R55 IonicContact OE2-NH2 3.06Å; E17-R55 PolarHBondContact OE2-NH2 3.03Å; E17-R55 VanDerWaalsContact OE2-NH2 3.15Å
18	S	62.9	Low	70.7	Confident	21 Å²	21	54.7 Å²	54.7	15%	0.147	31%	0.314	C	S	.	.	H	α-helix	trans	-77.7	-23.9	-176	78.2	0	0	0	0	114.7	L14 I15 S20 S50 K54	L14-S18 WeakPolarHBondContact O-CB 3.45Å; L14-S18 PolarHBondContact O-N 3.19Å; L14-S18 PolarHBondContact O-OG 3.27Å; I15-S18 PolarHBondContact O-N 3.05Å; I15-S18 PolarHBondContact O-OG 2.69Å; S18-S20 WeakPolarHBondContact OG-CB 3.42Å; S18-S20 PolarHBondContact OG-N 3.04Å; S18-S20 VanDerWaalsContact OG-N 3.16Å; S18-S20 PolarHBondContact OG-OG 2.64Å; S18-S50 VanDerWaalsContact CB-O 3.32Å; S18-S50 WeakPolarHBondContact CB-O 3.4Å; S18-S50 PolarHBondContact OG-O 2.93Å; S18-K54 PolarHBondContact O-NZ 2.79Å
19	Q	59.8	Low	70.6	Confident	171 Å²	171	59 Å²	59	80%	0.799	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	25.8	-167	-60.8	-174.9	-17	0	0	113.9	I15	I15-Q19 PolarHBondContact O-N 2.79Å
20	S	66.4	Low	70.7	Confident	20 Å²	20	59.9 Å²	59.9	14%	0.14	33%	0.325	C	S	.	.			trans	-67.4	145.5	174.2	69.6	0	0	0	0	112.1	S18 L22	S18-S20 WeakPolarHBondContact OG-CB 3.42Å; S18-S20 PolarHBondContact OG-N 3.04Å; S18-S20 VanDerWaalsContact OG-N 3.16Å; S18-S20 PolarHBondContact OG-OG 2.64Å; S20-L22 PolarHBondContact O-N 3.05Å; S20-L22 VanDerWaalsContact O-N 3.17Å
21	P	61.3	Low	70.7	Confident	133 Å²	133	59 Å²	59	86%	0.864	32%	0.319	S	S	*	.	S	Bend	trans	-78.6	9.7	-179.8	33.5	-37.4	0	0	0	113.9
22	L	69.1	Low	70.7	Confident	52 Å²	52	68.5 Å²	68.5	27%	0.272	36%	0.355	S	S	.	.			trans	-92.5	142.4	-174.3	-68.1	168.5	0	0	0	110.9	I15 S20 I27 V47	I15-L22 VanDerWaalsContact CG2-O 3.28Å; I15-L22 WeakPolarHBondContact CG2-O 3.36Å; S20-L22 PolarHBondContact O-N 3.05Å; S20-L22 VanDerWaalsContact O-N 3.17Å; L22-I27 HydrophobicContact CB-CD1 4.36Å; L22-I27 HydrophobicContact CB-CG1 4.48Å; L22-V47 HydrophobicContact CD1-CG1 4.04Å
23	T	74.3	Confident	70.6	Confident	82 Å²	82	67.4 Å²	67.4	50%	0.503	35%	0.346	S	S	.	.			trans	-95.4	151.8	174	61.2	0	0	0	0	111.3	E25 S26 I27	T23-E25 PolarHBondContact O-N 3.07Å; T23-S26 WeakPolarHBondContact O-CB 2.98Å; T23-S26 PolarHBondContact O-N 2.91Å; T23-S26 WeakPolarHBondContact OG1-CB 3.12Å; T23-S26 PolarHBondContact OG1-N 3.1Å; T23-I27 PolarHBondContact O-N 2.99Å
24	P	72.9	Confident	70	Confident	31 Å²	31	67.4 Å²	67.4	20%	0.201	35%	0.35	C	S	.	.	H	α-helix	trans	-52.5	-40.2	175.8	-27.2	33.2	0	0	0	113.6	L11 A12 I15 I27 I28	L11-P24 HydrophobicContact CB-CB 4.22Å; A12-P24 HydrophobicContact CB-CG 4.15Å; I15-P24 HydrophobicContact CD1-CG 3.82Å; P24-I27 PolarHBondContact O-N 2.78Å; P24-I28 WeakPolarHBondContact O-CD1 3.33Å; P24-I28 VanDerWaalsContact O-CG1 3.25Å; P24-I28 WeakPolarHBondContact O-CG1 3.28Å; P24-I28 PolarHBondContact O-N 3.12Å
25	E	73.2	Confident	69.5	Low	94 Å²	94	71.3 Å²	71.3	44%	0.439	38%	0.377	S	S	.	.	H	α-helix	trans	-69.5	-30.6	178.2	-65.6	-60.4	134.8	0	0	112.7	R8 T23 R29	R8-E25 IonicContact CZ-OE1 3.07Å; R8-E25 IonicContact NE-OE1 2.69Å; R8-E25 PolarHBondContact NE-OE1 2.83Å; R8-E25 IonicContact NH2-OE1 2.65Å; R8-E25 PolarHBondContact NH2-OE1 3.27Å; R8-E25 IonicContact NH2-OE2 2.65Å; R8-E25 PolarHBondContact NH2-OE2 3.4Å; T23-E25 PolarHBondContact O-N 3.07Å; E25-R29 WeakPolarHBondContact O-CB 3.4Å; E25-R29 PolarHBondContact O-N 3.47Å
26	S	73.2	Confident	68.6	Low	45 Å²	45	77.4 Å²	77.4	32%	0.315	41%	0.41	S	S	.	.	H	α-helix	trans	-64.2	-44.9	173.1	-163.5	0	0	0	0	110.9	T23 R29 E30	T23-S26 WeakPolarHBondContact O-CB 2.98Å; T23-S26 PolarHBondContact O-N 2.91Å; T23-S26 WeakPolarHBondContact OG1-CB 3.12Å; T23-S26 PolarHBondContact OG1-N 3.1Å; S26-R29 WeakPolarHBondContact O-CB 3.41Å; S26-R29 PolarHBondContact O-N 3Å; S26-E30 PolarHBondContact O-N 3.4Å
27	I	74.5	Confident	68.2	Low	2 Å²	2	83.6 Å²	83.6	1%	0.01	42%	0.42	C	S	.	.	H	α-helix	trans	-66.2	-47.2	179.2	-60.5	147.5	0	0	0	110.3	I15 L22 T23 P24 R29 E30 F31 V47 I51 L78	I15-I27 HydrophobicContact CD1-CD1 3.57Å; I15-I27 HydrophobicContact CG1-CD1 4.28Å; L22-I27 HydrophobicContact CB-CD1 4.36Å; L22-I27 HydrophobicContact CB-CG1 4.48Å; T23-I27 PolarHBondContact O-N 2.99Å; P24-I27 PolarHBondContact O-N 2.78Å; I27-R29 PolarHBondContact O-N 2.9Å; I27-E30 PolarHBondContact O-N 3.18Å; I27-F31 HydrophobicContact CG2-CD2 4Å; I27-F31 HydrophobicContact CG2-CE2 4.17Å; I27-F31 WeakPolarHBondContact O-CD2 3.4Å; I27-F31 PolarHBondContact O-N 3.13Å; I27-V47 HydrophobicContact CG1-CG1 4.14Å; I27-I51 HydrophobicContact CD1-CD1 3.34Å; I27-I51 HydrophobicContact CG1-CD1 4Å; I27-L78 HydrophobicContact CG2-CD1 4.26Å
28	I	77.8	Confident	68.4	Low	22 Å²	22	84.6 Å²	84.6	11%	0.113	42%	0.421	C	S	.	.	H	α-helix	trans	-60.3	-36.1	177.3	-66.1	163.7	0	0	0	111	L7 R8 L11 P24 R32 L78	L7-I28 HydrophobicContact CD2-CD1 3.8Å; L7-I28 HydrophobicContact CD2-CG1 3.83Å; R8-I28 HydrophobicContact CG-CD1 4.02Å; L11-I28 HydrophobicContact CD1-CD1 4.33Å; L11-I28 HydrophobicContact CD1-CG1 4.11Å; P24-I28 WeakPolarHBondContact O-CD1 3.33Å; P24-I28 VanDerWaalsContact O-CG1 3.25Å; P24-I28 WeakPolarHBondContact O-CG1 3.28Å; P24-I28 PolarHBondContact O-N 3.12Å; I28-R32 WeakPolarHBondContact O-CB 3.47Å; I28-R32 PolarHBondContact O-N 3.49Å; I28-L78 HydrophobicContact CG1-CD2 4.49Å
29	R	75.6	Confident	68.6	Low	189 Å²	189	87 Å²	87	71%	0.713	43%	0.431	S	S	*	.	H	α-helix	trans	-65.7	-46.3	176.1	177.1	177.3	170.9	173.3	-3.6	112.6	E25 S26 I27 R32 A33	E25-R29 WeakPolarHBondContact O-CB 3.4Å; E25-R29 PolarHBondContact O-N 3.47Å; S26-R29 WeakPolarHBondContact O-CB 3.41Å; S26-R29 PolarHBondContact O-N 3Å; I27-R29 PolarHBondContact O-N 2.9Å; R29-R32 CarbonylContact O-C 3.59Å; R29-R32 PolarHBondContact O-N 3.46Å; R29-A33 PolarHBondContact O-N 3.09Å
30	E	73.1	Confident	69.2	Low	53 Å²	53	82.4 Å²	82.4	25%	0.248	42%	0.417	C	S	.	.	H	α-helix	trans	-63.1	-43.6	177.7	-69.8	-52.8	132.4	0	0	112	S26 I27 R32 A33 L39 L44	S26-E30 PolarHBondContact O-N 3.4Å; I27-E30 PolarHBondContact O-N 3.18Å; E30-R32 VanDerWaalsContact C-N 3.26Å; E30-R32 PolarHBondContact O-N 2.92Å; E30-A33 WeakPolarHBondContact O-CB 3.44Å; E30-A33 PolarHBondContact O-N 3.39Å; E30-L39 HydrophobicContact CG-CD1 4.29Å; E30-L44 HydrophobicContact CB-CD2 4.1Å
31	F	73.7	Confident	69.3	Low	2 Å²	2	83.4 Å²	83.4	1%	0.009	43%	0.426	C	S	.	.	H	α-helix	trans	-72.3	-16.8	177.7	-81.3	-98.8	0	0	0	113.9	I27 L44 L48 L69 P74 L78	I27-F31 HydrophobicContact CG2-CD2 4Å; I27-F31 HydrophobicContact CG2-CE2 4.17Å; I27-F31 WeakPolarHBondContact O-CD2 3.4Å; I27-F31 PolarHBondContact O-N 3.13Å; F31-L44 HydrophobicContact CD2-CD2 4.13Å; F31-L44 HydrophobicContact CE1-CB 4.41Å; F31-L44 HydrophobicContact CE2-CB 4.32Å; F31-L44 HydrophobicContact CE2-CD2 3.88Å; F31-L44 HydrophobicContact CZ-CB 3.87Å; F31-L44 HydrophobicContact CZ-CD2 4.21Å; F31-L44 HydrophobicContact CZ-CG 4.48Å; F31-L48 HydrophobicContact CE1-CD1 4.06Å; F31-L48 HydrophobicContact CE2-CD2 4.17Å; F31-L48 HydrophobicContact CE2-CG 4.2Å; F31-L48 HydrophobicContact CZ-CD1 3.58Å; F31-L48 HydrophobicContact CZ-CD2 4.01Å; F31-L48 HydrophobicContact CZ-CG 3.68Å; F31-L69 HydrophobicContact CE1-CD2 4.38Å; F31-P74 HydrophobicContact CD1-CB 4Å; F31-P74 WeakPolarHBondContact CD1-O 3.49Å; F31-L78 HydrophobicContact CB-CB 4.46Å; F31-L78 HydrophobicContact CB-CD2 3.72Å; F31-L78 HydrophobicContact CD1-CB 3.8Å; F31-L78 HydrophobicContact CD1-CD2 4.37Å; F31-L78 HydrophobicContact CD1-CG 4.5Å; F31-L78 HydrophobicContact CD2-CD2 4.29Å; F31-L78 HydrophobicContact CE1-CB 4.3Å; F31-L78 HydrophobicContact CG-CB 4.17Å; F31-L78 HydrophobicContact CG-CD2 3.87Å; F31-L78 HydrophobicContact CG-CG 4.44Å
32	R	73.6	Confident	69.7	Low	201 Å²	201	81.3 Å²	81.3	76%	0.758	41%	0.414	S	S	*	.	H	α-helix	trans	-97.2	-5.5	174.6	-166.6	173.5	-178	-168.8	0.4	113.5	I28 R29 E30	I28-R32 WeakPolarHBondContact O-CB 3.47Å; I28-R32 PolarHBondContact O-N 3.49Å; R29-R32 CarbonylContact O-C 3.59Å; R29-R32 PolarHBondContact O-N 3.46Å; E30-R32 VanDerWaalsContact C-N 3.26Å; E30-R32 PolarHBondContact O-N 2.92Å
33	A	72.8	Confident	69.9	Low	19 Å²	19	81.4 Å²	81.4	16%	0.157	41%	0.414	C	S	.	.			trans	-60.4	143	179.2	0	0	0	0	0	111.9	R29 E30 R38	R29-A33 PolarHBondContact O-N 3.09Å; E30-A33 WeakPolarHBondContact O-CB 3.44Å; E30-A33 PolarHBondContact O-N 3.39Å; A33-R38 HydrophobicContact CB-CB 4.24Å; A33-R38 PolarHBondContact O-NE 2.83Å; A33-R38 PolarHBondContact O-NH2 2.89Å
34	T	59.1	Low	70	Confident	97 Å²	97	77.6 Å²	77.6	60%	0.595	39%	0.391	S	S	*	.			trans	-65.2	158.2	170.5	50.2	0	0	0	0	110.6	D36 R37 R38	T34-D36 PolarHBondContact O-N 3.09Å; T34-R37 PolarHBondContact O-N 3.37Å; T34-R38 PolarHBondContact O-N 3.36Å
35	S	58.6	Low	70.1	Confident	85 Å²	85	77.8 Å²	77.8	59%	0.594	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-43.6	-45.2	-175	45	0	0	0	0	113.7	R37 R38	S35-R37 VanDerWaalsContact C-N 3.27Å; S35-R37 PolarHBondContact O-N 3.37Å; S35-R38 PolarHBondContact O-N 3.03Å
36	D	54.6	Low	70.1	Confident	149 Å²	149	79.5 Å²	79.5	80%	0.797	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-79.9	-8.4	-168.9	-48.3	-6.9	0	0	0	113.5	T34	T34-D36 PolarHBondContact O-N 3.09Å
37	R	60.6	Low	70.2	Confident	215 Å²	215	78.7 Å²	78.7	81%	0.811	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-122.8	6.2	177.8	-69	-171.8	177.2	-173.3	-0.4	113.2	T34 S35	T34-R37 PolarHBondContact O-N 3.37Å; S35-R37 VanDerWaalsContact C-N 3.27Å; S35-R37 PolarHBondContact O-N 3.37Å
38	R	68.4	Low	70.2	Confident	94 Å²	94	78.9 Å²	78.9	36%	0.355	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-87.1	133.4	-175.4	-168.7	-177.8	-64.9	164.5	-3.2	110.3	A33 T34 S35 L44	A33-R38 HydrophobicContact CB-CB 4.24Å; A33-R38 PolarHBondContact O-NE 2.83Å; A33-R38 PolarHBondContact O-NH2 2.89Å; T34-R38 PolarHBondContact O-N 3.36Å; S35-R38 PolarHBondContact O-N 3.03Å; R38-L44 HydrophobicContact CG-CD1 3.99Å
39	L	68.4	Low	70	Confident	70 Å²	70	79.2 Å²	79.2	37%	0.366	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-55.7	145.8	168.7	-70.5	170.4	0	0	0	110.8	E30 D43 L44	E30-L39 HydrophobicContact CG-CD1 4.29Å; L39-D43 HydrophobicContact CB-CB 4.37Å; L39-L44 HydrophobicContact CB-CD2 4.03Å; L39-L44 HydrophobicContact CB-CG 4.11Å; L39-L44 HydrophobicContact CD1-CD2 4.49Å
40	P	73.1	Confident	69.8	Low	76 Å²	76	72.2 Å²	72.2	49%	0.494	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-61	150.8	178.1	27.8	-35.3	0	0	0	110.3	C42 D43 L44	P40-C42 PolarHBondContact O-N 2.87Å; P40-D43 HydrophobicContact CG-CB 4.12Å; P40-D43 VanDerWaalsContact CG-OD2 3.23Å; P40-D43 WeakPolarHBondContact CG-OD2 3.5Å; P40-D43 PolarHBondContact O-N 3.4Å; P40-L44 PolarHBondContact O-N 2.93Å; P40-L44 VanDerWaalsContact O-N 3.15Å
41	A	67.9	Low	69.7	Low	41 Å²	41	69.9 Å²	69.9	34%	0.339	36%	0.362	S	S	.	.	H	α-helix	trans	-53.8	-34.7	-172.7	0	0	0	0	0	113.4	D43 L44 I45	A41-D43 VanDerWaalsContact C-N 3.31Å; A41-D43 PolarHBondContact O-N 2.94Å; A41-L44 PolarHBondContact O-N 3.2Å; A41-I45 WeakPolarHBondContact O-CD1 3.31Å; A41-I45 WeakPolarHBondContact O-CG1 3.22Å; A41-I45 PolarHBondContact O-N 2.73Å
42	C	70.3	Confident	69.6	Low	88 Å²	88	69.8 Å²	69.8	60%	0.595	36%	0.362	S	S	*	.	H	α-helix	trans	-61.1	-35.1	175	-60.3	0	0	0	0	113.5	P40 K46	P40-C42 PolarHBondContact O-N 2.87Å; C42-K46 WeakPolarHBondContact O-CG 3.36Å; C42-K46 PolarHBondContact O-N 3.27Å; C42-K46 VanDerWaalsContact O-N 3.11Å
43	D	73.3	Confident	69.2	Low	54 Å²	54	66.3 Å²	66.3	29%	0.289	35%	0.354	S	S	.	.	H	α-helix	trans	-84.3	-33.3	-179.7	-66.2	-24.3	0	0	0	111.8	L39 P40 A41 I45 K46 V47	L39-D43 HydrophobicContact CB-CB 4.37Å; P40-D43 HydrophobicContact CG-CB 4.12Å; P40-D43 VanDerWaalsContact CG-OD2 3.23Å; P40-D43 WeakPolarHBondContact CG-OD2 3.5Å; P40-D43 PolarHBondContact O-N 3.4Å; A41-D43 VanDerWaalsContact C-N 3.31Å; A41-D43 PolarHBondContact O-N 2.94Å; D43-I45 VanDerWaalsContact C-N 3.28Å; D43-I45 PolarHBondContact O-N 3.46Å; D43-K46 WeakPolarHBondContact O-CB 3.46Å; D43-K46 PolarHBondContact O-N 3.19Å; D43-K46 WeakPolarHBondContact OD1-CD 3.41Å; D43-K46 WeakPolarHBondContact OD1-CE 3.48Å; D43-K46 IonicContact OD1-NZ 2.72Å; D43-K46 PolarHBondContact OD1-NZ 2.55Å; D43-V47 WeakPolarHBondContact O-CG2 3.34Å; D43-V47 PolarHBondContact O-N 2.9Å
44	L	74.9	Confident	68.7	Low	3 Å²	3	71.8 Å²	71.8	2%	0.016	38%	0.375	C	S	.	.	H	α-helix	trans	-60.9	-37.8	166.9	-68.4	177.9	0	0	0	111.8	E30 F31 R38 L39 P40 A41 V47 L48	E30-L44 HydrophobicContact CB-CD2 4.1Å; F31-L44 HydrophobicContact CD2-CD2 4.13Å; F31-L44 HydrophobicContact CE1-CB 4.41Å; F31-L44 HydrophobicContact CE2-CB 4.32Å; F31-L44 HydrophobicContact CE2-CD2 3.88Å; F31-L44 HydrophobicContact CZ-CB 3.87Å; F31-L44 HydrophobicContact CZ-CD2 4.21Å; F31-L44 HydrophobicContact CZ-CG 4.48Å; R38-L44 HydrophobicContact CG-CD1 3.99Å; L39-L44 HydrophobicContact CB-CD2 4.03Å; L39-L44 HydrophobicContact CB-CG 4.11Å; L39-L44 HydrophobicContact CD1-CD2 4.49Å; P40-L44 PolarHBondContact O-N 2.93Å; P40-L44 VanDerWaalsContact O-N 3.15Å; A41-L44 PolarHBondContact O-N 3.2Å; L44-V47 PolarHBondContact O-N 3.23Å; L44-L48 PolarHBondContact O-N 3.14Å
45	I	76.1	Confident	69.1	Low	35 Å²	35	69.6 Å²	69.6	18%	0.179	36%	0.355	C	S	.	.	H	α-helix	trans	-64.2	-47.5	172.4	-69.3	161	0	0	0	110.2	A41 D43 V47 L48 V49 T62 L69	A41-I45 WeakPolarHBondContact O-CD1 3.31Å; A41-I45 WeakPolarHBondContact O-CG1 3.22Å; A41-I45 PolarHBondContact O-N 2.73Å; D43-I45 VanDerWaalsContact C-N 3.28Å; D43-I45 PolarHBondContact O-N 3.46Å; I45-V47 PolarHBondContact O-N 2.95Å; I45-L48 PolarHBondContact O-N 3.43Å; I45-V49 HydrophobicContact CG2-CG2 3.96Å; I45-V49 WeakPolarHBondContact O-CB 3.31Å; I45-V49 VanDerWaalsContact O-CG2 3.23Å; I45-V49 WeakPolarHBondContact O-CG2 3.43Å; I45-V49 PolarHBondContact O-N 3.18Å; I45-T62 HydrophobicContact CG2-CG2 3.89Å; I45-L69 HydrophobicContact CD1-CD1 4.17Å; I45-L69 HydrophobicContact CG1-CD1 3.6Å
46	K	72.8	Confident	69.1	Low	129 Å²	129	71.3 Å²	71.3	56%	0.561	37%	0.365	S	S	*	.	H	α-helix	trans	-55.6	-36.4	175.9	-70.9	169.8	-164.1	163.6	0	113.2	C42 D43 V49 S50	C42-K46 WeakPolarHBondContact O-CG 3.36Å; C42-K46 PolarHBondContact O-N 3.27Å; C42-K46 VanDerWaalsContact O-N 3.11Å; D43-K46 WeakPolarHBondContact O-CB 3.46Å; D43-K46 PolarHBondContact O-N 3.19Å; D43-K46 WeakPolarHBondContact OD1-CD 3.41Å; D43-K46 WeakPolarHBondContact OD1-CE 3.48Å; D43-K46 IonicContact OD1-NZ 2.72Å; D43-K46 PolarHBondContact OD1-NZ 2.55Å; K46-V49 PolarHBondContact O-N 3.03Å; K46-S50 PolarHBondContact O-N 3.3Å; K46-S50 PolarHBondContact O-OG 3.2Å
47	V	75.6	Confident	69.8	Low	29 Å²	29	67.7 Å²	67.7	18%	0.176	35%	0.345	C	S	.	.	H	α-helix	trans	-64.7	-44.2	174.7	168.2	0	0	0	0	111.6	L22 I27 D43 L44 I45 V49 S50 I51	L22-V47 HydrophobicContact CD1-CG1 4.04Å; I27-V47 HydrophobicContact CG1-CG1 4.14Å; D43-V47 WeakPolarHBondContact O-CG2 3.34Å; D43-V47 PolarHBondContact O-N 2.9Å; L44-V47 PolarHBondContact O-N 3.23Å; I45-V47 PolarHBondContact O-N 2.95Å; V47-V49 VanDerWaalsContact C-N 3.34Å; V47-S50 PolarHBondContact O-OG 3.27Å; V47-S50 VanDerWaalsContact O-OG 3.09Å; V47-I51 HydrophobicContact CG1-CD1 4.35Å; V47-I51 WeakPolarHBondContact O-CD1 3.41Å; V47-I51 WeakPolarHBondContact O-CG1 3.32Å
48	L	73.6	Confident	70.4	Confident	5 Å²	5	59.8 Å²	59.8	3%	0.026	32%	0.317	C	S	.	.	H	α-helix	trans	-69.4	-33.9	175.8	-64.9	178.6	0	0	0	112.4	F31 L44 I45 I51 S52 I65 L78 F81	F31-L48 HydrophobicContact CE1-CD1 4.06Å; F31-L48 HydrophobicContact CE2-CD2 4.17Å; F31-L48 HydrophobicContact CE2-CG 4.2Å; F31-L48 HydrophobicContact CZ-CD1 3.58Å; F31-L48 HydrophobicContact CZ-CD2 4.01Å; F31-L48 HydrophobicContact CZ-CG 3.68Å; L44-L48 PolarHBondContact O-N 3.14Å; I45-L48 PolarHBondContact O-N 3.43Å; L48-I51 PolarHBondContact O-N 3Å; L48-S52 PolarHBondContact O-N 3.08Å; L48-S52 PolarHBondContact O-OG 3.19Å; L48-I65 HydrophobicContact CD1-CG2 3.87Å; L48-L78 HydrophobicContact CD2-CD1 3.86Å; L48-F81 HydrophobicContact CB-CD2 4.39Å; L48-F81 HydrophobicContact CB-CE2 3.93Å; L48-F81 HydrophobicContact CB-CZ 4.25Å; L48-F81 HydrophobicContact CD1-CD2 4.28Å; L48-F81 HydrophobicContact CD1-CG 4.44Å; L48-F81 HydrophobicContact CD2-CD1 3.98Å; L48-F81 HydrophobicContact CD2-CD2 4.33Å; L48-F81 HydrophobicContact CD2-CE1 3.88Å; L48-F81 HydrophobicContact CD2-CE2 4.2Å; L48-F81 HydrophobicContact CD2-CG 4.21Å; L48-F81 HydrophobicContact CD2-CZ 3.98Å; L48-F81 HydrophobicContact CG-CE2 4.47Å
49	V	73.4	Confident	70.4	Confident	30 Å²	30	58.9 Å²	58.9	18%	0.182	33%	0.329	C	S	.	.	H	α-helix	trans	-60.9	-52.9	176.1	163.4	0	0	0	0	111.3	I45 K46 V47 I51 S52 E53 F58 T62	I45-V49 HydrophobicContact CG2-CG2 3.96Å; I45-V49 WeakPolarHBondContact O-CB 3.31Å; I45-V49 VanDerWaalsContact O-CG2 3.23Å; I45-V49 WeakPolarHBondContact O-CG2 3.43Å; I45-V49 PolarHBondContact O-N 3.18Å; K46-V49 PolarHBondContact O-N 3.03Å; V47-V49 VanDerWaalsContact C-N 3.34Å; V49-I51 PolarHBondContact O-N 3.47Å; V49-S52 PolarHBondContact O-N 3.06Å; V49-E53 HydrophobicContact CG1-CG 4.16Å; V49-E53 WeakPolarHBondContact CG1-OE1 3.2Å; V49-E53 WeakPolarHBondContact O-CG 3.32Å; V49-E53 PolarHBondContact O-N 3.33Å; V49-E53 VanDerWaalsContact O-N 3.09Å; V49-F58 HydrophobicContact CB-CE2 4.06Å; V49-F58 HydrophobicContact CB-CZ 3.99Å; V49-F58 HydrophobicContact CG1-CE2 4.11Å; V49-F58 HydrophobicContact CG1-CZ 3.58Å; V49-F58 HydrophobicContact CG2-CE2 3.8Å; V49-F58 HydrophobicContact CG2-CZ 3.74Å; V49-T62 HydrophobicContact CG2-CG2 3.79Å
50	S	71.9	Confident	70.6	Confident	42 Å²	42	62.8 Å²	62.8	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-10.7	-179.6	68.9	0	0	0	0	114.7	S18 K46 V47	S18-S50 VanDerWaalsContact CB-O 3.32Å; S18-S50 WeakPolarHBondContact CB-O 3.4Å; S18-S50 PolarHBondContact OG-O 2.93Å; K46-S50 PolarHBondContact O-N 3.3Å; K46-S50 PolarHBondContact O-OG 3.2Å; V47-S50 PolarHBondContact O-OG 3.27Å; V47-S50 VanDerWaalsContact O-OG 3.09Å
51	I	72.1	Confident	70.8	Confident	3 Å²	3	59.6 Å²	59.6	2%	0.015	33%	0.325	C	S	.	.	H	α-helix	trans	-102.2	-21.4	178.3	-65.8	170.1	0	0	0	111.8	L14 I15 I27 V47 L48 V49	L14-I51 HydrophobicContact CB-CG2 3.42Å; L14-I51 VanDerWaalsContact CB-CG2 3.42Å; L14-I51 HydrophobicContact CD1-CG2 4.3Å; L14-I51 HydrophobicContact CG-CG2 4.47Å; I15-I51 HydrophobicContact CG1-CD1 4.25Å; I15-I51 HydrophobicContact CG1-CG1 4.32Å; I15-I51 HydrophobicContact CG1-CG2 4.29Å; I27-I51 HydrophobicContact CD1-CD1 3.34Å; I27-I51 HydrophobicContact CG1-CD1 4Å; V47-I51 HydrophobicContact CG1-CD1 4.35Å; V47-I51 WeakPolarHBondContact O-CD1 3.41Å; V47-I51 WeakPolarHBondContact O-CG1 3.32Å; L48-I51 PolarHBondContact O-N 3Å; V49-I51 PolarHBondContact O-N 3.47Å
52	S	70.5	Confident	71.2	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.007	32%	0.316	C	S	.	.	H	α-helix	trans	-116.7	-5.4	-172.3	52.3	0	0	0	0	116.1	L48 V49 K54 R55 F58 Y85	L48-S52 PolarHBondContact O-N 3.08Å; L48-S52 PolarHBondContact O-OG 3.19Å; V49-S52 PolarHBondContact O-N 3.06Å; S52-K54 PolarHBondContact O-N 3.31Å; S52-R55 PolarHBondContact O-N 3.2Å; S52-F58 VanDerWaalsContact OG-CD2 3.22Å; S52-F58 WeakPolarHBondContact OG-CD2 3.3Å; S52-F58 WeakPolarHBondContact OG-CE2 3.02Å; S52-Y85 WeakPolarHBondContact CB-OH 3.43Å
53	E	65.1	Low	71.5	Confident	127 Å²	127	62.2 Å²	62.2	59%	0.593	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.1	-26.3	178.7	-87.4	169.7	-161.9	0	0	116.3	V49 F58	V49-E53 HydrophobicContact CG1-CG 4.16Å; V49-E53 WeakPolarHBondContact CG1-OE1 3.2Å; V49-E53 WeakPolarHBondContact O-CG 3.32Å; V49-E53 PolarHBondContact O-N 3.33Å; V49-E53 VanDerWaalsContact O-N 3.09Å; E53-F58 HydrophobicContact CG-CE1 4.25Å; E53-F58 HydrophobicContact CG-CZ 4.33Å
54	K	63.1	Low	71.8	Confident	134 Å²	134	62.8 Å²	62.8	58%	0.583	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-1.4	-177.5	-63.6	-175.2	-172.8	174.7	0	114.9	E17 S18 S52	E17-K54 VanDerWaalsContact O-CD 3.26Å; E17-K54 WeakPolarHBondContact O-CD 3.32Å; E17-K54 WeakPolarHBondContact O-CE 3.18Å; E17-K54 PolarHBondContact O-NZ 2.76Å; S18-K54 PolarHBondContact O-NZ 2.79Å; S52-K54 PolarHBondContact O-N 3.31Å
55	R	67.1	Low	72	Confident	51 Å²	51	62.8 Å²	62.8	19%	0.192	32%	0.322	C	S	.	.	S	Bend	trans	-103.5	141.9	-179	-69.5	-64.9	-171.3	126.9	-4.1	111.5	L14 E17 S52 N57 F58 Y85 C88	L14-R55 HydrophobicContact CD2-CG 4.22Å; E17-R55 VanDerWaalsContact CD-NH2 3.35Å; E17-R55 IonicContact OE1-CZ 2.76Å; E17-R55 IonicContact OE1-NE 2.96Å; E17-R55 IonicContact OE1-NH2 3.93Å; E17-R55 PolarHBondContact OE1-NH2 2.86Å; E17-R55 IonicContact OE2-CZ 2.74Å; E17-R55 IonicContact OE2-NE 3.45Å; E17-R55 PolarHBondContact OE2-NE 3.36Å; E17-R55 IonicContact OE2-NH2 3.06Å; E17-R55 PolarHBondContact OE2-NH2 3.03Å; E17-R55 VanDerWaalsContact OE2-NH2 3.15Å; S52-R55 PolarHBondContact O-N 3.2Å; R55-N57 VanDerWaalsContact C-N 3.32Å; R55-N57 PolarHBondContact O-N 3.02Å; R55-F58 WeakPolarHBondContact O-CB 3.47Å; R55-F58 PolarHBondContact O-N 2.94Å; R55-Y85 HydrophobicContact CB-CD1 4.3Å; R55-Y85 HydrophobicContact CB-CE1 3.71Å; R55-Y85 HydrophobicContact CG-CD1 4.19Å; R55-Y85 HydrophobicContact CG-CE1 4.07Å; R55-C88 PolarHBondContact NH1-O 3.41Å; R55-C88 VanDerWaalsContact NH1-O 3.07Å
56	P	57.8	Low	72.1	Confident	121 Å²	121	62.8 Å²	62.8	79%	0.786	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-30.3	-170.9	24	-34.2	0	0	0	114.3	F58	P56-F58 PolarHBondContact O-N 3.15Å
57	N	69.8	Low	72.2	Confident	74 Å²	74	62.4 Å²	62.4	40%	0.396	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11.3	-176.2	-58.2	2.7	0	0	0	113.2	R55 A59 E60 V61	R55-N57 VanDerWaalsContact C-N 3.32Å; R55-N57 PolarHBondContact O-N 3.02Å; N57-A59 PolarHBondContact O-N 2.85Å; N57-E60 PolarHBondContact O-N 3.45Å; N57-V61 HydrophobicContact CB-CG2 4.39Å; N57-V61 WeakPolarHBondContact O-CG2 3.24Å; N57-V61 PolarHBondContact O-N 3.24Å
58	F	73.3	Confident	72.3	Confident	49 Å²	49	62 Å²	62	22%	0.215	32%	0.322	C	S	.	.	H	α-helix	trans	-55.3	-46.2	-169.5	164.5	-118.2	0	0	0	114.6	V49 S52 E53 R55 P56 E60 T62 Y85	V49-F58 HydrophobicContact CB-CE2 4.06Å; V49-F58 HydrophobicContact CB-CZ 3.99Å; V49-F58 HydrophobicContact CG1-CE2 4.11Å; V49-F58 HydrophobicContact CG1-CZ 3.58Å; V49-F58 HydrophobicContact CG2-CE2 3.8Å; V49-F58 HydrophobicContact CG2-CZ 3.74Å; S52-F58 VanDerWaalsContact OG-CD2 3.22Å; S52-F58 WeakPolarHBondContact OG-CD2 3.3Å; S52-F58 WeakPolarHBondContact OG-CE2 3.02Å; E53-F58 HydrophobicContact CG-CE1 4.25Å; E53-F58 HydrophobicContact CG-CZ 4.33Å; R55-F58 WeakPolarHBondContact O-CB 3.47Å; R55-F58 PolarHBondContact O-N 2.94Å; P56-F58 PolarHBondContact O-N 3.15Å; F58-E60 PolarHBondContact O-N 2.88Å; F58-T62 WeakPolarHBondContact CD2-OG1 3.4Å; F58-T62 WeakPolarHBondContact CE2-OG1 3.41Å; F58-T62 VanDerWaalsContact O-CB 3.31Å; F58-T62 WeakPolarHBondContact O-CB 3.5Å; F58-T62 PolarHBondContact O-N 3.18Å; F58-T62 PolarHBondContact O-OG1 3.47Å; F58-Y85 WeakPolarHBondContact CA-OH 3.35Å
59	A	67.7	Low	72.4	Confident	74 Å²	74	62.9 Å²	62.9	61%	0.612	33%	0.326	S	S	*	.	H	α-helix	trans	-68	-37.7	-175	0	0	0	0	0	113	N57 K63	N57-A59 PolarHBondContact O-N 2.85Å; A59-K63 WeakPolarHBondContact O-CB 3.46Å; A59-K63 PolarHBondContact O-N 3.18Å
60	E	73.9	Confident	72.4	Confident	152 Å²	152	68.6 Å²	68.6	71%	0.71	35%	0.351	S	S	*	.	H	α-helix	trans	-71.6	-48.3	-179.9	-62.3	-173.2	163.2	0	0	111.2	N57 F58 T62 K63 E64	N57-E60 PolarHBondContact O-N 3.45Å; F58-E60 PolarHBondContact O-N 2.88Å; E60-T62 VanDerWaalsContact C-N 3.31Å; E60-T62 PolarHBondContact O-N 2.8Å; E60-K63 PolarHBondContact O-N 3Å; E60-K63 VanDerWaalsContact O-N 3.13Å; E60-E64 PolarHBondContact O-N 3.02Å
61	V	76.9	Confident	72.3	Confident	9 Å²	9	71.7 Å²	71.7	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-62.8	-38.9	179.4	175.4	0	0	0	0	110.9	N57 K63 E64 I65 F81 R84 Y85	N57-V61 HydrophobicContact CB-CG2 4.39Å; N57-V61 WeakPolarHBondContact O-CG2 3.24Å; N57-V61 PolarHBondContact O-N 3.24Å; V61-K63 VanDerWaalsContact C-N 3.34Å; V61-K63 PolarHBondContact O-N 2.97Å; V61-E64 PolarHBondContact O-N 3.18Å; V61-I65 HydrophobicContact CG1-CD1 3.54Å; V61-I65 HydrophobicContact CG1-CG1 4.49Å; V61-I65 WeakPolarHBondContact O-CB 3.36Å; V61-I65 VanDerWaalsContact O-CD1 3.31Å; V61-I65 WeakPolarHBondContact O-CD1 3.16Å; V61-I65 VanDerWaalsContact O-CG1 3.28Å; V61-I65 WeakPolarHBondContact O-CG1 3.25Å; V61-I65 PolarHBondContact O-N 3.13Å; V61-F81 HydrophobicContact CG1-CD2 4.25Å; V61-R84 HydrophobicContact CG1-CB 4.22Å; V61-R84 HydrophobicContact CG1-CG 4.43Å; V61-R84 HydrophobicContact CG2-CB 4.07Å; V61-R84 HydrophobicContact CG2-CG 4.31Å; V61-Y85 HydrophobicContact CB-CE2 4.35Å; V61-Y85 HydrophobicContact CG1-CE2 3.65Å
62	T	75.3	Confident	72.3	Confident	25 Å²	25	77.1 Å²	77.1	15%	0.153	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-36	175.8	-58.4	0	0	0	0	112.4	I45 V49 F58 E60 S66	I45-T62 HydrophobicContact CG2-CG2 3.89Å; V49-T62 HydrophobicContact CG2-CG2 3.79Å; F58-T62 WeakPolarHBondContact CD2-OG1 3.4Å; F58-T62 WeakPolarHBondContact CE2-OG1 3.41Å; F58-T62 VanDerWaalsContact O-CB 3.31Å; F58-T62 WeakPolarHBondContact O-CB 3.5Å; F58-T62 PolarHBondContact O-N 3.18Å; F58-T62 PolarHBondContact O-OG1 3.47Å; E60-T62 VanDerWaalsContact C-N 3.31Å; E60-T62 PolarHBondContact O-N 2.8Å; T62-S66 WeakPolarHBondContact O-CB 3.35Å; T62-S66 PolarHBondContact O-N 3.26Å; T62-S66 PolarHBondContact O-OG 3Å
63	K	76.6	Confident	72.5	Confident	160 Å²	160	82.8 Å²	82.8	70%	0.696	42%	0.417	S	S	*	.	H	α-helix	trans	-71.3	-40	175.6	-170	179.5	-179.9	-176.9	0	112.1	A59 E60 V61 S66 H67	A59-K63 WeakPolarHBondContact O-CB 3.46Å; A59-K63 PolarHBondContact O-N 3.18Å; E60-K63 PolarHBondContact O-N 3Å; E60-K63 VanDerWaalsContact O-N 3.13Å; V61-K63 VanDerWaalsContact C-N 3.34Å; V61-K63 PolarHBondContact O-N 2.97Å; K63-S66 PolarHBondContact O-OG 3.47Å; K63-H67 PolarHBondContact O-N 3.1Å
64	E	79.7	Confident	73	Confident	65 Å²	65	77.1 Å²	77.1	30%	0.304	39%	0.392	S	S	.	.	H	α-helix	trans	-60.4	-46.9	173.1	-177.8	174.5	-148.6	0	0	110.8	E60 V61 H67 I68 R84	E60-E64 PolarHBondContact O-N 3.02Å; V61-E64 PolarHBondContact O-N 3.18Å; E64-H67 PolarHBondContact O-N 2.94Å; E64-I68 HydrophobicContact CG-CD1 3.89Å; E64-I68 VanDerWaalsContact O-CG1 3.32Å; E64-I68 WeakPolarHBondContact O-CG1 3.4Å; E64-I68 PolarHBondContact O-N 3.24Å; E64-R84 VanDerWaalsContact CD-NH2 3.31Å; E64-R84 IonicContact OE1-CZ 3.38Å; E64-R84 IonicContact OE1-NE 3.22Å; E64-R84 IonicContact OE1-NH2 2.99Å; E64-R84 PolarHBondContact OE1-NH2 3.47Å; E64-R84 IonicContact OE2-CZ 3.4Å; E64-R84 IonicContact OE2-NE 2.84Å; E64-R84 PolarHBondContact OE2-NE 3.14Å; E64-R84 IonicContact OE2-NH2 2.85Å; E64-R84 PolarHBondContact OE2-NH2 3.04Å; E64-R84 VanDerWaalsContact OE2-NH2 3.1Å
65	I	79.8	Confident	73.8	Confident	4 Å²	4	73.4 Å²	73.4	2%	0.021	38%	0.377	C	S	.	.	H	α-helix	trans	-70.1	-35.9	-178.4	-71.9	160.4	0	0	0	112.8	L48 V61 H67 I68 L69 A77 F81	L48-I65 HydrophobicContact CD1-CG2 3.87Å; V61-I65 HydrophobicContact CG1-CD1 3.54Å; V61-I65 HydrophobicContact CG1-CG1 4.49Å; V61-I65 WeakPolarHBondContact O-CB 3.36Å; V61-I65 VanDerWaalsContact O-CD1 3.31Å; V61-I65 WeakPolarHBondContact O-CD1 3.16Å; V61-I65 VanDerWaalsContact O-CG1 3.28Å; V61-I65 WeakPolarHBondContact O-CG1 3.25Å; V61-I65 PolarHBondContact O-N 3.13Å; I65-H67 VanDerWaalsContact C-N 3.27Å; I65-H67 PolarHBondContact O-N 3.21Å; I65-I68 PolarHBondContact O-N 3.21Å; I65-L69 HydrophobicContact CG2-CD1 3.76Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.34Å; I65-L69 WeakPolarHBondContact O-CG 3.32Å; I65-L69 PolarHBondContact O-N 3.03Å; I65-A77 HydrophobicContact CG2-CB 4.38Å; I65-F81 HydrophobicContact CD1-CB 3.51Å; I65-F81 HydrophobicContact CD1-CD2 3.39Å; I65-F81 HydrophobicContact CD1-CG 3.91Å; I65-F81 HydrophobicContact CG1-CB 4.48Å
66	S	77.6	Confident	74.4	Confident	35 Å²	35	76.3 Å²	76.3	25%	0.245	39%	0.389	C	S	.	.	H	α-helix	trans	-63	-37	175.2	71.2	0	0	0	0	111.8	T62 K63 Q70	T62-S66 WeakPolarHBondContact O-CB 3.35Å; T62-S66 PolarHBondContact O-N 3.26Å; T62-S66 PolarHBondContact O-OG 3Å; K63-S66 PolarHBondContact O-OG 3.47Å; S66-Q70 WeakPolarHBondContact O-CG 3.29Å; S66-Q70 PolarHBondContact O-N 3.16Å
67	H	76.5	Confident	75.4	Confident	120 Å²	120	70.5 Å²	70.5	56%	0.556	35%	0.351	S	S	*	.	H	α-helix	trans	-70.6	-35.8	173	-176.3	-95.7	0	0	0	113	K63 E64 I65 N71	K63-H67 PolarHBondContact O-N 3.1Å; E64-H67 PolarHBondContact O-N 2.94Å; I65-H67 VanDerWaalsContact C-N 3.27Å; I65-H67 PolarHBondContact O-N 3.21Å; H67-N71 PolarHBondContact CE1-ND2 2.84Å; H67-N71 PolarHBondContact NE2-ND2 3.28Å; H67-N71 PolarHBondContact O-ND2 2.63Å
68	I	77.2	Confident	75.8	Confident	22 Å²	22	67 Å²	67	11%	0.113	33%	0.333	C	S	.	.	H	α-helix	trans	-70.1	-40.9	175.7	-65.9	168.3	0	0	0	110.9	E64 I65 Q70 N71 K72 Y76 A77 V80	E64-I68 HydrophobicContact CG-CD1 3.89Å; E64-I68 VanDerWaalsContact O-CG1 3.32Å; E64-I68 WeakPolarHBondContact O-CG1 3.4Å; E64-I68 PolarHBondContact O-N 3.24Å; I65-I68 PolarHBondContact O-N 3.21Å; I68-Q70 PolarHBondContact O-N 3.08Å; I68-N71 PolarHBondContact O-N 3.16Å; I68-N71 VanDerWaalsContact O-N 3.1Å; I68-K72 HydrophobicContact CG2-CB 4.07Å; I68-K72 HydrophobicContact CG2-CD 4.42Å; I68-K72 PolarHBondContact O-N 3.26Å; I68-Y76 HydrophobicContact CG2-CD1 3.85Å; I68-Y76 HydrophobicContact CG2-CE1 4.18Å; I68-A77 HydrophobicContact CB-CB 4.35Å; I68-A77 HydrophobicContact CG2-CB 3.74Å; I68-V80 HydrophobicContact CD1-CB 4.39Å; I68-V80 HydrophobicContact CD1-CG1 3.98Å; I68-V80 HydrophobicContact CD1-CG2 4.47Å
69	L	76.1	Confident	76	Confident	23 Å²	23	67.9 Å²	67.9	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-63.4	-23.9	177.4	-85.3	164.9	0	0	0	114	F31 I45 I65 P74 A77	F31-L69 HydrophobicContact CE1-CD2 4.38Å; I45-L69 HydrophobicContact CD1-CD1 4.17Å; I45-L69 HydrophobicContact CG1-CD1 3.6Å; I65-L69 HydrophobicContact CG2-CD1 3.76Å; I65-L69 HydrophobicContact CG2-CG 4.29Å; I65-L69 WeakPolarHBondContact O-CB 3.34Å; I65-L69 WeakPolarHBondContact O-CG 3.32Å; I65-L69 PolarHBondContact O-N 3.03Å; L69-P74 HydrophobicContact CD2-CB 3.65Å; L69-A77 HydrophobicContact CD2-CB 4.13Å; L69-A77 HydrophobicContact CG-CB 3.91Å
70	Q	72.8	Confident	76.5	Confident	150 Å²	150	65.1 Å²	65.1	70%	0.701	32%	0.315	S	S	*	.	H	α-helix	trans	-80.7	-25.3	174.5	-72.5	175	0.7	0	0	113.1	S66 I68	S66-Q70 WeakPolarHBondContact O-CG 3.29Å; S66-Q70 PolarHBondContact O-N 3.16Å; I68-Q70 PolarHBondContact O-N 3.08Å
71	N	69.9	Low	76.7	Confident	106 Å²	106	57.9 Å²	57.9	57%	0.567	28%	0.281	S	S	*	.	H	α-helix	trans	-120.9	-13.3	-166.1	-68.5	-54.8	0	0	0	115	H67 I68	H67-N71 PolarHBondContact CE1-ND2 2.84Å; H67-N71 PolarHBondContact NE2-ND2 3.28Å; H67-N71 PolarHBondContact O-ND2 2.63Å; I68-N71 PolarHBondContact O-N 3.16Å; I68-N71 VanDerWaalsContact O-N 3.1Å
72	K	72.3	Confident	76.7	Confident	118 Å²	118	58 Å²	58	51%	0.513	28%	0.282	S	S	.	.	S	Bend	trans	-145.2	169.6	-174	-67.4	-173.5	176	-179.7	0	111.6	I68 Y76	I68-K72 HydrophobicContact CG2-CB 4.07Å; I68-K72 HydrophobicContact CG2-CD 4.42Å; I68-K72 PolarHBondContact O-N 3.26Å; K72-Y76 HydrophobicContact CB-CD1 4.2Å; K72-Y76 HydrophobicContact CD-CD1 3.7Å; K72-Y76 HydrophobicContact CD-CE1 3.49Å; K72-Y76 VanDerWaalsContact CD-CE1 3.49Å
73	D	75.1	Confident	76.8	Confident	119 Å²	119	62 Å²	62	64%	0.636	30%	0.298	S	S	*	.			trans	-56.4	137.3	177.8	-74.7	-45.8	0	0	0	113.1	M75 Y76 A77	D73-M75 VanDerWaalsContact C-N 3.29Å; D73-M75 PolarHBondContact O-N 2.93Å; D73-Y76 WeakPolarHBondContact O-CB 3.37Å; D73-Y76 PolarHBondContact O-N 3.22Å; D73-A77 PolarHBondContact O-N 3.44Å; D73-A77 VanDerWaalsContact O-N 3.14Å
74	P	75.1	Confident	76.6	Confident	9 Å²	9	59.7 Å²	59.7	6%	0.058	29%	0.285	C	S	.	.	H	α-helix	trans	-65.3	-31.5	-178	27.3	-36.2	0	0	0	112.6	F31 L69 Y76 A77 L78	F31-P74 HydrophobicContact CD1-CB 4Å; F31-P74 WeakPolarHBondContact CD1-O 3.49Å; L69-P74 HydrophobicContact CD2-CB 3.65Å; P74-Y76 VanDerWaalsContact C-N 3.25Å; P74-Y76 PolarHBondContact O-N 3.14Å; P74-A77 WeakPolarHBondContact O-CB 3.34Å; P74-A77 PolarHBondContact O-N 3.01Å; P74-A77 VanDerWaalsContact O-N 3.13Å; P74-L78 PolarHBondContact O-N 2.93Å
75	M	79.8	Confident	76.1	Confident	56 Å²	56	57.3 Å²	57.3	28%	0.276	27%	0.274	S	S	.	.	H	α-helix	trans	-65.4	-30.7	175.3	-169.3	66.5	-127.2	0	0	111.9	L7 D73 L78 L79	L7-M75 HydrophobicContact CD1-CE 4.35Å; L7-M75 HydrophobicContact CD2-CE 3.93Å; D73-M75 VanDerWaalsContact C-N 3.29Å; D73-M75 PolarHBondContact O-N 2.93Å; M75-L78 HydrophobicContact CE-CB 4.34Å; M75-L78 HydrophobicContact CE-CD2 3.85Å; M75-L78 HydrophobicContact CE-CG 4.31Å; M75-L78 HydrophobicContact SD-CD2 4.31Å; M75-L79 HydrophobicContact CE-CG 4.17Å; M75-L79 WeakPolarHBondContact O-CG 3.33Å; M75-L79 PolarHBondContact O-N 2.83Å; M75-L79 VanDerWaalsContact O-N 3.1Å
76	Y	79.6	Confident	75.5	Confident	111 Å²	111	60.7 Å²	60.7	44%	0.435	30%	0.298	S	S	.	.	H	α-helix	trans	-71.1	-40.2	171.1	177	-97.6	0	0	0	110.9	I68 K72 D73 P74 L78 L79 V80	I68-Y76 HydrophobicContact CG2-CD1 3.85Å; I68-Y76 HydrophobicContact CG2-CE1 4.18Å; K72-Y76 HydrophobicContact CB-CD1 4.2Å; K72-Y76 HydrophobicContact CD-CD1 3.7Å; K72-Y76 HydrophobicContact CD-CE1 3.49Å; K72-Y76 VanDerWaalsContact CD-CE1 3.49Å; D73-Y76 WeakPolarHBondContact O-CB 3.37Å; D73-Y76 PolarHBondContact O-N 3.22Å; P74-Y76 VanDerWaalsContact C-N 3.25Å; P74-Y76 PolarHBondContact O-N 3.14Å; Y76-L78 VanDerWaalsContact C-N 3.33Å; Y76-L78 PolarHBondContact O-N 3.28Å; Y76-L79 PolarHBondContact O-N 3.48Å; Y76-V80 HydrophobicContact CD1-CG2 4.35Å; Y76-V80 HydrophobicContact CE1-CG2 3.96Å; Y76-V80 HydrophobicContact CE2-CG2 4.4Å; Y76-V80 WeakPolarHBondContact O-CG2 3.4Å; Y76-V80 PolarHBondContact O-N 3.2Å
77	A	78.1	Confident	74.3	Confident	0 Å²	0	66 Å²	66	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.1	-40.9	172.5	0	0	0	0	0	112.7	I65 I68 L69 D73 P74 V80 F81	I65-A77 HydrophobicContact CG2-CB 4.38Å; I68-A77 HydrophobicContact CB-CB 4.35Å; I68-A77 HydrophobicContact CG2-CB 3.74Å; L69-A77 HydrophobicContact CD2-CB 4.13Å; L69-A77 HydrophobicContact CG-CB 3.91Å; D73-A77 PolarHBondContact O-N 3.44Å; D73-A77 VanDerWaalsContact O-N 3.14Å; P74-A77 WeakPolarHBondContact O-CB 3.34Å; P74-A77 PolarHBondContact O-N 3.01Å; P74-A77 VanDerWaalsContact O-N 3.13Å; A77-V80 PolarHBondContact O-N 2.85Å; A77-F81 PolarHBondContact O-N 3.45Å
78	L	78.1	Confident	72.6	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-68	-34	176	-177.2	63	0	0	0	112.8	L7 L11 I27 I28 F31 L48 P74 M75 Y76 F81 V82	L7-L78 HydrophobicContact CD1-CG 4.43Å; L11-L78 HydrophobicContact CD2-CD1 4.4Å; I27-L78 HydrophobicContact CG2-CD1 4.26Å; I28-L78 HydrophobicContact CG1-CD2 4.49Å; F31-L78 HydrophobicContact CB-CB 4.46Å; F31-L78 HydrophobicContact CB-CD2 3.72Å; F31-L78 HydrophobicContact CD1-CB 3.8Å; F31-L78 HydrophobicContact CD1-CD2 4.37Å; F31-L78 HydrophobicContact CD1-CG 4.5Å; F31-L78 HydrophobicContact CD2-CD2 4.29Å; F31-L78 HydrophobicContact CE1-CB 4.3Å; F31-L78 HydrophobicContact CG-CB 4.17Å; F31-L78 HydrophobicContact CG-CD2 3.87Å; F31-L78 HydrophobicContact CG-CG 4.44Å; L48-L78 HydrophobicContact CD2-CD1 3.86Å; P74-L78 PolarHBondContact O-N 2.93Å; M75-L78 HydrophobicContact CE-CB 4.34Å; M75-L78 HydrophobicContact CE-CD2 3.85Å; M75-L78 HydrophobicContact CE-CG 4.31Å; M75-L78 HydrophobicContact SD-CD2 4.31Å; Y76-L78 VanDerWaalsContact C-N 3.33Å; Y76-L78 PolarHBondContact O-N 3.28Å; L78-F81 HydrophobicContact CD1-CD1 4.35Å; L78-V82 PolarHBondContact O-N 3.39Å; L78-V82 VanDerWaalsContact O-N 3.13Å
79	L	78.4	Confident	70.3	Confident	68 Å²	68	70.8 Å²	70.8	36%	0.356	34%	0.343	S	S	.	.	H	α-helix	trans	-67.2	-44.2	173.6	-77.8	162.3	0	0	0	111.5	L7 M75 Y76 V82 E83	L7-L79 HydrophobicContact CD1-CD2 3.77Å; L7-L79 HydrophobicContact CD1-CG 4.35Å; M75-L79 HydrophobicContact CE-CG 4.17Å; M75-L79 WeakPolarHBondContact O-CG 3.33Å; M75-L79 PolarHBondContact O-N 2.83Å; M75-L79 VanDerWaalsContact O-N 3.1Å; Y76-L79 PolarHBondContact O-N 3.48Å; L79-V82 PolarHBondContact O-N 2.86Å; L79-E83 WeakPolarHBondContact O-CB 3.46Å; L79-E83 PolarHBondContact O-N 3.37Å
80	V	77.4	Confident	68.1	Low	15 Å²	15	75.1 Å²	75.1	9%	0.091	37%	0.372	C	S	.	.	H	α-helix	trans	-64	-40.5	175.9	174.6	0	0	0	0	111.3	I68 Y76 A77 V82 E83 R84	I68-V80 HydrophobicContact CD1-CB 4.39Å; I68-V80 HydrophobicContact CD1-CG1 3.98Å; I68-V80 HydrophobicContact CD1-CG2 4.47Å; Y76-V80 HydrophobicContact CD1-CG2 4.35Å; Y76-V80 HydrophobicContact CE1-CG2 3.96Å; Y76-V80 HydrophobicContact CE2-CG2 4.4Å; Y76-V80 WeakPolarHBondContact O-CG2 3.4Å; Y76-V80 PolarHBondContact O-N 3.2Å; A77-V80 PolarHBondContact O-N 2.85Å; V80-V82 PolarHBondContact O-N 2.88Å; V80-E83 PolarHBondContact O-N 3.15Å; V80-R84 HydrophobicContact CG1-CG 4.45Å; V80-R84 WeakPolarHBondContact O-CG 3.47Å; V80-R84 PolarHBondContact O-N 3.47Å
81	F	79	Confident	65.9	Low	1 Å²	1	74.4 Å²	74.4	0%	0.004	38%	0.378	C	S	.	.	H	α-helix	trans	-53.6	-52.4	171.6	177.5	-100.4	0	0	0	111.7	L11 L14 L48 V61 I65 A77 L78 E83 R84 Y85	L11-F81 HydrophobicContact CD2-CD1 4.41Å; L11-F81 HydrophobicContact CD2-CE1 4.04Å; L14-F81 HydrophobicContact CD1-CE1 3.8Å; L14-F81 HydrophobicContact CD1-CZ 4.1Å; L48-F81 HydrophobicContact CB-CD2 4.39Å; L48-F81 HydrophobicContact CB-CE2 3.93Å; L48-F81 HydrophobicContact CB-CZ 4.25Å; L48-F81 HydrophobicContact CD1-CD2 4.28Å; L48-F81 HydrophobicContact CD1-CG 4.44Å; L48-F81 HydrophobicContact CD2-CD1 3.98Å; L48-F81 HydrophobicContact CD2-CD2 4.33Å; L48-F81 HydrophobicContact CD2-CE1 3.88Å; L48-F81 HydrophobicContact CD2-CE2 4.2Å; L48-F81 HydrophobicContact CD2-CG 4.21Å; L48-F81 HydrophobicContact CD2-CZ 3.98Å; L48-F81 HydrophobicContact CG-CE2 4.47Å; V61-F81 HydrophobicContact CG1-CD2 4.25Å; I65-F81 HydrophobicContact CD1-CB 3.51Å; I65-F81 HydrophobicContact CD1-CD2 3.39Å; I65-F81 HydrophobicContact CD1-CG 3.91Å; I65-F81 HydrophobicContact CG1-CB 4.48Å; A77-F81 PolarHBondContact O-N 3.45Å; L78-F81 HydrophobicContact CD1-CD1 4.35Å; F81-E83 VanDerWaalsContact C-N 3.34Å; F81-E83 PolarHBondContact O-N 3.2Å; F81-R84 PolarHBondContact O-N 3.36Å; F81-Y85 HydrophobicContact CD1-CD2 4.31Å; F81-Y85 AromaticContact CD2-CD2 3.91Å; F81-Y85 HydrophobicContact CD2-CD2 3.91Å; F81-Y85 AromaticContact CD2-CE2 3.57Å; F81-Y85 HydrophobicContact CD2-CE2 3.57Å; F81-Y85 HydrophobicContact CE1-CD2 4.19Å; F81-Y85 HydrophobicContact CE1-CE2 4.49Å; F81-Y85 AromaticContact CE2-CD2 3.84Å; F81-Y85 HydrophobicContact CE2-CD2 3.84Å; F81-Y85 AromaticContact CE2-CE2 3.33Å; F81-Y85 HydrophobicContact CE2-CE2 3.33Å; F81-Y85 HydrophobicContact CG-CD2 4.19Å; F81-Y85 HydrophobicContact CG-CE2 4.3Å; F81-Y85 AromaticContact CZ-CD2 3.98Å; F81-Y85 HydrophobicContact CZ-CD2 3.98Å; F81-Y85 AromaticContact CZ-CE2 3.85Å; F81-Y85 HydrophobicContact CZ-CE2 3.85Å; F81-Y85 VanDerWaalsContact O-CD2 3.22Å; F81-Y85 WeakPolarHBondContact O-CD2 3.33Å; F81-Y85 PolarHBondContact O-N 3.25Å
82	V	76.8	Confident	63.8	Low	11 Å²	11	74.8 Å²	74.8	7%	0.067	39%	0.389	C	S	.	.	H	α-helix	trans	-62.7	-40.2	179.3	158.1	0	0	0	0	112.1	L7 V10 L11 L78 L79 V80 Y85 S86	L7-V82 HydrophobicContact CD1-CB 3.94Å; L7-V82 HydrophobicContact CD1-CG1 4.19Å; L7-V82 HydrophobicContact CD1-CG2 3.61Å; L7-V82 HydrophobicContact CG-CG2 4.15Å; V10-V82 HydrophobicContact CB-CG1 4.03Å; V10-V82 HydrophobicContact CB-CG2 4.42Å; V10-V82 HydrophobicContact CG1-CG1 4.3Å; V10-V82 HydrophobicContact CG1-CG2 4.35Å; V10-V82 HydrophobicContact CG2-CG1 4.12Å; L11-V82 HydrophobicContact CD2-CG2 4.31Å; L11-V82 HydrophobicContact CG-CG2 4.1Å; L78-V82 PolarHBondContact O-N 3.39Å; L78-V82 VanDerWaalsContact O-N 3.13Å; L79-V82 PolarHBondContact O-N 2.86Å; V80-V82 PolarHBondContact O-N 2.88Å; V82-Y85 PolarHBondContact O-N 3.24Å; V82-S86 WeakPolarHBondContact O-CB 3.3Å; V82-S86 PolarHBondContact O-N 3.48Å
83	E	76.9	Confident	61.6	Low	109 Å²	109	78.2 Å²	78.2	51%	0.509	41%	0.407	S	S	.	.	H	α-helix	trans	-61.5	-47.6	179.2	-164.8	157.2	-135.6	0	0	110.7	L79 V80 F81 Y85 S86	L79-E83 WeakPolarHBondContact O-CB 3.46Å; L79-E83 PolarHBondContact O-N 3.37Å; V80-E83 PolarHBondContact O-N 3.15Å; F81-E83 VanDerWaalsContact C-N 3.34Å; F81-E83 PolarHBondContact O-N 3.2Å; E83-Y85 PolarHBondContact O-N 3.48Å; E83-S86 WeakPolarHBondContact O-CB 3.47Å; E83-S86 PolarHBondContact O-N 2.98Å; E83-S86 VanDerWaalsContact O-N 3.15Å
84	R	72.1	Confident	59.1	Low	111 Å²	111	77.4 Å²	77.4	42%	0.419	41%	0.41	S	S	.	.	H	α-helix	trans	-59.9	-38.1	176.1	-66.7	-62.8	-162.4	-179	0.4	113.8	V61 E64 V80 F81	V61-R84 HydrophobicContact CG1-CB 4.22Å; V61-R84 HydrophobicContact CG1-CG 4.43Å; V61-R84 HydrophobicContact CG2-CB 4.07Å; V61-R84 HydrophobicContact CG2-CG 4.31Å; E64-R84 VanDerWaalsContact CD-NH2 3.31Å; E64-R84 IonicContact OE1-CZ 3.38Å; E64-R84 IonicContact OE1-NE 3.22Å; E64-R84 IonicContact OE1-NH2 2.99Å; E64-R84 PolarHBondContact OE1-NH2 3.47Å; E64-R84 IonicContact OE2-CZ 3.4Å; E64-R84 IonicContact OE2-NE 2.84Å; E64-R84 PolarHBondContact OE2-NE 3.14Å; E64-R84 IonicContact OE2-NH2 2.85Å; E64-R84 PolarHBondContact OE2-NH2 3.04Å; E64-R84 VanDerWaalsContact OE2-NH2 3.1Å; V80-R84 HydrophobicContact CG1-CG 4.45Å; V80-R84 WeakPolarHBondContact O-CG 3.47Å; V80-R84 PolarHBondContact O-N 3.47Å; F81-R84 PolarHBondContact O-N 3.36Å
85	Y	70	Confident	56.6	Low	15 Å²	15	81.8 Å²	81.8	6%	0.059	44%	0.441	C	S	.	.	H	α-helix	trans	-84.5	-15.1	177.7	-71.7	-66.8	0	0	0	114.1	L14 S52 R55 F58 V61 F81 V82 E83 E87	L14-Y85 HydrophobicContact CD1-CD2 4.17Å; L14-Y85 HydrophobicContact CD1-CG 4.11Å; L14-Y85 HydrophobicContact CD2-CD1 4.35Å; L14-Y85 HydrophobicContact CD2-CG 4.35Å; S52-Y85 WeakPolarHBondContact CB-OH 3.43Å; R55-Y85 HydrophobicContact CB-CD1 4.3Å; R55-Y85 HydrophobicContact CB-CE1 3.71Å; R55-Y85 HydrophobicContact CG-CD1 4.19Å; R55-Y85 HydrophobicContact CG-CE1 4.07Å; F58-Y85 WeakPolarHBondContact CA-OH 3.35Å; V61-Y85 HydrophobicContact CB-CE2 4.35Å; V61-Y85 HydrophobicContact CG1-CE2 3.65Å; F81-Y85 HydrophobicContact CD1-CD2 4.31Å; F81-Y85 AromaticContact CD2-CD2 3.91Å; F81-Y85 HydrophobicContact CD2-CD2 3.91Å; F81-Y85 AromaticContact CD2-CE2 3.57Å; F81-Y85 HydrophobicContact CD2-CE2 3.57Å; F81-Y85 HydrophobicContact CE1-CD2 4.19Å; F81-Y85 HydrophobicContact CE1-CE2 4.49Å; F81-Y85 AromaticContact CE2-CD2 3.84Å; F81-Y85 HydrophobicContact CE2-CD2 3.84Å; F81-Y85 AromaticContact CE2-CE2 3.33Å; F81-Y85 HydrophobicContact CE2-CE2 3.33Å; F81-Y85 HydrophobicContact CG-CD2 4.19Å; F81-Y85 HydrophobicContact CG-CE2 4.3Å; F81-Y85 AromaticContact CZ-CD2 3.98Å; F81-Y85 HydrophobicContact CZ-CD2 3.98Å; F81-Y85 AromaticContact CZ-CE2 3.85Å; F81-Y85 HydrophobicContact CZ-CE2 3.85Å; F81-Y85 VanDerWaalsContact O-CD2 3.22Å; F81-Y85 WeakPolarHBondContact O-CD2 3.33Å; F81-Y85 PolarHBondContact O-N 3.25Å; V82-Y85 PolarHBondContact O-N 3.24Å; E83-Y85 PolarHBondContact O-N 3.48Å; Y85-E87 VanDerWaalsContact C-N 3.3Å; Y85-E87 PolarHBondContact O-N 2.94Å
86	S	66.4	Low	53.9	Low	75 Å²	75	84.8 Å²	84.8	52%	0.524	47%	0.468	S	S	.	.	H	α-helix	trans	-70.9	-23.4	173.9	-173	0	0	0	0	113.2	V82 E83	V82-S86 WeakPolarHBondContact O-CB 3.3Å; V82-S86 PolarHBondContact O-N 3.48Å; E83-S86 WeakPolarHBondContact O-CB 3.47Å; E83-S86 PolarHBondContact O-N 2.98Å; E83-S86 VanDerWaalsContact O-N 3.15Å
87	E	52.4	Low	51.1	Low	146 Å²	146	84.4 Å²	84.4	68%	0.682	48%	0.481	S	S	*	.	S	Bend	trans	-86.4	-17.9	-173.9	-66.1	-177.8	150.8	0	0	113.5	Y85 K89	Y85-E87 VanDerWaalsContact C-N 3.3Å; Y85-E87 PolarHBondContact O-N 2.94Å; E87-K89 PolarHBondContact O-N 3.04Å
88	C	40.7	Very low	48.4	Very low	51 Å²	51	89.9 Å²	89.9	35%	0.345	52%	0.515	S	S	.	.			trans	-92.2	86.9	-178.4	-72.7	0	0	0	0	113.3	R55	R55-C88 PolarHBondContact NH1-O 3.41Å; R55-C88 VanDerWaalsContact NH1-O 3.07Å
89	K	30.3	Very low	45.7	Very low	192 Å²	192	94.3 Å²	94.3	84%	0.835	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-60.3	143.7	164	-71.9	-176.9	179.1	178.4	0	110.8	E87	E87-K89 PolarHBondContact O-N 3.04Å
90	P	28.1	Very low	43	Very low	114 Å²	114	98.3 Å²	98.3	74%	0.74	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-70.7	133.5	175.7	29.7	-33.6	0	0	0	110.8
91	V	28.3	Very low	40.3	Very low	136 Å²	136	102.4 Å²	102.4	82%	0.824	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-80.4	122.3	172.1	177	0	0	0	0	108.7
92	S	25.7	Very low	37.7	Very low	113 Å²	113	106.4 Å²	106.4	79%	0.79	63%	0.63	S	S	*	*			trans	-94.2	112.8	170.9	55	0	0	0	0	109.9
93	E	25.4	Very low	35.2	Very low	190 Å²	190	115.3 Å²	115.3	89%	0.888	67%	0.673	S	S	*	*			trans	-147.7	148.5	164	-127.1	172.1	-139.6	0	0	111.3
94	S	21.9	Very low	32.6	Very low	102 Å²	102	113.1 Å²	113.1	71%	0.713	68%	0.679	S	S	*	*			trans	-112.7	135.6	-163.1	52.9	0	0	0	0	114
95	S	24	Very low	30.5	Very low	101 Å²	101	115.9 Å²	115.9	71%	0.706	70%	0.702	S	S	*	*			trans	67.5	124.2	147.5	59.5	0	0	0	0	121.7
96	S	21.7	Very low	28.9	Very low	119 Å²	119	119.2 Å²	119.2	83%	0.832	73%	0.725	S	S	*	*			trans	65.5	139.5	148.4	64	0	0	0	0	118.6
97	S	20.9	Very low	26.9	Very low	103 Å²	103	124.6 Å²	124.6	72%	0.72	74%	0.741	S	S	*	*			cis	-140.3	-179	-0.2	58	0	0	0	0	108
98	T	22.5	Very low	25.5	Very low	115 Å²	115	120.7 Å²	120.7	71%	0.706	74%	0.741	S	S	*	*			cis	-171	135	45.5	-35.3	0	0	0	0	110
99	S	20.1	Very low	24.7	Very low	93 Å²	93	125.4 Å²	125.4	65%	0.65	76%	0.763	S	S	*	*			trans	34.9	150.1	145.5	72.7	0	0	0	0	125.1
100	L	22.6	Very low	24.4	Very low	153 Å²	153	124.3 Å²	124.3	80%	0.801	76%	0.758	S	S	*	*			trans	96.6	106.4	145.8	-75.6	155.9	0	0	0	120
101	S	21.3	Very low	24.1	Very low	101 Å²	101	125.1 Å²	125.1	71%	0.706	76%	0.761	S	S	*	*				42	147.3	123.8	64.1	0	0	0	0	121.4
102	A	22.9	Very low	23.9	Very low	85 Å²	85	123.7 Å²	123.7	70%	0.702	76%	0.757	S	S	*	*			cis	-176.5	176.3	-9.6	0	0	0	0	0	107.7
103	M	24.5	Very low	23.8	Very low	197 Å²	197	125.3 Å²	125.3	97%	0.97	76%	0.757	S	S	*	*			trans	66.3	139.6	170.7	-57.6	179	168.1	0	0	116.4
104	G	22.8	Very low	23.8	Very low	63 Å²	63	122.1 Å²	122.1	65%	0.649	75%	0.75	S	S	*	*			cis	159	138.4	-11.2	0	0	0	0	0	114.3
105	L	27.1	Very low	23.9	Very low	170 Å²	170	124.2 Å²	124.2	89%	0.89	75%	0.753	S	S	*	*			trans	76.4	161.7	148.9	-57.8	172.3	0	0	0	118.3
106	P	36.7	Very low	23.9	Very low	85 Å²	85	124.4 Å²	124.4	55%	0.552	76%	0.755	S	S	*	*				-147.6	-170.4	-55.9	43.1	-26.5	0	0	0	115.1
107	H	25.2	Very low	24	Very low	187 Å²	187	123.5 Å²	123.5	87%	0.866	75%	0.754	S	S	*	*			trans	84.8	138.3	159.2	-56.6	-24.7	0	0	0	117.8
108	G	22.9	Very low	24.2	Very low	65 Å²	65	123.3 Å²	123.3	67%	0.67	76%	0.759	S	S	*	*			cis	158.9	163.2	-8.4	0	0	0	0	0	113.8
109	N	23.7	Very low	24.2	Very low	150 Å²	150	121.6 Å²	121.6	80%	0.802	76%	0.764	S	S	*	*			trans	66.5	154.7	171.2	-72.1	-21.8	0	0	0	117.4
110	K	23.6	Very low	24.4	Very low	168 Å²	168	122.9 Å²	122.9	73%	0.73	77%	0.773	S	S	*	*			cis	-178.9	149.4	-32.4	-121	-176.9	-175	179.3	0	106.9
111	T	22.7	Very low	24.5	Very low	131 Å²	131	122.1 Å²	122.1	80%	0.804	77%	0.774	S	S	*	*			trans	61.6	157.2	156.4	50.7	0	0	0	0	117.2
112	S	24	Very low	25.2	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	77%	0.774	S	S	*	*			cis	-152.7	169.9	4.7	36	0	0	0	0	111.1
113	D	22.4	Very low	25.3	Very low	147 Å²	147	123.8 Å²	123.8	79%	0.786	77%	0.773	S	S	*	*			trans	-60.5	172.3	178.3	-44.7	-89.7	0	0	0	116.1
114	V	25.6	Very low	25.3	Very low	123 Å²	123	120.1 Å²	120.1	75%	0.745	76%	0.762	S	S	*	*				178.5	123	118.2	149.4	0	0	0	0	111.8
115	N	25.2	Very low	25.3	Very low	145 Å²	145	124.2 Å²	124.2	78%	0.775	77%	0.769	S	S	*	*			trans	41	155.6	143.9	-53.8	-19.1	0	0	0	121.7
116	S	24.2	Very low	25	Very low	106 Å²	106	120 Å²	120	74%	0.741	76%	0.759	S	S	*	*			cis	-162.4	142	7.4	19.5	0	0	0	0	108.4
117	A	23.9	Very low	24.4	Very low	100 Å²	100	124.3 Å²	124.3	83%	0.826	78%	0.775	S	S	*	*				62	143.1	97.3	0	0	0	0	0	115.7
118	A	23.9	Very low	24.3	Very low	99 Å²	99	119.2 Å²	119.2	82%	0.818	77%	0.766	S	S	*	*			cis	-164.1	166.5	8.1	0	0	0	0	0	113.2
119	G	23.2	Very low	24.3	Very low	78 Å²	78	120.8 Å²	120.8	80%	0.804	77%	0.766	S	S	*	*			trans	79.9	150.4	153.5	0	0	0	0	0	118.5
120	S	24.1	Very low	24.2	Very low	120 Å²	120	120 Å²	120	84%	0.839	77%	0.767	S	S	*	*			cis	-162.4	152.2	-6.1	51.1	0	0	0	0	112.4
121	V	24	Very low	24.2	Very low	137 Å²	137	116.7 Å²	116.7	83%	0.83	77%	0.765	S	S	*	*			trans	-88.4	177.9	170.4	-145.5	0	0	0	0	108.1
122	P	37.4	Very low	24.2	Very low	108 Å²	108	116.2 Å²	116.2	70%	0.701	76%	0.762	S	S	*	*			cis	-135.5	-174.1	14.3	36.3	-10.4	0	0	0	115.2
123	T	23.9	Very low	24.1	Very low	113 Å²	113	118 Å²	118	69%	0.693	76%	0.762	S	S	*	*				178.7	123.5	75.5	-54.3	0	0	0	0	111.9
124	T	24.3	Very low	24.1	Very low	120 Å²	120	117.5 Å²	117.5	74%	0.736	76%	0.758	S	S	*	*			trans	31.7	146.8	136.5	-8.6	0	0	0	0	121.1
125	L	23	Very low	23.9	Very low	149 Å²	149	117 Å²	117	78%	0.78	76%	0.756	S	S	*	*			cis	-152.9	137.6	35.9	-88.4	156.5	0	0	0	111.1
126	A	22.1	Very low	23.7	Very low	83 Å²	83	115.5 Å²	115.5	69%	0.686	75%	0.752	S	S	*	*				57.4	127.2	100.3	0	0	0	0	0	116.1
127	I	23.7	Very low	23.6	Very low	174 Å²	174	115.3 Å²	115.3	89%	0.892	75%	0.751	S	S	*	*				-145	151	85.2	-82.9	154.7	0	0	0	112.3
128	A	22.8	Very low	23.5	Very low	81 Å²	81	118.3 Å²	118.3	67%	0.669	75%	0.747	S	S	*	*			trans	-85	178.8	-180	0	0	0	0	0	112.5
129	S	23.1	Very low	23.4	Very low	98 Å²	98	120 Å²	120	69%	0.685	74%	0.743	S	S	*	*			cis	-170	153.1	41.8	-40.9	0	0	0	0	113.4
130	T	22.1	Very low	23.4	Very low	133 Å²	133	122.2 Å²	122.2	82%	0.816	74%	0.741	S	S	*	*			trans	32.5	142.9	137.3	59.9	0	0	0	0	121.1
131	S	22.5	Very low	23.2	Very low	98 Å²	98	122.3 Å²	122.3	69%	0.685	74%	0.741	S	S	*	*			cis	-163.1	137.6	23.8	35.7	0	0	0	0	109.8
132	T	22.6	Very low	23.1	Very low	122 Å²	122	119.2 Å²	119.2	75%	0.748	74%	0.737	S	S	*	*				46.8	137.6	96.6	30.4	0	0	0	0	115.7
133	I	22.3	Very low	22.3	Very low	143 Å²	143	119.6 Å²	119.6	73%	0.733	74%	0.742	S	S	*	*			cis	-164.8	144.4	37.6	-124.6	148.2	0	0	0	113.2
134	L	21.5	Very low	22.2	Very low	137 Å²	137	120.4 Å²	120.4	72%	0.717	75%	0.747	S	S	*	*			trans	37.9	122.4	147.6	-81.5	92.7	0	0	0	124.1
135	T	21.3	Very low	22.1	Very low	113 Å²	113	126 Å²	126	69%	0.693	76%	0.755	S	S	*	*				68.3	147.9	94.5	70.6	0	0	0	0	116.7
136	T	21.6	Very low	22	Very low	114 Å²	114	127.4 Å²	127.4	70%	0.699	76%	0.762	S	S	*	*			cis	-161.8	165.2	46.2	47.4	0	0	0	0	114.6
137	S	21.7	Very low	22	Very low	101 Å²	101	128.7 Å²	128.7	71%	0.706	77%	0.766	S	S	*	*			trans	59.9	150.6	139.1	59.1	0	0	0	0	121.9
138	Q	22.8	Very low	21.9	Very low	163 Å²	163	128.7 Å²	128.7	76%	0.762	77%	0.767	S	S	*	*			cis	-174.7	161.9	-25.4	-127.8	-177.6	5.5	0	0	108
139	N	21.8	Very low	22	Very low	136 Å²	136	131.5 Å²	131.5	73%	0.727	78%	0.776	S	S	*	*			trans	68.5	156.9	158.3	-58.8	-15.7	0	0	0	119.3
140	V	21.7	Very low	22	Very low	124 Å²	124	135.2 Å²	135.2	75%	0.752	78%	0.782	S	S	*	*			cis	-172.1	154.9	-41.9	127.6	0	0	0	0	107.5
141	S	21.5	Very low	22.1	Very low	122 Å²	122	134 Å²	134	85%	0.853	78%	0.78	S	S	*	*			trans	67.3	147.8	172.3	78.2	0	0	0	0	118.4
142	G	20.6	Very low	22.2	Very low	71 Å²	71	137.2 Å²	137.2	73%	0.732	78%	0.784	S	S	*	*			cis	177.6	139.5	-11	0	0	0	0	0	114.1
143	S	20.8	Very low	22.3	Very low	116 Å²	116	138.8 Å²	138.8	81%	0.811	79%	0.787	S	S	*	*			trans	51.2	124.8	159.1	-66.1	0	0	0	0	122.1
144	T	22.6	Very low	22.3	Very low	131 Å²	131	141.2 Å²	141.2	80%	0.804	79%	0.793	S	S	*	*				-163.9	128.8	102.6	9.8	0	0	0	0	116
145	R	22.7	Very low	22.5	Very low	238 Å²	238	140.8 Å²	140.8	90%	0.898	80%	0.799	S	S	*	*			trans	51.3	103.9	148.8	-69.4	179.6	178.2	-178.7	-0.4	121.8
146	L	20.7	Very low	22.7	Very low	177 Å²	177	141.7 Å²	141.7	93%	0.927	80%	0.804	S	S	*	*			trans	-70	146.9	134.5	-76.5	148.5	0	0	0	110.4
147	S	22.5	Very low	23	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	81%	0.806	S	S	*	*			trans	-130.9	129.8	161.7	54.6	0	0	0	0	109.5
148	L	21.9	Very low	23.2	Very low	173 Å²	173	142.9 Å²	142.9	91%	0.906	81%	0.812	S	S	*	*			trans	-72.8	145.3	-175.2	-59.7	100.8	0	0	0	112.3
149	T	22.9	Very low	23.5	Very low	140 Å²	140	140.9 Å²	140.9	86%	0.859	81%	0.813	S	S	*	*			trans	-119.4	150	154	46.4	0	0	0	0	109.9
150	Q	24.8	Very low	23.7	Very low	176 Å²	176	141.3 Å²	141.3	82%	0.822	82%	0.82	S	S	*	*			trans	-81.1	138.5	-162.8	-65.3	154.7	-27.4	0	0	112.1	Q152	Q150-Q152 PolarHBondContact O-N 3.24Å
151	S	23.2	Very low	23.8	Very low	109 Å²	109	143 Å²	143	76%	0.762	82%	0.824	S	S	*	*			trans	-74.1	109.3	161.8	52	0	0	0	0	109.5
152	Q	26	Very low	23.8	Very low	165 Å²	165	141.8 Å²	141.8	77%	0.771	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-92.2	121.1	162.9	-75	-170.7	-12.2	0	0	109.3	Q150	Q150-Q152 PolarHBondContact O-N 3.24Å
153	D	23.4	Very low	24	Very low	154 Å²	154	147.4 Å²	147.4	82%	0.824	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-74.2	132.3	176.5	-69.2	-54.3	0	0	0	111.3
154	F	23.4	Very low	24.2	Very low	194 Å²	194	151.6 Å²	151.6	85%	0.851	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-80.4	129.7	173.3	-78	-92.4	0	0	0	110.9	T156	F154-T156 PolarHBondContact O-N 3.31Å
155	P	25.3	Very low	24.1	Very low	129 Å²	129	149 Å²	149	84%	0.838	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-71.8	128.7	-179.6	28.7	-33.6	0	0	0	111.3
156	T	25.5	Very low	24.2	Very low	131 Å²	131	143.4 Å²	143.4	80%	0.804	81%	0.807	S	S	*	*			trans	-105.9	151.5	171.8	-58.8	0	0	0	0	110	F154	F154-T156 PolarHBondContact O-N 3.31Å
157	S	27.1	Very low	24.2	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	80%	0.804	S	S	*	*			trans	106.9	116.3	157.5	76.4	0	0	0	0	118.5
158	T	26.8	Very low	24.1	Very low	136 Å²	136	143 Å²	143	83%	0.834	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-59	132.4	143.2	5.8	0	0	0	0	109.3	V160	T158-V160 PolarHBondContact O-N 2.96Å
159	P	29.4	Very low	24.2	Very low	121 Å²	121	141.2 Å²	141.2	79%	0.786	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-79.7	120.2	-179.9	30.3	-32.7	0	0	0	111.6
160	V	24.9	Very low	24.1	Very low	144 Å²	144	139.8 Å²	139.8	87%	0.873	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-89	125.9	155.7	176.1	0	0	0	0	106.9	T158	T158-V160 PolarHBondContact O-N 2.96Å
161	N	23.9	Very low	24.1	Very low	159 Å²	159	137.8 Å²	137.8	85%	0.85	78%	0.782	S	S	*	*			trans	-140.1	142.1	167.5	-159.3	2.7	0	0	0	111.8
162	C	21.5	Very low	24.4	Very low	97 Å²	97	138 Å²	138	66%	0.655	78%	0.78	S	S	*	*			trans	-151.7	124	-175.2	-145.5	0	0	0	0	111.9
163	K	25.2	Very low	24.2	Very low	189 Å²	189	135.8 Å²	135.8	82%	0.822	78%	0.778	S	S	*	*			trans	74.1	116.9	159.1	-59.3	-177.8	178.4	-176.9	0	120.9
164	K	24	Very low	24.2	Very low	205 Å²	205	134.3 Å²	134.3	89%	0.891	77%	0.774	S	S	*	*				154.6	153.9	113.8	-84.9	-175.9	179.6	-176.9	0	109.7
165	A	22.1	Very low	24.1	Very low	77 Å²	77	133.8 Å²	133.8	64%	0.636	77%	0.772	S	S	*	*			cis	-170.9	175.4	-21.7	0	0	0	0	0	107.9
166	T	22.9	Very low	24	Very low	119 Å²	119	133.5 Å²	133.5	73%	0.73	77%	0.768	S	S	*	*			trans	63.4	115.3	170.8	50.7	0	0	0	0	116.7
167	E	22.1	Very low	23.8	Very low	183 Å²	183	137.3 Å²	137.3	86%	0.855	77%	0.767	S	S	*	*				66.5	134.2	81.2	-70.2	176	174.3	0	0	113.2
168	S	21	Very low	23.6	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	78%	0.775	S	S	*	*			cis	-160.8	-170.5	-9.5	59.5	0	0	0	0	110
169	D	22.2	Very low	23.4	Very low	134 Å²	134	140.5 Å²	140.5	72%	0.717	77%	0.77	S	S	*	*			trans	103.8	95.7	154.6	-65.7	11.7	0	0	0	122
170	T	22.1	Very low	24.1	Very low	111 Å²	111	140.8 Å²	140.8	68%	0.681	77%	0.772	S	S	*	*				68.6	99.8	124	62.7	0	0	0	0	122.9
171	T	24.8	Very low	24	Very low	134 Å²	134	141.9 Å²	141.9	82%	0.822	77%	0.77	S	S	*	*				74.7	154.6	123.7	55.1	0	0	0	0	121.9
172	P	28.9	Very low	24	Very low	112 Å²	112	140.7 Å²	140.7	73%	0.727	76%	0.764	S	S	*	*			trans	-135.4	-158.6	-145.8	34.4	-10.4	0	0	0	115.8
173	V	22.2	Very low	24.1	Very low	120 Å²	120	147.1 Å²	147.1	73%	0.727	77%	0.774	S	S	*	*			trans	94	144.5	155.2	-155.1	0	0	0	0	118
174	V	22.4	Very low	24.1	Very low	122 Å²	122	145.4 Å²	145.4	74%	0.739	77%	0.774	S	S	*	*			trans	120.4	82.1	147.9	-170.4	0	0	0	0	116.2
175	F	21	Very low	24.1	Very low	184 Å²	184	147 Å²	147	81%	0.807	77%	0.774	S	S	*	*				59.2	153.6	112	-101.5	-88.8	0	0	0	124
176	V	23.4	Very low	24.2	Very low	123 Å²	123	146.8 Å²	146.8	75%	0.745	78%	0.779	S	S	*	*			trans	80.4	110.6	165.4	-160.5	0	0	0	0	115.5
177	R	22.5	Very low	24.3	Very low	211 Å²	211	146.6 Å²	146.6	80%	0.796	79%	0.79	S	S	*	*			cis	89.7	94.2	31.7	-166.9	-157.2	-160	-172.8	9.4	114.9
178	R	22.6	Very low	24.4	Very low	235 Å²	235	141.1 Å²	141.1	89%	0.887	78%	0.782	S	S	*	*			trans	167.2	146.3	131.2	-95.7	172.6	175.5	176.1	-1	111.5
179	G	22.7	Very low	24.7	Very low	72 Å²	72	145.8 Å²	145.8	74%	0.742	79%	0.79	S	S	*	*			trans	-95.5	-133.4	171.4	0	0	0	0	0	112.5
180	P	44.7	Very low	25	Very low	127 Å²	127	146.2 Å²	146.2	83%	0.825	79%	0.792	S	S	*	*				-120.8	172.4	-96.4	39.1	-31.9	0	0	0	113
181	M	22.8	Very low	25.3	Very low	168 Å²	168	150.5 Å²	150.5	83%	0.828	81%	0.805	S	S	*	*			trans	171.8	124.6	145.4	-94.2	-81.3	171.2	0	0	113.5
182	D	24	Very low	25.5	Very low	134 Å²	134	155.1 Å²	155.1	72%	0.717	81%	0.807	S	S	*	*				31.4	118.8	129.4	-79.4	5.4	0	0	0	122.9
183	R	23.3	Very low	25.6	Very low	232 Å²	232	155.9 Å²	155.9	88%	0.875	81%	0.805	S	S	*	*				168	113.2	107	-95.7	167.6	179.7	-166.7	-1.5	116.5
184	N	24.2	Very low	26.1	Very low	153 Å²	153	154.8 Å²	154.8	82%	0.818	80%	0.795	S	S	*	*				59.2	149.8	114.9	-147.1	1.7	0	0	0	123.7
185	R	24.5	Very low	26.8	Very low	239 Å²	239	155.7 Å²	155.7	90%	0.902	80%	0.795	S	S	*	*			trans	83.6	137.2	177.2	-57.5	-179.2	170	-165.8	-3.1	116.9
186	G	23.2	Very low	28	Very low	72 Å²	72	150.3 Å²	150.3	74%	0.742	78%	0.78	S	S	*	*			cis	160.6	150.5	-10.5	0	0	0	0	0	114.7
187	A	25.6	Very low	29	Very low	114 Å²	114	148.2 Å²	148.2	94%	0.942	77%	0.768	S	S	*	*			trans	69.5	142.9	173.9	0	0	0	0	0	118.2
188	G	24.1	Very low	30.2	Very low	68 Å²	68	143 Å²	143	70%	0.701	76%	0.755	S	S	*	*			cis	176.5	-175	-3.5	0	0	0	0	0	113.4
189	K	28	Very low	31.2	Very low	197 Å²	197	139.3 Å²	139.3	86%	0.857	75%	0.745	S	S	*	*			trans	76.4	148.7	-174	-64.1	-171.9	171.8	-174.9	0	117
190	D	27.2	Very low	32	Very low	142 Å²	142	142.3 Å²	142.3	76%	0.759	74%	0.74	S	S	*	*			cis	-176.6	119.9	-35.7	-107.5	-31.5	0	0	0	106
191	E	29.6	Very low	31.8	Very low	202 Å²	202	145.2 Å²	145.2	94%	0.944	73%	0.734	S	S	*	*			trans	-172.2	138.1	142	-108.9	169.7	-160.7	0	0	112.8
192	R	29.6	Very low	32.7	Very low	231 Å²	231	141.7 Å²	141.7	87%	0.872	72%	0.722	S	S	*	*			trans	-85.7	169.7	176.1	-72.1	176.5	167.1	159.9	-6.3	109.6
193	N	29.7	Very low	33.4	Very low	128 Å²	128	140.5 Å²	140.5	68%	0.684	72%	0.715	S	S	*	*			cis	-163.3	174.5	-12.2	-108.9	38.9	0	0	0	104.9
194	D	33.3	Very low	34	Very low	96 Å²	96	135.2 Å²	135.2	51%	0.513	70%	0.704	S	S	.	*			cis	-143.5	166.3	3.3	-154.4	-76.4	0	0	0	108.9	S196	D194-S196 VanDerWaalsContact CG-OG 3.31Å; D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.2Å; D194-S196 PolarHBondContact OD1-OG 2.87Å
195	L	37.7	Very low	34.7	Very low	141 Å²	141	132 Å²	132	74%	0.738	70%	0.699	S	S	*	*	S	Bend	trans	-113.6	0	176.3	-129.3	76.3	0	0	0	114	I198	L195-I198 HydrophobicContact CD1-CD1 4.39Å
196	S	44.5	Very low	35.2	Very low	71 Å²	71	126.2 Å²	126.2	50%	0.497	69%	0.69	S	S	.	*	H	α-helix	trans	-67.5	-39.2	-177.7	50.6	0	0	0	0	113.8	D194 I198 K199	D194-S196 VanDerWaalsContact CG-OG 3.31Å; D194-S196 WeakPolarHBondContact OD1-CB 3.38Å; D194-S196 PolarHBondContact OD1-N 3.2Å; D194-S196 PolarHBondContact OD1-OG 2.87Å; S196-I198 VanDerWaalsContact C-N 3.31Å; S196-I198 PolarHBondContact O-N 3.38Å; S196-K199 PolarHBondContact O-N 3.44Å
197	V	45.8	Very low	35.7	Very low	80 Å²	80	127.1 Å²	127.1	49%	0.485	69%	0.685	S	S	.	*	H	α-helix	trans	-67	-27.7	-176.6	-177.8	0	0	0	0	113.2	R201	V197-R201 PolarHBondContact O-N 3.4Å
198	I	47.1	Very low	35.7	Very low	102 Å²	102	129.7 Å²	129.7	52%	0.523	68%	0.683	S	S	.	*	H	α-helix	trans	-73.4	-37.3	179.7	-59.1	175.5	0	0	0	110.4	L195 S196 E200 R201 V202	L195-I198 HydrophobicContact CD1-CD1 4.39Å; S196-I198 VanDerWaalsContact C-N 3.31Å; S196-I198 PolarHBondContact O-N 3.38Å; I198-E200 VanDerWaalsContact C-N 3.3Å; I198-E200 PolarHBondContact O-N 3.3Å; I198-R201 PolarHBondContact O-N 2.92Å; I198-V202 HydrophobicContact CG2-CG2 4.48Å; I198-V202 WeakPolarHBondContact O-CG2 3.37Å; I198-V202 PolarHBondContact O-N 2.97Å; I198-V202 VanDerWaalsContact O-N 3.11Å
199	K	42.9	Very low	36	Very low	156 Å²	156	135.7 Å²	135.7	68%	0.678	69%	0.692	S	S	*	*	H	α-helix	trans	-63.5	-35.8	179.9	-169.6	177.1	179.3	-177.5	0	112.4	S196 L203	S196-K199 PolarHBondContact O-N 3.44Å; K199-L203 PolarHBondContact O-N 3.27Å
200	E	39.8	Very low	35.8	Very low	135 Å²	135	131.5 Å²	131.5	63%	0.631	69%	0.688	S	S	*	*	H	α-helix	trans	-74	-37.5	179.2	-159.3	168	-144	0	0	112.1	I198 L203 N204	I198-E200 VanDerWaalsContact C-N 3.3Å; I198-E200 PolarHBondContact O-N 3.3Å; E200-L203 PolarHBondContact O-N 3.02Å; E200-N204 PolarHBondContact O-N 3.41Å
201	R	40.4	Very low	35.7	Very low	188 Å²	188	132.5 Å²	132.5	71%	0.709	69%	0.692	S	S	*	*	H	α-helix	trans	-65.9	-36.8	173.5	-70.4	-178	-177	-178.2	1.5	113.3	V197 I198 L203 A205	V197-R201 PolarHBondContact O-N 3.4Å; I198-R201 PolarHBondContact O-N 2.92Å; R201-L203 VanDerWaalsContact C-N 3.33Å; R201-A205 PolarHBondContact O-N 3.01Å
202	V	41.3	Very low	35.4	Very low	94 Å²	94	128.3 Å²	128.3	57%	0.57	69%	0.685	S	S	*	*	H	α-helix	trans	-69.6	-31.2	177.5	172.4	0	0	0	0	111.8	I198 V206	I198-V202 HydrophobicContact CG2-CG2 4.48Å; I198-V202 WeakPolarHBondContact O-CG2 3.37Å; I198-V202 PolarHBondContact O-N 2.97Å; I198-V202 VanDerWaalsContact O-N 3.11Å; V202-V206 WeakPolarHBondContact O-CG2 3.43Å
203	L	38.9	Very low	35.1	Very low	110 Å²	110	120.3 Å²	120.3	58%	0.576	68%	0.675	S	S	*	*	H	α-helix	trans	-73.3	-39.3	176.6	-79.1	162	0	0	0	112.6	K199 E200 R201 A205 V206	K199-L203 PolarHBondContact O-N 3.27Å; E200-L203 PolarHBondContact O-N 3.02Å; R201-L203 VanDerWaalsContact C-N 3.33Å; L203-A205 VanDerWaalsContact C-N 3.29Å; L203-A205 PolarHBondContact O-N 3.27Å; L203-V206 PolarHBondContact O-N 2.92Å
204	N	37.5	Very low	34.9	Very low	120 Å²	120	124.6 Å²	124.6	64%	0.642	68%	0.683	S	S	*	*	H	α-helix	trans	-71.4	-21.2	177.9	-71.7	-7.2	0	0	0	113.7	E200 V206	E200-N204 PolarHBondContact O-N 3.41Å; N204-V206 PolarHBondContact O-N 3.19Å
205	A	37.8	Very low	34.5	Very low	86 Å²	86	132.1 Å²	132.1	71%	0.711	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.1	-4.2	175.7	0	0	0	0	0	114.2	R201 L203	R201-A205 PolarHBondContact O-N 3.01Å; L203-A205 VanDerWaalsContact C-N 3.29Å; L203-A205 PolarHBondContact O-N 3.27Å
206	V	36.2	Very low	33.8	Very low	117 Å²	117	130.2 Å²	130.2	71%	0.709	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-1.6	-174.4	178.1	0	0	0	0	112.3	V202 L203 N204	V202-V206 WeakPolarHBondContact O-CG2 3.43Å; L203-V206 PolarHBondContact O-N 2.92Å; N204-V206 PolarHBondContact O-N 3.19Å
207	S	32.1	Very low	32.9	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	72%	0.715	S	S	*	*	S	Bend	trans	-103.4	-15.6	-168.4	-58.7	0	0	0	0	116.9
208	D	26.7	Very low	31.9	Very low	168 Å²	168	135.1 Å²	135.1	90%	0.898	73%	0.73	S	S	*	*			trans	-114.3	107.2	177.6	-84.7	-42.2	0	0	0	112.2
209	Q	29.9	Very low	30.8	Very low	193 Å²	193	137.5 Å²	137.5	90%	0.902	74%	0.744	S	S	*	*			trans	-138.2	98.2	-178.5	-174.3	175.5	53.4	0	0	111.7
210	S	24.1	Very low	29.9	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	75%	0.752	S	S	*	*			trans	-170.9	129.7	159.1	54.2	0	0	0	0	109.1
211	L	25	Very low	29.2	Very low	163 Å²	163	140 Å²	140	85%	0.853	77%	0.765	S	S	*	*			cis	-144.7	149.8	9.9	-77.9	109.6	0	0	0	112.9
212	S	23.1	Very low	28.4	Very low	114 Å²	114	134.1 Å²	134.1	80%	0.797	76%	0.762	S	S	*	*			trans	51.3	131.7	144.5	-155.1	0	0	0	0	121
213	G	22.8	Very low	27.5	Very low	63 Å²	63	137.8 Å²	137.8	65%	0.649	78%	0.779	S	S	*	*			cis	172.8	173.8	0.6	0	0	0	0	0	113.7
214	Y	26.4	Very low	26.8	Very low	219 Å²	219	137.7 Å²	137.7	86%	0.859	79%	0.788	S	S	*	*			trans	62.5	94.8	168.6	-62.9	-77.4	0	0	0	120.2
215	R	24.2	Very low	26.3	Very low	253 Å²	253	137.9 Å²	137.9	96%	0.955	80%	0.795	S	S	*	*			trans	-100.3	126.1	133.5	-115.7	-176	-180	-174.8	1.1	107.7
216	S	24.3	Very low	26	Very low	101 Å²	101	143.9 Å²	143.9	71%	0.706	81%	0.805	S	S	*	*			trans	-149.1	108.2	164.4	-172.5	0	0	0	0	110.3
217	V	25.4	Very low	25.4	Very low	123 Å²	123	143.7 Å²	143.7	75%	0.745	81%	0.809	S	S	*	*			trans	-83.1	120.2	170.3	172.3	0	0	0	0	108	N219	V217-N219 PolarHBondContact O-N 3.18Å
218	T	24.5	Very low	24.9	Very low	132 Å²	132	148.1 Å²	148.1	81%	0.81	82%	0.822	S	S	*	*			trans	-83.1	89.8	174.1	47.9	0	0	0	0	111.4
219	N	23.9	Very low	24.9	Very low	151 Å²	151	145.2 Å²	145.2	81%	0.807	81%	0.812	S	S	*	*			trans	-86.3	104	164.9	-99.4	-10	0	0	0	111.1	V217	V217-N219 PolarHBondContact O-N 3.18Å
220	K	24.4	Very low	24.5	Very low	199 Å²	199	142.4 Å²	142.4	87%	0.865	80%	0.803	S	S	*	*			trans	-150.8	137.4	149.7	-68.8	-167.9	-179.7	176.4	0	105.5
221	T	24.9	Very low	24.7	Very low	145 Å²	145	145.1 Å²	145.1	89%	0.89	81%	0.809	S	S	*	*			cis	-136.5	175.9	33.3	48.1	0	0	0	0	112
222	G	22.7	Very low	24.7	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	80%	0.802	S	S	*	*			trans	-128.4	143.4	174.1	0	0	0	0	0	113
223	N	22.9	Very low	24.8	Very low	172 Å²	172	143.6 Å²	143.6	92%	0.92	80%	0.796	S	S	*	*				-168.5	156.1	124.5	-99.1	-17.3	0	0	0	111.5
224	S	23.3	Very low	24.9	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	80%	0.801	S	S	*	*			trans	-63.9	168.2	-171.8	57.5	0	0	0	0	115.7
225	P	28.5	Very low	25.2	Very low	124 Å²	124	142.7 Å²	142.7	81%	0.805	80%	0.795	S	S	*	*			cis	-139.8	178.9	25.5	40.3	-19.2	0	0	0	119.5
226	K	31.3	Very low	25.4	Very low	212 Å²	212	136.7 Å²	136.7	92%	0.922	79%	0.787	S	S	*	*			trans	-63.9	142.5	-168.7	-54.4	164.4	178.4	175.8	0	115.6
227	S	22.2	Very low	25.6	Very low	112 Å²	112	139.4 Å²	139.4	78%	0.783	79%	0.793	S	S	*	*			trans	-157.6	104.6	145.2	60.6	0	0	0	0	113.4
228	M	22.9	Very low	25.9	Very low	185 Å²	185	138.6 Å²	138.6	91%	0.911	79%	0.788	S	S	*	*			trans	52.6	155	152.4	-69.6	-55.5	179.1	0	0	122.1
229	P	26.1	Very low	26.2	Very low	108 Å²	108	136.4 Å²	136.4	70%	0.701	78%	0.777	S	S	*	*			trans	-91.6	141.2	-161.1	35.5	-34.3	0	0	0	113.4
230	N	22.6	Very low	26.8	Very low	133 Å²	133	135.1 Å²	135.1	71%	0.711	77%	0.77	S	S	*	*			trans	-107.1	114	161.9	-88.6	-15.9	0	0	0	109.4	L232	N230-L232 HydrophobicContact CB-CD1 4.32Å; N230-L232 PolarHBondContact O-N 2.98Å
231	D	26.9	Very low	27.4	Very low	166 Å²	166	133.6 Å²	133.6	89%	0.888	77%	0.766	S	S	*	*			trans	-67.1	86	158.6	-77.4	-43.3	0	0	0	108.9
232	L	24.8	Very low	27.9	Very low	132 Å²	132	135.8 Å²	135.8	69%	0.691	76%	0.759	S	S	*	*			trans	-101.8	87.1	170	-102.4	158.6	0	0	0	108.7	N230 T234	N230-L232 HydrophobicContact CB-CD1 4.32Å; N230-L232 PolarHBondContact O-N 2.98Å; L232-T234 PolarHBondContact O-N 3.31Å
233	V	26.2	Very low	29.2	Very low	114 Å²	114	138.5 Å²	138.5	69%	0.691	75%	0.749	S	S	*	*			trans	-59	109.3	165.6	177.2	0	0	0	0	108	L235	V233-L235 VanDerWaalsContact C-N 3.28Å; V233-L235 HydrophobicContact CG1-CD1 4.44Å; V233-L235 HydrophobicContact CG1-CG 4.18Å; V233-L235 PolarHBondContact O-N 3.46Å
234	T	24.9	Very low	30.2	Very low	120 Å²	120	135.6 Å²	135.6	74%	0.736	74%	0.738	S	S	*	*			trans	-69.9	82.3	175.5	42.6	0	0	0	0	110.4	L232 T236	L232-T234 PolarHBondContact O-N 3.31Å; T234-T236 PolarHBondContact O-N 3.18Å; T234-T236 VanDerWaalsContact O-N 3.11Å
235	L	31.3	Very low	31.3	Very low	143 Å²	143	132.7 Å²	132.7	75%	0.749	71%	0.712	S	S	*	*			trans	-81	79.5	173.5	-98.7	162.6	0	0	0	110.9	V233	V233-L235 VanDerWaalsContact C-N 3.28Å; V233-L235 HydrophobicContact CG1-CD1 4.44Å; V233-L235 HydrophobicContact CG1-CG 4.18Å; V233-L235 PolarHBondContact O-N 3.46Å
236	T	28.4	Very low	32.2	Very low	126 Å²	126	129.6 Å²	129.6	77%	0.773	69%	0.689	S	S	*	*			trans	-172.5	69	141	46	0	0	0	0	110	T234 V238	T234-T236 PolarHBondContact O-N 3.18Å; T234-T236 VanDerWaalsContact O-N 3.11Å; T236-V238 VanDerWaalsContact C-N 3.31Å; T236-V238 PolarHBondContact O-N 3.09Å; T236-V238 VanDerWaalsContact O-N 3.08Å
237	D	30.2	Very low	33	Very low	158 Å²	158	124.1 Å²	124.1	85%	0.845	67%	0.669	S	S	*	*			trans	-73.2	90.3	158.5	-82.2	-33	0	0	0	108.4
238	V	31.1	Very low	34.3	Very low	106 Å²	106	119.4 Å²	119.4	64%	0.642	63%	0.634	S	S	*	*			trans	-107.2	124.6	162.1	-177	0	0	0	0	106.6	T236	T236-V238 VanDerWaalsContact C-N 3.31Å; T236-V238 PolarHBondContact O-N 3.09Å; T236-V238 VanDerWaalsContact O-N 3.08Å
239	P	30.5	Very low	35.2	Very low	87 Å²	87	116.3 Å²	116.3	57%	0.565	62%	0.617	S	S	*	*			trans	-56.7	143.4	-179.8	-25.7	34.5	0	0	0	112.7	E241	P239-E241 PolarHBondContact O-N 2.93Å
240	D	37.2	Very low	36.1	Very low	124 Å²	124	118 Å²	118	66%	0.663	61%	0.611	S	S	*	*	G	3₁₀ helix	trans	-58.3	-9.9	-177.7	-81.5	-44.2	0	0	0	114.9	Y242 R243	D240-Y242 VanDerWaalsContact C-N 3.28Å; D240-Y242 PolarHBondContact O-N 3.05Å; D240-R243 IonicContact OD1-NE 3.36Å
241	E	35.9	Very low	37.2	Very low	167 Å²	167	116.3 Å²	116.3	78%	0.78	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-71.9	-10.5	-170.7	-60.6	-177.2	150.4	0	0	115	P239	P239-E241 PolarHBondContact O-N 2.93Å
242	Y	36	Very low	37.8	Very low	190 Å²	190	117 Å²	117	75%	0.745	59%	0.59	S	S	*	*	G	3₁₀ helix	trans	-112	15.8	-175.2	-70.7	-76.2	0	0	0	115.5	D240 T244	D240-Y242 VanDerWaalsContact C-N 3.28Å; D240-Y242 PolarHBondContact O-N 3.05Å; Y242-T244 PolarHBondContact O-N 2.89Å; Y242-T244 VanDerWaalsContact O-N 3.16Å
243	R	49.6	Very low	38.5	Very low	121 Å²	121	116.2 Å²	116.2	46%	0.457	59%	0.591	S	S	.	*			trans	-81.5	90.2	179.1	-78	177.8	169.6	-112.5	1.4	112.1	D240 H245 L246	D240-R243 IonicContact OD1-NE 3.36Å; R243-H245 WeakPolarHBondContact CD-NE2 3.39Å; R243-H245 VanDerWaalsContact CG-CE1 3.43Å; R243-H245 WeakPolarHBondContact CG-CE1 3.46Å; R243-H245 PolarHBondContact NH1-CE1 3.14Å; R243-H245 PolarHBondContact NH1-NE2 2.91Å; R243-H245 VanDerWaalsContact NH1-NE2 3.14Å; R243-H245 PolarHBondContact O-N 3.11Å; R243-H245 VanDerWaalsContact O-N 3.14Å; R243-L246 HydrophobicContact CB-CD1 3.82Å; R243-L246 HydrophobicContact CB-CG 4.22Å; R243-L246 WeakPolarHBondContact O-CB 3.48Å; R243-L246 PolarHBondContact O-N 2.74Å
244	T	43.8	Very low	39	Very low	111 Å²	111	117.7 Å²	117.7	68%	0.681	60%	0.595	S	S	*	*	G	3₁₀ helix	trans	-56.3	-27.5	178.8	49	0	0	0	0	114.3	Y242 L246 L247	Y242-T244 PolarHBondContact O-N 2.89Å; Y242-T244 VanDerWaalsContact O-N 3.16Å; T244-L246 PolarHBondContact O-N 3.38Å; T244-L247 VanDerWaalsContact O-CB 3.32Å; T244-L247 WeakPolarHBondContact O-CB 3.48Å; T244-L247 WeakPolarHBondContact O-CD1 3.44Å; T244-L247 WeakPolarHBondContact O-CG 3.28Å; T244-L247 PolarHBondContact O-N 3.03Å; T244-L247 VanDerWaalsContact O-N 3.08Å
245	H	46	Very low	39.6	Very low	47 Å²	47	114.4 Å²	114.4	22%	0.218	59%	0.585	C	S	.	*	G	3₁₀ helix	trans	-64.7	-15.2	175.1	53.4	-106.7	0	0	0	114.4	R243 L247 A342	R243-H245 WeakPolarHBondContact CD-NE2 3.39Å; R243-H245 VanDerWaalsContact CG-CE1 3.43Å; R243-H245 WeakPolarHBondContact CG-CE1 3.46Å; R243-H245 PolarHBondContact NH1-CE1 3.14Å; R243-H245 PolarHBondContact NH1-NE2 2.91Å; R243-H245 VanDerWaalsContact NH1-NE2 3.14Å; R243-H245 PolarHBondContact O-N 3.11Å; R243-H245 VanDerWaalsContact O-N 3.14Å; H245-L247 VanDerWaalsContact C-N 3.26Å; H245-L247 PolarHBondContact O-N 2.97Å; H245-A342 HydrophobicContact CB-CB 3.67Å; H245-A342 VanDerWaalsContact CD2-CB 3.47Å; H245-A342 WeakPolarHBondContact CD2-CB 3.37Å; H245-A342 VanDerWaalsContact ND1-CB 3.3Å; H245-A342 WeakPolarHBondContact ND1-CB 3.31Å
246	L	48.4	Very low	39.9	Very low	59 Å²	59	115.5 Å²	115.5	31%	0.309	59%	0.591	S	S	.	*	G	3₁₀ helix	trans	-78.9	-2.7	172.5	-70	168.4	0	0	0	113.5	R243 T244 W248 E249 Y250	R243-L246 HydrophobicContact CB-CD1 3.82Å; R243-L246 HydrophobicContact CB-CG 4.22Å; R243-L246 WeakPolarHBondContact O-CB 3.48Å; R243-L246 PolarHBondContact O-N 2.74Å; T244-L246 PolarHBondContact O-N 3.38Å; L246-W248 PolarHBondContact O-N 2.79Å; L246-E249 HydrophobicContact CD2-CB 4.19Å; L246-E249 HydrophobicContact CD2-CG 4.29Å; L246-E249 WeakPolarHBondContact CD2-OE2 3.48Å; L246-E249 PolarHBondContact O-N 3.24Å; L246-Y250 VanDerWaalsContact O-CD2 3.28Å; L246-Y250 WeakPolarHBondContact O-CD2 3.45Å
247	L	47.1	Very low	40.5	Very low	97 Å²	97	117.5 Å²	117.5	51%	0.508	59%	0.589	S	S	.	*	G	3₁₀ helix	trans	-46.4	-38.4	176.6	-87.6	164.4	0	0	0	112.8	T244 H245	T244-L247 VanDerWaalsContact O-CB 3.32Å; T244-L247 WeakPolarHBondContact O-CB 3.48Å; T244-L247 WeakPolarHBondContact O-CD1 3.44Å; T244-L247 WeakPolarHBondContact O-CG 3.28Å; T244-L247 PolarHBondContact O-N 3.03Å; T244-L247 VanDerWaalsContact O-N 3.08Å; H245-L247 VanDerWaalsContact C-N 3.26Å; H245-L247 PolarHBondContact O-N 2.97Å
248	W	50	Low	41.1	Very low	14 Å²	14	113 Å²	113	5%	0.053	57%	0.568	C	S	.	*	G	3₁₀ helix	trans	-83.8	-15.4	-179.2	-57.7	104.9	0	0	0	115.4	L246 C282 G285 M335	L246-W248 PolarHBondContact O-N 2.79Å; W248-C282 WeakPolarHBondContact CH2-O 3.29Å; W248-G285 VanDerWaalsContact CE2-CA 3.48Å; W248-G285 VanDerWaalsContact CH2-N 3.26Å; W248-M335 HydrophobicContact CB-SD 4.19Å; W248-M335 HydrophobicContact CD2-CG 3.72Å; W248-M335 HydrophobicContact CD2-SD 3.62Å; W248-M335 VanDerWaalsContact CE2-CG 3.48Å; W248-M335 HydrophobicContact CE3-CG 4.34Å; W248-M335 HydrophobicContact CE3-SD 3.77Å; W248-M335 HydrophobicContact CG-CG 3.92Å; W248-M335 HydrophobicContact CG-SD 3.87Å; W248-M335 HydrophobicContact CH2-CG 4.44Å; W248-M335 HydrophobicContact CZ2-CG 3.83Å; W248-M335 HydrophobicContact CZ2-SD 4.43Å; W248-M335 HydrophobicContact CZ3-SD 4.26Å
249	E	42.3	Very low	41.8	Very low	120 Å²	120	111.3 Å²	111.3	56%	0.561	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-88.1	-2.3	175	-71.3	-157.4	159.9	0	0	113.3	L246 Y251	L246-E249 HydrophobicContact CD2-CB 4.19Å; L246-E249 HydrophobicContact CD2-CG 4.29Å; L246-E249 WeakPolarHBondContact CD2-OE2 3.48Å; L246-E249 PolarHBondContact O-N 3.24Å; E249-Y251 VanDerWaalsContact O-CD2 3.24Å; E249-Y251 WeakPolarHBondContact O-CD2 3.31Å; E249-Y251 PolarHBondContact O-N 3.14Å
250	Y	45.8	Very low	42.7	Very low	142 Å²	142	116.7 Å²	116.7	56%	0.557	57%	0.568	S	S	*	*			trans	-67.4	78.8	168.3	-79.6	-88.4	0	0	0	111.4	L246 K252	L246-Y250 VanDerWaalsContact O-CD2 3.28Å; L246-Y250 WeakPolarHBondContact O-CD2 3.45Å; Y250-K252 PolarHBondContact O-N 2.93Å
251	Y	43.7	Very low	43.1	Very low	98 Å²	98	114.8 Å²	114.8	38%	0.384	57%	0.569	S	S	.	*			trans	-65	-0.4	172.3	-81.5	-72.1	0	0	0	114.8	E249 K295 P296	E249-Y251 VanDerWaalsContact O-CD2 3.24Å; E249-Y251 WeakPolarHBondContact O-CD2 3.31Å; E249-Y251 PolarHBondContact O-N 3.14Å; Y251-K295 HydrophobicContact CD1-CG 4.29Å; Y251-K295 HydrophobicContact CE1-CD 4.34Å; Y251-K295 HydrophobicContact CE1-CG 3.5Å; Y251-K295 VanDerWaalsContact CE1-CG 3.5Å; Y251-P296 WeakPolarHBondContact OH-CD 3.47Å
252	K	39.9	Very low	43.9	Very low	180 Å²	180	112.6 Å²	112.6	78%	0.783	56%	0.559	S	S	*	*			trans	-144.2	73.9	-176.4	-66.7	-172.9	179.3	-178.1	0	110.8	Y250	Y250-K252 PolarHBondContact O-N 2.93Å
253	V	40.1	Very low	44.9	Very low	116 Å²	116	104.4 Å²	104.4	70%	0.703	53%	0.528	S	S	*	.			trans	-107.1	101.6	145.7	-176.3	0	0	0	0	105.4	G255	V253-G255 PolarHBondContact O-N 3.11Å
254	D	36.6	Very low	45.1	Very low	146 Å²	146	101.7 Å²	101.7	78%	0.781	53%	0.531	S	S	*	.			trans	-72.4	73.1	167.3	-82.6	-64.3	0	0	0	108
255	G	37.6	Very low	45.7	Very low	51 Å²	51	100.6 Å²	100.6	53%	0.526	53%	0.534	S	S	.	.			trans	-75.2	149.5	165.7	0	0	0	0	0	110.4	V253 K257	V253-G255 PolarHBondContact O-N 3.11Å; G255-K257 PolarHBondContact O-N 3.16Å
256	D	36.9	Very low	46.5	Very low	165 Å²	165	101.4 Å²	101.4	88%	0.882	54%	0.538	S	S	*	.			trans	-51.8	125	-168.5	-85.8	-47.8	0	0	0	113.7	V258	D256-V258 PolarHBondContact O-N 2.74Å
257	K	40.7	Very low	47.6	Very low	169 Å²	169	102.7 Å²	102.7	74%	0.735	55%	0.55	S	S	*	.			trans	-72	92.6	175.7	-68.6	170.5	-174.4	159.2	0	109.4	G255	G255-K257 PolarHBondContact O-N 3.16Å
258	V	44.7	Very low	48.8	Very low	64 Å²	64	103.1 Å²	103.1	39%	0.388	55%	0.552	S	S	.	*			trans	-52.5	125.5	160.9	-176	0	0	0	0	107.6	D256 R260	D256-V258 PolarHBondContact O-N 2.74Å; V258-R260 PolarHBondContact O-N 3.19Å; V258-R260 VanDerWaalsContact O-N 3.17Å
259	P	46	Very low	49.7	Very low	70 Å²	70	109 Å²	109	46%	0.455	58%	0.584	S	S	.	*			trans	-64.3	121.2	-173.6	23.2	-32.4	0	0	0	110.6	A261 E262	P259-A261 PolarHBondContact O-N 3.43Å; P259-E262 HydrophobicContact CG-CG 4.37Å; P259-E262 PolarHBondContact O-N 3Å
260	R	49	Very low	51.2	Low	200 Å²	200	105.6 Å²	105.6	76%	0.755	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.4	3.2	-171.5	-62.4	174.4	175.9	172.1	-5.5	116.4	V258	V258-R260 PolarHBondContact O-N 3.19Å; V258-R260 VanDerWaalsContact O-N 3.17Å
261	A	44.6	Very low	52.5	Low	84 Å²	84	99.5 Å²	99.5	69%	0.694	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-17.8	-176.5	0	0	0	0	0	114	P259	P259-A261 PolarHBondContact O-N 3.43Å
262	E	53.3	Low	54.2	Low	120 Å²	120	96.7 Å²	96.7	56%	0.561	54%	0.54	S	S	*	.	S	Bend	trans	-87.9	-25.7	-169.6	-65.8	179.8	173.9	0	0	113.7	P259 A264 A265	P259-E262 HydrophobicContact CG-CG 4.37Å; P259-E262 PolarHBondContact O-N 3Å; E262-A264 VanDerWaalsContact C-N 3.35Å; E262-A264 PolarHBondContact O-N 2.93Å; E262-A265 PolarHBondContact O-N 3.44Å
263	I	56.2	Low	55.9	Low	19 Å²	19	90.9 Å²	90.9	10%	0.097	52%	0.522	C	S	.	.	G	3₁₀ helix	trans	-61.2	-40.5	-176.1	-61.4	134.3	0	0	0	112.3	A265 M266 Q271 L290 L316	I263-A265 PolarHBondContact O-N 3.06Å; I263-M266 HydrophobicContact CB-CE 4.4Å; I263-M266 HydrophobicContact CG1-CE 4.29Å; I263-M266 HydrophobicContact CG2-CE 4.39Å; I263-M266 PolarHBondContact O-N 3.3Å; I263-Q271 PolarHBondContact O-NE2 2.97Å; I263-L290 HydrophobicContact CD1-CD2 3.72Å; I263-L290 HydrophobicContact CG1-CD2 4.23Å; I263-L290 HydrophobicContact CG2-CD2 4.32Å; I263-L316 HydrophobicContact CG2-CD2 4.33Å
264	A	53.3	Low	57.5	Low	64 Å²	64	87.8 Å²	87.8	53%	0.529	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-68.4	-14.9	179.4	0	0	0	0	0	113.9	E262 H315	E262-A264 VanDerWaalsContact C-N 3.35Å; E262-A264 PolarHBondContact O-N 2.93Å; A264-H315 HydrophobicContact CB-CB 4.47Å
265	A	56.7	Low	59.4	Low	88 Å²	88	81 Å²	81	73%	0.727	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-95.6	-6.8	177.7	0	0	0	0	0	113.3	E262 I263	E262-A265 PolarHBondContact O-N 3.44Å; I263-A265 PolarHBondContact O-N 3.06Å
266	M	63.5	Low	61.3	Low	64 Å²	64	78.6 Å²	78.6	32%	0.315	44%	0.44	S	S	.	.	S	Bend	trans	-80.1	150.4	-179.6	-68.3	-158.5	-74.6	0	0	113	I263 Q271 M274	I263-M266 HydrophobicContact CB-CE 4.4Å; I263-M266 HydrophobicContact CG1-CE 4.29Å; I263-M266 HydrophobicContact CG2-CE 4.39Å; I263-M266 PolarHBondContact O-N 3.3Å; M266-Q271 HydrophobicContact CB-CG 3.99Å; M266-Q271 PolarHBondContact O-NE2 3.08Å; M266-M274 HydrophobicContact CE-SD 3.77Å
267	P	72.4	Confident	63.2	Low	85 Å²	85	74.1 Å²	74.1	55%	0.552	42%	0.416	S	S	*	.			trans	-59.6	146.7	169.7	-21.5	33.2	0	0	0	112.2	L269 S270 Q271	P267-L269 PolarHBondContact O-N 3.21Å; P267-L269 VanDerWaalsContact O-N 3.1Å; P267-S270 WeakPolarHBondContact O-CB 3.38Å; P267-S270 PolarHBondContact O-N 3.07Å; P267-Q271 PolarHBondContact O-N 3.4Å
268	L	70.4	Confident	64.9	Low	106 Å²	106	66.4 Å²	66.4	56%	0.555	38%	0.382	S	S	*	.	H	α-helix	trans	-50.8	-37.4	179.7	-73.3	162.5	0	0	0	113.6	Q271 E272 D317	L268-Q271 PolarHBondContact O-N 3.04Å; L268-E272 WeakPolarHBondContact O-CB 3.17Å; L268-E272 PolarHBondContact O-N 3.1Å; L268-D317 HydrophobicContact CD2-CB 4.11Å
269	L	70.5	Confident	66.5	Low	137 Å²	137	63.4 Å²	63.4	72%	0.717	36%	0.364	S	S	*	.	H	α-helix	trans	-67	-36.1	177.6	-69.5	163.8	0	0	0	112.9	P267 S273	P267-L269 PolarHBondContact O-N 3.21Å; P267-L269 VanDerWaalsContact O-N 3.1Å; L269-S273 PolarHBondContact O-N 2.82Å; L269-S273 PolarHBondContact O-OG 2.97Å
270	S	73.8	Confident	68.1	Low	49 Å²	49	60.4 Å²	60.4	34%	0.343	34%	0.344	S	S	.	.	H	α-helix	trans	-77.2	-32	176.4	-56.4	0	0	0	0	111.7	P267 S273 M274	P267-S270 WeakPolarHBondContact O-CB 3.38Å; P267-S270 PolarHBondContact O-N 3.07Å; S270-S273 WeakPolarHBondContact CA-OG 3.2Å; S270-S273 PolarHBondContact O-OG 2.94Å; S270-S273 VanDerWaalsContact O-OG 3.09Å; S270-M274 WeakPolarHBondContact O-CB 3.28Å; S270-M274 PolarHBondContact O-N 3.02Å; S270-M274 VanDerWaalsContact O-N 3.13Å
271	Q	73.4	Confident	69.3	Low	14 Å²	14	53.2 Å²	53.2	7%	0.065	32%	0.319	C	S	.	.	H	α-helix	trans	-64.4	-45.2	168.7	-66.3	177.6	-13	0	0	110.8	I263 M266 P267 L268 M274 L275 L320	I263-Q271 PolarHBondContact O-NE2 2.97Å; M266-Q271 HydrophobicContact CB-CG 3.99Å; M266-Q271 PolarHBondContact O-NE2 3.08Å; P267-Q271 PolarHBondContact O-N 3.4Å; L268-Q271 PolarHBondContact O-N 3.04Å; Q271-M274 PolarHBondContact O-N 3.41Å; Q271-L275 VanDerWaalsContact O-CB 3.31Å; Q271-L275 WeakPolarHBondContact O-CB 3.35Å; Q271-L275 VanDerWaalsContact O-CG 3.22Å; Q271-L275 WeakPolarHBondContact O-CG 3.41Å; Q271-L275 PolarHBondContact O-N 3.47Å; Q271-L320 HydrophobicContact CB-CD1 4.45Å
272	E	77.4	Confident	70.8	Confident	39 Å²	39	49.5 Å²	49.5	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-62.9	-44.5	177.4	-172.1	179.7	178.7	0	0	112	L268 M274 L275 L276 L320 T382 L383	L268-E272 WeakPolarHBondContact O-CB 3.17Å; L268-E272 PolarHBondContact O-N 3.1Å; E272-M274 PolarHBondContact O-N 2.66Å; E272-L275 PolarHBondContact O-N 3.41Å; E272-L276 HydrophobicContact CG-CD1 4.1Å; E272-L276 WeakPolarHBondContact O-CB 3.27Å; E272-L276 WeakPolarHBondContact O-CG 3.13Å; E272-L276 PolarHBondContact O-N 2.93Å; E272-L320 HydrophobicContact CB-CD2 4.46Å; E272-L320 HydrophobicContact CG-CD2 4.36Å; E272-T382 VanDerWaalsContact OE1-CA 3.29Å; E272-T382 WeakPolarHBondContact OE1-CA 3.49Å; E272-T382 WeakPolarHBondContact OE1-CB 3.41Å; E272-L383 HydrophobicContact CG-CB 4.33Å; E272-L383 PolarHBondContact OE1-N 3.31Å
273	S	76.8	Confident	71.8	Confident	58 Å²	58	43.8 Å²	43.8	41%	0.406	26%	0.261	S	S	.	.	H	α-helix	trans	-64.9	-40	178.4	61.7	0	0	0	0	113	L269 S270 L276 D277	L269-S273 PolarHBondContact O-N 2.82Å; L269-S273 PolarHBondContact O-OG 2.97Å; S270-S273 WeakPolarHBondContact CA-OG 3.2Å; S270-S273 PolarHBondContact O-OG 2.94Å; S270-S273 VanDerWaalsContact O-OG 3.09Å; S273-L276 PolarHBondContact O-N 3.36Å; S273-D277 PolarHBondContact O-N 3.14Å
274	M	74.4	Confident	72.5	Confident	52 Å²	52	44.3 Å²	44.3	26%	0.256	27%	0.265	S	S	.	.	H	α-helix	trans	-69.5	-40.3	177.1	-171.2	178.2	-177.9	0	0	111.5	M266 S270 Q271 E272 L276 D277 E278 L290	M266-M274 HydrophobicContact CE-SD 3.77Å; S270-M274 WeakPolarHBondContact O-CB 3.28Å; S270-M274 PolarHBondContact O-N 3.02Å; S270-M274 VanDerWaalsContact O-N 3.13Å; Q271-M274 PolarHBondContact O-N 3.41Å; E272-M274 PolarHBondContact O-N 2.66Å; M274-L276 VanDerWaalsContact C-N 3.34Å; M274-D277 PolarHBondContact O-N 2.78Å; M274-E278 WeakPolarHBondContact O-CB 3.37Å; M274-E278 WeakPolarHBondContact O-CG 3.46Å; M274-E278 PolarHBondContact O-N 3.34Å; M274-L290 HydrophobicContact CE-CD1 3.92Å; M274-L290 HydrophobicContact CG-CD1 3.9Å; M274-L290 HydrophobicContact SD-CD1 3.92Å
275	L	75.5	Confident	73	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	24%	0.244	C	C	.	.	H	α-helix	trans	-63.8	-37.4	173.8	-76.9	171.1	0	0	0	112.7	Q271 E272 L279 L290 L316 L320	Q271-L275 VanDerWaalsContact O-CB 3.31Å; Q271-L275 WeakPolarHBondContact O-CB 3.35Å; Q271-L275 VanDerWaalsContact O-CG 3.22Å; Q271-L275 WeakPolarHBondContact O-CG 3.41Å; Q271-L275 PolarHBondContact O-N 3.47Å; E272-L275 PolarHBondContact O-N 3.41Å; L275-L279 WeakPolarHBondContact O-CB 3.4Å; L275-L279 PolarHBondContact O-N 3.25Å; L275-L290 HydrophobicContact CD2-CD1 4.28Å; L275-L316 HydrophobicContact CD1-CD2 3.68Å; L275-L316 HydrophobicContact CD2-CD1 3.82Å; L275-L316 HydrophobicContact CD2-CD2 3.89Å; L275-L316 HydrophobicContact CG-CD2 4.03Å; L275-L320 HydrophobicContact CD1-CB 4.06Å; L275-L320 HydrophobicContact CD1-CD1 4.04Å
276	L	77.4	Confident	73.4	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-41.8	177	-81.2	168.8	0	0	0	111.6	E272 S273 M274 L279 L280 L376 L381 L383 L386	E272-L276 HydrophobicContact CG-CD1 4.1Å; E272-L276 WeakPolarHBondContact O-CB 3.27Å; E272-L276 WeakPolarHBondContact O-CG 3.13Å; E272-L276 PolarHBondContact O-N 2.93Å; S273-L276 PolarHBondContact O-N 3.36Å; M274-L276 VanDerWaalsContact C-N 3.34Å; L276-L279 PolarHBondContact O-N 2.92Å; L276-L280 VanDerWaalsContact O-CG 3.3Å; L276-L280 WeakPolarHBondContact O-CG 3.38Å; L276-L280 PolarHBondContact O-N 2.73Å; L276-L376 HydrophobicContact CB-CD1 3.83Å; L276-L376 HydrophobicContact CB-CD2 4.27Å; L276-L376 HydrophobicContact CD1-CD1 4.09Å; L276-L381 HydrophobicContact CD1-CB 4.47Å; L276-L381 HydrophobicContact CD1-CD2 4.45Å; L276-L381 HydrophobicContact CD1-CG 4.31Å; L276-L381 HydrophobicContact CD2-CD2 3.92Å; L276-L381 HydrophobicContact CD2-CG 4.21Å; L276-L383 HydrophobicContact CD2-CB 4.39Å; L276-L383 HydrophobicContact CD2-CD1 3.93Å; L276-L386 HydrophobicContact CD2-CB 4.26Å; L276-L386 HydrophobicContact CD2-CD2 3.64Å
277	D	77.5	Confident	73	Confident	70 Å²	70	42.2 Å²	42.2	37%	0.374	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-53.1	176.9	-148.9	12.6	0	0	0	110.4	S273 M274 L279 L280 H281 L376	S273-D277 PolarHBondContact O-N 3.14Å; M274-D277 PolarHBondContact O-N 2.78Å; D277-L279 VanDerWaalsContact C-N 3.27Å; D277-L279 PolarHBondContact O-N 2.84Å; D277-L280 PolarHBondContact O-N 3.03Å; D277-L280 VanDerWaalsContact O-N 3.15Å; D277-H281 PolarHBondContact O-N 2.93Å; D277-H281 PolarHBondContact O-ND1 3.1Å; D277-H281 IonicContact OD1-CE1 3.63Å; D277-H281 PolarHBondContact OD1-CE1 3.13Å; D277-H281 VanDerWaalsContact OD1-CE1 3.31Å; D277-H281 IonicContact OD1-ND1 3.82Å; D277-L376 HydrophobicContact CB-CD2 4.1Å
278	E	76.3	Confident	72.2	Confident	7 Å²	7	41.6 Å²	41.6	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-57.2	-36.8	175.7	-75.4	-120.7	-166.4	0	0	112.8	M274 C282 E288 S289 L290 L291	M274-E278 WeakPolarHBondContact O-CB 3.37Å; M274-E278 WeakPolarHBondContact O-CG 3.46Å; M274-E278 PolarHBondContact O-N 3.34Å; E278-C282 WeakPolarHBondContact O-CB 3.49Å; E278-C282 PolarHBondContact O-N 3.5Å; E278-E288 WeakPolarHBondContact CA-OE2 3.4Å; E278-E288 HydrophobicContact CG-CB 4.1Å; E278-E288 WeakPolarHBondContact CG-OE2 3.37Å; E278-E288 WeakPolarHBondContact OE2-CB 3.33Å; E278-S289 WeakPolarHBondContact OE1-CB 3.45Å; E278-S289 PolarHBondContact OE1-N 3.4Å; E278-S289 PolarHBondContact OE1-OG 3.21Å; E278-S289 PolarHBondContact OE2-N 2.9Å; E278-L290 VanDerWaalsContact CD-CB 3.46Å; E278-L290 HydrophobicContact CG-CB 4.24Å; E278-L290 HydrophobicContact CG-CD1 4.02Å; E278-L290 HydrophobicContact CG-CG 4.48Å; E278-L290 WeakPolarHBondContact OE1-CG 3.32Å; E278-L290 PolarHBondContact OE1-N 2.89Å; E278-L290 WeakPolarHBondContact OE2-CA 3.44Å; E278-L290 VanDerWaalsContact OE2-CB 3.28Å; E278-L290 WeakPolarHBondContact OE2-CB 3.49Å; E278-L290 PolarHBondContact OE2-N 3.02Å; E278-L291 PolarHBondContact OE2-N 3.39Å
279	L	77.5	Confident	71.5	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-72.1	-37.2	178.8	-176.9	64.9	0	0	0	112.3	L275 L276 D277 C282 L283 L291 I327 L383 L386	L275-L279 WeakPolarHBondContact O-CB 3.4Å; L275-L279 PolarHBondContact O-N 3.25Å; L276-L279 PolarHBondContact O-N 2.92Å; D277-L279 VanDerWaalsContact C-N 3.27Å; D277-L279 PolarHBondContact O-N 2.84Å; L279-C282 CarbonylContact O-C 3.53Å; L279-C282 PolarHBondContact O-N 3.49Å; L279-L283 HydrophobicContact CG-CD1 4.27Å; L279-L283 WeakPolarHBondContact O-CB 3.07Å; L279-L283 WeakPolarHBondContact O-CD1 3.42Å; L279-L283 VanDerWaalsContact O-CG 3.24Å; L279-L283 WeakPolarHBondContact O-CG 3.38Å; L279-L283 PolarHBondContact O-N 2.92Å; L279-L291 HydrophobicContact CB-CD1 4.22Å; L279-L291 HydrophobicContact CD1-CD1 3.95Å; L279-I327 HydrophobicContact CD1-CG2 4.15Å; L279-I327 HydrophobicContact CD2-CB 4.42Å; L279-I327 HydrophobicContact CD2-CD1 3.78Å; L279-I327 HydrophobicContact CD2-CG2 4.15Å; L279-I327 HydrophobicContact CG-CG2 4.42Å; L279-L383 HydrophobicContact CD2-CD1 3.73Å; L279-L386 HydrophobicContact CD2-CD2 3.87Å
280	L	79.1	Confident	70.6	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.037	17%	0.174	C	C	.	.	H	α-helix	trans	-68	-38.9	173.6	-67.7	174.4	0	0	0	111.1	L276 D277 L283 T284 I369 A372 E373 L376 L381 L386	L276-L280 VanDerWaalsContact O-CG 3.3Å; L276-L280 WeakPolarHBondContact O-CG 3.38Å; L276-L280 PolarHBondContact O-N 2.73Å; D277-L280 PolarHBondContact O-N 3.03Å; D277-L280 VanDerWaalsContact O-N 3.15Å; L280-L283 HydrophobicContact CD2-CD1 4.43Å; L280-L283 PolarHBondContact O-N 3.33Å; L280-T284 WeakPolarHBondContact O-CG2 2.98Å; L280-T284 PolarHBondContact O-N 3.47Å; L280-T284 PolarHBondContact O-OG1 3.48Å; L280-I369 HydrophobicContact CD2-CG2 4.2Å; L280-A372 HydrophobicContact CD2-CB 3.8Å; L280-E373 HydrophobicContact CD1-CB 4.24Å; L280-E373 HydrophobicContact CD1-CG 4.49Å; L280-L376 HydrophobicContact CD1-CB 4.35Å; L280-L376 HydrophobicContact CD1-CD2 3.77Å; L280-L381 HydrophobicContact CD1-CD2 4.39Å; L280-L386 HydrophobicContact CD2-CD1 4.26Å; L280-L386 HydrophobicContact CD2-CD2 4.35Å
281	H	75.6	Confident	69.9	Low	50 Å²	50	30.1 Å²	30.1	23%	0.231	16%	0.159	C	C	.	.	H	α-helix	trans	-62.8	-41.6	171.1	-70.1	95.1	0	0	0	111.9	D277 L283 T284 G285 I286 E288	D277-H281 PolarHBondContact O-N 2.93Å; D277-H281 PolarHBondContact O-ND1 3.1Å; D277-H281 IonicContact OD1-CE1 3.63Å; D277-H281 PolarHBondContact OD1-CE1 3.13Å; D277-H281 VanDerWaalsContact OD1-CE1 3.31Å; D277-H281 IonicContact OD1-ND1 3.82Å; H281-L283 VanDerWaalsContact C-N 3.27Å; H281-L283 PolarHBondContact O-N 3.3Å; H281-T284 PolarHBondContact O-N 2.91Å; H281-T284 PolarHBondContact O-OG1 3.17Å; H281-G285 PolarHBondContact O-N 3.22Å; H281-I286 CarbonylContact C-O 3.44Å; H281-I286 HydrophobicContact CB-CB 4.13Å; H281-I286 HydrophobicContact CB-CG2 4.33Å; H281-I286 PolarHBondContact O-N 3.02Å; H281-E288 HydrophobicContact CB-CG 3.89Å; H281-E288 IonicContact CD2-OE1 3.07Å; H281-E288 IonicContact CG-OE1 2.64Å; H281-E288 IonicContact CG-OE2 2.74Å; H281-E288 IonicContact ND1-OE1 3.56Å; H281-E288 IonicContact ND1-OE2 3.82Å
282	C	75.6	Confident	69.2	Low	5 Å²	5	32.3 Å²	32.3	3%	0.034	17%	0.173	C	C	.	.	H	α-helix	trans	-66.5	-21	173.9	-171.5	0	0	0	0	114.1	W248 E278 L279 L291 F310	W248-C282 WeakPolarHBondContact CH2-O 3.29Å; E278-C282 WeakPolarHBondContact O-CB 3.49Å; E278-C282 PolarHBondContact O-N 3.5Å; L279-C282 CarbonylContact O-C 3.53Å; L279-C282 PolarHBondContact O-N 3.49Å; C282-L291 HydrophobicContact CB-CB 4.47Å; C282-L291 HydrophobicContact CB-CD1 4Å; C282-F310 WeakPolarHBondContact SG-CE1 3.27Å
283	L	74.6	Confident	68.3	Low	1 Å²	1	30.7 Å²	30.7	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-87.3	-19	174	-73.4	162.8	0	0	0	112.9	L279 L280 H281 I327 L330 A331 F365 I369 L390	L279-L283 HydrophobicContact CG-CD1 4.27Å; L279-L283 WeakPolarHBondContact O-CB 3.07Å; L279-L283 WeakPolarHBondContact O-CD1 3.42Å; L279-L283 VanDerWaalsContact O-CG 3.24Å; L279-L283 WeakPolarHBondContact O-CG 3.38Å; L279-L283 PolarHBondContact O-N 2.92Å; L280-L283 HydrophobicContact CD2-CD1 4.43Å; L280-L283 PolarHBondContact O-N 3.33Å; H281-L283 VanDerWaalsContact C-N 3.27Å; H281-L283 PolarHBondContact O-N 3.3Å; L283-I327 HydrophobicContact CD1-CG2 4.32Å; L283-I327 HydrophobicContact CD2-CG2 4.36Å; L283-L330 HydrophobicContact CD2-CB 4.28Å; L283-L330 HydrophobicContact CD2-CD2 4.18Å; L283-L330 HydrophobicContact CD2-CG 4.14Å; L283-A331 HydrophobicContact CD2-CB 4.08Å; L283-F365 HydrophobicContact CB-CZ 4.5Å; L283-F365 HydrophobicContact CD2-CZ 4.14Å; L283-I369 HydrophobicContact CB-CD1 3.89Å; L283-I369 HydrophobicContact CB-CG1 4.47Å; L283-L390 HydrophobicContact CD1-CD1 3.91Å
284	T	70.1	Confident	67.4	Low	30 Å²	30	31.6 Å²	31.6	18%	0.184	16%	0.163	C	C	.	.	H	α-helix	trans	-96.8	-46.7	-173.7	48	0	0	0	0	115.3	L280 H281 Y366 I369	L280-T284 WeakPolarHBondContact O-CG2 2.98Å; L280-T284 PolarHBondContact O-N 3.47Å; L280-T284 PolarHBondContact O-OG1 3.48Å; H281-T284 PolarHBondContact O-N 2.91Å; H281-T284 PolarHBondContact O-OG1 3.17Å; T284-Y366 HydrophobicContact CG2-CD1 4.33Å; T284-Y366 HydrophobicContact CG2-CE1 4.25Å; T284-Y366 WeakPolarHBondContact O-CE1 3.27Å; T284-Y366 PolarHBondContact O-OH 3.03Å; T284-I369 HydrophobicContact CG2-CB 4.34Å; T284-I369 HydrophobicContact CG2-CD1 3.82Å; T284-I369 HydrophobicContact CG2-CG2 3.56Å
285	G	64.9	Low	66.5	Low	8 Å²	8	36.4 Å²	36.4	8%	0.082	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	174.4	-14.5	-166.4	0	0	0	0	0	116	W248 H281	W248-G285 VanDerWaalsContact CE2-CA 3.48Å; W248-G285 VanDerWaalsContact CH2-N 3.26Å; H281-G285 PolarHBondContact O-N 3.22Å
286	I	65.2	Low	65.4	Low	82 Å²	82	38.7 Å²	38.7	42%	0.421	20%	0.198	S	C	.	.			trans	-124.2	127.3	-146.1	-59.8	168.1	0	0	0	109.3	H281 E288	H281-I286 CarbonylContact C-O 3.44Å; H281-I286 HydrophobicContact CB-CB 4.13Å; H281-I286 HydrophobicContact CB-CG2 4.33Å; H281-I286 PolarHBondContact O-N 3.02Å; I286-E288 HydrophobicContact CG2-CG 4.23Å
287	R	55.2	Low	64	Low	82 Å²	82	43.7 Å²	43.7	31%	0.309	22%	0.223	S	C	.	.			trans	-84.4	122.1	175.5	-73.4	178.9	170.6	-105.9	-6.4	109.4	P293	R287-P293 HydrophobicContact CG-CG 4.19Å; R287-P293 PolarHBondContact NH1-O 3.4Å; R287-P293 PolarHBondContact NH2-O 3.46Å; R287-P293 VanDerWaalsContact NH2-O 3.12Å
288	E	55.6	Low	62.6	Low	71 Å²	71	48.9 Å²	48.9	33%	0.332	25%	0.249	S	C	.	.			trans	-117.3	-171.1	173.9	-63.5	-150	140.3	0	0	111.9	E278 H281 I286	E278-E288 WeakPolarHBondContact CA-OE2 3.4Å; E278-E288 HydrophobicContact CG-CB 4.1Å; E278-E288 WeakPolarHBondContact CG-OE2 3.37Å; E278-E288 WeakPolarHBondContact OE2-CB 3.33Å; H281-E288 HydrophobicContact CB-CG 3.89Å; H281-E288 IonicContact CD2-OE1 3.07Å; H281-E288 IonicContact CG-OE1 2.64Å; H281-E288 IonicContact CG-OE2 2.74Å; H281-E288 IonicContact ND1-OE1 3.56Å; H281-E288 IonicContact ND1-OE2 3.82Å; I286-E288 HydrophobicContact CG2-CG 4.23Å
289	S	55	Low	60.9	Low	46 Å²	46	53.5 Å²	53.5	32%	0.322	28%	0.282	S	S	.	.	S	Bend	trans	-80.8	-27.7	-162.2	80	0	0	0	0	114.1	E278 H313	E278-S289 WeakPolarHBondContact OE1-CB 3.45Å; E278-S289 PolarHBondContact OE1-N 3.4Å; E278-S289 PolarHBondContact OE1-OG 3.21Å; E278-S289 PolarHBondContact OE2-N 2.9Å; S289-H313 PolarHBondContact O-NE2 3.09Å
290	L	51.8	Low	59.1	Low	3 Å²	3	54.5 Å²	54.5	2%	0.016	29%	0.291	C	S	.	.	S	Bend	trans	-98	-23.5	-172	-69	163.8	0	0	0	114.7	I263 M274 L275 E278 H313	I263-L290 HydrophobicContact CD1-CD2 3.72Å; I263-L290 HydrophobicContact CG1-CD2 4.23Å; I263-L290 HydrophobicContact CG2-CD2 4.32Å; M274-L290 HydrophobicContact CE-CD1 3.92Å; M274-L290 HydrophobicContact CG-CD1 3.9Å; M274-L290 HydrophobicContact SD-CD1 3.92Å; L275-L290 HydrophobicContact CD2-CD1 4.28Å; E278-L290 VanDerWaalsContact CD-CB 3.46Å; E278-L290 HydrophobicContact CG-CB 4.24Å; E278-L290 HydrophobicContact CG-CD1 4.02Å; E278-L290 HydrophobicContact CG-CG 4.48Å; E278-L290 WeakPolarHBondContact OE1-CG 3.32Å; E278-L290 PolarHBondContact OE1-N 2.89Å; E278-L290 WeakPolarHBondContact OE2-CA 3.44Å; E278-L290 VanDerWaalsContact OE2-CB 3.28Å; E278-L290 WeakPolarHBondContact OE2-CB 3.49Å; E278-L290 PolarHBondContact OE2-N 3.02Å; L290-H313 WeakPolarHBondContact CA-CD2 3.5Å; L290-H313 WeakPolarHBondContact CA-NE2 3.5Å; L290-H313 PolarHBondContact O-CD2 3.24Å
291	L	58.6	Low	57.3	Low	3 Å²	3	61 Å²	61	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	107.7	-178.6	-64.4	174	0	0	0	111	E278 L279 C282 I312 V324	E278-L291 PolarHBondContact OE2-N 3.39Å; L279-L291 HydrophobicContact CB-CD1 4.22Å; L279-L291 HydrophobicContact CD1-CD1 3.95Å; C282-L291 HydrophobicContact CB-CB 4.47Å; C282-L291 HydrophobicContact CB-CD1 4Å; L291-I312 HydrophobicContact CD2-CG1 4.14Å; L291-I312 HydrophobicContact CD2-CG2 4.48Å; L291-V324 HydrophobicContact CD2-CG1 3.95Å
292	V	59	Low	56.3	Low	59 Å²	59	59.5 Å²	59.5	36%	0.358	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116	-175.3	-176.8	0	0	0	0	110.6	Q294 D311	V292-Q294 PolarHBondContact O-N 2.91Å; V292-D311 PolarHBondContact N-O 2.88Å; V292-D311 PolarHBondContact O-N 3.47Å
293	P	58.7	Low	55	Low	5 Å²	5	63.7 Å²	63.7	3%	0.032	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	126	169.8	-6.3	16.8	0	0	0	110	R287 F310	R287-P293 HydrophobicContact CG-CG 4.19Å; R287-P293 PolarHBondContact NH1-O 3.4Å; R287-P293 PolarHBondContact NH2-O 3.46Å; R287-P293 VanDerWaalsContact NH2-O 3.12Å; P293-F310 HydrophobicContact CB-CD1 4.01Å; P293-F310 HydrophobicContact CB-CE1 3.97Å; P293-F310 HydrophobicContact CG-CD1 4.11Å; P293-F310 HydrophobicContact CG-CE1 3.88Å
294	Q	58.7	Low	53.6	Low	77 Å²	77	66.1 Å²	66.1	36%	0.36	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-60.5	156.9	175.5	-69.8	-167.5	3.1	0	0	111	V292 D309 D311	V292-Q294 PolarHBondContact O-N 2.91Å; Q294-D309 HydrophobicContact CB-CB 4.36Å; Q294-D309 WeakPolarHBondContact CB-O 3.34Å; Q294-D309 HydrophobicContact CG-CB 4.26Å; Q294-D309 PolarHBondContact N-O 3.03Å; Q294-D311 WeakPolarHBondContact CG-OD2 3.39Å; Q294-D311 PolarHBondContact NE2-OD1 3.45Å
295	K	53.8	Low	52.7	Low	154 Å²	154	70.2 Å²	70.2	67%	0.67	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-69.7	133.8	175.4	-76.5	178.1	176.7	-178.4	0	109.6	Y251 I297	Y251-K295 HydrophobicContact CD1-CG 4.29Å; Y251-K295 HydrophobicContact CE1-CD 4.34Å; Y251-K295 HydrophobicContact CE1-CG 3.5Å; Y251-K295 VanDerWaalsContact CE1-CG 3.5Å; K295-I297 PolarHBondContact O-N 3.06Å
296	P	53.7	Low	52.1	Low	49 Å²	49	70.9 Å²	70.9	32%	0.318	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-61.2	134.3	174.3	28.2	-33.7	0	0	0	108.8	Y251 I298	Y251-P296 WeakPolarHBondContact OH-CD 3.47Å; P296-I298 PolarHBondContact O-N 2.95Å; P296-I298 VanDerWaalsContact O-N 3.09Å
297	I	46.9	Very low	51.7	Low	107 Å²	107	69.4 Å²	69.4	55%	0.549	38%	0.379	S	S	.	.			trans	-73.1	107.6	-176.8	-61.6	170.5	0	0	0	107.8	K295 S299 A300	K295-I297 PolarHBondContact O-N 3.06Å; I297-S299 WeakPolarHBondContact CG2-OG 3.49Å; I297-S299 PolarHBondContact O-N 3.03Å; I297-A300 HydrophobicContact CB-CB 4.17Å; I297-A300 HydrophobicContact CG2-CB 4.35Å; I297-A300 WeakPolarHBondContact O-CB 3.17Å; I297-A300 PolarHBondContact O-N 3.49Å
298	I	48.3	Very low	52	Low	179 Å²	179	66 Å²	66	92%	0.918	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-17.5	-174.1	-59.5	170.1	0	0	0	112.8	P296	P296-I298 PolarHBondContact O-N 2.95Å; P296-I298 VanDerWaalsContact O-N 3.09Å
299	S	40.9	Very low	52.2	Low	104 Å²	104	67.5 Å²	67.5	73%	0.727	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	8.6	178.1	64.7	0	0	0	0	115.4	I297	I297-S299 WeakPolarHBondContact CG2-OG 3.49Å; I297-S299 PolarHBondContact O-N 3.03Å
300	A	39.9	Very low	52.7	Low	23 Å²	23	66.6 Å²	66.6	19%	0.19	37%	0.368	C	S	.	.			trans	-81	134.9	-177.3	0	0	0	0	0	113	I297 A304	I297-A300 HydrophobicContact CB-CB 4.17Å; I297-A300 HydrophobicContact CG2-CB 4.35Å; I297-A300 WeakPolarHBondContact O-CB 3.17Å; I297-A300 PolarHBondContact O-N 3.49Å; A300-A304 HydrophobicContact CB-CB 3.85Å; A300-A304 WeakPolarHBondContact CB-O 3.38Å
301	V	41.2	Very low	53.1	Low	142 Å²	142	70.5 Å²	70.5	86%	0.861	39%	0.389	S	S	*	.			trans	-111.9	138.7	172.9	-177.7	0	0	0	0	108.3
302	G	53.8	Low	53.3	Low	19 Å²	19	71.7 Å²	71.7	20%	0.196	40%	0.395	C	S	.	.	S	Bend	trans	90.3	-150.9	-178.8	0	0	0	0	0	113.8	A304 K305	G302-A304 PolarHBondContact O-N 3.35Å; G302-K305 WeakPolarHBondContact O-CB 3.41Å; G302-K305 PolarHBondContact O-N 3.17Å; G302-K305 VanDerWaalsContact O-N 3.13Å
303	L	48.3	Very low	53.4	Low	93 Å²	93	71.6 Å²	71.6	49%	0.487	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-47.8	-43.5	-179.3	-105.3	74.1	0	0	0	113.1	K305 Y306 D307 V405	L303-K305 PolarHBondContact O-N 3.42Å; L303-Y306 PolarHBondContact O-N 2.8Å; L303-D307 PolarHBondContact O-N 2.96Å; L303-D307 VanDerWaalsContact O-N 3.1Å; L303-V405 HydrophobicContact CD1-CB 4.43Å; L303-V405 HydrophobicContact CD1-CG1 3.53Å; L303-V405 HydrophobicContact CG-CG1 3.9Å
304	A	45.1	Very low	53.2	Low	53 Å²	53	77.3 Å²	77.3	44%	0.438	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-66.8	-3.5	-175.4	0	0	0	0	0	115.2	A300 G302	A300-A304 HydrophobicContact CB-CB 3.85Å; A300-A304 WeakPolarHBondContact CB-O 3.38Å; G302-A304 PolarHBondContact O-N 3.35Å
305	K	51.2	Low	53.1	Low	116 Å²	116	79.4 Å²	79.4	50%	0.504	44%	0.435	S	S	.	.	G	3₁₀ helix	trans	-74.8	-33.4	167.8	-177.7	-177.3	173	-159.8	0	112	G302 L303	G302-K305 WeakPolarHBondContact O-CB 3.41Å; G302-K305 PolarHBondContact O-N 3.17Å; G302-K305 VanDerWaalsContact O-N 3.13Å; L303-K305 PolarHBondContact O-N 3.42Å
306	Y	53.2	Low	53.6	Low	21 Å²	21	72.9 Å²	72.9	8%	0.082	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-20.7	-171	-53.1	-80.4	0	0	0	113.4	L303 W401 Q408	L303-Y306 PolarHBondContact O-N 2.8Å; Y306-W401 HydrophobicContact CG-CH2 4.44Å; Y306-Q408 HydrophobicContact CE2-CG 4.14Å; Y306-Q408 VanDerWaalsContact OH-CG 3.31Å; Y306-Q408 WeakPolarHBondContact OH-CG 3.33Å
307	D	57.7	Low	54.3	Low	52 Å²	52	73.7 Å²	73.7	28%	0.278	41%	0.409	S	S	.	.			trans	-62.6	156	169	-149.8	-10.7	0	0	0	111.8	L303 S332	L303-D307 PolarHBondContact O-N 2.96Å; L303-D307 VanDerWaalsContact O-N 3.1Å; D307-S332 WeakPolarHBondContact OD1-CB 3.29Å; D307-S332 PolarHBondContact OD1-OG 3.45Å
308	T	61.5	Low	55.4	Low	10 Å²	10	79.2 Å²	79.2	6%	0.061	42%	0.423	C	S	.	.			trans	-142.7	102.1	-178.2	56	0	0	0	0	110.5	F310 S332 M335	T308-F310 WeakPolarHBondContact O-CD2 3.46Å; T308-F310 WeakPolarHBondContact O-CE2 3.43Å; T308-S332 WeakPolarHBondContact O-CB 3.45Å; T308-S332 WeakPolarHBondContact OG1-CA 3.33Å; T308-S332 VanDerWaalsContact OG1-CB 3.25Å; T308-S332 WeakPolarHBondContact OG1-CB 3.2Å; T308-M335 HydrophobicContact CG2-CE 4.3Å; T308-M335 HydrophobicContact CG2-SD 4.23Å; T308-M335 WeakPolarHBondContact OG1-CE 3.47Å
309	D	58.9	Low	56.8	Low	102 Å²	102	73.7 Å²	73.7	55%	0.545	40%	0.4	S	S	.	.			trans	-68.1	153.3	170.8	-70.1	-52.9	0	0	0	111.5	Q294	Q294-D309 HydrophobicContact CB-CB 4.36Å; Q294-D309 WeakPolarHBondContact CB-O 3.34Å; Q294-D309 HydrophobicContact CG-CB 4.26Å; Q294-D309 PolarHBondContact N-O 3.03Å
310	F	65.9	Low	58.3	Low	27 Å²	27	69.4 Å²	69.4	12%	0.118	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.6	-179.4	-67.1	-93.4	0	0	0	111.4	C282 P293 T308 L328 A331 M335	C282-F310 WeakPolarHBondContact SG-CE1 3.27Å; P293-F310 HydrophobicContact CB-CD1 4.01Å; P293-F310 HydrophobicContact CB-CE1 3.97Å; P293-F310 HydrophobicContact CG-CD1 4.11Å; P293-F310 HydrophobicContact CG-CE1 3.88Å; T308-F310 WeakPolarHBondContact O-CD2 3.46Å; T308-F310 WeakPolarHBondContact O-CE2 3.43Å; F310-L328 HydrophobicContact CB-CD1 3.97Å; F310-L328 HydrophobicContact CB-CD2 3.99Å; F310-L328 HydrophobicContact CB-CG 4.45Å; F310-L328 HydrophobicContact CD1-CD2 4Å; F310-L328 HydrophobicContact CD2-CB 4.06Å; F310-L328 HydrophobicContact CD2-CD2 3.86Å; F310-L328 HydrophobicContact CD2-CG 4.41Å; F310-L328 HydrophobicContact CE1-CD2 4.36Å; F310-L328 HydrophobicContact CE2-CB 4.48Å; F310-L328 HydrophobicContact CE2-CD2 4.22Å; F310-L328 WeakPolarHBondContact CE2-O 3.5Å; F310-L328 HydrophobicContact CG-CD2 3.72Å; F310-L328 HydrophobicContact CZ-CD2 4.43Å; F310-A331 HydrophobicContact CE2-CB 3.9Å; F310-A331 HydrophobicContact CZ-CB 3.51Å; F310-M335 HydrophobicContact CE1-CE 3.87Å; F310-M335 HydrophobicContact CE2-CE 4.09Å; F310-M335 HydrophobicContact CZ-CE 3.27Å
311	D	59.6	Low	59.9	Low	85 Å²	85	69.3 Å²	69.3	46%	0.455	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	124	169.7	-71.2	-36.8	0	0	0	110.1	V292 Q294	V292-D311 PolarHBondContact N-O 2.88Å; V292-D311 PolarHBondContact O-N 3.47Å; Q294-D311 WeakPolarHBondContact CG-OD2 3.39Å; Q294-D311 PolarHBondContact NE2-OD1 3.45Å
312	I	63.6	Low	61.8	Low	28 Å²	28	67.9 Å²	67.9	14%	0.144	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	137.2	173.3	-52.4	170.7	0	0	0	108.5	L291 L316 T321 V324 R325 L328	L291-I312 HydrophobicContact CD2-CG1 4.14Å; L291-I312 HydrophobicContact CD2-CG2 4.48Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; I312-T321 HydrophobicContact CD1-CG2 4.21Å; I312-T321 HydrophobicContact CG2-CG2 4.21Å; I312-V324 HydrophobicContact CD1-CG1 4.03Å; I312-V324 HydrophobicContact CG1-CG1 4.47Å; I312-R325 HydrophobicContact CD1-CG 3.43Å; I312-R325 VanDerWaalsContact CD1-CG 3.43Å; I312-L328 HydrophobicContact CD1-CD1 3.62Å; I312-L328 HydrophobicContact CG1-CD1 3.77Å
313	H	59.5	Low	62.8	Low	57 Å²	57	68.7 Å²	68.7	26%	0.264	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-61	142.7	-179.7	-73.2	-76.3	0	0	0	114.2	S289 L290 H315 L316	S289-H313 PolarHBondContact O-NE2 3.09Å; L290-H313 WeakPolarHBondContact CA-CD2 3.5Å; L290-H313 WeakPolarHBondContact CA-NE2 3.5Å; L290-H313 PolarHBondContact O-CD2 3.24Å; H313-H315 PolarHBondContact O-N 2.81Å; H313-H315 VanDerWaalsContact O-N 3.08Å; H313-L316 HydrophobicContact CB-CD1 4.42Å
314	T	55.9	Low	64.2	Low	126 Å²	126	64.4 Å²	64.4	77%	0.773	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	2.9	-177.5	49.9	0	0	0	0	115.4
315	H	56.3	Low	65.9	Low	120 Å²	120	69.6 Å²	69.6	56%	0.556	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.4	5.3	-173.4	-65.8	-70	0	0	0	114.5	A264 H313	A264-H315 HydrophobicContact CB-CB 4.47Å; H313-H315 PolarHBondContact O-N 2.81Å; H313-H315 VanDerWaalsContact O-N 3.08Å
316	L	64	Low	67.2	Low	18 Å²	18	68 Å²	68	9%	0.094	33%	0.329	C	S	.	.	S	Bend	trans	-84.1	155.2	175.2	-71	160.5	0	0	0	111.2	I263 L275 I312 H313	I263-L316 HydrophobicContact CG2-CD2 4.33Å; L275-L316 HydrophobicContact CD1-CD2 3.68Å; L275-L316 HydrophobicContact CD2-CD1 3.82Å; L275-L316 HydrophobicContact CD2-CD2 3.89Å; L275-L316 HydrophobicContact CG-CD2 4.03Å; I312-L316 HydrophobicContact CG2-CD1 3.69Å; H313-L316 HydrophobicContact CB-CD1 4.42Å
317	D	68.6	Low	68.5	Low	65 Å²	65	67 Å²	67	35%	0.348	33%	0.325	S	S	.	.			trans	-62.8	145.6	174.3	-178.5	44.8	0	0	0	111.2	L268 S319 L320 T321	L268-D317 HydrophobicContact CD2-CB 4.11Å; D317-S319 PolarHBondContact O-N 3.06Å; D317-S319 VanDerWaalsContact OD2-CB 3.31Å; D317-S319 WeakPolarHBondContact OD2-CB 3.37Å; D317-S319 PolarHBondContact OD2-N 3.45Å; D317-S319 PolarHBondContact OD2-OG 3.28Å; D317-L320 PolarHBondContact O-N 3.1Å; D317-T321 WeakPolarHBondContact O-CB 3.34Å; D317-T321 PolarHBondContact O-N 3.18Å; D317-T321 PolarHBondContact O-OG1 3.34Å
318	R	70.9	Confident	69.5	Low	224 Å²	224	65.1 Å²	65.1	85%	0.845	32%	0.315	S	S	*	.	H	α-helix	trans	-63.2	-29.5	-176.5	-70.7	-176.9	175.3	-177.5	-1.2	112.5	H322	R318-H322 PolarHBondContact O-N 3.4Å
319	S	77.2	Confident	70.5	Confident	63 Å²	63	66.9 Å²	66.9	44%	0.441	33%	0.326	S	S	.	.	H	α-helix	trans	-71.1	-51.3	178.9	70.2	0	0	0	0	112	D317 T321 H322 Q323	D317-S319 PolarHBondContact O-N 3.06Å; D317-S319 VanDerWaalsContact OD2-CB 3.31Å; D317-S319 WeakPolarHBondContact OD2-CB 3.37Å; D317-S319 PolarHBondContact OD2-N 3.45Å; D317-S319 PolarHBondContact OD2-OG 3.28Å; S319-T321 VanDerWaalsContact C-N 3.33Å; S319-T321 PolarHBondContact O-N 2.89Å; S319-H322 WeakPolarHBondContact O-CB 3.25Å; S319-H322 PolarHBondContact O-N 3.18Å; S319-H322 VanDerWaalsContact O-N 3.16Å; S319-Q323 PolarHBondContact O-N 3.28Å
320	L	71.5	Confident	71.6	Confident	13 Å²	13	62 Å²	62	7%	0.068	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-42.5	175.5	-64	174.4	0	0	0	111.1	Q271 E272 L275 D317 H322 Q323 V324 L383	Q271-L320 HydrophobicContact CB-CD1 4.45Å; E272-L320 HydrophobicContact CB-CD2 4.46Å; E272-L320 HydrophobicContact CG-CD2 4.36Å; L275-L320 HydrophobicContact CD1-CB 4.06Å; L275-L320 HydrophobicContact CD1-CD1 4.04Å; D317-L320 PolarHBondContact O-N 3.1Å; L320-H322 VanDerWaalsContact C-N 3.26Å; L320-H322 PolarHBondContact O-N 2.88Å; L320-Q323 PolarHBondContact O-N 3.39Å; L320-V324 WeakPolarHBondContact O-CG2 3.27Å; L320-V324 PolarHBondContact O-N 2.98Å; L320-L383 HydrophobicContact CD2-CD2 3.94Å
321	T	74.9	Confident	72.1	Confident	21 Å²	21	60.9 Å²	60.9	13%	0.129	30%	0.296	C	S	.	.	H	α-helix	trans	-58.1	-36.8	175.9	-56.5	0	0	0	0	112.3	I312 D317 S319 R325	I312-T321 HydrophobicContact CD1-CG2 4.21Å; I312-T321 HydrophobicContact CG2-CG2 4.21Å; D317-T321 WeakPolarHBondContact O-CB 3.34Å; D317-T321 PolarHBondContact O-N 3.18Å; D317-T321 PolarHBondContact O-OG1 3.34Å; S319-T321 VanDerWaalsContact C-N 3.33Å; S319-T321 PolarHBondContact O-N 2.89Å; T321-R325 WeakPolarHBondContact O-CG 3.24Å; T321-R325 PolarHBondContact O-N 2.87Å; T321-R325 VanDerWaalsContact O-N 3.14Å
322	H	79.4	Confident	72.9	Confident	113 Å²	113	57.1 Å²	57.1	52%	0.523	28%	0.276	S	S	.	.	H	α-helix	trans	-69.4	-45.6	176.9	-165.5	-73.2	0	0	0	111.9	R318 S319 L320 V324 R325 E326	R318-H322 PolarHBondContact O-N 3.4Å; S319-H322 WeakPolarHBondContact O-CB 3.25Å; S319-H322 PolarHBondContact O-N 3.18Å; S319-H322 VanDerWaalsContact O-N 3.16Å; L320-H322 VanDerWaalsContact C-N 3.26Å; L320-H322 PolarHBondContact O-N 2.88Å; H322-V324 VanDerWaalsContact C-N 3.35Å; H322-V324 PolarHBondContact O-N 3.34Å; H322-R325 WeakPolarHBondContact O-CB 3.17Å; H322-R325 PolarHBondContact O-N 3.14Å; H322-E326 IonicContact CE1-OE1 3.69Å; H322-E326 PolarHBondContact CE1-OE1 3.47Å; H322-E326 IonicContact ND1-OE1 3.89Å; H322-E326 PolarHBondContact ND1-OE1 3.02Å; H322-E326 PolarHBondContact O-N 3.46Å
323	Q	76.5	Confident	73.7	Confident	36 Å²	36	58 Å²	58	17%	0.168	28%	0.278	C	S	.	.	H	α-helix	trans	-65.1	-37.6	179.2	-69.4	176.1	7.6	0	0	112	S319 L320 E326 I327 L383	S319-Q323 PolarHBondContact O-N 3.28Å; L320-Q323 PolarHBondContact O-N 3.39Å; Q323-E326 PolarHBondContact O-N 3.16Å; Q323-I327 PolarHBondContact O-N 2.97Å; Q323-L383 HydrophobicContact CB-CD2 3.59Å; Q323-L383 HydrophobicContact CB-CG 3.92Å
324	V	78	Confident	74.7	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.012	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-42.2	172.4	172.1	0	0	0	0	111.1	L291 I312 L320 H322 E326 I327 L328 L383	L291-V324 HydrophobicContact CD2-CG1 3.95Å; I312-V324 HydrophobicContact CD1-CG1 4.03Å; I312-V324 HydrophobicContact CG1-CG1 4.47Å; L320-V324 WeakPolarHBondContact O-CG2 3.27Å; L320-V324 PolarHBondContact O-N 2.98Å; H322-V324 VanDerWaalsContact C-N 3.35Å; H322-V324 PolarHBondContact O-N 3.34Å; V324-E326 PolarHBondContact O-N 3.13Å; V324-I327 PolarHBondContact O-N 3.37Å; V324-L328 HydrophobicContact CG1-CD1 3.76Å; V324-L328 HydrophobicContact CG1-CD2 4.48Å; V324-L328 HydrophobicContact CG1-CG 3.95Å; V324-L328 WeakPolarHBondContact O-CG 3.16Å; V324-L328 PolarHBondContact O-N 3.18Å; V324-L383 HydrophobicContact CG2-CD2 4.01Å
325	R	80.2	Confident	75.6	Confident	162 Å²	162	49.5 Å²	49.5	61%	0.611	23%	0.23	S	C	*	.	H	α-helix	trans	-61.1	-28.1	176	-78.3	179.5	179.4	169.3	0.9	114.3	I312 T321 H322 I327 P329	I312-R325 HydrophobicContact CD1-CG 3.43Å; I312-R325 VanDerWaalsContact CD1-CG 3.43Å; T321-R325 WeakPolarHBondContact O-CG 3.24Å; T321-R325 PolarHBondContact O-N 2.87Å; T321-R325 VanDerWaalsContact O-N 3.14Å; H322-R325 WeakPolarHBondContact O-CB 3.17Å; H322-R325 PolarHBondContact O-N 3.14Å; R325-I327 VanDerWaalsContact C-N 3.34Å; R325-P329 VanDerWaalsContact O-CD 3.28Å; R325-P329 WeakPolarHBondContact O-CD 3.43Å
326	E	78.9	Confident	76.5	Confident	84 Å²	84	43.8 Å²	43.8	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-73.3	-27.7	174.8	-70.7	174.2	170.4	0	0	112.2	H322 Q323 V324 L387	H322-E326 IonicContact CE1-OE1 3.69Å; H322-E326 PolarHBondContact CE1-OE1 3.47Å; H322-E326 IonicContact ND1-OE1 3.89Å; H322-E326 PolarHBondContact ND1-OE1 3.02Å; H322-E326 PolarHBondContact O-N 3.46Å; Q323-E326 PolarHBondContact O-N 3.16Å; V324-E326 PolarHBondContact O-N 3.13Å; E326-L387 HydrophobicContact CB-CD1 3.93Å; E326-L387 WeakPolarHBondContact OE2-CD2 3.48Å
327	I	80.6	Confident	77.2	Confident	0 Å²	0	43 Å²	43	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-89.7	-34.4	-178.4	-60	170.2	0	0	0	112.2	L279 L283 Q323 V324 R325 P329 L330 L383 L386 L387 L390	L279-I327 HydrophobicContact CD1-CG2 4.15Å; L279-I327 HydrophobicContact CD2-CB 4.42Å; L279-I327 HydrophobicContact CD2-CD1 3.78Å; L279-I327 HydrophobicContact CD2-CG2 4.15Å; L279-I327 HydrophobicContact CG-CG2 4.42Å; L283-I327 HydrophobicContact CD1-CG2 4.32Å; L283-I327 HydrophobicContact CD2-CG2 4.36Å; Q323-I327 PolarHBondContact O-N 2.97Å; V324-I327 PolarHBondContact O-N 3.37Å; R325-I327 VanDerWaalsContact C-N 3.34Å; I327-P329 VanDerWaalsContact C-CD 3.4Å; I327-L330 WeakPolarHBondContact O-CB 3.37Å; I327-L330 PolarHBondContact O-N 3.21Å; I327-L383 HydrophobicContact CD1-CD1 3.89Å; I327-L386 HydrophobicContact CD1-CD2 4.47Å; I327-L387 HydrophobicContact CD1-CB 4.21Å; I327-L387 HydrophobicContact CD1-CD1 4.25Å; I327-L387 HydrophobicContact CG1-CB 4.49Å; I327-L387 HydrophobicContact CG1-CD1 3.63Å; I327-L390 HydrophobicContact CG2-CD1 3.68Å
328	L	77.6	Confident	77.7	Confident	12 Å²	12	41.5 Å²	41.5	6%	0.063	19%	0.19	C	C	.	.	H	α-helix	trans	-54	-35.6	-174.9	-75.5	167.7	0	0	0	116.4	F310 I312 V324 L330 A331 S332	F310-L328 HydrophobicContact CB-CD1 3.97Å; F310-L328 HydrophobicContact CB-CD2 3.99Å; F310-L328 HydrophobicContact CB-CG 4.45Å; F310-L328 HydrophobicContact CD1-CD2 4Å; F310-L328 HydrophobicContact CD2-CB 4.06Å; F310-L328 HydrophobicContact CD2-CD2 3.86Å; F310-L328 HydrophobicContact CD2-CG 4.41Å; F310-L328 HydrophobicContact CE1-CD2 4.36Å; F310-L328 HydrophobicContact CE2-CB 4.48Å; F310-L328 HydrophobicContact CE2-CD2 4.22Å; F310-L328 WeakPolarHBondContact CE2-O 3.5Å; F310-L328 HydrophobicContact CG-CD2 3.72Å; F310-L328 HydrophobicContact CZ-CD2 4.43Å; I312-L328 HydrophobicContact CD1-CD1 3.62Å; I312-L328 HydrophobicContact CG1-CD1 3.77Å; V324-L328 HydrophobicContact CG1-CD1 3.76Å; V324-L328 HydrophobicContact CG1-CD2 4.48Å; V324-L328 HydrophobicContact CG1-CG 3.95Å; V324-L328 WeakPolarHBondContact O-CG 3.16Å; V324-L328 PolarHBondContact O-N 3.18Å; L328-L330 PolarHBondContact O-N 2.86Å; L328-A331 WeakPolarHBondContact O-CB 3.38Å; L328-A331 PolarHBondContact O-N 3.28Å; L328-S332 PolarHBondContact O-N 3.07Å
329	P	82.1	Confident	77.9	Confident	47 Å²	47	33.3 Å²	33.3	31%	0.305	16%	0.161	S	C	.	.	H	α-helix	trans	-57.6	-29	174.4	-26.6	35.7	0	0	0	113.6	R325 I327 A331 S332 Y333	R325-P329 VanDerWaalsContact O-CD 3.28Å; R325-P329 WeakPolarHBondContact O-CD 3.43Å; I327-P329 VanDerWaalsContact C-CD 3.4Å; P329-A331 VanDerWaalsContact C-N 3.29Å; P329-A331 PolarHBondContact O-N 3.46Å; P329-S332 PolarHBondContact O-N 3.39Å; P329-S332 PolarHBondContact O-OG 2.65Å; P329-Y333 HydrophobicContact CB-CE2 3.99Å; P329-Y333 WeakPolarHBondContact O-CD1 3.41Å; P329-Y333 WeakPolarHBondContact O-CD2 3.21Å; P329-Y333 PolarHBondContact O-N 2.74Å
330	L	82.1	Confident	77.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-40.7	174.7	-174.6	50.6	0	0	0	112	L283 I327 L328 F334 F365 L390 M394 M397	L283-L330 HydrophobicContact CD2-CB 4.28Å; L283-L330 HydrophobicContact CD2-CD2 4.18Å; L283-L330 HydrophobicContact CD2-CG 4.14Å; I327-L330 WeakPolarHBondContact O-CB 3.37Å; I327-L330 PolarHBondContact O-N 3.21Å; L328-L330 PolarHBondContact O-N 2.86Å; L330-F334 VanDerWaalsContact O-CB 3.29Å; L330-F334 WeakPolarHBondContact O-CB 3.5Å; L330-F334 PolarHBondContact O-N 3.21Å; L330-F365 HydrophobicContact CD1-CE2 4.18Å; L330-F365 HydrophobicContact CD1-CZ 4.46Å; L330-F365 HydrophobicContact CD2-CE2 3.85Å; L330-F365 HydrophobicContact CD2-CZ 4.18Å; L330-F365 HydrophobicContact CG-CE2 4.05Å; L330-F365 HydrophobicContact CG-CZ 4.06Å; L330-L390 HydrophobicContact CD2-CB 3.96Å; L330-L390 HydrophobicContact CD2-CD1 4.09Å; L330-L390 HydrophobicContact CD2-CD2 3.92Å; L330-L390 HydrophobicContact CD2-CG 4.2Å; L330-M394 HydrophobicContact CB-CG 3.97Å; L330-M394 HydrophobicContact CD1-CG 4.24Å; L330-M394 HydrophobicContact CD2-CG 3.94Å; L330-M394 HydrophobicContact CG-CG 4.28Å; L330-M397 HydrophobicContact CD1-CB 3.92Å; L330-M397 HydrophobicContact CD1-CG 4.38Å
331	A	76.4	Confident	78.1	Confident	2 Å²	2	30.4 Å²	30.4	2%	0.017	14%	0.14	C	C	.	.	H	α-helix	trans	-70.8	-33.5	179.1	0	0	0	0	0	111.7	L283 F310 L328 P329 M335	L283-A331 HydrophobicContact CD2-CB 4.08Å; F310-A331 HydrophobicContact CE2-CB 3.9Å; F310-A331 HydrophobicContact CZ-CB 3.51Å; L328-A331 WeakPolarHBondContact O-CB 3.38Å; L328-A331 PolarHBondContact O-N 3.28Å; P329-A331 VanDerWaalsContact C-N 3.29Å; P329-A331 PolarHBondContact O-N 3.46Å; A331-M335 WeakPolarHBondContact O-CB 3.45Å; A331-M335 PolarHBondContact O-N 3.13Å
332	S	77.8	Confident	78.1	Confident	6 Å²	6	29.9 Å²	29.9	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-70.4	-42.5	173.9	84.7	0	0	0	0	112	D307 T308 L328 P329 F334 G336	D307-S332 WeakPolarHBondContact OD1-CB 3.29Å; D307-S332 PolarHBondContact OD1-OG 3.45Å; T308-S332 WeakPolarHBondContact O-CB 3.45Å; T308-S332 WeakPolarHBondContact OG1-CA 3.33Å; T308-S332 VanDerWaalsContact OG1-CB 3.25Å; T308-S332 WeakPolarHBondContact OG1-CB 3.2Å; L328-S332 PolarHBondContact O-N 3.07Å; P329-S332 PolarHBondContact O-N 3.39Å; P329-S332 PolarHBondContact O-OG 2.65Å; S332-F334 VanDerWaalsContact C-N 3.33Å; S332-F334 PolarHBondContact O-N 3.48Å; S332-G336 PolarHBondContact O-N 2.99Å
333	Y	80.4	Confident	77.8	Confident	48 Å²	48	26.9 Å²	26.9	19%	0.188	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-42.1	173	-54.5	-24.2	0	0	0	111.4	P329 G336 V337 H398 W401	P329-Y333 HydrophobicContact CB-CE2 3.99Å; P329-Y333 WeakPolarHBondContact O-CD1 3.41Å; P329-Y333 WeakPolarHBondContact O-CD2 3.21Å; P329-Y333 PolarHBondContact O-N 2.74Å; Y333-G336 PolarHBondContact O-N 3.15Å; Y333-V337 VanDerWaalsContact O-CG2 3.27Å; Y333-V337 WeakPolarHBondContact O-CG2 3.25Å; Y333-V337 PolarHBondContact O-N 3.29Å; Y333-H398 HydrophobicContact CD2-CB 4.02Å; Y333-H398 HydrophobicContact CE2-CB 3.7Å; Y333-H398 AromaticContact CE2-CD2 3.99Å; Y333-H398 AromaticContact CZ-CD2 3.64Å; Y333-W401 HydrophobicContact CD1-CB 4.44Å; Y333-W401 AromaticContact CD1-CD1 3.17Å; Y333-W401 AromaticContact CD1-CG 3.88Å; Y333-W401 HydrophobicContact CD1-CG 3.88Å; Y333-W401 AromaticContact CD1-NE1 3.49Å; Y333-W401 AromaticContact CE1-CD1 3.69Å; Y333-W401 AromaticContact CE1-NE1 3.94Å; Y333-W401 HydrophobicContact CG-CB 4.37Å; Y333-W401 AromaticContact CG-CD1 3.91Å; Y333-W401 HydrophobicContact CG-CG 4.25Å
334	F	79.7	Confident	77.6	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-64.5	-52.6	178.4	-176.5	-101.6	0	0	0	113	L330 S332 G336 V337 Q338 T362 F365 Y366 M397	L330-F334 VanDerWaalsContact O-CB 3.29Å; L330-F334 WeakPolarHBondContact O-CB 3.5Å; L330-F334 PolarHBondContact O-N 3.21Å; S332-F334 VanDerWaalsContact C-N 3.33Å; S332-F334 PolarHBondContact O-N 3.48Å; F334-G336 PolarHBondContact O-N 3.05Å; F334-V337 PolarHBondContact O-N 2.68Å; F334-Q338 VanDerWaalsContact CE1-CD 3.42Å; F334-Q338 HydrophobicContact CE1-CG 4.17Å; F334-Q338 VanDerWaalsContact CE1-NE2 3.29Å; F334-Q338 HydrophobicContact CZ-CG 4.2Å; F334-Q338 PolarHBondContact O-N 3.34Å; F334-T362 HydrophobicContact CD2-CG2 4.46Å; F334-T362 HydrophobicContact CE2-CG2 3.79Å; F334-F365 HydrophobicContact CB-CE1 4.28Å; F334-F365 HydrophobicContact CD1-CE1 4.21Å; F334-F365 AromaticContact CD2-CD1 3.33Å; F334-F365 HydrophobicContact CD2-CD1 3.33Å; F334-F365 AromaticContact CD2-CE1 3.47Å; F334-F365 HydrophobicContact CD2-CE1 3.47Å; F334-F365 VanDerWaalsContact CD2-CE1 3.47Å; F334-F365 HydrophobicContact CD2-CG 4.22Å; F334-F365 HydrophobicContact CD2-CZ 4.5Å; F334-F365 HydrophobicContact CE1-CE1 4.45Å; F334-F365 HydrophobicContact CE2-CB 4.5Å; F334-F365 AromaticContact CE2-CD1 3.27Å; F334-F365 HydrophobicContact CE2-CD1 3.27Å; F334-F365 AromaticContact CE2-CE1 3.78Å; F334-F365 HydrophobicContact CE2-CE1 3.78Å; F334-F365 HydrophobicContact CE2-CG 4.23Å; F334-F365 HydrophobicContact CG-CD1 4.07Å; F334-F365 AromaticContact CG-CE1 3.72Å; F334-F365 HydrophobicContact CG-CE1 3.72Å; F334-F365 AromaticContact CZ-CD1 3.94Å; F334-F365 HydrophobicContact CZ-CD1 3.94Å; F334-F365 HydrophobicContact CZ-CE1 4.25Å; F334-Y366 HydrophobicContact CE1-CE1 4.47Å; F334-Y366 AromaticContact CE1-CZ 3.99Å; F334-Y366 HydrophobicContact CZ-CD2 4.44Å; F334-Y366 HydrophobicContact CZ-CE1 4.17Å; F334-Y366 AromaticContact CZ-CE2 3.72Å; F334-Y366 HydrophobicContact CZ-CE2 3.72Å; F334-Y366 AromaticContact CZ-CZ 3.54Å; F334-M397 HydrophobicContact CD2-CE 3.59Å; F334-M397 HydrophobicContact CE2-CE 4.3Å
335	M	74.3	Confident	77.1	Confident	4 Å²	4	29 Å²	29	2%	0.02	15%	0.145	C	C	.	.	H	α-helix	trans	-56.3	-40.4	173.5	-88.2	-170.6	-83.4	0	0	111.7	W248 T308 F310 A331 Q338 K339	W248-M335 HydrophobicContact CB-SD 4.19Å; W248-M335 HydrophobicContact CD2-CG 3.72Å; W248-M335 HydrophobicContact CD2-SD 3.62Å; W248-M335 VanDerWaalsContact CE2-CG 3.48Å; W248-M335 HydrophobicContact CE3-CG 4.34Å; W248-M335 HydrophobicContact CE3-SD 3.77Å; W248-M335 HydrophobicContact CG-CG 3.92Å; W248-M335 HydrophobicContact CG-SD 3.87Å; W248-M335 HydrophobicContact CH2-CG 4.44Å; W248-M335 HydrophobicContact CZ2-CG 3.83Å; W248-M335 HydrophobicContact CZ2-SD 4.43Å; W248-M335 HydrophobicContact CZ3-SD 4.26Å; T308-M335 HydrophobicContact CG2-CE 4.3Å; T308-M335 HydrophobicContact CG2-SD 4.23Å; T308-M335 WeakPolarHBondContact OG1-CE 3.47Å; F310-M335 HydrophobicContact CE1-CE 3.87Å; F310-M335 HydrophobicContact CE2-CE 4.09Å; F310-M335 HydrophobicContact CZ-CE 3.27Å; A331-M335 WeakPolarHBondContact O-CB 3.45Å; A331-M335 PolarHBondContact O-N 3.13Å; M335-Q338 PolarHBondContact O-N 2.83Å; M335-K339 VanDerWaalsContact O-CG 3.28Å; M335-K339 WeakPolarHBondContact O-CG 3.46Å; M335-K339 PolarHBondContact O-N 2.69Å
336	G	74.9	Confident	76.5	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-56.8	-54.3	175.7	0	0	0	0	0	112.9	S332 Y333 F334 Q338 K339 I340 W401	S332-G336 PolarHBondContact O-N 2.99Å; Y333-G336 PolarHBondContact O-N 3.15Å; F334-G336 PolarHBondContact O-N 3.05Å; G336-Q338 VanDerWaalsContact C-N 3.32Å; G336-Q338 PolarHBondContact O-N 3.44Å; G336-K339 PolarHBondContact O-N 3.02Å; G336-I340 WeakPolarHBondContact O-CG1 3.38Å; G336-I340 PolarHBondContact O-N 3.02Å; G336-W401 WeakPolarHBondContact O-CZ3 3.48Å
337	V	80.1	Confident	76	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.012	15%	0.145	C	C	.	.	H	α-helix	trans	-57	-45.2	177.2	171.4	0	0	0	0	110.8	Y333 F334 K339 I340 I341 T362 M397 V400 W401 L404	Y333-V337 VanDerWaalsContact O-CG2 3.27Å; Y333-V337 WeakPolarHBondContact O-CG2 3.25Å; Y333-V337 PolarHBondContact O-N 3.29Å; F334-V337 PolarHBondContact O-N 2.68Å; V337-K339 PolarHBondContact O-N 3.15Å; V337-I340 PolarHBondContact O-N 2.74Å; V337-I341 HydrophobicContact CG1-CD1 3.85Å; V337-I341 HydrophobicContact CG1-CG1 4.48Å; V337-I341 WeakPolarHBondContact O-CG1 3.39Å; V337-I341 PolarHBondContact O-N 3.22Å; V337-T362 HydrophobicContact CG1-CG2 4.24Å; V337-M397 HydrophobicContact CB-CE 4.39Å; V337-M397 HydrophobicContact CG1-CE 4.45Å; V337-M397 HydrophobicContact CG2-CE 4.28Å; V337-M397 HydrophobicContact CG2-SD 4.15Å; V337-V400 HydrophobicContact CG2-CG1 4.41Å; V337-W401 HydrophobicContact CG2-CB 4.45Å; V337-W401 HydrophobicContact CG2-CE3 4.36Å; V337-L404 HydrophobicContact CG1-CD1 4.24Å; V337-L404 HydrophobicContact CG2-CD1 4.06Å
338	Q	78.1	Confident	76	Confident	32 Å²	32	24.3 Å²	24.3	15%	0.15	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-42.4	177.3	-71.4	-168.3	-30	0	0	113.3	F334 M335 G336 I340 A342 Y366	F334-Q338 VanDerWaalsContact CE1-CD 3.42Å; F334-Q338 HydrophobicContact CE1-CG 4.17Å; F334-Q338 VanDerWaalsContact CE1-NE2 3.29Å; F334-Q338 HydrophobicContact CZ-CG 4.2Å; F334-Q338 PolarHBondContact O-N 3.34Å; M335-Q338 PolarHBondContact O-N 2.83Å; G336-Q338 VanDerWaalsContact C-N 3.32Å; G336-Q338 PolarHBondContact O-N 3.44Å; Q338-I340 VanDerWaalsContact C-N 3.32Å; Q338-I340 PolarHBondContact O-N 3.26Å; Q338-A342 WeakPolarHBondContact O-CB 3.17Å; Q338-A342 PolarHBondContact O-N 3.32Å; Q338-A342 VanDerWaalsContact O-N 3.14Å; Q338-Y366 PolarHBondContact NE2-OH 3.17Å
339	K	75.3	Confident	76.2	Confident	53 Å²	53	26.8 Å²	26.8	23%	0.23	16%	0.157	C	C	.	.	H	α-helix	trans	-62.9	-37	175.6	-73.8	168.8	-174.9	171.3	0	112.4	M335 G336 V337 A343	M335-K339 VanDerWaalsContact O-CG 3.28Å; M335-K339 WeakPolarHBondContact O-CG 3.46Å; M335-K339 PolarHBondContact O-N 2.69Å; G336-K339 PolarHBondContact O-N 3.02Å; V337-K339 PolarHBondContact O-N 3.15Å; K339-A343 WeakPolarHBondContact O-CB 3.03Å; K339-A343 PolarHBondContact O-N 3.15Å
340	I	75.8	Confident	76.4	Confident	3 Å²	3	24.5 Å²	24.5	2%	0.015	14%	0.143	C	C	.	.	H	α-helix	trans	-69.3	-51.2	178.1	-67.4	176.8	0	0	0	110.1	G336 V337 Q338 A342 A343 T344 W401 L404 V405 Q408	G336-I340 WeakPolarHBondContact O-CG1 3.38Å; G336-I340 PolarHBondContact O-N 3.02Å; V337-I340 PolarHBondContact O-N 2.74Å; Q338-I340 VanDerWaalsContact C-N 3.32Å; Q338-I340 PolarHBondContact O-N 3.26Å; I340-A342 VanDerWaalsContact C-N 3.26Å; I340-A342 PolarHBondContact O-N 2.92Å; I340-A343 CarbonylContact O-C 3.58Å; I340-A343 WeakPolarHBondContact O-CA 3.27Å; I340-A343 PolarHBondContact O-N 2.64Å; I340-T344 HydrophobicContact CG2-CG2 4.06Å; I340-T344 PolarHBondContact O-N 3.45Å; I340-T344 PolarHBondContact O-OG1 3.07Å; I340-W401 HydrophobicContact CD1-CE3 4.11Å; I340-W401 HydrophobicContact CD1-CZ3 3.6Å; I340-W401 HydrophobicContact CG1-CZ3 4.31Å; I340-L404 HydrophobicContact CD1-CB 3.75Å; I340-L404 HydrophobicContact CG2-CB 4.41Å; I340-V405 HydrophobicContact CD1-CG2 4.05Å; I340-Q408 HydrophobicContact CD1-CB 4.44Å
341	I	77.8	Confident	76.5	Confident	11 Å²	11	25 Å²	25	6%	0.056	15%	0.145	C	C	.	.	H	α-helix	trans	-48.5	-51.4	176.7	-67.6	163.9	0	0	0	110.5	V337 A343 T344 D345 N355 L358 Q359 T362	V337-I341 HydrophobicContact CG1-CD1 3.85Å; V337-I341 HydrophobicContact CG1-CG1 4.48Å; V337-I341 WeakPolarHBondContact O-CG1 3.39Å; V337-I341 PolarHBondContact O-N 3.22Å; I341-A343 VanDerWaalsContact C-N 3.27Å; I341-A343 PolarHBondContact O-N 3.12Å; I341-T344 PolarHBondContact O-N 3.33Å; I341-T344 VanDerWaalsContact O-N 3.16Å; I341-T344 PolarHBondContact O-OG1 2.71Å; I341-T344 VanDerWaalsContact O-OG1 3.11Å; I341-D345 VanDerWaalsContact O-CG 3.23Å; I341-D345 PolarHBondContact O-N 3.37Å; I341-N355 HydrophobicContact CG2-CB 4.16Å; I341-N355 PolarHBondContact O-ND2 2.98Å; I341-L358 HydrophobicContact CD1-CB 3.75Å; I341-L358 HydrophobicContact CG1-CB 4.07Å; I341-L358 HydrophobicContact CG1-CD1 4.01Å; I341-Q359 HydrophobicContact CD1-CG 4.36Å; I341-Q359 HydrophobicContact CG2-CG 4.19Å; I341-T362 HydrophobicContact CD1-CG2 4.49Å
342	A	74.3	Confident	77	Confident	10 Å²	10	27.8 Å²	27.8	8%	0.083	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-27.7	179.3	0	0	0	0	0	115.6	H245 Q338 I340	H245-A342 HydrophobicContact CB-CB 3.67Å; H245-A342 VanDerWaalsContact CD2-CB 3.47Å; H245-A342 WeakPolarHBondContact CD2-CB 3.37Å; H245-A342 VanDerWaalsContact ND1-CB 3.3Å; H245-A342 WeakPolarHBondContact ND1-CB 3.31Å; Q338-A342 WeakPolarHBondContact O-CB 3.17Å; Q338-A342 PolarHBondContact O-N 3.32Å; Q338-A342 VanDerWaalsContact O-N 3.14Å; I340-A342 VanDerWaalsContact C-N 3.26Å; I340-A342 PolarHBondContact O-N 2.92Å
343	A	73.5	Confident	77.5	Confident	51 Å²	51	28.2 Å²	28.2	42%	0.421	16%	0.163	S	C	.	.	H	α-helix	trans	-88.1	-22.2	178.3	0	0	0	0	0	112.6	K339 I340 I341	K339-A343 WeakPolarHBondContact O-CB 3.03Å; K339-A343 PolarHBondContact O-N 3.15Å; I340-A343 CarbonylContact O-C 3.58Å; I340-A343 WeakPolarHBondContact O-CA 3.27Å; I340-A343 PolarHBondContact O-N 2.64Å; I341-A343 VanDerWaalsContact C-N 3.27Å; I341-A343 PolarHBondContact O-N 3.12Å
344	T	71.4	Confident	77.8	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.006	16%	0.155	C	C	.	.	H	α-helix	trans	-97.4	-11.6	-179.3	53.1	0	0	0	0	113.8	I340 I341 G346 L347 M351 N355 Q408	I340-T344 HydrophobicContact CG2-CG2 4.06Å; I340-T344 PolarHBondContact O-N 3.45Å; I340-T344 PolarHBondContact O-OG1 3.07Å; I341-T344 PolarHBondContact O-N 3.33Å; I341-T344 VanDerWaalsContact O-N 3.16Å; I341-T344 PolarHBondContact O-OG1 2.71Å; I341-T344 VanDerWaalsContact O-OG1 3.11Å; T344-G346 PolarHBondContact O-N 3.08Å; T344-G346 VanDerWaalsContact O-N 3.14Å; T344-L347 WeakPolarHBondContact O-CB 3.47Å; T344-L347 PolarHBondContact O-N 2.66Å; T344-M351 HydrophobicContact CG2-CE 3.5Å; T344-N355 VanDerWaalsContact OG1-CG 3.26Å; T344-N355 PolarHBondContact OG1-ND2 3.49Å; T344-N355 PolarHBondContact OG1-OD1 3.07Å; T344-Q408 VanDerWaalsContact CG2-OE1 3.26Å
345	D	68.1	Low	78.2	Confident	81 Å²	81	26.2 Å²	26.2	43%	0.433	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	116.6	175.7	-75.9	-25.9	0	0	0	111.6	I341 N355	I341-D345 VanDerWaalsContact O-CG 3.23Å; I341-D345 PolarHBondContact O-N 3.37Å; D345-N355 PolarHBondContact N-ND2 2.91Å; D345-N355 PolarHBondContact OD1-ND2 2.85Å
346	G	68.1	Low	78.8	Confident	47 Å²	47	32.1 Å²	32.1	49%	0.485	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	95.7	-8.9	-177.8	0	0	0	0	0	115.4	T344 G348 N352	T344-G346 PolarHBondContact O-N 3.08Å; T344-G346 VanDerWaalsContact O-N 3.14Å; G346-G348 PolarHBondContact O-N 2.92Å; G346-N352 PolarHBondContact N-OD1 3.43Å
347	L	68.8	Low	79.4	Confident	98 Å²	98	32.2 Å²	32.2	51%	0.513	18%	0.183	S	C	.	.	S	Bend	trans	-82.9	55.5	177.2	-60	-175.9	0	0	0	112.7	T344 M351	T344-L347 WeakPolarHBondContact O-CB 3.47Å; T344-L347 PolarHBondContact O-N 2.66Å; L347-M351 VanDerWaalsContact O-CB 3.25Å; L347-M351 WeakPolarHBondContact O-CB 3.43Å; L347-M351 WeakPolarHBondContact O-CG 3.46Å
348	G	78.8	Confident	79.7	Confident	3 Å²	3	32.2 Å²	32.2	3%	0.031	18%	0.183	C	C	.	.			trans	96.6	160.9	175	0	0	0	0	0	115.3	G346 N352 E468	G346-G348 PolarHBondContact O-N 2.92Å; G348-N352 WeakPolarHBondContact O-CB 3.46Å; G348-N352 PolarHBondContact O-N 3.36Å; G348-N352 PolarHBondContact O-ND2 3.35Å; G348-E468 WeakPolarHBondContact CA-OE1 3.47Å
349	Q	83.1	Confident	80.1	Confident	63 Å²	63	35.1 Å²	35.1	29%	0.294	20%	0.197	S	C	.	.	H	α-helix	trans	-71.8	-38.4	-176.6	-59.5	-174.7	19.5	0	0	112	N352 S353 P448 E468	Q349-N352 PolarHBondContact O-N 2.76Å; Q349-S353 WeakPolarHBondContact O-CB 3.29Å; Q349-S353 PolarHBondContact O-N 3.27Å; Q349-P448 HydrophobicContact CB-CB 3.96Å; Q349-P448 HydrophobicContact CB-CG 4.46Å; Q349-E468 WeakPolarHBondContact CB-OE2 3.31Å; Q349-E468 VanDerWaalsContact N-CD 3.28Å; Q349-E468 PolarHBondContact N-OE1 3.05Å; Q349-E468 PolarHBondContact N-OE2 2.88Å
350	V	86.9	Confident	80.6	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-47.2	175.9	174.5	0	0	0	0	110.2	S353 L354 D414 L418 P448 Y449 E468	V350-S353 PolarHBondContact O-N 2.98Å; V350-L354 PolarHBondContact O-N 3.01Å; V350-D414 HydrophobicContact CB-CB 3.98Å; V350-D414 WeakPolarHBondContact CB-OD1 3.3Å; V350-D414 HydrophobicContact CG2-CB 4.13Å; V350-L418 HydrophobicContact CG1-CD1 4.13Å; V350-L418 HydrophobicContact CG1-CD2 3.83Å; V350-L418 HydrophobicContact CG1-CG 3.78Å; V350-L418 HydrophobicContact CG2-CD1 4.29Å; V350-P448 HydrophobicContact CG2-CG 4.35Å; V350-Y449 HydrophobicContact CG2-CD2 4.29Å; V350-E468 PolarHBondContact N-OE2 3.09Å
351	M	83.8	Confident	81.1	Confident	9 Å²	9	39.1 Å²	39.1	4%	0.044	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-42.3	176.1	-70.1	-59.2	-67.8	0	0	112.9	T344 L347 S353 L354 N355 I407 V417	T344-M351 HydrophobicContact CG2-CE 3.5Å; L347-M351 VanDerWaalsContact O-CB 3.25Å; L347-M351 WeakPolarHBondContact O-CB 3.43Å; L347-M351 WeakPolarHBondContact O-CG 3.46Å; M351-S353 VanDerWaalsContact C-N 3.28Å; M351-S353 PolarHBondContact O-N 2.81Å; M351-L354 HydrophobicContact CE-CD2 4.43Å; M351-L354 WeakPolarHBondContact O-CB 3.49Å; M351-L354 PolarHBondContact O-N 3.16Å; M351-L354 HydrophobicContact SD-CD2 4.19Å; M351-N355 WeakPolarHBondContact O-CB 3.37Å; M351-N355 PolarHBondContact O-N 3.4Å; M351-N355 PolarHBondContact O-OD1 2.88Å; M351-I407 HydrophobicContact CE-CG2 4.4Å; M351-V417 HydrophobicContact SD-CB 4.2Å; M351-V417 HydrophobicContact SD-CG1 3.88Å; M351-V417 HydrophobicContact SD-CG2 3.77Å
352	N	86.8	Confident	81.4	Confident	62 Å²	62	39.3 Å²	39.3	33%	0.332	22%	0.219	S	C	.	.	H	α-helix	trans	-60.4	-37.9	175.2	-71.6	-25.3	0	0	0	112.1	G346 G348 Q349 N355 E356	G346-N352 PolarHBondContact N-OD1 3.43Å; G348-N352 WeakPolarHBondContact O-CB 3.46Å; G348-N352 PolarHBondContact O-N 3.36Å; G348-N352 PolarHBondContact O-ND2 3.35Å; Q349-N352 PolarHBondContact O-N 2.76Å; N352-N355 WeakPolarHBondContact O-CB 3.36Å; N352-N355 PolarHBondContact O-N 3.01Å; N352-E356 PolarHBondContact O-N 3.17Å
353	S	87.6	Confident	82	Confident	15 Å²	15	44.7 Å²	44.7	11%	0.105	24%	0.242	C	C	.	.	H	α-helix	trans	-75.3	-28.7	176.6	-166.9	0	0	0	0	113.1	Q349 V350 M351 A357 K444	Q349-S353 WeakPolarHBondContact O-CB 3.29Å; Q349-S353 PolarHBondContact O-N 3.27Å; V350-S353 PolarHBondContact O-N 2.98Å; M351-S353 VanDerWaalsContact C-N 3.28Å; M351-S353 PolarHBondContact O-N 2.81Å; S353-A357 PolarHBondContact O-N 3.06Å; S353-A357 VanDerWaalsContact O-N 3.15Å; S353-K444 PolarHBondContact OG-O 2.94Å
354	L	87.7	Confident	82.6	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-66.4	-45.2	167.2	-179	61.7	0	0	0	110.6	V350 M351 E356 A357 L358 L404 V417 L421 A445	V350-L354 PolarHBondContact O-N 3.01Å; M351-L354 HydrophobicContact CE-CD2 4.43Å; M351-L354 WeakPolarHBondContact O-CB 3.49Å; M351-L354 PolarHBondContact O-N 3.16Å; M351-L354 HydrophobicContact SD-CD2 4.19Å; L354-E356 PolarHBondContact O-N 3.46Å; L354-A357 WeakPolarHBondContact O-CB 3.45Å; L354-A357 PolarHBondContact O-N 3.19Å; L354-A357 VanDerWaalsContact O-N 3.12Å; L354-L358 HydrophobicContact CD1-CG 4.41Å; L354-L358 HydrophobicContact CG-CD1 4.12Å; L354-L358 HydrophobicContact CG-CG 4.43Å; L354-L358 VanDerWaalsContact O-CG 3.27Å; L354-L358 WeakPolarHBondContact O-CG 3.47Å; L354-L358 PolarHBondContact O-N 3.24Å; L354-L404 HydrophobicContact CD2-CD2 4.15Å; L354-V417 HydrophobicContact CD2-CG1 4.13Å; L354-L421 HydrophobicContact CD1-CD1 4.4Å; L354-L421 HydrophobicContact CD2-CD1 4.35Å; L354-A445 HydrophobicContact CB-CB 3.9Å; L354-A445 HydrophobicContact CD1-CB 4.1Å
355	N	86.8	Confident	83.3	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.011	25%	0.245	C	C	.	.	H	α-helix	trans	-58.2	-44.8	175.6	-78.9	11	0	0	0	111.7	I341 T344 D345 M351 N352 A357 L358 Q359	I341-N355 HydrophobicContact CG2-CB 4.16Å; I341-N355 PolarHBondContact O-ND2 2.98Å; T344-N355 VanDerWaalsContact OG1-CG 3.26Å; T344-N355 PolarHBondContact OG1-ND2 3.49Å; T344-N355 PolarHBondContact OG1-OD1 3.07Å; D345-N355 PolarHBondContact N-ND2 2.91Å; D345-N355 PolarHBondContact OD1-ND2 2.85Å; M351-N355 WeakPolarHBondContact O-CB 3.37Å; M351-N355 PolarHBondContact O-N 3.4Å; M351-N355 PolarHBondContact O-OD1 2.88Å; N352-N355 WeakPolarHBondContact O-CB 3.36Å; N352-N355 PolarHBondContact O-N 3.01Å; N355-A357 VanDerWaalsContact C-N 3.34Å; N355-A357 PolarHBondContact O-N 3.19Å; N355-L358 PolarHBondContact O-N 2.99Å; N355-Q359 WeakPolarHBondContact O-CB 3.46Å; N355-Q359 VanDerWaalsContact O-CG 3.27Å; N355-Q359 WeakPolarHBondContact O-CG 3.48Å; N355-Q359 PolarHBondContact O-N 3.18Å
356	E	86.7	Confident	84.2	Confident	128 Å²	128	46.3 Å²	46.3	60%	0.598	24%	0.238	S	C	*	.	H	α-helix	trans	-56.4	-46.2	172.7	-176.1	-175.7	-166.5	0	0	111.6	N352 L354 L358 Q359 E360	N352-E356 PolarHBondContact O-N 3.17Å; L354-E356 PolarHBondContact O-N 3.46Å; E356-L358 VanDerWaalsContact C-N 3.35Å; E356-L358 PolarHBondContact O-N 3.01Å; E356-Q359 PolarHBondContact O-N 2.96Å; E356-E360 PolarHBondContact O-N 2.95Å
357	A	87.9	Confident	85.2	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-33.3	178.2	0	0	0	0	0	113.5	S353 L354 N355 L361 L441 K444	S353-A357 PolarHBondContact O-N 3.06Å; S353-A357 VanDerWaalsContact O-N 3.15Å; L354-A357 WeakPolarHBondContact O-CB 3.45Å; L354-A357 PolarHBondContact O-N 3.19Å; L354-A357 VanDerWaalsContact O-N 3.12Å; N355-A357 VanDerWaalsContact C-N 3.34Å; N355-A357 PolarHBondContact O-N 3.19Å; A357-L361 PolarHBondContact O-N 2.9Å; A357-L441 HydrophobicContact CB-CD2 3.84Å; A357-K444 HydrophobicContact CB-CB 3.75Å; A357-K444 HydrophobicContact CB-CD 3.58Å; A357-K444 HydrophobicContact CB-CG 4.31Å
358	L	86.4	Confident	86	Confident	2 Å²	2	46 Å²	46	1%	0.01	23%	0.225	C	C	.	.	H	α-helix	trans	-73.6	-37.4	173.4	-65.6	169.7	0	0	0	111.7	I341 L354 N355 E356 E360 L361 T362 V400 L404 L441	I341-L358 HydrophobicContact CD1-CB 3.75Å; I341-L358 HydrophobicContact CG1-CB 4.07Å; I341-L358 HydrophobicContact CG1-CD1 4.01Å; L354-L358 HydrophobicContact CD1-CG 4.41Å; L354-L358 HydrophobicContact CG-CD1 4.12Å; L354-L358 HydrophobicContact CG-CG 4.43Å; L354-L358 VanDerWaalsContact O-CG 3.27Å; L354-L358 WeakPolarHBondContact O-CG 3.47Å; L354-L358 PolarHBondContact O-N 3.24Å; N355-L358 PolarHBondContact O-N 2.99Å; E356-L358 VanDerWaalsContact C-N 3.35Å; E356-L358 PolarHBondContact O-N 3.01Å; L358-E360 VanDerWaalsContact C-N 3.29Å; L358-E360 PolarHBondContact O-N 2.95Å; L358-L361 PolarHBondContact O-N 3.36Å; L358-T362 WeakPolarHBondContact O-CG2 3.46Å; L358-T362 PolarHBondContact O-N 3.18Å; L358-V400 HydrophobicContact CD2-CG1 3.59Å; L358-L404 HydrophobicContact CD1-CD1 3.64Å; L358-L404 HydrophobicContact CD1-CD2 3.73Å; L358-L404 HydrophobicContact CD1-CG 4.33Å; L358-L404 HydrophobicContact CD2-CD1 3.84Å; L358-L404 HydrophobicContact CG-CD1 4.39Å; L358-L441 HydrophobicContact CD2-CD1 4.41Å; L358-L441 HydrophobicContact CD2-CD2 4.13Å
359	Q	86.5	Confident	86.3	Confident	94 Å²	94	46.1 Å²	46.1	44%	0.439	23%	0.225	S	C	.	.	H	α-helix	trans	-60.8	-40.3	174.4	-76	173.9	12.7	0	0	110.9	I341 N355 E356 T362 H363	I341-Q359 HydrophobicContact CD1-CG 4.36Å; I341-Q359 HydrophobicContact CG2-CG 4.19Å; N355-Q359 WeakPolarHBondContact O-CB 3.46Å; N355-Q359 VanDerWaalsContact O-CG 3.27Å; N355-Q359 WeakPolarHBondContact O-CG 3.48Å; N355-Q359 PolarHBondContact O-N 3.18Å; E356-Q359 PolarHBondContact O-N 2.96Å; Q359-T362 WeakPolarHBondContact CA-OG1 3.36Å; Q359-T362 PolarHBondContact O-N 3.5Å; Q359-T362 PolarHBondContact O-OG1 2.97Å; Q359-H363 PolarHBondContact O-N 3.21Å
360	E	87.1	Confident	86.5	Confident	97 Å²	97	46.5 Å²	46.5	45%	0.453	23%	0.232	S	C	.	.	H	α-helix	trans	-59	-46.4	172.2	-162.6	-179.8	134.7	0	0	111.8	E356 L358 T362 H363 D364 K444	E356-E360 PolarHBondContact O-N 2.95Å; L358-E360 VanDerWaalsContact C-N 3.29Å; L358-E360 PolarHBondContact O-N 2.95Å; E360-T362 VanDerWaalsContact C-N 3.33Å; E360-T362 PolarHBondContact O-N 2.93Å; E360-H363 WeakPolarHBondContact O-CB 3.21Å; E360-H363 PolarHBondContact O-N 2.9Å; E360-H363 VanDerWaalsContact O-N 3.1Å; E360-D364 PolarHBondContact O-N 3.24Å; E360-K444 IonicContact OE1-NZ 3.39Å; E360-K444 PolarHBondContact OE1-NZ 2.84Å; E360-K444 IonicContact OE2-NZ 2.76Å; E360-K444 PolarHBondContact OE2-NZ 3.41Å
361	L	85.7	Confident	86.5	Confident	43 Å²	43	51.6 Å²	51.6	23%	0.225	26%	0.256	C	S	.	.	H	α-helix	trans	-61.9	-36.9	173.7	-68.9	-178.7	0	0	0	112.9	A357 L358 H363 F365 V400 L437 L441	A357-L361 PolarHBondContact O-N 2.9Å; L358-L361 PolarHBondContact O-N 3.36Å; L361-H363 VanDerWaalsContact C-N 3.32Å; L361-F365 PolarHBondContact O-N 3.25Å; L361-F365 VanDerWaalsContact O-N 3.14Å; L361-V400 HydrophobicContact CD1-CG2 4.3Å; L361-L437 HydrophobicContact CD1-CD2 4.36Å; L361-L437 HydrophobicContact CD2-CD1 4.47Å; L361-L441 HydrophobicContact CD1-CD1 4.09Å; L361-L441 HydrophobicContact CD1-CD2 3.8Å; L361-L441 HydrophobicContact CD1-CG 4.23Å; L361-L441 HydrophobicContact CG-CD2 4.5Å
362	T	83.5	Confident	86.5	Confident	14 Å²	14	51.5 Å²	51.5	9%	0.086	26%	0.256	C	S	.	.	H	α-helix	trans	-69.6	-30.5	174.8	63	0	0	0	0	112.3	F334 V337 I341 L358 Q359 E360 F365 Y366 M397	F334-T362 HydrophobicContact CD2-CG2 4.46Å; F334-T362 HydrophobicContact CE2-CG2 3.79Å; V337-T362 HydrophobicContact CG1-CG2 4.24Å; I341-T362 HydrophobicContact CD1-CG2 4.49Å; L358-T362 WeakPolarHBondContact O-CG2 3.46Å; L358-T362 PolarHBondContact O-N 3.18Å; Q359-T362 WeakPolarHBondContact CA-OG1 3.36Å; Q359-T362 PolarHBondContact O-N 3.5Å; Q359-T362 PolarHBondContact O-OG1 2.97Å; E360-T362 VanDerWaalsContact C-N 3.33Å; E360-T362 PolarHBondContact O-N 2.93Å; T362-F365 PolarHBondContact O-N 3.41Å; T362-Y366 WeakPolarHBondContact O-CD2 3.35Å; T362-Y366 PolarHBondContact O-N 3.33Å; T362-M397 HydrophobicContact CG2-CE 4.34Å
363	H	87.2	Confident	86.5	Confident	123 Å²	123	51.3 Å²	51.3	57%	0.569	25%	0.253	S	S	*	.	H	α-helix	trans	-68.4	-44.3	174.9	-175	73.4	0	0	0	111.6	Q359 E360 L361 F365 Y366 L367	Q359-H363 PolarHBondContact O-N 3.21Å; E360-H363 WeakPolarHBondContact O-CB 3.21Å; E360-H363 PolarHBondContact O-N 2.9Å; E360-H363 VanDerWaalsContact O-N 3.1Å; L361-H363 VanDerWaalsContact C-N 3.32Å; H363-F365 VanDerWaalsContact C-N 3.26Å; H363-F365 PolarHBondContact O-N 3.44Å; H363-Y366 PolarHBondContact O-N 3.01Å; H363-L367 PolarHBondContact O-N 3Å
364	D	87.1	Confident	86.4	Confident	83 Å²	83	55.7 Å²	55.7	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-58.9	-39.3	173.7	-71.3	-19.1	0	0	0	111.5	E360 L367 I368	E360-D364 PolarHBondContact O-N 3.24Å; D364-L367 WeakPolarHBondContact O-CB 3.48Å; D364-L367 PolarHBondContact O-N 3.49Å; D364-I368 WeakPolarHBondContact O-CG1 3.26Å; D364-I368 PolarHBondContact O-N 3.33Å; D364-I368 VanDerWaalsContact O-N 3.13Å
365	F	85.5	Confident	86.3	Confident	11 Å²	11	57.9 Å²	57.9	5%	0.048	28%	0.282	C	S	.	.	H	α-helix	trans	-64.8	-44.2	174.5	179.7	-110.3	0	0	0	112.9	L283 L330 F334 L361 T362 H363 L367 I368 I369 L390	L283-F365 HydrophobicContact CB-CZ 4.5Å; L283-F365 HydrophobicContact CD2-CZ 4.14Å; L330-F365 HydrophobicContact CD1-CE2 4.18Å; L330-F365 HydrophobicContact CD1-CZ 4.46Å; L330-F365 HydrophobicContact CD2-CE2 3.85Å; L330-F365 HydrophobicContact CD2-CZ 4.18Å; L330-F365 HydrophobicContact CG-CE2 4.05Å; L330-F365 HydrophobicContact CG-CZ 4.06Å; F334-F365 HydrophobicContact CB-CE1 4.28Å; F334-F365 HydrophobicContact CD1-CE1 4.21Å; F334-F365 AromaticContact CD2-CD1 3.33Å; F334-F365 HydrophobicContact CD2-CD1 3.33Å; F334-F365 AromaticContact CD2-CE1 3.47Å; F334-F365 HydrophobicContact CD2-CE1 3.47Å; F334-F365 VanDerWaalsContact CD2-CE1 3.47Å; F334-F365 HydrophobicContact CD2-CG 4.22Å; F334-F365 HydrophobicContact CD2-CZ 4.5Å; F334-F365 HydrophobicContact CE1-CE1 4.45Å; F334-F365 HydrophobicContact CE2-CB 4.5Å; F334-F365 AromaticContact CE2-CD1 3.27Å; F334-F365 HydrophobicContact CE2-CD1 3.27Å; F334-F365 AromaticContact CE2-CE1 3.78Å; F334-F365 HydrophobicContact CE2-CE1 3.78Å; F334-F365 HydrophobicContact CE2-CG 4.23Å; F334-F365 HydrophobicContact CG-CD1 4.07Å; F334-F365 AromaticContact CG-CE1 3.72Å; F334-F365 HydrophobicContact CG-CE1 3.72Å; F334-F365 AromaticContact CZ-CD1 3.94Å; F334-F365 HydrophobicContact CZ-CD1 3.94Å; F334-F365 HydrophobicContact CZ-CE1 4.25Å; L361-F365 PolarHBondContact O-N 3.25Å; L361-F365 VanDerWaalsContact O-N 3.14Å; T362-F365 PolarHBondContact O-N 3.41Å; H363-F365 VanDerWaalsContact C-N 3.26Å; H363-F365 PolarHBondContact O-N 3.44Å; F365-L367 VanDerWaalsContact C-N 3.25Å; F365-L367 PolarHBondContact O-N 2.88Å; F365-I368 WeakPolarHBondContact O-CB 3.49Å; F365-I368 PolarHBondContact O-N 3.43Å; F365-I369 HydrophobicContact CD1-CD1 3.87Å; F365-I369 HydrophobicContact CE1-CD1 3.46Å; F365-I369 VanDerWaalsContact CE1-CD1 3.46Å; F365-I369 HydrophobicContact CE1-CG1 4.39Å; F365-I369 HydrophobicContact CE2-CD1 4.48Å; F365-I369 HydrophobicContact CZ-CD1 3.81Å; F365-I369 HydrophobicContact CZ-CG1 4.35Å; F365-I369 PolarHBondContact O-N 3.12Å; F365-I369 VanDerWaalsContact O-N 3.07Å; F365-L390 HydrophobicContact CE2-CD2 4.5Å
366	Y	86.2	Confident	86.1	Confident	73 Å²	73	58.8 Å²	58.8	29%	0.286	29%	0.287	S	S	.	.	H	α-helix	trans	-59.4	-36.3	172.9	-80.2	-59.8	0	0	0	112.3	T284 F334 Q338 T362 H363 I369 V370	T284-Y366 HydrophobicContact CG2-CD1 4.33Å; T284-Y366 HydrophobicContact CG2-CE1 4.25Å; T284-Y366 WeakPolarHBondContact O-CE1 3.27Å; T284-Y366 PolarHBondContact O-OH 3.03Å; F334-Y366 HydrophobicContact CE1-CE1 4.47Å; F334-Y366 AromaticContact CE1-CZ 3.99Å; F334-Y366 HydrophobicContact CZ-CD2 4.44Å; F334-Y366 HydrophobicContact CZ-CE1 4.17Å; F334-Y366 AromaticContact CZ-CE2 3.72Å; F334-Y366 HydrophobicContact CZ-CE2 3.72Å; F334-Y366 AromaticContact CZ-CZ 3.54Å; Q338-Y366 PolarHBondContact NE2-OH 3.17Å; T362-Y366 WeakPolarHBondContact O-CD2 3.35Å; T362-Y366 PolarHBondContact O-N 3.33Å; H363-Y366 PolarHBondContact O-N 3.01Å; Y366-I369 HydrophobicContact CD1-CD1 4.42Å; Y366-I369 PolarHBondContact O-N 2.92Å; Y366-V370 WeakPolarHBondContact O-CG2 3.49Å; Y366-V370 PolarHBondContact O-N 3.41Å
367	L	88.4	Confident	86	Confident	86 Å²	86	61.8 Å²	61.8	45%	0.45	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-37.2	176.9	-172.9	143.1	0	0	0	112.3	H363 D364 F365 V370 Q371	H363-L367 PolarHBondContact O-N 3Å; D364-L367 WeakPolarHBondContact O-CB 3.48Å; D364-L367 PolarHBondContact O-N 3.49Å; F365-L367 VanDerWaalsContact C-N 3.25Å; F365-L367 PolarHBondContact O-N 2.88Å; L367-V370 PolarHBondContact O-N 3.13Å; L367-Q371 VanDerWaalsContact CD2-NE2 3.34Å; L367-Q371 WeakPolarHBondContact O-CG 3.45Å; L367-Q371 PolarHBondContact O-N 3.43Å; L367-Q371 VanDerWaalsContact O-N 3.1Å
368	I	86.6	Confident	85.9	Confident	53 Å²	53	67.4 Å²	67.4	27%	0.272	32%	0.318	S	S	.	.	H	α-helix	trans	-63.3	-41.2	171.4	-66.4	168.9	0	0	0	110.9	D364 F365 Q371 A372 L390 T393	D364-I368 WeakPolarHBondContact O-CG1 3.26Å; D364-I368 PolarHBondContact O-N 3.33Å; D364-I368 VanDerWaalsContact O-N 3.13Å; F365-I368 WeakPolarHBondContact O-CB 3.49Å; F365-I368 PolarHBondContact O-N 3.43Å; I368-Q371 PolarHBondContact O-N 3.12Å; I368-A372 PolarHBondContact O-N 3.42Å; I368-L390 HydrophobicContact CG2-CD2 4.33Å; I368-T393 HydrophobicContact CD1-CG2 3.67Å
369	I	85.1	Confident	85.6	Confident	6 Å²	6	74.3 Å²	74.3	3%	0.031	36%	0.355	C	S	.	.	H	α-helix	trans	-64.3	-44.7	176.7	-64.5	167.1	0	0	0	111.4	L280 L283 T284 F365 Y366 Q371 A372 E373	L280-I369 HydrophobicContact CD2-CG2 4.2Å; L283-I369 HydrophobicContact CB-CD1 3.89Å; L283-I369 HydrophobicContact CB-CG1 4.47Å; T284-I369 HydrophobicContact CG2-CB 4.34Å; T284-I369 HydrophobicContact CG2-CD1 3.82Å; T284-I369 HydrophobicContact CG2-CG2 3.56Å; F365-I369 HydrophobicContact CD1-CD1 3.87Å; F365-I369 HydrophobicContact CE1-CD1 3.46Å; F365-I369 VanDerWaalsContact CE1-CD1 3.46Å; F365-I369 HydrophobicContact CE1-CG1 4.39Å; F365-I369 HydrophobicContact CE2-CD1 4.48Å; F365-I369 HydrophobicContact CZ-CD1 3.81Å; F365-I369 HydrophobicContact CZ-CG1 4.35Å; F365-I369 PolarHBondContact O-N 3.12Å; F365-I369 VanDerWaalsContact O-N 3.07Å; Y366-I369 HydrophobicContact CD1-CD1 4.42Å; Y366-I369 PolarHBondContact O-N 2.92Å; I369-Q371 PolarHBondContact O-N 2.89Å; I369-A372 WeakPolarHBondContact O-CB 3.08Å; I369-A372 PolarHBondContact O-N 3.41Å; I369-E373 PolarHBondContact O-N 3.05Å
370	V	86.6	Confident	85.3	Confident	71 Å²	71	77.3 Å²	77.3	43%	0.43	36%	0.363	S	S	.	.	H	α-helix	trans	-59.8	-36.5	176.8	170.4	0	0	0	0	111.5	Y366 L367 Q374	Y366-V370 WeakPolarHBondContact O-CG2 3.49Å; Y366-V370 PolarHBondContact O-N 3.41Å; L367-V370 PolarHBondContact O-N 3.13Å; V370-Q374 VanDerWaalsContact O-CG 3.27Å; V370-Q374 WeakPolarHBondContact O-CG 3.14Å; V370-Q374 PolarHBondContact O-N 3.37Å
371	Q	87.1	Confident	85	Confident	107 Å²	107	73.3 Å²	73.3	50%	0.5	34%	0.344	S	S	.	.	H	α-helix	trans	-67.8	-40.4	173.3	-71	175.8	0.7	0	0	112.4	L367 I368 I369 Q374 E375	L367-Q371 VanDerWaalsContact CD2-NE2 3.34Å; L367-Q371 WeakPolarHBondContact O-CG 3.45Å; L367-Q371 PolarHBondContact O-N 3.43Å; L367-Q371 VanDerWaalsContact O-N 3.1Å; I368-Q371 PolarHBondContact O-N 3.12Å; I369-Q371 PolarHBondContact O-N 2.89Å; Q371-Q374 PolarHBondContact O-N 2.91Å; Q371-E375 PolarHBondContact O-N 3.43Å; Q371-E375 VanDerWaalsContact O-N 3.08Å
372	A	85.2	Confident	85	Confident	7 Å²	7	74.2 Å²	74.2	6%	0.058	35%	0.352	C	S	.	.	H	α-helix	trans	-64.5	-41.8	175	0	0	0	0	0	112	L280 I368 I369 Q374 E375 L376 L386	L280-A372 HydrophobicContact CD2-CB 3.8Å; I368-A372 PolarHBondContact O-N 3.42Å; I369-A372 WeakPolarHBondContact O-CB 3.08Å; I369-A372 PolarHBondContact O-N 3.41Å; A372-Q374 VanDerWaalsContact C-N 3.35Å; A372-Q374 PolarHBondContact O-N 3.01Å; A372-E375 PolarHBondContact O-N 2.95Å; A372-L376 PolarHBondContact O-N 3.29Å; A372-L386 HydrophobicContact CB-CD1 3.95Å
373	E	86	Confident	84.9	Confident	58 Å²	58	73.6 Å²	73.6	27%	0.271	35%	0.348	S	S	.	.	H	α-helix	trans	-63.2	-39.7	175.9	-160.1	-151.8	143.1	0	0	111.7	L280 I369 L376 R377	L280-E373 HydrophobicContact CD1-CB 4.24Å; L280-E373 HydrophobicContact CD1-CG 4.49Å; I369-E373 PolarHBondContact O-N 3.05Å; E373-L376 WeakPolarHBondContact O-CB 3.49Å; E373-L376 PolarHBondContact O-N 3.39Å; E373-R377 WeakPolarHBondContact O-CG 3.41Å; E373-R377 PolarHBondContact O-N 3.23Å; E373-R377 IonicContact OE1-CZ 3.9Å; E373-R377 IonicContact OE1-NE 3.83Å; E373-R377 PolarHBondContact OE1-NE 3.26Å; E373-R377 IonicContact OE1-NH2 3.72Å; E373-R377 PolarHBondContact OE1-NH2 3.04Å
374	Q	86.3	Confident	84.7	Confident	106 Å²	106	73.9 Å²	73.9	50%	0.495	35%	0.35	S	S	.	.	H	α-helix	trans	-61.2	-44.6	172.3	-74	172.8	20.4	0	0	111.7	V370 Q371 A372 L376 R377 H378	V370-Q374 VanDerWaalsContact O-CG 3.27Å; V370-Q374 WeakPolarHBondContact O-CG 3.14Å; V370-Q374 PolarHBondContact O-N 3.37Å; Q371-Q374 PolarHBondContact O-N 2.91Å; A372-Q374 VanDerWaalsContact C-N 3.35Å; A372-Q374 PolarHBondContact O-N 3.01Å; Q374-L376 VanDerWaalsContact C-N 3.32Å; Q374-L376 PolarHBondContact O-N 3.4Å; Q374-R377 PolarHBondContact O-N 3.36Å; Q374-H378 PolarHBondContact O-N 3.44Å; Q374-H378 PolarHBondContact O-ND1 3.14Å
375	E	83.7	Confident	84.6	Confident	50 Å²	50	72.4 Å²	72.4	23%	0.234	34%	0.339	C	S	.	.	H	α-helix	trans	-67.3	-30.6	176.1	-78.9	-77.4	113.1	0	0	113	Q371 A372 H378 N379 R380 L381 K385	Q371-E375 PolarHBondContact O-N 3.43Å; Q371-E375 VanDerWaalsContact O-N 3.08Å; A372-E375 PolarHBondContact O-N 2.95Å; E375-H378 PolarHBondContact O-N 3.21Å; E375-N379 PolarHBondContact O-N 3.46Å; E375-R380 PolarHBondContact O-N 3.42Å; E375-R380 WeakPolarHBondContact OE2-CB 3.47Å; E375-L381 HydrophobicContact CB-CB 4.42Å; E375-L381 PolarHBondContact O-N 2.95Å; E375-K385 IonicContact OE2-NZ 3.31Å; E375-K385 PolarHBondContact OE2-NZ 3.42Å
376	L	83.5	Confident	84.5	Confident	21 Å²	21	72 Å²	72	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-65.1	-49.5	171.7	-177.6	61.3	0	0	0	110.9	L276 D277 L280 A372 E373 Q374 H378 N379 L381	L276-L376 HydrophobicContact CB-CD1 3.83Å; L276-L376 HydrophobicContact CB-CD2 4.27Å; L276-L376 HydrophobicContact CD1-CD1 4.09Å; D277-L376 HydrophobicContact CB-CD2 4.1Å; L280-L376 HydrophobicContact CD1-CB 4.35Å; L280-L376 HydrophobicContact CD1-CD2 3.77Å; A372-L376 PolarHBondContact O-N 3.29Å; E373-L376 WeakPolarHBondContact O-CB 3.49Å; E373-L376 PolarHBondContact O-N 3.39Å; Q374-L376 VanDerWaalsContact C-N 3.32Å; Q374-L376 PolarHBondContact O-N 3.4Å; L376-H378 PolarHBondContact O-N 3.4Å; L376-H378 VanDerWaalsContact O-N 3.15Å; L376-N379 WeakPolarHBondContact O-CA 3.43Å; L376-N379 PolarHBondContact O-N 3.25Å; L376-L381 HydrophobicContact CB-CB 4.28Å; L376-L381 HydrophobicContact CB-CD2 4Å; L376-L381 HydrophobicContact CD1-CB 4.38Å; L376-L381 HydrophobicContact CD1-CD2 4.45Å
377	R	84.3	Confident	84.4	Confident	190 Å²	190	70.1 Å²	70.1	72%	0.717	33%	0.332	S	S	*	.	H	α-helix	trans	-59.5	-25.2	176.5	-69.6	173.9	-178.4	-139	5.5	113.5	E373 Q374 N379	E373-R377 WeakPolarHBondContact O-CG 3.41Å; E373-R377 PolarHBondContact O-N 3.23Å; E373-R377 IonicContact OE1-CZ 3.9Å; E373-R377 IonicContact OE1-NE 3.83Å; E373-R377 PolarHBondContact OE1-NE 3.26Å; E373-R377 IonicContact OE1-NH2 3.72Å; E373-R377 PolarHBondContact OE1-NH2 3.04Å; Q374-R377 PolarHBondContact O-N 3.36Å; R377-N379 VanDerWaalsContact C-N 3.35Å
378	H	85.6	Confident	84.3	Confident	120 Å²	120	73.8 Å²	73.8	56%	0.556	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	3.7	173.5	-70.4	95	0	0	0	114	Q374 E375 L376 R380	Q374-H378 PolarHBondContact O-N 3.44Å; Q374-H378 PolarHBondContact O-ND1 3.14Å; E375-H378 PolarHBondContact O-N 3.21Å; L376-H378 PolarHBondContact O-N 3.4Å; L376-H378 VanDerWaalsContact O-N 3.15Å; H378-R380 VanDerWaalsContact C-N 3.26Å; H378-R380 HydrophobicContact CB-CG 4.25Å; H378-R380 PolarHBondContact O-N 3.1Å
379	N	79.7	Confident	84.2	Confident	147 Å²	147	76.5 Å²	76.5	79%	0.786	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	35.8	-173.8	-64.5	-34.9	0	0	0	113.6	E375 L376 R377	E375-N379 PolarHBondContact O-N 3.46Å; L376-N379 WeakPolarHBondContact O-CA 3.43Å; L376-N379 PolarHBondContact O-N 3.25Å; R377-N379 VanDerWaalsContact C-N 3.35Å
380	R	81.4	Confident	84.2	Confident	158 Å²	158	76.3 Å²	76.3	60%	0.596	35%	0.348	S	S	*	.			trans	-112.8	-4	-179.5	-68.5	178.1	-177.7	178.5	0.5	113.7	E375 H378 K385	E375-R380 PolarHBondContact O-N 3.42Å; E375-R380 WeakPolarHBondContact OE2-CB 3.47Å; H378-R380 VanDerWaalsContact C-N 3.26Å; H378-R380 HydrophobicContact CB-CG 4.25Å; H378-R380 PolarHBondContact O-N 3.1Å; R380-K385 WeakPolarHBondContact O-CD 3.49Å; R380-K385 PolarHBondContact O-NZ 3.2Å
381	L	81.4	Confident	84.1	Confident	13 Å²	13	78.1 Å²	78.1	7%	0.068	35%	0.351	C	S	.	.			trans	-89.8	134.3	177	-165.4	66.9	0	0	0	110.1	L276 L280 E375 L376 L386	L276-L381 HydrophobicContact CD1-CB 4.47Å; L276-L381 HydrophobicContact CD1-CD2 4.45Å; L276-L381 HydrophobicContact CD1-CG 4.31Å; L276-L381 HydrophobicContact CD2-CD2 3.92Å; L276-L381 HydrophobicContact CD2-CG 4.21Å; L280-L381 HydrophobicContact CD1-CD2 4.39Å; E375-L381 HydrophobicContact CB-CB 4.42Å; E375-L381 PolarHBondContact O-N 2.95Å; L376-L381 HydrophobicContact CB-CB 4.28Å; L376-L381 HydrophobicContact CB-CD2 4Å; L376-L381 HydrophobicContact CD1-CB 4.38Å; L376-L381 HydrophobicContact CD1-CD2 4.45Å; L381-L386 HydrophobicContact CD1-CB 4.06Å; L381-L386 HydrophobicContact CD1-CD1 4.5Å; L381-L386 HydrophobicContact CD2-CB 4.49Å; L381-L386 HydrophobicContact CD2-CD1 4.46Å; L381-L386 HydrophobicContact CG-CB 4.38Å
382	T	84.3	Confident	84	Confident	62 Å²	62	77.1 Å²	77.1	38%	0.38	35%	0.354	S	S	.	.			trans	-123.1	158.2	165.3	60.1	0	0	0	0	108.1	E272 Q384 K385 L386	E272-T382 VanDerWaalsContact OE1-CA 3.29Å; E272-T382 WeakPolarHBondContact OE1-CA 3.49Å; E272-T382 WeakPolarHBondContact OE1-CB 3.41Å; T382-Q384 VanDerWaalsContact C-N 3.25Å; T382-Q384 PolarHBondContact O-N 2.96Å; T382-K385 WeakPolarHBondContact O-CB 3.38Å; T382-K385 PolarHBondContact O-N 2.95Å; T382-K385 WeakPolarHBondContact OG1-CB 3.24Å; T382-K385 PolarHBondContact OG1-N 3.2Å; T382-L386 PolarHBondContact O-N 3.37Å
383	L	81	Confident	83.8	Confident	0 Å²	0	78 Å²	78	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61	-35.5	-176.7	-170	59.7	0	0	0	112.3	E272 L276 L279 L320 Q323 V324 I327 L386 L387	E272-L383 HydrophobicContact CG-CB 4.33Å; E272-L383 PolarHBondContact OE1-N 3.31Å; L276-L383 HydrophobicContact CD2-CB 4.39Å; L276-L383 HydrophobicContact CD2-CD1 3.93Å; L279-L383 HydrophobicContact CD2-CD1 3.73Å; L320-L383 HydrophobicContact CD2-CD2 3.94Å; Q323-L383 HydrophobicContact CB-CD2 3.59Å; Q323-L383 HydrophobicContact CB-CG 3.92Å; V324-L383 HydrophobicContact CG2-CD2 4.01Å; I327-L383 HydrophobicContact CD1-CD1 3.89Å; L383-L386 PolarHBondContact O-N 3.31Å; L383-L387 WeakPolarHBondContact O-CB 3.5Å; L383-L387 PolarHBondContact O-N 3.31Å
384	Q	83	Confident	83.7	Confident	130 Å²	130	76.8 Å²	76.8	61%	0.607	35%	0.354	S	S	*	.	H	α-helix	trans	-66	-38.6	172.6	-66.1	179.3	-10.6	0	0	113.2	T382 L387 Y388	T382-Q384 VanDerWaalsContact C-N 3.25Å; T382-Q384 PolarHBondContact O-N 2.96Å; Q384-L387 PolarHBondContact O-N 2.85Å; Q384-Y388 PolarHBondContact O-N 2.75Å
385	K	85.2	Confident	83.5	Confident	52 Å²	52	79.5 Å²	79.5	23%	0.226	36%	0.36	C	S	.	.	H	α-helix	trans	-70.5	-37.6	177.9	-179.6	178.3	166.4	-170.1	0	111	E375 R380 T382 Y388 Y389	E375-K385 IonicContact OE2-NZ 3.31Å; E375-K385 PolarHBondContact OE2-NZ 3.42Å; R380-K385 WeakPolarHBondContact O-CD 3.49Å; R380-K385 PolarHBondContact O-NZ 3.2Å; T382-K385 WeakPolarHBondContact O-CB 3.38Å; T382-K385 PolarHBondContact O-N 2.95Å; T382-K385 WeakPolarHBondContact OG1-CB 3.24Å; T382-K385 PolarHBondContact OG1-N 3.2Å; K385-Y388 PolarHBondContact O-N 3.43Å; K385-Y389 HydrophobicContact CD-CE2 4.24Å; K385-Y389 WeakPolarHBondContact CE-OH 3.29Å; K385-Y389 HydrophobicContact CG-CD2 4.28Å; K385-Y389 HydrophobicContact CG-CE2 3.66Å; K385-Y389 WeakPolarHBondContact O-CD2 3.25Å; K385-Y389 PolarHBondContact O-N 3.49Å; K385-Y389 VanDerWaalsContact O-N 3.13Å
386	L	84.6	Confident	83.5	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-63.7	-48.2	171.7	-176.8	61.7	0	0	0	111.3	L276 L279 L280 I327 A372 L381 T382 L383 Y388 Y389 L390	L276-L386 HydrophobicContact CD2-CB 4.26Å; L276-L386 HydrophobicContact CD2-CD2 3.64Å; L279-L386 HydrophobicContact CD2-CD2 3.87Å; L280-L386 HydrophobicContact CD2-CD1 4.26Å; L280-L386 HydrophobicContact CD2-CD2 4.35Å; I327-L386 HydrophobicContact CD1-CD2 4.47Å; A372-L386 HydrophobicContact CB-CD1 3.95Å; L381-L386 HydrophobicContact CD1-CB 4.06Å; L381-L386 HydrophobicContact CD1-CD1 4.5Å; L381-L386 HydrophobicContact CD2-CB 4.49Å; L381-L386 HydrophobicContact CD2-CD1 4.46Å; L381-L386 HydrophobicContact CG-CB 4.38Å; T382-L386 PolarHBondContact O-N 3.37Å; L383-L386 PolarHBondContact O-N 3.31Å; L386-Y388 VanDerWaalsContact C-N 3.29Å; L386-Y388 PolarHBondContact O-N 2.77Å; L386-Y389 PolarHBondContact O-N 3.14Å; L386-Y389 VanDerWaalsContact O-N 3.1Å; L386-L390 HydrophobicContact CD1-CD1 3.81Å; L386-L390 HydrophobicContact CD1-CG 4.01Å; L386-L390 HydrophobicContact CD2-CD1 4.36Å; L386-L390 HydrophobicContact CG-CD1 3.76Å; L386-L390 HydrophobicContact CG-CG 4.29Å; L386-L390 WeakPolarHBondContact O-CG 3.34Å; L386-L390 PolarHBondContact O-N 3.04Å
387	L	84	Confident	83.5	Confident	33 Å²	33	79.5 Å²	79.5	17%	0.173	36%	0.363	C	S	.	.	H	α-helix	trans	-54.8	-44.4	175.9	-179.2	68.7	0	0	0	111.7	E326 I327 L383 Q384 Y389 L390 Q391 M394	E326-L387 HydrophobicContact CB-CD1 3.93Å; E326-L387 WeakPolarHBondContact OE2-CD2 3.48Å; I327-L387 HydrophobicContact CD1-CB 4.21Å; I327-L387 HydrophobicContact CD1-CD1 4.25Å; I327-L387 HydrophobicContact CG1-CB 4.49Å; I327-L387 HydrophobicContact CG1-CD1 3.63Å; L383-L387 WeakPolarHBondContact O-CB 3.5Å; L383-L387 PolarHBondContact O-N 3.31Å; Q384-L387 PolarHBondContact O-N 2.85Å; L387-Y389 PolarHBondContact O-N 3.35Å; L387-L390 PolarHBondContact O-N 3.44Å; L387-Q391 WeakPolarHBondContact O-CB 3.42Å; L387-Q391 PolarHBondContact O-N 3.44Å; L387-M394 HydrophobicContact CD1-CE 3.95Å
388	Y	86.2	Confident	83.5	Confident	164 Å²	164	73.6 Å²	73.6	64%	0.643	34%	0.343	S	S	*	.	H	α-helix	trans	-61	-42.2	175.9	175.9	-101.5	0	0	0	112.9	Q384 K385 L386	Q384-Y388 PolarHBondContact O-N 2.75Å; K385-Y388 PolarHBondContact O-N 3.43Å; L386-Y388 VanDerWaalsContact C-N 3.29Å; L386-Y388 PolarHBondContact O-N 2.77Å
389	Y	85.3	Confident	83.3	Confident	109 Å²	109	69.2 Å²	69.2	43%	0.427	32%	0.323	S	S	.	.	H	α-helix	trans	-69.7	-33.1	176.2	-64.9	-32.6	0	0	0	113.4	K385 L386 L387 P392	K385-Y389 HydrophobicContact CD-CE2 4.24Å; K385-Y389 WeakPolarHBondContact CE-OH 3.29Å; K385-Y389 HydrophobicContact CG-CD2 4.28Å; K385-Y389 HydrophobicContact CG-CE2 3.66Å; K385-Y389 WeakPolarHBondContact O-CD2 3.25Å; K385-Y389 PolarHBondContact O-N 3.49Å; K385-Y389 VanDerWaalsContact O-N 3.13Å; L386-Y389 PolarHBondContact O-N 3.14Å; L386-Y389 VanDerWaalsContact O-N 3.1Å; L387-Y389 PolarHBondContact O-N 3.35Å; Y389-P392 WeakPolarHBondContact O-CD 3.17Å
390	L	84.9	Confident	83.4	Confident	3 Å²	3	62.4 Å²	62.4	2%	0.016	29%	0.287	C	S	.	.	H	α-helix	trans	-84.6	-18.2	-179.6	-64.1	178.4	0	0	0	113.5	L283 I327 L330 F365 I368 L386 L387 T393 M394	L283-L390 HydrophobicContact CD1-CD1 3.91Å; I327-L390 HydrophobicContact CG2-CD1 3.68Å; L330-L390 HydrophobicContact CD2-CB 3.96Å; L330-L390 HydrophobicContact CD2-CD1 4.09Å; L330-L390 HydrophobicContact CD2-CD2 3.92Å; L330-L390 HydrophobicContact CD2-CG 4.2Å; F365-L390 HydrophobicContact CE2-CD2 4.5Å; I368-L390 HydrophobicContact CG2-CD2 4.33Å; L386-L390 HydrophobicContact CD1-CD1 3.81Å; L386-L390 HydrophobicContact CD1-CG 4.01Å; L386-L390 HydrophobicContact CD2-CD1 4.36Å; L386-L390 HydrophobicContact CG-CD1 3.76Å; L386-L390 HydrophobicContact CG-CG 4.29Å; L386-L390 WeakPolarHBondContact O-CG 3.34Å; L386-L390 PolarHBondContact O-N 3.04Å; L387-L390 PolarHBondContact O-N 3.44Å; L390-T393 WeakPolarHBondContact CA-OG1 3.47Å; L390-T393 PolarHBondContact O-N 2.77Å; L390-T393 PolarHBondContact O-OG1 3.28Å; L390-M394 WeakPolarHBondContact O-CG 3.31Å; L390-M394 PolarHBondContact O-N 3.04Å
391	Q	84.1	Confident	83.4	Confident	108 Å²	108	55.1 Å²	55.1	51%	0.505	26%	0.259	S	S	.	.	H	α-helix	trans	-53.1	-43	-178	-171.1	-178.8	1.6	0	0	114.3	L387 M394	L387-Q391 WeakPolarHBondContact O-CB 3.42Å; L387-Q391 PolarHBondContact O-N 3.44Å; Q391-M394 HydrophobicContact CB-CE 4.42Å
392	P	83.7	Confident	83.4	Confident	86 Å²	86	55.6 Å²	55.6	56%	0.558	26%	0.264	S	S	*	.	H	α-helix	trans	-68	-39.6	175	-19.4	34	0	0	0	112.6	Y389 M394 W395 V396	Y389-P392 WeakPolarHBondContact O-CD 3.17Å; P392-M394 VanDerWaalsContact C-N 3.34Å; P392-M394 PolarHBondContact O-N 2.78Å; P392-W395 PolarHBondContact O-N 3.41Å; P392-V396 PolarHBondContact O-N 2.98Å
393	T	82.6	Confident	83.1	Confident	25 Å²	25	52.8 Å²	52.8	15%	0.153	25%	0.247	C	C	.	.	H	α-helix	trans	-68.3	-31.5	-180	53.7	0	0	0	0	112.9	I368 L390 W395 V396 M397	I368-T393 HydrophobicContact CD1-CG2 3.67Å; L390-T393 WeakPolarHBondContact CA-OG1 3.47Å; L390-T393 PolarHBondContact O-N 2.77Å; L390-T393 PolarHBondContact O-OG1 3.28Å; T393-W395 PolarHBondContact O-N 3.39Å; T393-V396 PolarHBondContact O-N 2.93Å; T393-M397 WeakPolarHBondContact O-CB 3.45Å; T393-M397 PolarHBondContact O-N 3.04Å
394	M	83.1	Confident	82.9	Confident	34 Å²	34	53.1 Å²	53.1	17%	0.167	25%	0.249	C	C	.	.	H	α-helix	trans	-59.2	-45.8	175	-74	-164.7	-74.6	0	0	112.8	L330 L387 L390 Q391 P392 H398	L330-M394 HydrophobicContact CB-CG 3.97Å; L330-M394 HydrophobicContact CD1-CG 4.24Å; L330-M394 HydrophobicContact CD2-CG 3.94Å; L330-M394 HydrophobicContact CG-CG 4.28Å; L387-M394 HydrophobicContact CD1-CE 3.95Å; L390-M394 WeakPolarHBondContact O-CG 3.31Å; L390-M394 PolarHBondContact O-N 3.04Å; Q391-M394 HydrophobicContact CB-CE 4.42Å; P392-M394 VanDerWaalsContact C-N 3.34Å; P392-M394 PolarHBondContact O-N 2.78Å; M394-H398 VanDerWaalsContact O-CB 3.29Å; M394-H398 WeakPolarHBondContact O-CB 3.22Å; M394-H398 PolarHBondContact O-N 3.4Å
395	W	82.4	Confident	82.5	Confident	163 Å²	163	47 Å²	47	62%	0.617	22%	0.22	S	C	*	.	H	α-helix	trans	-66.3	-44.8	177.6	-82.8	94.5	0	0	0	112.4	P392 T393 E399	P392-W395 PolarHBondContact O-N 3.41Å; T393-W395 PolarHBondContact O-N 3.39Å; W395-E399 PolarHBondContact O-N 3.1Å; W395-E399 VanDerWaalsContact O-N 3.15Å
396	V	82.9	Confident	82	Confident	57 Å²	57	48 Å²	48	35%	0.345	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-50.4	176.7	165.9	0	0	0	0	110.9	P392 T393 H398 E399 V400 L437	P392-V396 PolarHBondContact O-N 2.98Å; T393-V396 PolarHBondContact O-N 2.93Å; V396-H398 PolarHBondContact O-N 3.47Å; V396-E399 PolarHBondContact O-N 2.82Å; V396-V400 WeakPolarHBondContact O-CG2 3.44Å; V396-V400 PolarHBondContact O-N 2.94Å; V396-L437 HydrophobicContact CB-CD1 4.37Å; V396-L437 HydrophobicContact CG1-CD1 3.39Å; V396-L437 HydrophobicContact CG1-CD2 4.23Å; V396-L437 HydrophobicContact CG1-CG 4.46Å; V396-L437 HydrophobicContact CG2-CD1 4.08Å
397	M	83	Confident	81.5	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.069	23%	0.228	C	C	.	.	H	α-helix	trans	-70.6	-33.1	-174.2	-151.7	56.4	140.3	0	0	111.9	L330 F334 V337 T362 T393 W401	L330-M397 HydrophobicContact CD1-CB 3.92Å; L330-M397 HydrophobicContact CD1-CG 4.38Å; F334-M397 HydrophobicContact CD2-CE 3.59Å; F334-M397 HydrophobicContact CE2-CE 4.3Å; V337-M397 HydrophobicContact CB-CE 4.39Å; V337-M397 HydrophobicContact CG1-CE 4.45Å; V337-M397 HydrophobicContact CG2-CE 4.28Å; V337-M397 HydrophobicContact CG2-SD 4.15Å; T362-M397 HydrophobicContact CG2-CE 4.34Å; T393-M397 WeakPolarHBondContact O-CB 3.45Å; T393-M397 PolarHBondContact O-N 3.04Å; M397-W401 WeakPolarHBondContact O-CB 3.26Å; M397-W401 PolarHBondContact O-N 2.95Å
398	H	84.7	Confident	80.9	Confident	66 Å²	66	48.9 Å²	48.9	31%	0.306	23%	0.23	S	C	.	.	H	α-helix	trans	-61	-46.2	170.5	175.9	-97.3	0	0	0	113.1	Y333 M394 V396 W401 S402	Y333-H398 HydrophobicContact CD2-CB 4.02Å; Y333-H398 HydrophobicContact CE2-CB 3.7Å; Y333-H398 AromaticContact CE2-CD2 3.99Å; Y333-H398 AromaticContact CZ-CD2 3.64Å; M394-H398 VanDerWaalsContact O-CB 3.29Å; M394-H398 WeakPolarHBondContact O-CB 3.22Å; M394-H398 PolarHBondContact O-N 3.4Å; V396-H398 PolarHBondContact O-N 3.47Å; H398-W401 PolarHBondContact O-N 2.82Å; H398-S402 WeakPolarHBondContact O-CB 3.44Å; H398-S402 PolarHBondContact O-N 3.42Å; H398-S402 PolarHBondContact O-OG 2.75Å
399	E	81.2	Confident	79.9	Confident	27 Å²	27	45.3 Å²	45.3	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-70.1	-35.9	-178.9	-69.9	-53.6	116.5	0	0	112.4	W395 V396 S402 S403 R424 A434	W395-E399 PolarHBondContact O-N 3.1Å; W395-E399 VanDerWaalsContact O-N 3.15Å; V396-E399 PolarHBondContact O-N 2.82Å; E399-S402 PolarHBondContact O-OG 3.41Å; E399-S402 VanDerWaalsContact O-OG 3.13Å; E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 2.86Å; E399-S403 PolarHBondContact O-OG 3.29Å; E399-R424 IonicContact OE2-CZ 3.64Å; E399-R424 IonicContact OE2-NH1 3.1Å; E399-R424 PolarHBondContact OE2-NH1 2.87Å; E399-R424 IonicContact OE2-NH2 3.24Å; E399-R424 PolarHBondContact OE2-NH2 3.06Å; E399-A434 HydrophobicContact CG-CB 4.46Å
400	V	82.7	Confident	78.8	Confident	4 Å²	4	43 Å²	43	2%	0.024	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-50.8	171.8	173.4	0	0	0	0	110.4	V337 L358 L361 V396 S403 L404 L437 L441	V337-V400 HydrophobicContact CG2-CG1 4.41Å; L358-V400 HydrophobicContact CD2-CG1 3.59Å; L361-V400 HydrophobicContact CD1-CG2 4.3Å; V396-V400 WeakPolarHBondContact O-CG2 3.44Å; V396-V400 PolarHBondContact O-N 2.94Å; V400-S403 WeakPolarHBondContact O-CB 3.32Å; V400-S403 PolarHBondContact O-N 3.09Å; V400-L404 HydrophobicContact CG1-CD1 3.77Å; V400-L404 HydrophobicContact CG1-CG 4.37Å; V400-L404 WeakPolarHBondContact O-CG 3.33Å; V400-L404 PolarHBondContact O-N 3.23Å; V400-L437 HydrophobicContact CG2-CD2 3.5Å; V400-L437 VanDerWaalsContact CG2-CD2 3.5Å; V400-L441 HydrophobicContact CG2-CD1 3.97Å
401	W	81.7	Confident	77.8	Confident	5 Å²	5	48.7 Å²	48.7	2%	0.019	25%	0.252	C	S	.	.	H	α-helix	trans	-54.9	-55.8	179.1	168.6	-125.7	0	0	0	113.1	Y306 Y333 G336 V337 I340 M397 H398 S403 L404 V405	Y306-W401 HydrophobicContact CG-CH2 4.44Å; Y333-W401 HydrophobicContact CD1-CB 4.44Å; Y333-W401 AromaticContact CD1-CD1 3.17Å; Y333-W401 AromaticContact CD1-CG 3.88Å; Y333-W401 HydrophobicContact CD1-CG 3.88Å; Y333-W401 AromaticContact CD1-NE1 3.49Å; Y333-W401 AromaticContact CE1-CD1 3.69Å; Y333-W401 AromaticContact CE1-NE1 3.94Å; Y333-W401 HydrophobicContact CG-CB 4.37Å; Y333-W401 AromaticContact CG-CD1 3.91Å; Y333-W401 HydrophobicContact CG-CG 4.25Å; G336-W401 WeakPolarHBondContact O-CZ3 3.48Å; V337-W401 HydrophobicContact CG2-CB 4.45Å; V337-W401 HydrophobicContact CG2-CE3 4.36Å; I340-W401 HydrophobicContact CD1-CE3 4.11Å; I340-W401 HydrophobicContact CD1-CZ3 3.6Å; I340-W401 HydrophobicContact CG1-CZ3 4.31Å; M397-W401 WeakPolarHBondContact O-CB 3.26Å; M397-W401 PolarHBondContact O-N 2.95Å; H398-W401 PolarHBondContact O-N 2.82Å; W401-S403 PolarHBondContact O-N 3.01Å; W401-L404 PolarHBondContact O-N 2.95Å; W401-L404 VanDerWaalsContact O-N 3.09Å; W401-V405 HydrophobicContact CD2-CG2 3.56Å; W401-V405 HydrophobicContact CE3-CG2 3.41Å; W401-V405 VanDerWaalsContact CE3-CG2 3.41Å; W401-V405 HydrophobicContact CG-CG2 4.46Å; W401-V405 HydrophobicContact CH2-CG2 3.57Å; W401-V405 HydrophobicContact CZ2-CG2 3.65Å; W401-V405 HydrophobicContact CZ3-CG2 3.36Å; W401-V405 WeakPolarHBondContact O-CG2 3.27Å; W401-V405 PolarHBondContact O-N 3.23Å
402	S	81.6	Confident	76.9	Confident	23 Å²	23	44.6 Å²	44.6	16%	0.161	24%	0.236	C	C	.	.	H	α-helix	trans	-57.2	-35.4	179.5	55.9	0	0	0	0	112.3	H398 E399 I406 R424	H398-S402 WeakPolarHBondContact O-CB 3.44Å; H398-S402 PolarHBondContact O-N 3.42Å; H398-S402 PolarHBondContact O-OG 2.75Å; E399-S402 PolarHBondContact O-OG 3.41Å; E399-S402 VanDerWaalsContact O-OG 3.13Å; S402-I406 WeakPolarHBondContact O-CD1 2.96Å; S402-I406 VanDerWaalsContact O-CG1 3.31Å; S402-I406 WeakPolarHBondContact O-CG1 3.14Å; S402-I406 PolarHBondContact O-N 3.29Å; S402-R424 PolarHBondContact OG-NH2 2.85Å
403	S	77.8	Confident	76.1	Confident	4 Å²	4	48.1 Å²	48.1	3%	0.028	24%	0.238	C	C	.	.	H	α-helix	trans	-70.8	-42.6	177	-55.5	0	0	0	0	111.9	E399 V400 W401 I406 I407 Y420 R424	E399-S403 WeakPolarHBondContact O-CB 3.47Å; E399-S403 PolarHBondContact O-N 2.86Å; E399-S403 PolarHBondContact O-OG 3.29Å; V400-S403 WeakPolarHBondContact O-CB 3.32Å; V400-S403 PolarHBondContact O-N 3.09Å; W401-S403 PolarHBondContact O-N 3.01Å; S403-I406 PolarHBondContact O-N 3.2Å; S403-I407 WeakPolarHBondContact O-CD1 3.19Å; S403-I407 WeakPolarHBondContact O-CG1 3.45Å; S403-I407 PolarHBondContact O-N 3.04Å; S403-Y420 WeakPolarHBondContact O-CE1 3.24Å; S403-R424 PolarHBondContact OG-NE 3.05Å
404	L	77.3	Confident	75.6	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.037	23%	0.234	C	C	.	.	H	α-helix	trans	-69.8	-38.9	178.7	-68	171.6	0	0	0	113.4	V337 I340 L354 L358 V400 W401 I406 I407 Q408	V337-L404 HydrophobicContact CG1-CD1 4.24Å; V337-L404 HydrophobicContact CG2-CD1 4.06Å; I340-L404 HydrophobicContact CD1-CB 3.75Å; I340-L404 HydrophobicContact CG2-CB 4.41Å; L354-L404 HydrophobicContact CD2-CD2 4.15Å; L358-L404 HydrophobicContact CD1-CD1 3.64Å; L358-L404 HydrophobicContact CD1-CD2 3.73Å; L358-L404 HydrophobicContact CD1-CG 4.33Å; L358-L404 HydrophobicContact CD2-CD1 3.84Å; L358-L404 HydrophobicContact CG-CD1 4.39Å; V400-L404 HydrophobicContact CG1-CD1 3.77Å; V400-L404 HydrophobicContact CG1-CG 4.37Å; V400-L404 WeakPolarHBondContact O-CG 3.33Å; V400-L404 PolarHBondContact O-N 3.23Å; W401-L404 PolarHBondContact O-N 2.95Å; W401-L404 VanDerWaalsContact O-N 3.09Å; L404-I406 VanDerWaalsContact C-N 3.26Å; L404-I406 PolarHBondContact O-N 2.89Å; L404-I407 HydrophobicContact CD2-CD1 4.3Å; L404-I407 PolarHBondContact O-N 3.37Å; L404-Q408 WeakPolarHBondContact O-CB 3.2Å; L404-Q408 PolarHBondContact O-N 3.22Å
405	V	73.9	Confident	75.3	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-38.5	176.4	175	0	0	0	0	110.8	L303 I340 W401 Q408 L409	L303-V405 HydrophobicContact CD1-CB 4.43Å; L303-V405 HydrophobicContact CD1-CG1 3.53Å; L303-V405 HydrophobicContact CG-CG1 3.9Å; I340-V405 HydrophobicContact CD1-CG2 4.05Å; W401-V405 HydrophobicContact CD2-CG2 3.56Å; W401-V405 HydrophobicContact CE3-CG2 3.41Å; W401-V405 VanDerWaalsContact CE3-CG2 3.41Å; W401-V405 HydrophobicContact CG-CG2 4.46Å; W401-V405 HydrophobicContact CH2-CG2 3.57Å; W401-V405 HydrophobicContact CZ2-CG2 3.65Å; W401-V405 HydrophobicContact CZ3-CG2 3.36Å; W401-V405 WeakPolarHBondContact O-CG2 3.27Å; W401-V405 PolarHBondContact O-N 3.23Å; V405-Q408 PolarHBondContact O-N 3.04Å; V405-L409 HydrophobicContact CG1-CD1 3.72Å; V405-L409 HydrophobicContact CG1-CG 4.28Å; V405-L409 WeakPolarHBondContact O-CB 3.35Å; V405-L409 WeakPolarHBondContact O-CD1 3.46Å; V405-L409 WeakPolarHBondContact O-CG 3.3Å; V405-L409 PolarHBondContact O-N 3.39Å
406	I	74.1	Confident	75.2	Confident	74 Å²	74	41.9 Å²	41.9	38%	0.379	21%	0.214	S	C	.	.	H	α-helix	trans	-67	-42.1	177.2	-67.4	166.8	0	0	0	111	S402 S403 L404 Q408 L409 S410 Y420	S402-I406 WeakPolarHBondContact O-CD1 2.96Å; S402-I406 VanDerWaalsContact O-CG1 3.31Å; S402-I406 WeakPolarHBondContact O-CG1 3.14Å; S402-I406 PolarHBondContact O-N 3.29Å; S403-I406 PolarHBondContact O-N 3.2Å; L404-I406 VanDerWaalsContact C-N 3.26Å; L404-I406 PolarHBondContact O-N 2.89Å; I406-Q408 PolarHBondContact O-N 2.85Å; I406-L409 PolarHBondContact O-N 2.87Å; I406-S410 PolarHBondContact O-N 3.46Å; I406-S410 VanDerWaalsContact O-N 3.17Å; I406-S410 PolarHBondContact O-OG 2.91Å; I406-Y420 HydrophobicContact CB-CE1 4.45Å; I406-Y420 HydrophobicContact CB-CE2 4.27Å; I406-Y420 WeakPolarHBondContact CB-OH 3.4Å; I406-Y420 VanDerWaalsContact CD1-OH 3.25Å; I406-Y420 WeakPolarHBondContact CD1-OH 3.15Å; I406-Y420 HydrophobicContact CG2-CD2 4.25Å; I406-Y420 HydrophobicContact CG2-CE1 4.37Å; I406-Y420 HydrophobicContact CG2-CE2 3.44Å; I406-Y420 VanDerWaalsContact CG2-CE2 3.44Å
407	I	75	Confident	75.2	Confident	6 Å²	6	39.2 Å²	39.2	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-58	-46.3	173.8	-68.5	159	0	0	0	111.3	M351 S403 L404 L409 S410 V417 Y420 L421	M351-I407 HydrophobicContact CE-CG2 4.4Å; S403-I407 WeakPolarHBondContact O-CD1 3.19Å; S403-I407 WeakPolarHBondContact O-CG1 3.45Å; S403-I407 PolarHBondContact O-N 3.04Å; L404-I407 HydrophobicContact CD2-CD1 4.3Å; L404-I407 PolarHBondContact O-N 3.37Å; I407-L409 VanDerWaalsContact C-N 3.26Å; I407-L409 PolarHBondContact O-N 3.25Å; I407-S410 PolarHBondContact O-N 3.27Å; I407-S410 PolarHBondContact O-OG 3.17Å; I407-S410 VanDerWaalsContact O-OG 3.14Å; I407-V417 HydrophobicContact CD1-CG1 3.8Å; I407-V417 HydrophobicContact CG1-CG1 4.15Å; I407-V417 HydrophobicContact CG2-CG1 4Å; I407-V417 HydrophobicContact CG2-CG2 3.88Å; I407-Y420 HydrophobicContact CD1-CD1 3.87Å; I407-Y420 HydrophobicContact CD1-CE1 4.17Å; I407-Y420 HydrophobicContact CG1-CD1 3.49Å; I407-Y420 VanDerWaalsContact CG1-CD1 3.49Å; I407-Y420 HydrophobicContact CG1-CE1 3.88Å; I407-Y420 HydrophobicContact CG1-CG 4.31Å; I407-L421 HydrophobicContact CD1-CD2 3.91Å; I407-L421 HydrophobicContact CD1-CG 4.19Å
408	Q	71.3	Confident	75.3	Confident	47 Å²	47	38.6 Å²	38.6	22%	0.22	20%	0.195	C	C	.	.	H	α-helix	trans	-72.7	-18	-178.7	-163.9	64.7	11.9	0	0	113.2	Y306 I340 T344 L404 V405 I406	Y306-Q408 HydrophobicContact CE2-CG 4.14Å; Y306-Q408 VanDerWaalsContact OH-CG 3.31Å; Y306-Q408 WeakPolarHBondContact OH-CG 3.33Å; I340-Q408 HydrophobicContact CD1-CB 4.44Å; T344-Q408 VanDerWaalsContact CG2-OE1 3.26Å; L404-Q408 WeakPolarHBondContact O-CB 3.2Å; L404-Q408 PolarHBondContact O-N 3.22Å; V405-Q408 PolarHBondContact O-N 3.04Å; I406-Q408 PolarHBondContact O-N 2.85Å
409	L	64.7	Low	75.3	Confident	89 Å²	89	36.9 Å²	36.9	47%	0.466	19%	0.189	S	C	.	.	H	α-helix	trans	-88.4	-20.1	175.5	-74	171.2	0	0	0	113.4	V405 I406 I407	V405-L409 HydrophobicContact CG1-CD1 3.72Å; V405-L409 HydrophobicContact CG1-CG 4.28Å; V405-L409 WeakPolarHBondContact O-CB 3.35Å; V405-L409 WeakPolarHBondContact O-CD1 3.46Å; V405-L409 WeakPolarHBondContact O-CG 3.3Å; V405-L409 PolarHBondContact O-N 3.39Å; I406-L409 PolarHBondContact O-N 2.87Å; I407-L409 VanDerWaalsContact C-N 3.26Å; I407-L409 PolarHBondContact O-N 3.25Å
410	S	61.3	Low	75.5	Confident	62 Å²	62	37 Å²	37	43%	0.434	19%	0.188	S	C	.	.	H	α-helix	trans	-90.6	-6	176.8	60	0	0	0	0	114.4	I406 I407 S412	I406-S410 PolarHBondContact O-N 3.46Å; I406-S410 VanDerWaalsContact O-N 3.17Å; I406-S410 PolarHBondContact O-OG 2.91Å; I407-S410 PolarHBondContact O-N 3.27Å; I407-S410 PolarHBondContact O-OG 3.17Å; I407-S410 VanDerWaalsContact O-OG 3.14Å; S410-S412 WeakPolarHBondContact CB-OG 3.16Å; S410-S412 PolarHBondContact O-N 3.36Å; S410-S412 VanDerWaalsContact O-N 3.16Å; S410-S412 VanDerWaalsContact OG-CB 3.24Å; S410-S412 WeakPolarHBondContact OG-CB 3.37Å; S410-S412 PolarHBondContact OG-OG 2.88Å
411	D	65.7	Low	75.6	Confident	121 Å²	121	37.1 Å²	37.1	65%	0.647	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	29.1	-169.8	-162.2	44	0	0	0	112.4	R413	D411-R413 PolarHBondContact O-N 3.44Å
412	S	63.6	Low	75.8	Confident	23 Å²	23	38 Å²	38	16%	0.161	19%	0.193	C	C	.	.			trans	-71.3	128.7	-169.7	-82.2	0	0	0	0	111.7	S410 E416 V417	S410-S412 WeakPolarHBondContact CB-OG 3.16Å; S410-S412 PolarHBondContact O-N 3.36Å; S410-S412 VanDerWaalsContact O-N 3.16Å; S410-S412 VanDerWaalsContact OG-CB 3.24Å; S410-S412 WeakPolarHBondContact OG-CB 3.37Å; S410-S412 PolarHBondContact OG-OG 2.88Å; S412-E416 WeakPolarHBondContact CA-OE2 3.23Å; S412-E416 WeakPolarHBondContact CB-OE2 3.41Å; S412-E416 PolarHBondContact OG-OE2 3Å; S412-V417 WeakPolarHBondContact O-CG2 3.36Å
413	R	67.4	Low	75.9	Confident	159 Å²	159	40.7 Å²	40.7	60%	0.6	20%	0.203	S	C	*	.			trans	-94.9	127.6	-178.5	-61.3	-177.2	-173.7	172.9	3.1	111.2	D411 A415 E416	D411-R413 PolarHBondContact O-N 3.44Å; R413-A415 PolarHBondContact O-N 3.15Å; R413-E416 WeakPolarHBondContact O-CB 3.44Å; R413-E416 PolarHBondContact O-N 3.21Å
414	D	71.4	Confident	76.2	Confident	13 Å²	13	42.1 Å²	42.1	7%	0.07	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	37.5	-84.4	164.7	-55.4	-73.3	0	0	0	116.5	V350 E416 V417 L418 E468	V350-D414 HydrophobicContact CB-CB 3.98Å; V350-D414 WeakPolarHBondContact CB-OD1 3.3Å; V350-D414 HydrophobicContact CG2-CB 4.13Å; D414-E416 VanDerWaalsContact C-N 3.3Å; D414-E416 PolarHBondContact O-N 3.46Å; D414-V417 WeakPolarHBondContact O-CB 3.48Å; D414-V417 PolarHBondContact O-N 3.46Å; D414-V417 VanDerWaalsContact O-N 3.07Å; D414-L418 PolarHBondContact O-N 3.17Å; D414-L418 VanDerWaalsContact O-N 3.08Å; D414-E468 HydrophobicContact CB-CB 4.3Å; D414-E468 HydrophobicContact CB-CG 3.95Å
415	A	77.6	Confident	76.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.008	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-31	179.8	0	0	0	0	0	114	R413 V417 T419 Q501 P503	R413-A415 PolarHBondContact O-N 3.15Å; A415-V417 VanDerWaalsContact C-N 3.35Å; A415-T419 PolarHBondContact O-N 2.63Å; A415-T419 PolarHBondContact O-OG1 2.88Å; A415-Q501 HydrophobicContact CB-CB 4.25Å; A415-Q501 WeakPolarHBondContact CB-O 3.47Å; A415-P503 HydrophobicContact CB-CG 4.07Å
416	E	80.2	Confident	77.1	Confident	78 Å²	78	47.3 Å²	47.3	36%	0.364	23%	0.231	S	C	.	.	H	α-helix	trans	-67.6	-37	171.7	-69.5	-173	-176.6	0	0	111.4	S412 R413 D414 T419 Y420	S412-E416 WeakPolarHBondContact CA-OE2 3.23Å; S412-E416 WeakPolarHBondContact CB-OE2 3.41Å; S412-E416 PolarHBondContact OG-OE2 3Å; R413-E416 WeakPolarHBondContact O-CB 3.44Å; R413-E416 PolarHBondContact O-N 3.21Å; D414-E416 VanDerWaalsContact C-N 3.3Å; D414-E416 PolarHBondContact O-N 3.46Å; E416-T419 WeakPolarHBondContact O-CB 3.23Å; E416-T419 PolarHBondContact O-N 3.36Å; E416-T419 VanDerWaalsContact O-N 3.17Å; E416-Y420 WeakPolarHBondContact O-CB 3.36Å; E416-Y420 PolarHBondContact O-N 2.82Å
417	V	83.6	Confident	77.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-43	177.6	-175	0	0	0	0	110.3	M351 L354 I407 S412 D414 A415 T419 Y420 L421	M351-V417 HydrophobicContact SD-CB 4.2Å; M351-V417 HydrophobicContact SD-CG1 3.88Å; M351-V417 HydrophobicContact SD-CG2 3.77Å; L354-V417 HydrophobicContact CD2-CG1 4.13Å; I407-V417 HydrophobicContact CD1-CG1 3.8Å; I407-V417 HydrophobicContact CG1-CG1 4.15Å; I407-V417 HydrophobicContact CG2-CG1 4Å; I407-V417 HydrophobicContact CG2-CG2 3.88Å; S412-V417 WeakPolarHBondContact O-CG2 3.36Å; D414-V417 WeakPolarHBondContact O-CB 3.48Å; D414-V417 PolarHBondContact O-N 3.46Å; D414-V417 VanDerWaalsContact O-N 3.07Å; A415-V417 VanDerWaalsContact C-N 3.35Å; V417-T419 VanDerWaalsContact C-N 3.3Å; V417-T419 PolarHBondContact O-N 3.42Å; V417-Y420 PolarHBondContact O-N 3.4Å; V417-L421 HydrophobicContact CG1-CD1 4.05Å; V417-L421 HydrophobicContact CG1-CG 4.42Å; V417-L421 WeakPolarHBondContact O-CB 3.41Å; V417-L421 VanDerWaalsContact O-CG 3.29Å; V417-L421 WeakPolarHBondContact O-CG 3.39Å; V417-L421 PolarHBondContact O-N 2.92Å
418	L	83.9	Confident	77.9	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-61.6	-38.2	172	-65.1	177.9	0	0	0	112.2	V350 D414 H422 A445 A446 Y449 P503 F505	V350-L418 HydrophobicContact CG1-CD1 4.13Å; V350-L418 HydrophobicContact CG1-CD2 3.83Å; V350-L418 HydrophobicContact CG1-CG 3.78Å; V350-L418 HydrophobicContact CG2-CD1 4.29Å; D414-L418 PolarHBondContact O-N 3.17Å; D414-L418 VanDerWaalsContact O-N 3.08Å; L418-H422 VanDerWaalsContact O-CB 3.24Å; L418-H422 WeakPolarHBondContact O-CB 3.31Å; L418-H422 PolarHBondContact O-N 2.83Å; L418-A445 HydrophobicContact CD2-CB 4.28Å; L418-A446 HydrophobicContact CD2-CB 4.05Å; L418-Y449 HydrophobicContact CD1-CD2 4.21Å; L418-Y449 HydrophobicContact CD1-CG 3.98Å; L418-P503 HydrophobicContact CD1-CG 4.46Å; L418-F505 HydrophobicContact CB-CE1 4.33Å
419	T	85.6	Confident	78.1	Confident	30 Å²	30	56.1 Å²	56.1	18%	0.184	26%	0.264	C	S	.	.	H	α-helix	trans	-64.4	-48.3	175.5	-67.8	0	0	0	0	111.7	A415 E416 V417 H422 E423 P503 S504	A415-T419 PolarHBondContact O-N 2.63Å; A415-T419 PolarHBondContact O-OG1 2.88Å; E416-T419 WeakPolarHBondContact O-CB 3.23Å; E416-T419 PolarHBondContact O-N 3.36Å; E416-T419 VanDerWaalsContact O-N 3.17Å; V417-T419 VanDerWaalsContact C-N 3.3Å; V417-T419 PolarHBondContact O-N 3.42Å; T419-H422 PolarHBondContact O-N 3.26Å; T419-E423 PolarHBondContact O-N 3.1Å; T419-P503 WeakPolarHBondContact OG1-CA 3.41Å; T419-S504 PolarHBondContact OG1-N 3.26Å
420	Y	85.4	Confident	78.9	Confident	30 Å²	30	56 Å²	56	12%	0.118	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-47.5	178.5	174.2	-96.4	0	0	0	111.9	S403 I406 I407 E416 V417 H422 E423 R424	S403-Y420 WeakPolarHBondContact O-CE1 3.24Å; I406-Y420 HydrophobicContact CB-CE1 4.45Å; I406-Y420 HydrophobicContact CB-CE2 4.27Å; I406-Y420 WeakPolarHBondContact CB-OH 3.4Å; I406-Y420 VanDerWaalsContact CD1-OH 3.25Å; I406-Y420 WeakPolarHBondContact CD1-OH 3.15Å; I406-Y420 HydrophobicContact CG2-CD2 4.25Å; I406-Y420 HydrophobicContact CG2-CE1 4.37Å; I406-Y420 HydrophobicContact CG2-CE2 3.44Å; I406-Y420 VanDerWaalsContact CG2-CE2 3.44Å; I407-Y420 HydrophobicContact CD1-CD1 3.87Å; I407-Y420 HydrophobicContact CD1-CE1 4.17Å; I407-Y420 HydrophobicContact CG1-CD1 3.49Å; I407-Y420 VanDerWaalsContact CG1-CD1 3.49Å; I407-Y420 HydrophobicContact CG1-CE1 3.88Å; I407-Y420 HydrophobicContact CG1-CG 4.31Å; E416-Y420 WeakPolarHBondContact O-CB 3.36Å; E416-Y420 PolarHBondContact O-N 2.82Å; V417-Y420 PolarHBondContact O-N 3.4Å; Y420-H422 VanDerWaalsContact C-N 3.3Å; Y420-H422 PolarHBondContact O-N 2.71Å; Y420-E423 WeakPolarHBondContact O-CB 3.33Å; Y420-E423 PolarHBondContact O-N 2.85Å; Y420-E423 VanDerWaalsContact O-N 3.16Å; Y420-R424 PolarHBondContact O-N 3.39Å
421	L	84.9	Confident	79.9	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-36	177.7	-66.4	171.1	0	0	0	111.6	L354 I407 V417 R424 I425 V442	L354-L421 HydrophobicContact CD1-CD1 4.4Å; L354-L421 HydrophobicContact CD2-CD1 4.35Å; I407-L421 HydrophobicContact CD1-CD2 3.91Å; I407-L421 HydrophobicContact CD1-CG 4.19Å; V417-L421 HydrophobicContact CG1-CD1 4.05Å; V417-L421 HydrophobicContact CG1-CG 4.42Å; V417-L421 WeakPolarHBondContact O-CB 3.41Å; V417-L421 VanDerWaalsContact O-CG 3.29Å; V417-L421 WeakPolarHBondContact O-CG 3.39Å; V417-L421 PolarHBondContact O-N 2.92Å; L421-R424 WeakPolarHBondContact O-CB 3.31Å; L421-R424 PolarHBondContact O-N 3.47Å; L421-I425 WeakPolarHBondContact O-CG1 3.22Å; L421-I425 PolarHBondContact O-N 3.22Å; L421-V442 HydrophobicContact CB-CG2 3.41Å; L421-V442 VanDerWaalsContact CB-CG2 3.41Å; L421-V442 HydrophobicContact CD1-CG2 3.98Å; L421-V442 HydrophobicContact CG-CG2 4.23Å
422	H	84.4	Confident	80.7	Confident	23 Å²	23	58.1 Å²	58.1	11%	0.106	28%	0.282	C	S	.	.	H	α-helix	trans	-66.2	-36.4	173.3	-178.5	67.2	0	0	0	112.8	L418 T419 Y420 K426 F505	L418-H422 VanDerWaalsContact O-CB 3.24Å; L418-H422 WeakPolarHBondContact O-CB 3.31Å; L418-H422 PolarHBondContact O-N 2.83Å; T419-H422 PolarHBondContact O-N 3.26Å; Y420-H422 VanDerWaalsContact C-N 3.3Å; Y420-H422 PolarHBondContact O-N 2.71Å; H422-K426 PolarHBondContact CD2-NZ 3.11Å; H422-K426 WeakPolarHBondContact NE2-CE 3.44Å; H422-K426 PolarHBondContact NE2-NZ 2.91Å; H422-F505 HydrophobicContact CB-CD1 4.5Å
423	E	84.8	Confident	81.6	Confident	80 Å²	80	63.4 Å²	63.4	37%	0.374	31%	0.309	S	S	.	.	H	α-helix	trans	-65.7	-39.6	169	-74.7	-165.6	-168.8	0	0	112.6	T419 Y420 I425 K426 R427	T419-E423 PolarHBondContact O-N 3.1Å; Y420-E423 WeakPolarHBondContact O-CB 3.33Å; Y420-E423 PolarHBondContact O-N 2.85Å; Y420-E423 VanDerWaalsContact O-N 3.16Å; E423-I425 VanDerWaalsContact C-N 3.29Å; E423-I425 PolarHBondContact O-N 2.81Å; E423-K426 WeakPolarHBondContact O-CB 3.45Å; E423-K426 PolarHBondContact O-N 3.26Å; E423-K426 VanDerWaalsContact O-N 3.1Å; E423-R427 WeakPolarHBondContact O-CG 3.42Å; E423-R427 PolarHBondContact O-N 3.48Å; E423-R427 IonicContact OE2-CZ 2.84Å; E423-R427 IonicContact OE2-NH2 3.09Å; E423-R427 PolarHBondContact OE2-NH2 3.13Å
424	R	83.9	Confident	82.2	Confident	33 Å²	33	56.4 Å²	56.4	13%	0.125	29%	0.285	C	S	.	.	H	α-helix	trans	-61.1	-38	178.4	-167.9	62.9	159.2	115.2	-2.4	111.6	E399 S402 S403 Y420 L421 K426 R427 L428 I438	E399-R424 IonicContact OE2-CZ 3.64Å; E399-R424 IonicContact OE2-NH1 3.1Å; E399-R424 PolarHBondContact OE2-NH1 2.87Å; E399-R424 IonicContact OE2-NH2 3.24Å; E399-R424 PolarHBondContact OE2-NH2 3.06Å; S402-R424 PolarHBondContact OG-NH2 2.85Å; S403-R424 PolarHBondContact OG-NE 3.05Å; Y420-R424 PolarHBondContact O-N 3.39Å; L421-R424 WeakPolarHBondContact O-CB 3.31Å; L421-R424 PolarHBondContact O-N 3.47Å; R424-K426 VanDerWaalsContact C-N 3.31Å; R424-K426 PolarHBondContact O-N 2.97Å; R424-R427 PolarHBondContact O-N 3.11Å; R424-L428 HydrophobicContact CG-CD1 4.02Å; R424-L428 WeakPolarHBondContact O-CB 3.47Å; R424-L428 WeakPolarHBondContact O-CG 3.25Å; R424-L428 PolarHBondContact O-N 2.84Å; R424-L428 VanDerWaalsContact O-N 3.14Å; R424-I438 HydrophobicContact CG-CD1 4.23Å
425	I	84.6	Confident	82.8	Confident	11 Å²	11	57.5 Å²	57.5	6%	0.056	29%	0.29	C	S	.	.	H	α-helix	trans	-57.9	-40.7	173.2	-69.3	168.2	0	0	0	111.9	L421 E423 L428 Q435 I438 I439 V442 P542	L421-I425 WeakPolarHBondContact O-CG1 3.22Å; L421-I425 PolarHBondContact O-N 3.22Å; E423-I425 VanDerWaalsContact C-N 3.29Å; E423-I425 PolarHBondContact O-N 2.81Å; I425-L428 PolarHBondContact O-N 3.09Å; I425-Q435 HydrophobicContact CG2-CG 4.16Å; I425-Q435 PolarHBondContact O-NE2 3.28Å; I425-I438 HydrophobicContact CD1-CG2 4.34Å; I425-I438 HydrophobicContact CG1-CG2 3.69Å; I425-I439 HydrophobicContact CD1-CG1 3.94Å; I425-I439 HydrophobicContact CG1-CG1 4.22Å; I425-I439 HydrophobicContact CG2-CD1 4.41Å; I425-I439 HydrophobicContact CG2-CG1 4.12Å; I425-V442 HydrophobicContact CD1-CB 4.23Å; I425-V442 HydrophobicContact CD1-CG2 3.92Å; I425-P542 HydrophobicContact CD1-CB 4.16Å; I425-P542 HydrophobicContact CD1-CG 4.25Å
426	K	84.9	Confident	83.2	Confident	106 Å²	106	63 Å²	63	46%	0.461	32%	0.315	S	S	.	.	H	α-helix	trans	-70.3	-40.4	177.7	-64.1	173.1	-174.4	165.2	0	112	H422 E423 R424 L428 E429	H422-K426 PolarHBondContact CD2-NZ 3.11Å; H422-K426 WeakPolarHBondContact NE2-CE 3.44Å; H422-K426 PolarHBondContact NE2-NZ 2.91Å; E423-K426 WeakPolarHBondContact O-CB 3.45Å; E423-K426 PolarHBondContact O-N 3.26Å; E423-K426 VanDerWaalsContact O-N 3.1Å; R424-K426 VanDerWaalsContact C-N 3.31Å; R424-K426 PolarHBondContact O-N 2.97Å; K426-L428 PolarHBondContact O-N 3.1Å; K426-E429 WeakPolarHBondContact O-CG 3.44Å; K426-E429 PolarHBondContact O-N 3.38Å
427	R	84.7	Confident	83.4	Confident	161 Å²	161	61.3 Å²	61.3	61%	0.608	31%	0.309	S	S	*	.	H	α-helix	trans	-65.2	-18.5	175.8	-63	178.6	-160.3	-170.7	7.1	112.9	E423 R424	E423-R427 WeakPolarHBondContact O-CG 3.42Å; E423-R427 PolarHBondContact O-N 3.48Å; E423-R427 IonicContact OE2-CZ 2.84Å; E423-R427 IonicContact OE2-NH2 3.09Å; E423-R427 PolarHBondContact OE2-NH2 3.13Å; R424-R427 PolarHBondContact O-N 3.11Å
428	L	80.9	Confident	83.5	Confident	17 Å²	17	61.4 Å²	61.4	9%	0.089	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.8	11.5	-176.6	-73.3	172.6	0	0	0	114.9	R424 I425 K426 G430 N431 Q435 I438	R424-L428 HydrophobicContact CG-CD1 4.02Å; R424-L428 WeakPolarHBondContact O-CB 3.47Å; R424-L428 WeakPolarHBondContact O-CG 3.25Å; R424-L428 PolarHBondContact O-N 2.84Å; R424-L428 VanDerWaalsContact O-N 3.14Å; I425-L428 PolarHBondContact O-N 3.09Å; K426-L428 PolarHBondContact O-N 3.1Å; L428-G430 PolarHBondContact O-N 3.36Å; L428-N431 PolarHBondContact O-N 3.48Å; L428-Q435 HydrophobicContact CB-CB 4.49Å; L428-I438 HydrophobicContact CD1-CD1 3.32Å
429	E	77.3	Confident	83.7	Confident	134 Å²	134	61.6 Å²	61.6	63%	0.626	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-19.9	177.8	-74.8	171.3	-163.7	0	0	114.5	K426	K426-E429 WeakPolarHBondContact O-CG 3.44Å; K426-E429 PolarHBondContact O-N 3.38Å
430	G	80.3	Confident	83.7	Confident	85 Å²	85	61.2 Å²	61.2	88%	0.876	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-20	174.1	0	0	0	0	0	115.9	L428	L428-G430 PolarHBondContact O-N 3.36Å
431	N	83.7	Confident	83.8	Confident	66 Å²	66	60.5 Å²	60.5	35%	0.353	31%	0.31	S	S	.	.			trans	-126.4	101	-178.6	-177.2	-11.6	0	0	0	110.8	L428 D433 A434 Q435	L428-N431 PolarHBondContact O-N 3.48Å; N431-D433 VanDerWaalsContact C-N 3.35Å; N431-D433 PolarHBondContact O-N 3.28Å; N431-D433 PolarHBondContact OD1-N 2.9Å; N431-A434 HydrophobicContact CB-CB 4.22Å; N431-A434 PolarHBondContact OD1-N 3.3Å; N431-Q435 VanDerWaalsContact O-CB 3.25Å; N431-Q435 WeakPolarHBondContact O-CB 3.48Å; N431-Q435 PolarHBondContact O-N 3Å
432	K	82.6	Confident	83.9	Confident	162 Å²	162	60.1 Å²	60.1	70%	0.704	31%	0.308	S	S	*	.	H	α-helix	trans	-60.6	-38.9	-174.7	-67.4	-178.2	178.4	178.5	0	113.5	Q435 Q436	K432-Q435 PolarHBondContact O-N 2.93Å; K432-Q436 VanDerWaalsContact O-CG 3.31Å; K432-Q436 WeakPolarHBondContact O-CG 3.31Å; K432-Q436 PolarHBondContact O-N 3.19Å
433	D	81.9	Confident	84.1	Confident	135 Å²	135	63.6 Å²	63.6	72%	0.722	32%	0.321	S	S	*	.	H	α-helix	trans	-74.7	-44.1	-173.2	-57.6	-32.1	0	0	0	110.7	N431 Q435 Q436 L437	N431-D433 VanDerWaalsContact C-N 3.35Å; N431-D433 PolarHBondContact O-N 3.28Å; N431-D433 PolarHBondContact OD1-N 2.9Å; D433-Q435 VanDerWaalsContact C-N 3.32Å; D433-Q435 PolarHBondContact O-N 3.39Å; D433-Q436 PolarHBondContact O-N 3.39Å; D433-L437 PolarHBondContact O-N 3.14Å; D433-L437 VanDerWaalsContact O-N 3.12Å
434	A	80.2	Confident	84.2	Confident	12 Å²	12	63.4 Å²	63.4	10%	0.099	32%	0.318	C	S	.	.	H	α-helix	trans	-62.9	-38.6	171.6	0	0	0	0	0	112	E399 N431 L437 I438	E399-A434 HydrophobicContact CG-CB 4.46Å; N431-A434 HydrophobicContact CB-CB 4.22Å; N431-A434 PolarHBondContact OD1-N 3.3Å; A434-L437 PolarHBondContact O-N 3.39Å; A434-I438 PolarHBondContact O-N 3.4Å; A434-I438 VanDerWaalsContact O-N 3.13Å
435	Q	84.3	Confident	84.4	Confident	36 Å²	36	61.9 Å²	61.9	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-45.8	176.3	-166.3	-174.7	45.5	0	0	111.6	I425 L428 N431 K432 D433 L437 I438 I439	I425-Q435 HydrophobicContact CG2-CG 4.16Å; I425-Q435 PolarHBondContact O-NE2 3.28Å; L428-Q435 HydrophobicContact CB-CB 4.49Å; N431-Q435 VanDerWaalsContact O-CB 3.25Å; N431-Q435 WeakPolarHBondContact O-CB 3.48Å; N431-Q435 PolarHBondContact O-N 3Å; K432-Q435 PolarHBondContact O-N 2.93Å; D433-Q435 VanDerWaalsContact C-N 3.32Å; D433-Q435 PolarHBondContact O-N 3.39Å; Q435-L437 VanDerWaalsContact C-N 3.32Å; Q435-L437 PolarHBondContact O-N 3.47Å; Q435-I438 PolarHBondContact O-N 3.03Å; Q435-I439 HydrophobicContact CG-CD1 3.91Å; Q435-I439 HydrophobicContact CG-CG1 4.5Å; Q435-I439 WeakPolarHBondContact O-CB 3.43Å; Q435-I439 WeakPolarHBondContact O-CD1 3.26Å; Q435-I439 WeakPolarHBondContact O-CG1 3.48Å; Q435-I439 PolarHBondContact O-N 3.32Å
436	Q	86.1	Confident	84.6	Confident	116 Å²	116	61.3 Å²	61.3	54%	0.542	31%	0.31	S	S	.	.	H	α-helix	trans	-61.5	-39	177.2	-73.6	-64.2	-22.6	0	0	112.4	K432 D433 I439 G440	K432-Q436 VanDerWaalsContact O-CG 3.31Å; K432-Q436 WeakPolarHBondContact O-CG 3.31Å; K432-Q436 PolarHBondContact O-N 3.19Å; D433-Q436 PolarHBondContact O-N 3.39Å; Q436-I439 WeakPolarHBondContact O-CB 3.42Å; Q436-I439 PolarHBondContact O-N 2.86Å; Q436-G440 PolarHBondContact O-N 3.19Å
437	L	84.2	Confident	84.8	Confident	43 Å²	43	63.6 Å²	63.6	23%	0.225	32%	0.32	C	S	.	.	H	α-helix	trans	-65.1	-46.1	178.3	-172.9	136.3	0	0	0	112.2	L361 V396 V400 D433 A434 Q435 G440 L441	L361-L437 HydrophobicContact CD1-CD2 4.36Å; L361-L437 HydrophobicContact CD2-CD1 4.47Å; V396-L437 HydrophobicContact CB-CD1 4.37Å; V396-L437 HydrophobicContact CG1-CD1 3.39Å; V396-L437 HydrophobicContact CG1-CD2 4.23Å; V396-L437 HydrophobicContact CG1-CG 4.46Å; V396-L437 HydrophobicContact CG2-CD1 4.08Å; V400-L437 HydrophobicContact CG2-CD2 3.5Å; V400-L437 VanDerWaalsContact CG2-CD2 3.5Å; D433-L437 PolarHBondContact O-N 3.14Å; D433-L437 VanDerWaalsContact O-N 3.12Å; A434-L437 PolarHBondContact O-N 3.39Å; Q435-L437 VanDerWaalsContact C-N 3.32Å; Q435-L437 PolarHBondContact O-N 3.47Å; L437-G440 WeakPolarHBondContact O-CA 3.16Å; L437-G440 PolarHBondContact O-N 3Å; L437-G440 VanDerWaalsContact O-N 3.12Å; L437-L441 HydrophobicContact CD2-CD1 3.93Å; L437-L441 PolarHBondContact O-N 3.43Å
438	I	84.8	Confident	85	Confident	3 Å²	3	56.9 Å²	56.9	2%	0.015	30%	0.297	C	S	.	.	H	α-helix	trans	-70.4	-32.9	177.4	-70.7	164.8	0	0	0	111.2	R424 I425 L428 A434 Q435 G440 L441 V442	R424-I438 HydrophobicContact CG-CD1 4.23Å; I425-I438 HydrophobicContact CD1-CG2 4.34Å; I425-I438 HydrophobicContact CG1-CG2 3.69Å; L428-I438 HydrophobicContact CD1-CD1 3.32Å; A434-I438 PolarHBondContact O-N 3.4Å; A434-I438 VanDerWaalsContact O-N 3.13Å; Q435-I438 PolarHBondContact O-N 3.03Å; I438-G440 VanDerWaalsContact C-N 3.29Å; I438-G440 PolarHBondContact O-N 3.37Å; I438-L441 PolarHBondContact O-N 3.39Å; I438-V442 HydrophobicContact CG2-CG2 4.28Å; I438-V442 VanDerWaalsContact O-CG2 3.29Å; I438-V442 WeakPolarHBondContact O-CG2 3.33Å; I438-V442 PolarHBondContact O-N 2.73Å
439	I	87.6	Confident	85.3	Confident	3 Å²	3	56.1 Å²	56.1	2%	0.015	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-42.9	167.7	-74	168.3	0	0	0	110.9	I425 Q435 Q436 V442 R443 P542 T543	I425-I439 HydrophobicContact CD1-CG1 3.94Å; I425-I439 HydrophobicContact CG1-CG1 4.22Å; I425-I439 HydrophobicContact CG2-CD1 4.41Å; I425-I439 HydrophobicContact CG2-CG1 4.12Å; Q435-I439 HydrophobicContact CG-CD1 3.91Å; Q435-I439 HydrophobicContact CG-CG1 4.5Å; Q435-I439 WeakPolarHBondContact O-CB 3.43Å; Q435-I439 WeakPolarHBondContact O-CD1 3.26Å; Q435-I439 WeakPolarHBondContact O-CG1 3.48Å; Q435-I439 PolarHBondContact O-N 3.32Å; Q436-I439 WeakPolarHBondContact O-CB 3.42Å; Q436-I439 PolarHBondContact O-N 2.86Å; I439-V442 PolarHBondContact O-N 3.35Å; I439-R443 WeakPolarHBondContact O-CB 3.5Å; I439-R443 PolarHBondContact O-N 2.79Å; I439-P542 HydrophobicContact CB-CG 4.1Å; I439-P542 HydrophobicContact CD1-CG 4.36Å; I439-P542 HydrophobicContact CG1-CG 3.69Å; I439-P542 HydrophobicContact CG2-CG 3.64Å; I439-T543 HydrophobicContact CD1-CG2 3.96Å
440	G	86.9	Confident	85.9	Confident	23 Å²	23	49.9 Å²	49.9	24%	0.237	26%	0.264	C	S	.	.	H	α-helix	trans	-61.2	-47.6	175.4	0	0	0	0	0	113	Q436 L437 I438 R443 K444	Q436-G440 PolarHBondContact O-N 3.19Å; L437-G440 WeakPolarHBondContact O-CA 3.16Å; L437-G440 PolarHBondContact O-N 3Å; L437-G440 VanDerWaalsContact O-N 3.12Å; I438-G440 VanDerWaalsContact C-N 3.29Å; I438-G440 PolarHBondContact O-N 3.37Å; G440-R443 PolarHBondContact O-N 3.38Å; G440-K444 PolarHBondContact O-N 2.88Å
441	L	86.3	Confident	86.3	Confident	14 Å²	14	54.6 Å²	54.6	7%	0.073	26%	0.255	C	S	.	.	H	α-helix	trans	-60.1	-47	175.4	-74.4	173.3	0	0	0	112.1	A357 L358 L361 V400 L437 I438 R443 K444 A445	A357-L441 HydrophobicContact CB-CD2 3.84Å; L358-L441 HydrophobicContact CD2-CD1 4.41Å; L358-L441 HydrophobicContact CD2-CD2 4.13Å; L361-L441 HydrophobicContact CD1-CD1 4.09Å; L361-L441 HydrophobicContact CD1-CD2 3.8Å; L361-L441 HydrophobicContact CD1-CG 4.23Å; L361-L441 HydrophobicContact CG-CD2 4.5Å; V400-L441 HydrophobicContact CG2-CD1 3.97Å; L437-L441 HydrophobicContact CD2-CD1 3.93Å; L437-L441 PolarHBondContact O-N 3.43Å; I438-L441 PolarHBondContact O-N 3.39Å; L441-R443 PolarHBondContact O-N 3.26Å; L441-K444 PolarHBondContact O-N 3.24Å; L441-A445 WeakPolarHBondContact O-CB 3.16Å; L441-A445 PolarHBondContact O-N 3.29Å
442	V	87.8	Confident	86.5	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.2	-38.7	179.3	178.6	0	0	0	0	111.7	L421 I425 I438 I439 K444 A445 A446 F540	L421-V442 HydrophobicContact CB-CG2 3.41Å; L421-V442 VanDerWaalsContact CB-CG2 3.41Å; L421-V442 HydrophobicContact CD1-CG2 3.98Å; L421-V442 HydrophobicContact CG-CG2 4.23Å; I425-V442 HydrophobicContact CD1-CB 4.23Å; I425-V442 HydrophobicContact CD1-CG2 3.92Å; I438-V442 HydrophobicContact CG2-CG2 4.28Å; I438-V442 VanDerWaalsContact O-CG2 3.29Å; I438-V442 WeakPolarHBondContact O-CG2 3.33Å; I438-V442 PolarHBondContact O-N 2.73Å; I439-V442 PolarHBondContact O-N 3.35Å; V442-K444 VanDerWaalsContact C-N 3.27Å; V442-K444 PolarHBondContact O-N 2.96Å; V442-A445 PolarHBondContact O-N 3.34Å; V442-A446 WeakPolarHBondContact O-CB 3.48Å; V442-A446 PolarHBondContact O-N 3.11Å; V442-F540 HydrophobicContact CG1-CD1 3.89Å; V442-F540 HydrophobicContact CG1-CE1 3.45Å; V442-F540 VanDerWaalsContact CG1-CE1 3.45Å; V442-F540 HydrophobicContact CG1-CZ 4.4Å
443	R	88.6	Confident	86.8	Confident	96 Å²	96	44.3 Å²	44.3	36%	0.362	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-38.3	175.6	-173.2	-177.8	-66.4	115.6	-7.2	111.5	I439 G440 L441 D541	I439-R443 WeakPolarHBondContact O-CB 3.5Å; I439-R443 PolarHBondContact O-N 2.79Å; G440-R443 PolarHBondContact O-N 3.38Å; L441-R443 PolarHBondContact O-N 3.26Å; R443-D541 IonicContact CZ-OD1 2.64Å; R443-D541 IonicContact NE-OD1 2.66Å; R443-D541 PolarHBondContact NE-OD1 3.42Å; R443-D541 VanDerWaalsContact NE-OD1 3.1Å; R443-D541 IonicContact NH2-OD1 3.9Å; R443-D541 PolarHBondContact NH2-OD1 3.13Å
444	K	87.4	Confident	87.1	Confident	75 Å²	75	40.1 Å²	40.1	33%	0.326	18%	0.184	S	C	.	.	H	α-helix	trans	-69.5	-55.8	174.3	-69.1	178.2	179.3	-179.3	0	111.1	S353 A357 E360 G440 L441 V442 A446 K447	S353-K444 PolarHBondContact OG-O 2.94Å; A357-K444 HydrophobicContact CB-CB 3.75Å; A357-K444 HydrophobicContact CB-CD 3.58Å; A357-K444 HydrophobicContact CB-CG 4.31Å; E360-K444 IonicContact OE1-NZ 3.39Å; E360-K444 PolarHBondContact OE1-NZ 2.84Å; E360-K444 IonicContact OE2-NZ 2.76Å; E360-K444 PolarHBondContact OE2-NZ 3.41Å; G440-K444 PolarHBondContact O-N 2.88Å; L441-K444 PolarHBondContact O-N 3.24Å; V442-K444 VanDerWaalsContact C-N 3.27Å; V442-K444 PolarHBondContact O-N 2.96Å; K444-A446 VanDerWaalsContact C-N 3.29Å; K444-A446 PolarHBondContact O-N 3.04Å; K444-K447 WeakPolarHBondContact O-CB 3.37Å; K444-K447 PolarHBondContact O-N 3.07Å
445	A	87.9	Confident	87.4	Confident	1 Å²	1	42 Å²	42	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-34.1	-179	0	0	0	0	0	114.2	L354 L418 L441 V442 K447 P448	L354-A445 HydrophobicContact CB-CB 3.9Å; L354-A445 HydrophobicContact CD1-CB 4.1Å; L418-A445 HydrophobicContact CD2-CB 4.28Å; L441-A445 WeakPolarHBondContact O-CB 3.16Å; L441-A445 PolarHBondContact O-N 3.29Å; V442-A445 PolarHBondContact O-N 3.34Å; A445-K447 VanDerWaalsContact C-N 3.31Å; A445-K447 PolarHBondContact O-N 3.11Å; A445-P448 WeakPolarHBondContact O-CD 3.35Å; A445-P448 WeakPolarHBondContact O-CG 3.39Å
446	A	88.3	Confident	87.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-75.4	-15.2	177.6	0	0	0	0	0	113.7	L418 V442 K444 Y449 M450 F540	L418-A446 HydrophobicContact CD2-CB 4.05Å; V442-A446 WeakPolarHBondContact O-CB 3.48Å; V442-A446 PolarHBondContact O-N 3.11Å; K444-A446 VanDerWaalsContact C-N 3.29Å; K444-A446 PolarHBondContact O-N 3.04Å; A446-Y449 WeakPolarHBondContact O-CB 3.17Å; A446-Y449 PolarHBondContact O-N 3.36Å; A446-M450 HydrophobicContact CB-CE 4.48Å; A446-M450 WeakPolarHBondContact O-CG 3.47Å; A446-M450 PolarHBondContact O-N 2.99Å; A446-F540 HydrophobicContact CB-CB 3.95Å; A446-F540 HydrophobicContact CB-CD1 4.11Å; A446-F540 HydrophobicContact CB-CG 4.11Å
447	K	88.7	Confident	87.8	Confident	154 Å²	154	35.1 Å²	35.1	67%	0.67	16%	0.159	S	C	*	.	H	α-helix	trans	-55.8	-48.9	-176.8	-170.6	-179.5	-179.8	-176	0	114.5	K444 A445 Y449 M450 R451	K444-K447 WeakPolarHBondContact O-CB 3.37Å; K444-K447 PolarHBondContact O-N 3.07Å; A445-K447 VanDerWaalsContact C-N 3.31Å; A445-K447 PolarHBondContact O-N 3.11Å; K447-Y449 VanDerWaalsContact C-N 3.35Å; K447-Y449 PolarHBondContact O-N 2.74Å; K447-M450 PolarHBondContact O-N 2.74Å; K447-R451 WeakPolarHBondContact O-CB 3.3Å; K447-R451 PolarHBondContact O-N 3.06Å
448	P	88.9	Confident	87.8	Confident	20 Å²	20	33.9 Å²	33.9	13%	0.13	15%	0.152	C	C	.	.	H	α-helix	trans	-59.8	-43.4	173.7	22.2	-34.7	0	0	0	112.3	Q349 V350 A445 R451 M452	Q349-P448 HydrophobicContact CB-CB 3.96Å; Q349-P448 HydrophobicContact CB-CG 4.46Å; V350-P448 HydrophobicContact CG2-CG 4.35Å; A445-P448 WeakPolarHBondContact O-CD 3.35Å; A445-P448 WeakPolarHBondContact O-CG 3.39Å; P448-R451 WeakPolarHBondContact O-CB 3.42Å; P448-R451 PolarHBondContact O-N 2.93Å; P448-M452 PolarHBondContact O-N 3.29Å
449	Y	88.6	Confident	87.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-63.4	-45	179.1	-166.2	-82	0	0	0	112.3	V350 L418 A446 K447 R451 M452 L453 L470 Q501 P503 L506	V350-Y449 HydrophobicContact CG2-CD2 4.29Å; L418-Y449 HydrophobicContact CD1-CD2 4.21Å; L418-Y449 HydrophobicContact CD1-CG 3.98Å; A446-Y449 WeakPolarHBondContact O-CB 3.17Å; A446-Y449 PolarHBondContact O-N 3.36Å; K447-Y449 VanDerWaalsContact C-N 3.35Å; K447-Y449 PolarHBondContact O-N 2.74Å; Y449-R451 VanDerWaalsContact C-N 3.29Å; Y449-R451 PolarHBondContact O-N 3.38Å; Y449-M452 HydrophobicContact CD2-CE 4.32Å; Y449-M452 PolarHBondContact O-N 3.19Å; Y449-L453 WeakPolarHBondContact O-CB 3.42Å; Y449-L453 PolarHBondContact O-N 3.33Å; Y449-L470 WeakPolarHBondContact OH-CB 3.35Å; Y449-L470 VanDerWaalsContact OH-CD2 3.3Å; Y449-L470 WeakPolarHBondContact OH-CD2 3.25Å; Y449-Q501 PolarHBondContact OH-O 2.85Å; Y449-P503 HydrophobicContact CE1-CG 3.89Å; Y449-P503 HydrophobicContact CE2-CG 4.2Å; Y449-P503 VanDerWaalsContact OH-CD 3.23Å; Y449-P503 WeakPolarHBondContact OH-CD 3.39Å; Y449-L506 HydrophobicContact CE1-CD1 3.69Å
450	M	88.2	Confident	87.6	Confident	4 Å²	4	38.1 Å²	38.1	2%	0.02	17%	0.171	C	C	.	.	H	α-helix	trans	-63.3	-34.3	174.4	-67.5	-54.9	132.9	0	0	112.1	A446 K447 L453 Q454 F505 L538 F540	A446-M450 HydrophobicContact CB-CE 4.48Å; A446-M450 WeakPolarHBondContact O-CG 3.47Å; A446-M450 PolarHBondContact O-N 2.99Å; K447-M450 PolarHBondContact O-N 2.74Å; M450-L453 PolarHBondContact O-N 2.58Å; M450-L453 HydrophobicContact SD-CD2 4.14Å; M450-Q454 VanDerWaalsContact O-CB 3.27Å; M450-Q454 WeakPolarHBondContact O-CB 3.4Å; M450-Q454 PolarHBondContact O-N 2.76Å; M450-F505 HydrophobicContact CE-CE2 3.55Å; M450-F505 HydrophobicContact CE-CZ 3.63Å; M450-L538 HydrophobicContact CB-CG 4.49Å; M450-L538 WeakPolarHBondContact CB-O 3.28Å; M450-L538 HydrophobicContact SD-CD2 4.08Å; M450-L538 HydrophobicContact SD-CG 4.14Å; M450-F540 HydrophobicContact CE-CB 4.17Å; M450-F540 HydrophobicContact CE-CD2 4.12Å; M450-F540 HydrophobicContact CE-CG 4.41Å; M450-F540 HydrophobicContact CG-CB 3.9Å; M450-F540 HydrophobicContact SD-CB 4.28Å
451	R	88.3	Confident	87.5	Confident	184 Å²	184	38.9 Å²	38.9	69%	0.694	17%	0.172	S	C	*	.	H	α-helix	trans	-67	-41.8	174.8	-173.9	177.8	-178.6	167.3	1.1	112.2	K447 P448 Y449 Q454 M455	K447-R451 WeakPolarHBondContact O-CB 3.3Å; K447-R451 PolarHBondContact O-N 3.06Å; P448-R451 WeakPolarHBondContact O-CB 3.42Å; P448-R451 PolarHBondContact O-N 2.93Å; Y449-R451 VanDerWaalsContact C-N 3.29Å; Y449-R451 PolarHBondContact O-N 3.38Å; R451-Q454 PolarHBondContact O-N 2.77Å; R451-M455 VanDerWaalsContact O-CG 3.32Å; R451-M455 WeakPolarHBondContact O-CG 3.47Å; R451-M455 PolarHBondContact O-N 3.07Å
452	M	88.3	Confident	87.4	Confident	12 Å²	12	40.3 Å²	40.3	6%	0.059	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-46.3	172.2	-69.5	-170.9	-76.4	0	0	110.8	P448 Y449 Q454 M455 W456 D464 E468 F469	P448-M452 PolarHBondContact O-N 3.29Å; Y449-M452 HydrophobicContact CD2-CE 4.32Å; Y449-M452 PolarHBondContact O-N 3.19Å; M452-Q454 PolarHBondContact O-N 2.9Å; M452-M455 PolarHBondContact O-N 2.78Å; M452-W456 PolarHBondContact O-N 3.28Å; M452-D464 HydrophobicContact SD-CB 4.48Å; M452-E468 HydrophobicContact CE-CB 4.18Å; M452-F469 HydrophobicContact CB-CD2 3.97Å; M452-F469 HydrophobicContact CB-CE2 4.3Å; M452-F469 HydrophobicContact SD-CB 4.46Å
453	L	89.3	Confident	87.1	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-61.2	-41.2	177.1	-175.4	56.1	0	0	0	112.6	Y449 M450 W456 I457 F469 L470 L506 I513 L538	Y449-L453 WeakPolarHBondContact O-CB 3.42Å; Y449-L453 PolarHBondContact O-N 3.33Å; M450-L453 PolarHBondContact O-N 2.58Å; M450-L453 HydrophobicContact SD-CD2 4.14Å; L453-W456 PolarHBondContact O-N 3.06Å; L453-I457 HydrophobicContact CD1-CD1 3.61Å; L453-I457 HydrophobicContact CD1-CG1 4.02Å; L453-I457 HydrophobicContact CG-CD1 3.81Å; L453-I457 HydrophobicContact CG-CG1 4.46Å; L453-I457 VanDerWaalsContact O-CB 3.31Å; L453-I457 WeakPolarHBondContact O-CB 3.23Å; L453-I457 WeakPolarHBondContact O-CG1 3.4Å; L453-I457 PolarHBondContact O-N 3.14Å; L453-F469 HydrophobicContact CB-CE2 4.05Å; L453-F469 HydrophobicContact CD1-CE2 4.07Å; L453-F469 HydrophobicContact CD1-CZ 4.05Å; L453-L470 HydrophobicContact CD1-CD2 4.43Å; L453-L506 HydrophobicContact CD2-CD1 3.78Å; L453-L506 HydrophobicContact CD2-CD2 4.38Å; L453-I513 HydrophobicContact CD1-CD1 4.18Å; L453-I513 HydrophobicContact CD1-CG1 4.36Å; L453-I513 HydrophobicContact CD1-CG2 3.45Å; L453-I513 VanDerWaalsContact CD1-CG2 3.45Å; L453-L538 HydrophobicContact CB-CD2 4Å; L453-L538 HydrophobicContact CD2-CD2 3.79Å; L453-L538 HydrophobicContact CG-CD2 3.71Å
454	Q	88.3	Confident	86.8	Confident	47 Å²	47	41.6 Å²	41.6	22%	0.22	20%	0.195	C	C	.	.	H	α-helix	trans	-63.1	-43.9	175.4	-175.7	-178	-8.8	0	0	111.5	M450 R451 M452 W456 I457 Q458 M536 L538	M450-Q454 VanDerWaalsContact O-CB 3.27Å; M450-Q454 WeakPolarHBondContact O-CB 3.4Å; M450-Q454 PolarHBondContact O-N 2.76Å; R451-Q454 PolarHBondContact O-N 2.77Å; M452-Q454 PolarHBondContact O-N 2.9Å; Q454-W456 VanDerWaalsContact C-N 3.31Å; Q454-W456 PolarHBondContact O-N 3.39Å; Q454-I457 PolarHBondContact O-N 3.39Å; Q454-Q458 VanDerWaalsContact CG-CD 3.45Å; Q454-Q458 HydrophobicContact CG-CG 4.23Å; Q454-Q458 VanDerWaalsContact CG-OE1 3.32Å; Q454-Q458 VanDerWaalsContact O-CB 3.26Å; Q454-Q458 WeakPolarHBondContact O-CB 3.31Å; Q454-Q458 WeakPolarHBondContact O-CG 3.39Å; Q454-Q458 PolarHBondContact O-N 2.99Å; Q454-M536 PolarHBondContact NE2-O 3.28Å; Q454-L538 HydrophobicContact CB-CB 4.24Å; Q454-L538 HydrophobicContact CB-CD2 4.44Å
455	M	87.2	Confident	86.4	Confident	52 Å²	52	47.7 Å²	47.7	26%	0.256	22%	0.216	S	C	.	.	H	α-helix	trans	-63.4	-37.2	177.2	-71.9	-70.1	-69.2	0	0	112.3	R451 M452 K459 G460 V461	R451-M455 VanDerWaalsContact O-CG 3.32Å; R451-M455 WeakPolarHBondContact O-CG 3.47Å; R451-M455 PolarHBondContact O-N 3.07Å; M452-M455 PolarHBondContact O-N 2.78Å; M455-K459 HydrophobicContact CE-CD 4.13Å; M455-K459 CarbonylContact O-C 3.36Å; M455-K459 WeakPolarHBondContact O-CA 3.28Å; M455-K459 WeakPolarHBondContact O-CB 3.3Å; M455-K459 PolarHBondContact O-N 2.78Å; M455-K459 HydrophobicContact SD-CD 3.92Å; M455-G460 PolarHBondContact O-N 3.31Å; M455-V461 CarbonylContact C-O 3.59Å; M455-V461 HydrophobicContact CE-CB 4.41Å; M455-V461 PolarHBondContact O-N 3.45Å
456	W	90.2	Very high	85.9	Confident	0 Å²	0	52 Å²	52	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-67.5	-51.5	173.1	179.2	-111.8	0	0	0	112.1	M452 L453 Q454 Q458 G460 V461 I462 F469 V471 Y495 I513 G517 N521	M452-W456 PolarHBondContact O-N 3.28Å; L453-W456 PolarHBondContact O-N 3.06Å; Q454-W456 VanDerWaalsContact C-N 3.31Å; Q454-W456 PolarHBondContact O-N 3.39Å; W456-Q458 PolarHBondContact O-N 3.25Å; W456-G460 WeakPolarHBondContact CZ3-O 3.26Å; W456-G460 VanDerWaalsContact O-CA 3.23Å; W456-G460 WeakPolarHBondContact O-CA 3.3Å; W456-G460 PolarHBondContact O-N 3.09Å; W456-V461 PolarHBondContact N-O 3.24Å; W456-I462 HydrophobicContact CD2-CG1 4.24Å; W456-I462 HydrophobicContact CE3-CD1 3.93Å; W456-I462 HydrophobicContact CE3-CG1 3.34Å; W456-I462 HydrophobicContact CH2-CD1 4.23Å; W456-I462 HydrophobicContact CH2-CG1 4.49Å; W456-I462 HydrophobicContact CZ3-CD1 3.66Å; W456-I462 HydrophobicContact CZ3-CG1 3.49Å; W456-I462 VanDerWaalsContact CZ3-CG1 3.49Å; W456-F469 HydrophobicContact CB-CE1 3.91Å; W456-F469 HydrophobicContact CB-CZ 3.73Å; W456-F469 AromaticContact CD1-CZ 3.98Å; W456-F469 HydrophobicContact CD2-CE1 4.27Å; W456-F469 AromaticContact CG-CE1 3.83Å; W456-F469 HydrophobicContact CG-CE1 3.83Å; W456-F469 AromaticContact CG-CZ 3.88Å; W456-F469 HydrophobicContact CG-CZ 3.88Å; W456-V471 HydrophobicContact CH2-CG1 4.1Å; W456-V471 HydrophobicContact CZ2-CB 4.46Å; W456-V471 HydrophobicContact CZ2-CG1 3.86Å; W456-V471 HydrophobicContact CZ2-CG2 4.21Å; W456-Y495 AromaticContact CH2-CD1 3.59Å; W456-Y495 HydrophobicContact CH2-CD1 3.59Å; W456-Y495 AromaticContact CH2-CE1 3.74Å; W456-Y495 HydrophobicContact CH2-CE1 3.74Å; W456-Y495 HydrophobicContact CH2-CG 4.01Å; W456-Y495 HydrophobicContact CZ3-CD1 4.18Å; W456-Y495 AromaticContact CZ3-CE1 3.95Å; W456-Y495 HydrophobicContact CZ3-CE1 3.95Å; W456-I513 PolarHBondContact NE1-O 2.7Å; W456-G517 VanDerWaalsContact CE2-CA 3.47Å; W456-G517 VanDerWaalsContact CZ2-CA 3.45Å; W456-N521 VanDerWaalsContact CZ3-ND2 3.3Å; W456-N521 WeakPolarHBondContact CZ3-ND2 3.28Å
457	I	88.3	Confident	85.6	Confident	7 Å²	7	60.5 Å²	60.5	4%	0.036	27%	0.268	C	S	.	.	H	α-helix	trans	-69.5	-31.5	-175.3	-73.5	-179.3	0	0	0	113.4	L453 Q454 I513 T516 L520 I551 A554	L453-I457 HydrophobicContact CD1-CD1 3.61Å; L453-I457 HydrophobicContact CD1-CG1 4.02Å; L453-I457 HydrophobicContact CG-CD1 3.81Å; L453-I457 HydrophobicContact CG-CG1 4.46Å; L453-I457 VanDerWaalsContact O-CB 3.31Å; L453-I457 WeakPolarHBondContact O-CB 3.23Å; L453-I457 WeakPolarHBondContact O-CG1 3.4Å; L453-I457 PolarHBondContact O-N 3.14Å; Q454-I457 PolarHBondContact O-N 3.39Å; I457-I513 HydrophobicContact CD1-CG1 4.3Å; I457-I513 HydrophobicContact CD1-CG2 4.44Å; I457-I513 HydrophobicContact CG1-CG2 4.42Å; I457-T516 HydrophobicContact CG2-CG2 4.3Å; I457-L520 WeakPolarHBondContact O-CD1 3.47Å; I457-I551 HydrophobicContact CD1-CB 4.48Å; I457-I551 HydrophobicContact CD1-CG1 3.8Å; I457-I551 HydrophobicContact CD1-CG2 4.42Å; I457-A554 HydrophobicContact CG2-CB 3.22Å
458	Q	84.6	Confident	85.3	Confident	17 Å²	17	53.2 Å²	53.2	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-98	-31.6	-178	-68.9	177.6	-7.2	0	0	113.8	Q454 W456 V530 P532 M536	Q454-Q458 VanDerWaalsContact CG-CD 3.45Å; Q454-Q458 HydrophobicContact CG-CG 4.23Å; Q454-Q458 VanDerWaalsContact CG-OE1 3.32Å; Q454-Q458 VanDerWaalsContact O-CB 3.26Å; Q454-Q458 WeakPolarHBondContact O-CB 3.31Å; Q454-Q458 WeakPolarHBondContact O-CG 3.39Å; Q454-Q458 PolarHBondContact O-N 2.99Å; W456-Q458 PolarHBondContact O-N 3.25Å; Q458-V530 VanDerWaalsContact O-CG1 3.31Å; Q458-V530 WeakPolarHBondContact O-CG1 3.26Å; Q458-P532 HydrophobicContact CB-CG 3.88Å; Q458-P532 HydrophobicContact CG-CG 4.4Å; Q458-P532 WeakPolarHBondContact O-CG 3.48Å; Q458-M536 VanDerWaalsContact NE2-N 3.16Å; Q458-M536 PolarHBondContact NE2-O 2.91Å
459	K	81.7	Confident	85.2	Confident	91 Å²	91	52.3 Å²	52.3	40%	0.396	23%	0.231	S	C	.	.	H	α-helix	trans	-125.9	-7	-170.4	-58.5	176.8	-175.6	168.1	0	113.4	M455 V461 R524	M455-K459 HydrophobicContact CE-CD 4.13Å; M455-K459 CarbonylContact O-C 3.36Å; M455-K459 WeakPolarHBondContact O-CA 3.28Å; M455-K459 WeakPolarHBondContact O-CB 3.3Å; M455-K459 PolarHBondContact O-N 2.78Å; M455-K459 HydrophobicContact SD-CD 3.92Å; K459-V461 HydrophobicContact CB-CG2 4.06Å; K459-V461 PolarHBondContact O-N 3.06Å; K459-R524 VanDerWaalsContact O-CD 3.25Å; K459-R524 WeakPolarHBondContact O-CD 3.36Å; K459-R524 PolarHBondContact O-NH1 2.94Å
460	G	84.9	Confident	85.1	Confident	3 Å²	3	52.3 Å²	52.3	3%	0.031	23%	0.231	C	C	.	.			trans	67.7	11.5	-173.9	0	0	0	0	0	114.4	M455 W456 N521	M455-G460 PolarHBondContact O-N 3.31Å; W456-G460 WeakPolarHBondContact CZ3-O 3.26Å; W456-G460 VanDerWaalsContact O-CA 3.23Å; W456-G460 WeakPolarHBondContact O-CA 3.3Å; W456-G460 PolarHBondContact O-N 3.09Å; G460-N521 PolarHBondContact O-ND2 3.36Å; G460-N521 PolarHBondContact O-OD1 3.38Å; G460-N521 VanDerWaalsContact O-OD1 3.05Å
461	V	84.8	Confident	85.1	Confident	40 Å²	40	52.1 Å²	52.1	24%	0.242	23%	0.23	C	C	.	.			trans	-97.2	126.5	-176	-172.8	0	0	0	0	110.2	M455 W456 K459 V463	M455-V461 CarbonylContact C-O 3.59Å; M455-V461 HydrophobicContact CE-CB 4.41Å; M455-V461 PolarHBondContact O-N 3.45Å; W456-V461 PolarHBondContact N-O 3.24Å; K459-V461 HydrophobicContact CB-CG2 4.06Å; K459-V461 PolarHBondContact O-N 3.06Å; V461-V463 HydrophobicContact CG1-CG2 3.78Å
462	I	85.8	Confident	85	Confident	44 Å²	44	44.5 Å²	44.5	23%	0.226	20%	0.204	C	C	.	.			trans	-91.2	129.3	166.8	-53.4	-179	0	0	0	107.8	W456 D464 F469 V471 D473 Y495	W456-I462 HydrophobicContact CD2-CG1 4.24Å; W456-I462 HydrophobicContact CE3-CD1 3.93Å; W456-I462 HydrophobicContact CE3-CG1 3.34Å; W456-I462 HydrophobicContact CH2-CD1 4.23Å; W456-I462 HydrophobicContact CH2-CG1 4.49Å; W456-I462 HydrophobicContact CZ3-CD1 3.66Å; W456-I462 HydrophobicContact CZ3-CG1 3.49Å; W456-I462 VanDerWaalsContact CZ3-CG1 3.49Å; I462-D464 HydrophobicContact CG2-CB 3.79Å; I462-F469 HydrophobicContact CG2-CD1 4.15Å; I462-V471 HydrophobicContact CD1-CB 4.14Å; I462-V471 HydrophobicContact CD1-CG1 3.89Å; I462-D473 HydrophobicContact CD1-CB 4.26Å; I462-Y495 HydrophobicContact CD1-CD1 4.18Å; I462-Y495 HydrophobicContact CD1-CE1 4.21Å
463	V	80.5	Confident	84.7	Confident	84 Å²	84	46.2 Å²	46.2	51%	0.509	21%	0.213	S	C	.	.			trans	-127.5	74.9	173.9	-173.1	0	0	0	0	107.5	V461	V461-V463 HydrophobicContact CG1-CG2 3.78Å
464	D	81.9	Confident	84	Confident	38 Å²	38	49.3 Å²	49.3	20%	0.203	23%	0.23	C	C	.	.			trans	-123.7	100.2	-173.4	-179.2	9.5	0	0	0	110.1	M452 I462 H466 R467 E468 F469 R498	M452-D464 HydrophobicContact SD-CB 4.48Å; I462-D464 HydrophobicContact CG2-CB 3.79Å; D464-H466 PolarHBondContact OD1-N 3.28Å; D464-R467 VanDerWaalsContact OD1-CA 3.27Å; D464-R467 WeakPolarHBondContact OD1-CA 3.28Å; D464-R467 PolarHBondContact OD1-N 2.96Å; D464-R467 VanDerWaalsContact OD2-C 3.31Å; D464-R467 WeakPolarHBondContact OD2-CA 3.28Å; D464-E468 PolarHBondContact OD1-N 3.23Å; D464-E468 PolarHBondContact OD2-N 3.19Å; D464-E468 VanDerWaalsContact OD2-N 3.15Å; D464-F469 HydrophobicContact CB-CB 4.1Å; D464-F469 WeakPolarHBondContact OD2-CB 3.36Å; D464-F469 PolarHBondContact OD2-N 3.09Å; D464-R498 IonicContact OD2-NH1 2.71Å; D464-R498 PolarHBondContact OD2-NH1 3.32Å
465	R	79.5	Confident	83	Confident	203 Å²	203	53.7 Å²	53.7	77%	0.766	25%	0.25	S	C	*	.	S	Bend	trans	-84.1	-25.5	178.6	-179.6	173.1	-179.7	163	-0.5	112.7
466	H	77.2	Confident	81.4	Confident	91 Å²	91	54.9 Å²	54.9	42%	0.421	26%	0.26	S	S	.	.	S	Bend	trans	-110.3	-4.9	-167.1	-69.6	-91.2	0	0	0	113.4	D464 E468	D464-H466 PolarHBondContact OD1-N 3.28Å; H466-E468 HydrophobicContact CB-CG 3.88Å; H466-E468 WeakPolarHBondContact CB-OE1 3.49Å; H466-E468 IonicContact CD2-OE1 3.11Å; H466-E468 IonicContact CG-OE1 2.63Å
467	R	81.5	Confident	79.5	Confident	179 Å²	179	61.8 Å²	61.8	68%	0.675	30%	0.296	S	S	*	.	S	Bend	trans	73.2	33.9	-178.2	-56.7	-179.1	173.8	-173.1	-3.4	114	D464 R498	D464-R467 VanDerWaalsContact OD1-CA 3.27Å; D464-R467 WeakPolarHBondContact OD1-CA 3.28Å; D464-R467 PolarHBondContact OD1-N 2.96Å; D464-R467 VanDerWaalsContact OD2-C 3.31Å; D464-R467 WeakPolarHBondContact OD2-CA 3.28Å; R467-R498 VanDerWaalsContact C-NH1 3.3Å; R467-R498 PolarHBondContact O-NH1 2.98Å; R467-R498 VanDerWaalsContact O-NH1 3.07Å
468	E	82.7	Confident	77.3	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	31%	0.313	C	S	.	.			trans	-87.3	-20.8	-177.2	-63.5	171.9	-135.4	0	0	113.5	G348 Q349 V350 D414 M452 D464 H466	G348-E468 WeakPolarHBondContact CA-OE1 3.47Å; Q349-E468 WeakPolarHBondContact CB-OE2 3.31Å; Q349-E468 VanDerWaalsContact N-CD 3.28Å; Q349-E468 PolarHBondContact N-OE1 3.05Å; Q349-E468 PolarHBondContact N-OE2 2.88Å; V350-E468 PolarHBondContact N-OE2 3.09Å; D414-E468 HydrophobicContact CB-CB 4.3Å; D414-E468 HydrophobicContact CB-CG 3.95Å; M452-E468 HydrophobicContact CE-CB 4.18Å; D464-E468 PolarHBondContact OD1-N 3.23Å; D464-E468 PolarHBondContact OD2-N 3.19Å; D464-E468 VanDerWaalsContact OD2-N 3.15Å; H466-E468 HydrophobicContact CB-CG 3.88Å; H466-E468 WeakPolarHBondContact CB-OE1 3.49Å; H466-E468 IonicContact CD2-OE1 3.11Å; H466-E468 IonicContact CG-OE1 2.63Å
469	F	86.6	Confident	75.5	Confident	1 Å²	1	75.7 Å²	75.7	0%	0.004	35%	0.35	C	S	.	.	S	Bend	trans	-82.6	146.4	-172	-168.2	-122.1	0	0	0	112.2	M452 L453 W456 I462 D464 V471 R498	M452-F469 HydrophobicContact CB-CD2 3.97Å; M452-F469 HydrophobicContact CB-CE2 4.3Å; M452-F469 HydrophobicContact SD-CB 4.46Å; L453-F469 HydrophobicContact CB-CE2 4.05Å; L453-F469 HydrophobicContact CD1-CE2 4.07Å; L453-F469 HydrophobicContact CD1-CZ 4.05Å; W456-F469 HydrophobicContact CB-CE1 3.91Å; W456-F469 HydrophobicContact CB-CZ 3.73Å; W456-F469 AromaticContact CD1-CZ 3.98Å; W456-F469 HydrophobicContact CD2-CE1 4.27Å; W456-F469 AromaticContact CG-CE1 3.83Å; W456-F469 HydrophobicContact CG-CE1 3.83Å; W456-F469 AromaticContact CG-CZ 3.88Å; W456-F469 HydrophobicContact CG-CZ 3.88Å; I462-F469 HydrophobicContact CG2-CD1 4.15Å; D464-F469 HydrophobicContact CB-CB 4.1Å; D464-F469 WeakPolarHBondContact OD2-CB 3.36Å; D464-F469 PolarHBondContact OD2-N 3.09Å; F469-V471 HydrophobicContact CD1-CB 3.86Å; F469-V471 HydrophobicContact CD1-CG2 4.31Å; F469-V471 HydrophobicContact CE1-CB 3.69Å; F469-V471 HydrophobicContact CE1-CG2 3.73Å; F469-V471 HydrophobicContact CZ-CG2 4.39Å; F469-V471 PolarHBondContact O-N 3.48Å; F469-R498 PolarHBondContact O-NH1 2.87Å
470	L	87.6	Confident	73.6	Confident	1 Å²	1	78.9 Å²	78.9	1%	0.005	37%	0.372	C	S	.	.	S	Bend	trans	-63.4	-23.3	-178.8	72	98.7	0	0	0	114.4	Y449 L453 L497 R498 I502 L506 I513	Y449-L470 WeakPolarHBondContact OH-CB 3.35Å; Y449-L470 VanDerWaalsContact OH-CD2 3.3Å; Y449-L470 WeakPolarHBondContact OH-CD2 3.25Å; L453-L470 HydrophobicContact CD1-CD2 4.43Å; L470-L497 HydrophobicContact CD1-CD2 3.42Å; L470-L497 VanDerWaalsContact CD1-CD2 3.42Å; L470-L497 CarbonylContact O-C 3.6Å; L470-L497 WeakPolarHBondContact O-CA 3.3Å; L470-R498 PolarHBondContact O-N 3.17Å; L470-I502 HydrophobicContact CB-CG1 4.29Å; L470-L506 HydrophobicContact CD2-CD1 4.37Å; L470-I513 HydrophobicContact CD1-CG2 4.24Å; L470-I513 HydrophobicContact CD2-CG2 4.3Å
471	V	88.1	Confident	71.7	Confident	0 Å²	0	85.9 Å²	85.9	0%	0	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	131.9	177.4	-172.5	0	0	0	0	110.2	W456 I462 F469 Y495 L514	W456-V471 HydrophobicContact CH2-CG1 4.1Å; W456-V471 HydrophobicContact CZ2-CB 4.46Å; W456-V471 HydrophobicContact CZ2-CG1 3.86Å; W456-V471 HydrophobicContact CZ2-CG2 4.21Å; I462-V471 HydrophobicContact CD1-CB 4.14Å; I462-V471 HydrophobicContact CD1-CG1 3.89Å; F469-V471 HydrophobicContact CD1-CB 3.86Å; F469-V471 HydrophobicContact CD1-CG2 4.31Å; F469-V471 HydrophobicContact CE1-CB 3.69Å; F469-V471 HydrophobicContact CE1-CG2 3.73Å; F469-V471 HydrophobicContact CZ-CG2 4.39Å; F469-V471 PolarHBondContact O-N 3.48Å; V471-Y495 HydrophobicContact CG1-CD1 4.04Å; V471-Y495 HydrophobicContact CG1-CG 4.44Å; V471-L514 HydrophobicContact CB-CD1 4.45Å; V471-L514 HydrophobicContact CG1-CD1 3.67Å; V471-L514 HydrophobicContact CG2-CD1 3.97Å
472	V	85.7	Confident	69.8	Low	24 Å²	24	87.2 Å²	87.2	15%	0.145	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	139.8	168.4	-159.1	0	0	0	0	109.6	N474 Y495 T496 R498	V472-N474 VanDerWaalsContact CG1-OD1 3.26Å; V472-N474 WeakPolarHBondContact CG1-OD1 3.47Å; V472-Y495 WeakPolarHBondContact O-CA 3.36Å; V472-T496 PolarHBondContact N-O 3.45Å; V472-R498 HydrophobicContact CG2-CG 3.47Å; V472-R498 VanDerWaalsContact CG2-CG 3.47Å
473	D	82.4	Confident	67.9	Low	48 Å²	48	89 Å²	89	26%	0.257	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	99.6	153.4	-157.9	-23.5	0	0	0	107.2	I462 E475 R494 Y495	I462-D473 HydrophobicContact CD1-CB 4.26Å; D473-E475 HydrophobicContact CB-CG 4.48Å; D473-E475 PolarHBondContact O-N 3.17Å; D473-R494 WeakPolarHBondContact OD1-CG 3.08Å; D473-R494 IonicContact OD1-CZ 3.78Å; D473-R494 IonicContact OD1-NE 2.66Å; D473-R494 PolarHBondContact OD1-NE 3.18Å; D473-R494 IonicContact OD1-NH2 3.02Å; D473-R494 PolarHBondContact OD1-NH2 2.96Å; D473-R494 IonicContact OD2-CZ 2.78Å; D473-R494 IonicContact OD2-NE 3.21Å; D473-R494 PolarHBondContact OD2-NE 2.89Å; D473-R494 IonicContact OD2-NH2 2.69Å; D473-R494 PolarHBondContact OD2-NH2 3.44Å; D473-Y495 HydrophobicContact CB-CD1 4.2Å; D473-Y495 HydrophobicContact CB-CE1 3.82Å; D473-Y495 WeakPolarHBondContact OD2-CE1 3.19Å; D473-Y495 PolarHBondContact OD2-OH 2.64Å; D473-Y495 VanDerWaalsContact OD2-OH 3.14Å
474	N	75	Confident	66.5	Low	64 Å²	64	93.8 Å²	93.8	34%	0.342	44%	0.44	S	S	.	.			trans	-75.3	78.5	165.2	-57.1	-41	0	0	0	106.7	V472 V476 R493 R494 T496	V472-N474 VanDerWaalsContact CG1-OD1 3.26Å; V472-N474 WeakPolarHBondContact CG1-OD1 3.47Å; N474-V476 VanDerWaalsContact C-N 3.35Å; N474-V476 PolarHBondContact O-N 3.09Å; N474-R493 PolarHBondContact ND2-O 2.81Å; N474-R494 WeakPolarHBondContact CB-O 3.36Å; N474-R494 PolarHBondContact N-O 2.72Å; N474-T496 WeakPolarHBondContact ND2-CG2 3.32Å; N474-T496 PolarHBondContact ND2-OG1 3.08Å
475	E	65.9	Low	64.8	Low	139 Å²	139	98.6 Å²	98.6	65%	0.65	46%	0.461	S	S	*	.			trans	-59.7	99.9	171.2	-69.6	-164.8	151.8	0	0	108.3	D473 I477	D473-E475 HydrophobicContact CB-CG 4.48Å; D473-E475 PolarHBondContact O-N 3.17Å; E475-I477 WeakPolarHBondContact O-CG1 3.34Å; E475-I477 PolarHBondContact O-N 3.36Å
476	V	54.5	Low	63.3	Low	78 Å²	78	94 Å²	94	47%	0.473	45%	0.445	S	S	.	.			trans	-63.3	112.6	175.2	-176.8	0	0	0	0	106.9	N474 H478	N474-V476 VanDerWaalsContact C-N 3.35Å; N474-V476 PolarHBondContact O-N 3.09Å; V476-H478 PolarHBondContact O-N 3.45Å
477	I	50	Low	62.3	Low	145 Å²	145	91.6 Å²	91.6	74%	0.744	44%	0.438	S	S	*	.	S	Bend	trans	-68	-13.8	-147.2	-64.3	179.6	0	0	0	114.1	E475	E475-I477 WeakPolarHBondContact O-CG1 3.34Å; E475-I477 PolarHBondContact O-N 3.36Å
478	H	41.8	Very low	61	Low	86 Å²	86	83.9 Å²	83.9	40%	0.398	41%	0.41	S	S	.	.			trans	-127.5	109.8	-175.8	-62.3	-61.9	0	0	0	112.7	V476 D480 E481	V476-H478 PolarHBondContact O-N 3.45Å; H478-D480 PolarHBondContact O-N 3.11Å; H478-E481 HydrophobicContact CB-CB 3.79Å; H478-E481 HydrophobicContact CB-CG 3.61Å; H478-E481 IonicContact CD2-OE2 3.69Å; H478-E481 PolarHBondContact CD2-OE2 3.44Å; H478-E481 VanDerWaalsContact CD2-OE2 3.27Å; H478-E481 IonicContact CG-OE2 3.15Å; H478-E481 PolarHBondContact O-N 2.98Å
479	R	47.2	Very low	59.7	Low	230 Å²	230	85.6 Å²	85.6	87%	0.868	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-27	162.1	-91.7	-173	173.5	-173.3	-2.2	112.6
480	D	41.4	Very low	58.7	Low	157 Å²	157	88.2 Å²	88.2	84%	0.84	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-6.5	-173	-48.9	-41.4	0	0	0	113.4	H478	H478-D480 PolarHBondContact O-N 3.11Å
481	E	45.4	Very low	57.7	Low	150 Å²	150	89.3 Å²	89.3	70%	0.701	43%	0.434	S	S	*	.	S	Bend	trans	-103.4	-2.4	173.9	-66.9	-174.6	153	0	0	113.3	H478 P483	H478-E481 HydrophobicContact CB-CB 3.79Å; H478-E481 HydrophobicContact CB-CG 3.61Å; H478-E481 IonicContact CD2-OE2 3.69Å; H478-E481 PolarHBondContact CD2-OE2 3.44Å; H478-E481 VanDerWaalsContact CD2-OE2 3.27Å; H478-E481 IonicContact CG-OE2 3.15Å; H478-E481 PolarHBondContact O-N 2.98Å; E481-P483 VanDerWaalsContact O-CD 3.26Å; E481-P483 WeakPolarHBondContact O-CD 3.42Å
482	L	45	Very low	56.8	Low	68 Å²	68	96 Å²	96	36%	0.356	47%	0.465	S	S	.	.			trans	-79.4	114.7	177.9	-82.2	154.1	0	0	0	110.3	Y490	L482-Y490 HydrophobicContact CD1-CE2 4.47Å; L482-Y490 HydrophobicContact CD2-CD2 4.26Å
483	P	45.4	Very low	56.1	Low	81 Å²	81	101.6 Å²	101.6	53%	0.526	48%	0.484	S	S	.	.			trans	-66.1	147.7	165.7	-12.7	29.9	0	0	0	109.1	E481 H485 Y486	E481-P483 VanDerWaalsContact O-CD 3.26Å; E481-P483 WeakPolarHBondContact O-CD 3.42Å; P483-H485 PolarHBondContact O-N 2.94Å; P483-Y486 PolarHBondContact O-N 3.31Å
484	E	51.3	Low	55.9	Low	186 Å²	186	100.8 Å²	100.8	87%	0.869	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-9.2	-176.5	-63.8	174.3	146.3	0	0	114.3
485	H	47	Very low	56.3	Low	139 Å²	139	98 Å²	98	64%	0.644	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	12	-171.1	-52.8	-47	0	0	0	115.5	P483	P483-H485 PolarHBondContact O-N 2.94Å
486	Y	48.5	Very low	57.3	Low	107 Å²	107	93.9 Å²	93.9	42%	0.42	45%	0.446	S	S	.	.			trans	-109.7	25.8	-171.3	-121.6	-99.2	0	0	0	115.7	P483 D488 D489 Y490	P483-Y486 PolarHBondContact O-N 3.31Å; Y486-D488 VanDerWaalsContact C-N 3.27Å; Y486-D488 PolarHBondContact O-N 3.22Å; Y486-D488 VanDerWaalsContact O-N 3.17Å; Y486-D489 HydrophobicContact CD1-CB 3.52Å; Y486-D489 HydrophobicContact CE1-CB 3.37Å; Y486-Y490 WeakPolarHBondContact O-CB 3.35Å; Y486-Y490 PolarHBondContact O-N 3.09Å
487	S	56	Low	58.8	Low	40 Å²	40	92.6 Å²	92.6	28%	0.28	44%	0.436	S	S	.	.	H	α-helix	trans	-58.9	-29.2	-172.4	54.5	0	0	0	0	115.6	W491	S487-W491 VanDerWaalsContact O-CD1 3.24Å
488	D	52.6	Low	60.5	Low	17 Å²	17	88.4 Å²	88.4	9%	0.091	41%	0.411	C	S	.	.	H	α-helix	trans	-89.3	-55.4	-166.3	-47	-29.3	0	0	0	110.3	Y486 Y490 W491 E492 N688 H689	Y486-D488 VanDerWaalsContact C-N 3.27Å; Y486-D488 PolarHBondContact O-N 3.22Å; Y486-D488 VanDerWaalsContact O-N 3.17Å; D488-Y490 PolarHBondContact O-N 2.9Å; D488-Y490 VanDerWaalsContact O-N 3.15Å; D488-W491 PolarHBondContact O-N 2.93Å; D488-E492 PolarHBondContact O-N 2.85Å; D488-N688 PolarHBondContact OD1-ND2 2.93Å; D488-N688 WeakPolarHBondContact OD2-CA 3.28Å; D488-N688 WeakPolarHBondContact OD2-CB 3.36Å; D488-N688 PolarHBondContact OD2-ND2 2.77Å; D488-H689 IonicContact OD2-CE1 3.27Å; D488-H689 IonicContact OD2-CG 3.19Å; D488-H689 PolarHBondContact OD2-N 2.91Å; D488-H689 IonicContact OD2-ND1 3.81Å; D488-H689 PolarHBondContact OD2-ND1 2.97Å
489	D	57.4	Low	62.4	Low	36 Å²	36	90.5 Å²	90.5	19%	0.193	43%	0.425	C	S	.	.	H	α-helix	trans	-54.4	-30.2	170.2	-87.5	54.7	0	0	0	112.3	Y486 R493	Y486-D489 HydrophobicContact CD1-CB 3.52Å; Y486-D489 HydrophobicContact CE1-CB 3.37Å; D489-R493 WeakPolarHBondContact O-CB 3.26Å; D489-R493 WeakPolarHBondContact O-CG 3.32Å; D489-R493 PolarHBondContact O-N 3.47Å; D489-R493 IonicContact OD2-CZ 3.82Å; D489-R493 IonicContact OD2-NE 3.51Å; D489-R493 PolarHBondContact OD2-NE 3.09Å; D489-R493 IonicContact OD2-NH2 3.85Å; D489-R493 PolarHBondContact OD2-NH2 3.29Å
490	Y	63.6	Low	63.9	Low	56 Å²	56	87 Å²	87	22%	0.22	42%	0.419	C	S	.	.	H	α-helix	trans	-57.2	-50.9	172.9	179.4	-98.5	0	0	0	111.9	L482 Y486 D488 R494	L482-Y490 HydrophobicContact CD1-CE2 4.47Å; L482-Y490 HydrophobicContact CD2-CD2 4.26Å; Y486-Y490 WeakPolarHBondContact O-CB 3.35Å; Y486-Y490 PolarHBondContact O-N 3.09Å; D488-Y490 PolarHBondContact O-N 2.9Å; D488-Y490 VanDerWaalsContact O-N 3.15Å; Y490-R494 WeakPolarHBondContact O-CA 3.41Å; Y490-R494 WeakPolarHBondContact O-CB 3.48Å; Y490-R494 PolarHBondContact O-N 3.19Å; Y490-R494 PolarHBondContact OH-NH1 3.37Å
491	W	67.1	Low	65.8	Low	24 Å²	24	80.4 Å²	80.4	9%	0.091	38%	0.383	C	S	.	.	H	α-helix	trans	-77.1	-25.1	-178	-70.6	104.6	0	0	0	113.7	S487 D488 Y495 K518 N521 V522 Q525	S487-W491 VanDerWaalsContact O-CD1 3.24Å; D488-W491 PolarHBondContact O-N 2.93Å; W491-Y495 HydrophobicContact CE3-CD2 4.37Å; W491-Y495 HydrophobicContact CE3-CE2 4.03Å; W491-Y495 AromaticContact CZ3-CE2 3.86Å; W491-Y495 HydrophobicContact CZ3-CE2 3.86Å; W491-K518 VanDerWaalsContact O-CE 3.24Å; W491-K518 WeakPolarHBondContact O-CE 3.43Å; W491-K518 PolarHBondContact O-NZ 3.16Å; W491-N521 HydrophobicContact CH2-CB 4.38Å; W491-N521 HydrophobicContact CZ3-CB 4.07Å; W491-V522 HydrophobicContact CD2-CG2 4.27Å; W491-V522 HydrophobicContact CE3-CG2 4.22Å; W491-V522 HydrophobicContact CH2-CB 4.43Å; W491-V522 HydrophobicContact CH2-CG2 3.68Å; W491-V522 HydrophobicContact CZ2-CG2 3.77Å; W491-V522 HydrophobicContact CZ3-CG2 3.92Å; W491-Q525 VanDerWaalsContact CZ2-OE1 3.27Å
492	E	70.1	Confident	67.7	Low	142 Å²	142	74.5 Å²	74.5	66%	0.664	36%	0.356	S	S	*	.	H	α-helix	trans	-70.6	-49.4	171	-68	-162.6	166.8	0	0	111.5	D488 K518	D488-E492 PolarHBondContact O-N 2.85Å; E492-K518 PolarHBondContact O-NZ 3.14Å
493	R	71.6	Confident	69.6	Low	141 Å²	141	71.3 Å²	71.3	53%	0.532	34%	0.339	S	S	.	.	H	α-helix	trans	-81.5	-27.1	-175.2	-59.7	174.4	-171.9	-154.3	4.8	114	N474 D489	N474-R493 PolarHBondContact ND2-O 2.81Å; D489-R493 WeakPolarHBondContact O-CB 3.26Å; D489-R493 WeakPolarHBondContact O-CG 3.32Å; D489-R493 PolarHBondContact O-N 3.47Å; D489-R493 IonicContact OD2-CZ 3.82Å; D489-R493 IonicContact OD2-NE 3.51Å; D489-R493 PolarHBondContact OD2-NE 3.09Å; D489-R493 IonicContact OD2-NH2 3.85Å; D489-R493 PolarHBondContact OD2-NH2 3.29Å
494	R	76.8	Confident	71.4	Confident	31 Å²	31	69.6 Å²	69.6	12%	0.117	33%	0.329	C	S	.	.	H	α-helix	trans	-64.5	-48.1	-179.8	179.2	174.9	-179.7	174.9	-1.4	112.5	D473 N474 Y490	D473-R494 WeakPolarHBondContact OD1-CG 3.08Å; D473-R494 IonicContact OD1-CZ 3.78Å; D473-R494 IonicContact OD1-NE 2.66Å; D473-R494 PolarHBondContact OD1-NE 3.18Å; D473-R494 IonicContact OD1-NH2 3.02Å; D473-R494 PolarHBondContact OD1-NH2 2.96Å; D473-R494 IonicContact OD2-CZ 2.78Å; D473-R494 IonicContact OD2-NE 3.21Å; D473-R494 PolarHBondContact OD2-NE 2.89Å; D473-R494 IonicContact OD2-NH2 2.69Å; D473-R494 PolarHBondContact OD2-NH2 3.44Å; N474-R494 WeakPolarHBondContact CB-O 3.36Å; N474-R494 PolarHBondContact N-O 2.72Å; Y490-R494 WeakPolarHBondContact O-CA 3.41Å; Y490-R494 WeakPolarHBondContact O-CB 3.48Å; Y490-R494 PolarHBondContact O-N 3.19Å; Y490-R494 PolarHBondContact OH-NH1 3.37Å
495	Y	84.6	Confident	72.9	Confident	6 Å²	6	62 Å²	62	2%	0.024	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	108.2	176.2	-50.6	-83.5	0	0	0	111.3	W456 I462 V471 V472 D473 W491 K518 N521	W456-Y495 AromaticContact CH2-CD1 3.59Å; W456-Y495 HydrophobicContact CH2-CD1 3.59Å; W456-Y495 AromaticContact CH2-CE1 3.74Å; W456-Y495 HydrophobicContact CH2-CE1 3.74Å; W456-Y495 HydrophobicContact CH2-CG 4.01Å; W456-Y495 HydrophobicContact CZ3-CD1 4.18Å; W456-Y495 AromaticContact CZ3-CE1 3.95Å; W456-Y495 HydrophobicContact CZ3-CE1 3.95Å; I462-Y495 HydrophobicContact CD1-CD1 4.18Å; I462-Y495 HydrophobicContact CD1-CE1 4.21Å; V471-Y495 HydrophobicContact CG1-CD1 4.04Å; V471-Y495 HydrophobicContact CG1-CG 4.44Å; V472-Y495 WeakPolarHBondContact O-CA 3.36Å; D473-Y495 HydrophobicContact CB-CD1 4.2Å; D473-Y495 HydrophobicContact CB-CE1 3.82Å; D473-Y495 WeakPolarHBondContact OD2-CE1 3.19Å; D473-Y495 PolarHBondContact OD2-OH 2.64Å; D473-Y495 VanDerWaalsContact OD2-OH 3.14Å; W491-Y495 HydrophobicContact CE3-CD2 4.37Å; W491-Y495 HydrophobicContact CE3-CE2 4.03Å; W491-Y495 AromaticContact CZ3-CE2 3.86Å; W491-Y495 HydrophobicContact CZ3-CE2 3.86Å; Y495-K518 HydrophobicContact CD2-CG 4Å; Y495-K518 HydrophobicContact CG-CG 4.45Å; Y495-K518 WeakPolarHBondContact O-CE 3.28Å; Y495-K518 PolarHBondContact O-NZ 3.04Å; Y495-N521 PolarHBondContact OH-ND2 3.2Å
496	T	85.3	Confident	74.7	Confident	52 Å²	52	55.4 Å²	55.4	32%	0.319	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	152.9	178.2	56.2	0	0	0	0	110.8	V472 N474	V472-T496 PolarHBondContact N-O 3.45Å; N474-T496 WeakPolarHBondContact ND2-CG2 3.32Å; N474-T496 PolarHBondContact ND2-OG1 3.08Å
497	L	87.4	Confident	76.5	Confident	50 Å²	50	52.7 Å²	52.7	26%	0.262	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	146.1	170.3	-66.1	173.9	0	0	0	110.6	L470 L514	L470-L497 HydrophobicContact CD1-CD2 3.42Å; L470-L497 VanDerWaalsContact CD1-CD2 3.42Å; L470-L497 CarbonylContact O-C 3.6Å; L470-L497 WeakPolarHBondContact O-CA 3.3Å; L497-L514 HydrophobicContact CD2-CB 4.15Å; L497-L514 HydrophobicContact CD2-CD1 4.39Å; L497-L514 HydrophobicContact CD2-CD2 4.48Å; L497-L514 HydrophobicContact CG-CD2 4.15Å
498	R	85.5	Confident	78.1	Confident	57 Å²	57	59.2 Å²	59.2	22%	0.215	29%	0.286	C	S	.	.			trans	-100.8	100.8	162.7	-68	-177.7	-175.2	124.8	2.6	108.4	D464 R467 F469 L470 V472 E500 Q501 I502	D464-R498 IonicContact OD2-NH1 2.71Å; D464-R498 PolarHBondContact OD2-NH1 3.32Å; R467-R498 VanDerWaalsContact C-NH1 3.3Å; R467-R498 PolarHBondContact O-NH1 2.98Å; R467-R498 VanDerWaalsContact O-NH1 3.07Å; F469-R498 PolarHBondContact O-NH1 2.87Å; L470-R498 PolarHBondContact O-N 3.17Å; V472-R498 HydrophobicContact CG2-CG 3.47Å; V472-R498 VanDerWaalsContact CG2-CG 3.47Å; R498-E500 PolarHBondContact O-N 3.06Å; R498-Q501 HydrophobicContact CB-CB 3.96Å; R498-Q501 HydrophobicContact CB-CG 4.28Å; R498-Q501 CarbonylContact O-C 3.57Å; R498-Q501 PolarHBondContact O-N 2.9Å; R498-I502 WeakPolarHBondContact O-CG1 3.4Å
499	D	81.3	Confident	79.8	Confident	130 Å²	130	60.8 Å²	60.8	70%	0.695	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-58.7	-34.5	-175.6	-63.7	-35.8	0	0	0	113.2	Q501 I502	D499-Q501 PolarHBondContact O-N 3.13Å; D499-I502 PolarHBondContact O-N 2.78Å
500	E	78.2	Confident	81.3	Confident	158 Å²	158	60 Å²	60	74%	0.738	29%	0.288	S	S	*	.	G	3₁₀ helix	trans	-62.5	-26.3	173.8	-62.1	172.9	179.1	0	0	113.6	R498	R498-E500 PolarHBondContact O-N 3.06Å
501	Q	81.4	Confident	82.5	Confident	18 Å²	18	60.9 Å²	60.9	8%	0.084	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-106.9	25.4	-176.3	-62.4	-64.6	-37.1	0	0	112.7	A415 Y449 R498 D499 P503	A415-Q501 HydrophobicContact CB-CB 4.25Å; A415-Q501 WeakPolarHBondContact CB-O 3.47Å; Y449-Q501 PolarHBondContact OH-O 2.85Å; R498-Q501 HydrophobicContact CB-CB 3.96Å; R498-Q501 HydrophobicContact CB-CG 4.28Å; R498-Q501 CarbonylContact O-C 3.57Å; R498-Q501 PolarHBondContact O-N 2.9Å; D499-Q501 PolarHBondContact O-N 3.13Å; Q501-P503 WeakPolarHBondContact O-CD 3.39Å
502	I	85	Confident	83.5	Confident	26 Å²	26	62.5 Å²	62.5	13%	0.133	30%	0.304	C	S	.	.			trans	-99.8	111	174.6	-60.5	177.2	0	0	0	109.6	L470 R498 D499 S504 A507	L470-I502 HydrophobicContact CB-CG1 4.29Å; R498-I502 WeakPolarHBondContact O-CG1 3.4Å; D499-I502 PolarHBondContact O-N 2.78Å; I502-S504 PolarHBondContact O-N 2.71Å; I502-A507 HydrophobicContact CG2-CB 3.97Å
503	P	84.9	Confident	84.5	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.273	C	S	.	.			trans	-59.5	136.2	172.1	-23.2	33.3	0	0	0	111.2	A415 L418 T419 Y449 Q501 F505 L506 A507	A415-P503 HydrophobicContact CB-CG 4.07Å; L418-P503 HydrophobicContact CD1-CG 4.46Å; T419-P503 WeakPolarHBondContact OG1-CA 3.41Å; Y449-P503 HydrophobicContact CE1-CG 3.89Å; Y449-P503 HydrophobicContact CE2-CG 4.2Å; Y449-P503 VanDerWaalsContact OH-CD 3.23Å; Y449-P503 WeakPolarHBondContact OH-CD 3.39Å; Q501-P503 WeakPolarHBondContact O-CD 3.39Å; P503-F505 HydrophobicContact CB-CD1 3.77Å; P503-F505 HydrophobicContact CB-CE1 3.34Å; P503-F505 HydrophobicContact CB-CE2 4.47Å; P503-F505 HydrophobicContact CB-CG 4.49Å; P503-F505 HydrophobicContact CB-CZ 3.74Å; P503-F505 HydrophobicContact CG-CE1 4.31Å; P503-F505 HydrophobicContact CG-CZ 4.32Å; P503-F505 PolarHBondContact O-N 3.47Å; P503-L506 HydrophobicContact CG-CD1 4.36Å; P503-L506 PolarHBondContact O-N 3.06Å; P503-A507 PolarHBondContact O-N 2.92Å
504	S	84.2	Confident	85.4	Confident	46 Å²	46	49.9 Å²	49.9	32%	0.322	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-28.9	-173.4	62.3	0	0	0	0	114.7	T419 I502	T419-S504 PolarHBondContact OG1-N 3.26Å; I502-S504 PolarHBondContact O-N 2.71Å
505	F	83.1	Confident	85.9	Confident	25 Å²	25	51.4 Å²	51.4	11%	0.11	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-21.8	176	64	-92.6	0	0	0	114	L418 H422 M450 P503 F540	L418-F505 HydrophobicContact CB-CE1 4.33Å; H422-F505 HydrophobicContact CB-CD1 4.5Å; M450-F505 HydrophobicContact CE-CE2 3.55Å; M450-F505 HydrophobicContact CE-CZ 3.63Å; P503-F505 HydrophobicContact CB-CD1 3.77Å; P503-F505 HydrophobicContact CB-CE1 3.34Å; P503-F505 HydrophobicContact CB-CE2 4.47Å; P503-F505 HydrophobicContact CB-CG 4.49Å; P503-F505 HydrophobicContact CB-CZ 3.74Å; P503-F505 HydrophobicContact CG-CE1 4.31Å; P503-F505 HydrophobicContact CG-CZ 4.32Å; P503-F505 PolarHBondContact O-N 3.47Å; F505-F540 HydrophobicContact CD1-CE2 4.07Å; F505-F540 HydrophobicContact CD1-CZ 4.29Å; F505-F540 HydrophobicContact CD2-CD2 4.05Å; F505-F540 AromaticContact CD2-CE2 3.47Å; F505-F540 HydrophobicContact CD2-CE2 3.47Å; F505-F540 VanDerWaalsContact CD2-CE2 3.47Å; F505-F540 HydrophobicContact CD2-CZ 4.43Å; F505-F540 HydrophobicContact CE1-CE2 4.03Å; F505-F540 HydrophobicContact CE1-CZ 4.3Å; F505-F540 AromaticContact CE2-CD2 3.59Å; F505-F540 HydrophobicContact CE2-CD2 3.59Å; F505-F540 AromaticContact CE2-CE2 3.43Å; F505-F540 HydrophobicContact CE2-CE2 3.43Å; F505-F540 VanDerWaalsContact CE2-CE2 3.43Å; F505-F540 HydrophobicContact CE2-CZ 4.43Å; F505-F540 AromaticContact CG-CE2 3.81Å; F505-F540 HydrophobicContact CG-CE2 3.81Å; F505-F540 HydrophobicContact CG-CZ 4.36Å; F505-F540 AromaticContact CZ-CD2 3.94Å; F505-F540 HydrophobicContact CZ-CD2 3.94Å; F505-F540 AromaticContact CZ-CE2 3.74Å; F505-F540 HydrophobicContact CZ-CE2 3.74Å; F505-F540 HydrophobicContact CZ-CZ 4.38Å
506	L	85.1	Confident	86.2	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.5	-12.2	175.1	-64.1	-179.9	0	0	0	113.8	Y449 L453 L470 P503 K508 Y509 S510 I513 I551	Y449-L506 HydrophobicContact CE1-CD1 3.69Å; L453-L506 HydrophobicContact CD2-CD1 3.78Å; L453-L506 HydrophobicContact CD2-CD2 4.38Å; L470-L506 HydrophobicContact CD2-CD1 4.37Å; P503-L506 HydrophobicContact CG-CD1 4.36Å; P503-L506 PolarHBondContact O-N 3.06Å; L506-K508 PolarHBondContact O-N 3.04Å; L506-Y509 CarbonylContact O-C 3.58Å; L506-Y509 PolarHBondContact O-N 3.2Å; L506-S510 PolarHBondContact O-N 3.33Å; L506-S510 VanDerWaalsContact O-N 3.11Å; L506-I513 HydrophobicContact CB-CD1 4.49Å; L506-I513 HydrophobicContact CD2-CD1 4.34Å; L506-I551 HydrophobicContact CD2-CD1 3.95Å
507	A	85.8	Confident	86.3	Confident	51 Å²	51	48.6 Å²	48.6	42%	0.421	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-34.8	-173.6	0	0	0	0	0	114.4	I502 P503 Y509 S510	I502-A507 HydrophobicContact CG2-CB 3.97Å; P503-A507 PolarHBondContact O-N 2.92Å; A507-Y509 VanDerWaalsContact C-N 3.28Å; A507-Y509 PolarHBondContact O-N 3.4Å; A507-S510 PolarHBondContact O-OG 2.97Å; A507-S510 VanDerWaalsContact O-OG 3.1Å
508	K	88.4	Confident	86.3	Confident	177 Å²	177	48.1 Å²	48.1	77%	0.77	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-20.1	176.6	-63.5	179.5	-177.5	174.4	0	114.5	L506	L506-K508 PolarHBondContact O-N 3.04Å
509	Y	88.3	Confident	86.4	Confident	50 Å²	50	46.3 Å²	46.3	20%	0.196	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.7	2.5	-172.2	-56	-73.2	0	0	0	113	L506 A507 D511 K512 I513 V548	L506-Y509 CarbonylContact O-C 3.58Å; L506-Y509 PolarHBondContact O-N 3.2Å; A507-Y509 VanDerWaalsContact C-N 3.28Å; A507-Y509 PolarHBondContact O-N 3.4Å; Y509-D511 PolarHBondContact O-N 2.96Å; Y509-K512 HydrophobicContact CD1-CD 4.46Å; Y509-K512 WeakPolarHBondContact O-CB 3.47Å; Y509-K512 PolarHBondContact O-N 3.08Å; Y509-K512 VanDerWaalsContact O-N 3.1Å; Y509-I513 VanDerWaalsContact O-CG1 3.31Å; Y509-I513 WeakPolarHBondContact O-CG1 3.31Å; Y509-I513 PolarHBondContact O-N 3.35Å; Y509-V548 HydrophobicContact CD1-CG1 4.41Å; Y509-V548 HydrophobicContact CD2-CG1 4.3Å; Y509-V548 HydrophobicContact CD2-CG2 4.38Å; Y509-V548 HydrophobicContact CE1-CG1 3.75Å; Y509-V548 HydrophobicContact CE2-CB 4.4Å; Y509-V548 HydrophobicContact CE2-CG1 3.63Å; Y509-V548 HydrophobicContact CE2-CG2 3.84Å; Y509-V548 WeakPolarHBondContact OH-CG1 3.31Å
510	S	88.8	Confident	86.6	Confident	19 Å²	19	40.2 Å²	40.2	13%	0.133	20%	0.198	C	C	.	.	H	α-helix	trans	-52.8	-49.2	-178.5	54.8	0	0	0	0	113.3	L506 A507 K512 I513 L514	L506-S510 PolarHBondContact O-N 3.33Å; L506-S510 VanDerWaalsContact O-N 3.11Å; A507-S510 PolarHBondContact O-OG 2.97Å; A507-S510 VanDerWaalsContact O-OG 3.1Å; S510-K512 PolarHBondContact O-N 2.72Å; S510-I513 PolarHBondContact O-N 3.32Å; S510-L514 PolarHBondContact O-N 2.96Å
511	D	88.9	Confident	87	Confident	75 Å²	75	33.3 Å²	33.3	40%	0.401	17%	0.166	S	C	.	.	H	α-helix	trans	-61.5	-41.1	176.3	171.4	76.5	0	0	0	112.2	Y509 L514 R515	Y509-D511 PolarHBondContact O-N 2.96Å; D511-L514 PolarHBondContact O-N 3.47Å; D511-R515 VanDerWaalsContact O-CG 3.3Å; D511-R515 WeakPolarHBondContact O-CG 3.39Å; D511-R515 PolarHBondContact O-N 3.07Å; D511-R515 IonicContact OD1-CZ 2.75Å; D511-R515 IonicContact OD1-NE 3.1Å; D511-R515 PolarHBondContact OD1-NE 2.75Å; D511-R515 IonicContact OD1-NH2 3.46Å; D511-R515 PolarHBondContact OD1-NH2 2.67Å; D511-R515 IonicContact OD2-CZ 3.31Å; D511-R515 IonicContact OD2-NE 3.33Å; D511-R515 PolarHBondContact OD2-NE 3.25Å; D511-R515 IonicContact OD2-NH2 3.49Å; D511-R515 PolarHBondContact OD2-NH2 2.66Å
512	K	89	Confident	87	Confident	58 Å²	58	32.6 Å²	32.6	25%	0.252	16%	0.163	S	C	.	.	H	α-helix	trans	-62.5	-46.8	174.2	-64.1	-162	-175.2	-167.9	0	111.4	Y509 S510 L514 R515 T516 N552 Y555	Y509-K512 HydrophobicContact CD1-CD 4.46Å; Y509-K512 WeakPolarHBondContact O-CB 3.47Å; Y509-K512 PolarHBondContact O-N 3.08Å; Y509-K512 VanDerWaalsContact O-N 3.1Å; S510-K512 PolarHBondContact O-N 2.72Å; K512-L514 VanDerWaalsContact C-N 3.31Å; K512-L514 PolarHBondContact O-N 3.25Å; K512-R515 PolarHBondContact O-N 3.49Å; K512-T516 PolarHBondContact O-N 2.72Å; K512-T516 PolarHBondContact O-OG1 2.68Å; K512-N552 PolarHBondContact NZ-OD1 2.98Å; K512-Y555 HydrophobicContact CB-CD2 4.14Å
513	I	90.6	Very high	86.9	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-59.4	-43.8	179.1	-66.4	163.2	0	0	0	110.5	L453 W456 I457 L470 L506 Y509 S510 G517 I551	L453-I513 HydrophobicContact CD1-CD1 4.18Å; L453-I513 HydrophobicContact CD1-CG1 4.36Å; L453-I513 HydrophobicContact CD1-CG2 3.45Å; L453-I513 VanDerWaalsContact CD1-CG2 3.45Å; W456-I513 PolarHBondContact NE1-O 2.7Å; I457-I513 HydrophobicContact CD1-CG1 4.3Å; I457-I513 HydrophobicContact CD1-CG2 4.44Å; I457-I513 HydrophobicContact CG1-CG2 4.42Å; L470-I513 HydrophobicContact CD1-CG2 4.24Å; L470-I513 HydrophobicContact CD2-CG2 4.3Å; L506-I513 HydrophobicContact CB-CD1 4.49Å; L506-I513 HydrophobicContact CD2-CD1 4.34Å; Y509-I513 VanDerWaalsContact O-CG1 3.31Å; Y509-I513 WeakPolarHBondContact O-CG1 3.31Å; Y509-I513 PolarHBondContact O-N 3.35Å; S510-I513 PolarHBondContact O-N 3.32Å; I513-G517 PolarHBondContact O-N 2.88Å; I513-I551 HydrophobicContact CD1-CD1 4.34Å; I513-I551 HydrophobicContact CD1-CG2 4.47Å; I513-I551 HydrophobicContact CG1-CG2 3.8Å
514	L	90.3	Very high	86.8	Confident	18 Å²	18	36.8 Å²	36.8	9%	0.094	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-51.2	175.2	-177.2	70.1	0	0	0	111.3	V471 L497 S510 D511 K512 T516 G517 K518	V471-L514 HydrophobicContact CB-CD1 4.45Å; V471-L514 HydrophobicContact CG1-CD1 3.67Å; V471-L514 HydrophobicContact CG2-CD1 3.97Å; L497-L514 HydrophobicContact CD2-CB 4.15Å; L497-L514 HydrophobicContact CD2-CD1 4.39Å; L497-L514 HydrophobicContact CD2-CD2 4.48Å; L497-L514 HydrophobicContact CG-CD2 4.15Å; S510-L514 PolarHBondContact O-N 2.96Å; D511-L514 PolarHBondContact O-N 3.47Å; K512-L514 VanDerWaalsContact C-N 3.31Å; K512-L514 PolarHBondContact O-N 3.25Å; L514-T516 PolarHBondContact O-N 3.33Å; L514-G517 PolarHBondContact O-N 2.96Å; L514-K518 HydrophobicContact CG-CD 4.28Å; L514-K518 WeakPolarHBondContact O-CG 3.06Å; L514-K518 PolarHBondContact O-N 3.29Å
515	R	88.4	Confident	86.4	Confident	62 Å²	62	38.8 Å²	38.8	23%	0.234	18%	0.181	C	C	.	.	H	α-helix	trans	-58.5	-45.2	178.7	-71.7	174.2	-162.4	-93.5	-17.9	112.4	D511 K512 G517 K518 Y519 Y555 D777	D511-R515 VanDerWaalsContact O-CG 3.3Å; D511-R515 WeakPolarHBondContact O-CG 3.39Å; D511-R515 PolarHBondContact O-N 3.07Å; D511-R515 IonicContact OD1-CZ 2.75Å; D511-R515 IonicContact OD1-NE 3.1Å; D511-R515 PolarHBondContact OD1-NE 2.75Å; D511-R515 IonicContact OD1-NH2 3.46Å; D511-R515 PolarHBondContact OD1-NH2 2.67Å; D511-R515 IonicContact OD2-CZ 3.31Å; D511-R515 IonicContact OD2-NE 3.33Å; D511-R515 PolarHBondContact OD2-NE 3.25Å; D511-R515 IonicContact OD2-NH2 3.49Å; D511-R515 PolarHBondContact OD2-NH2 2.66Å; K512-R515 PolarHBondContact O-N 3.49Å; R515-G517 PolarHBondContact O-N 3.44Å; R515-K518 WeakPolarHBondContact O-CB 3.07Å; R515-K518 PolarHBondContact O-N 3.38Å; R515-Y519 HydrophobicContact CB-CE2 4.01Å; R515-Y519 WeakPolarHBondContact O-CD2 3.37Å; R515-Y519 PolarHBondContact O-N 3.21Å; R515-Y555 HydrophobicContact CB-CD2 4.43Å; R515-Y555 HydrophobicContact CB-CE2 3.97Å; R515-D777 WeakPolarHBondContact CD-OD2 3.49Å; R515-D777 IonicContact CZ-OD2 2.77Å; R515-D777 IonicContact NE-OD2 3.57Å; R515-D777 IonicContact NH1-OD1 2.94Å; R515-D777 PolarHBondContact NH1-OD1 2.65Å; R515-D777 IonicContact NH1-OD2 3.1Å; R515-D777 PolarHBondContact NH1-OD2 2.65Å
516	T	90.1	Very high	86	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-52.9	-52.7	179.3	-58.2	0	0	0	0	111.3	I457 K512 L514 Y519 L520 Y555 A558	I457-T516 HydrophobicContact CG2-CG2 4.3Å; K512-T516 PolarHBondContact O-N 2.72Å; K512-T516 PolarHBondContact O-OG1 2.68Å; L514-T516 PolarHBondContact O-N 3.33Å; T516-Y519 PolarHBondContact O-N 2.87Å; T516-L520 WeakPolarHBondContact O-CG 3.49Å; T516-L520 PolarHBondContact O-N 2.83Å; T516-Y555 WeakPolarHBondContact OG1-CA 3.04Å; T516-Y555 WeakPolarHBondContact OG1-CB 3.48Å; T516-A558 HydrophobicContact CG2-CB 3.9Å
517	G	88.4	Confident	85.2	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-73.4	-30.5	179.9	0	0	0	0	0	113.9	W456 I513 L514 R515 L520 N521	W456-G517 VanDerWaalsContact CE2-CA 3.47Å; W456-G517 VanDerWaalsContact CZ2-CA 3.45Å; I513-G517 PolarHBondContact O-N 2.88Å; L514-G517 PolarHBondContact O-N 2.96Å; R515-G517 PolarHBondContact O-N 3.44Å; G517-L520 PolarHBondContact O-N 3.49Å; G517-N521 WeakPolarHBondContact O-CB 3.36Å; G517-N521 PolarHBondContact O-N 3.09Å; G517-N521 PolarHBondContact O-ND2 3.06Å
518	K	86.1	Confident	84.4	Confident	39 Å²	39	43.1 Å²	43.1	17%	0.17	22%	0.215	C	C	.	.	H	α-helix	trans	-56.1	-50	167.3	-76.6	-173.9	177.2	-168.4	0	110.4	W491 E492 Y495 L514 R515 L520 N521 V522	W491-K518 VanDerWaalsContact O-CE 3.24Å; W491-K518 WeakPolarHBondContact O-CE 3.43Å; W491-K518 PolarHBondContact O-NZ 3.16Å; E492-K518 PolarHBondContact O-NZ 3.14Å; Y495-K518 HydrophobicContact CD2-CG 4Å; Y495-K518 HydrophobicContact CG-CG 4.45Å; Y495-K518 WeakPolarHBondContact O-CE 3.28Å; Y495-K518 PolarHBondContact O-NZ 3.04Å; L514-K518 HydrophobicContact CG-CD 4.28Å; L514-K518 WeakPolarHBondContact O-CG 3.06Å; L514-K518 PolarHBondContact O-N 3.29Å; R515-K518 WeakPolarHBondContact O-CB 3.07Å; R515-K518 PolarHBondContact O-N 3.38Å; K518-L520 PolarHBondContact O-N 3.31Å; K518-N521 PolarHBondContact O-N 2.81Å; K518-V522 WeakPolarHBondContact O-CG2 3.36Å; K518-V522 PolarHBondContact O-N 3.24Å
519	Y	87.9	Confident	83.1	Confident	20 Å²	20	45 Å²	45	8%	0.078	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-44.9	178.3	-60.5	-26.3	0	0	0	112.6	R515 T516 N521 V522 I523 Y555 A559 L562 D777	R515-Y519 HydrophobicContact CB-CE2 4.01Å; R515-Y519 WeakPolarHBondContact O-CD2 3.37Å; R515-Y519 PolarHBondContact O-N 3.21Å; T516-Y519 PolarHBondContact O-N 2.87Å; Y519-N521 VanDerWaalsContact C-N 3.3Å; Y519-N521 PolarHBondContact O-N 3.31Å; Y519-V522 PolarHBondContact O-N 2.9Å; Y519-I523 VanDerWaalsContact O-CG1 3.31Å; Y519-I523 WeakPolarHBondContact O-CG1 3.35Å; Y519-I523 PolarHBondContact O-N 2.9Å; Y519-Y555 HydrophobicContact CE2-CE2 4Å; Y519-A559 HydrophobicContact CD2-CB 4.16Å; Y519-A559 HydrophobicContact CE2-CB 4.08Å; Y519-L562 HydrophobicContact CD1-CD2 3.41Å; Y519-L562 VanDerWaalsContact CD1-CD2 3.41Å; Y519-L562 HydrophobicContact CE1-CD2 4.14Å; Y519-L562 HydrophobicContact CG-CD2 3.87Å; Y519-D777 PolarHBondContact OH-OD1 2.74Å; Y519-D777 PolarHBondContact OH-OD2 2.87Å
520	L	86.3	Confident	81.9	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-62.8	-35.7	176.1	-66.6	-169.5	0	0	0	112.8	I457 T516 G517 K518 I523 R524 V530 A558	I457-L520 WeakPolarHBondContact O-CD1 3.47Å; T516-L520 WeakPolarHBondContact O-CG 3.49Å; T516-L520 PolarHBondContact O-N 2.83Å; G517-L520 PolarHBondContact O-N 3.49Å; K518-L520 PolarHBondContact O-N 3.31Å; L520-I523 HydrophobicContact CD2-CD1 4.12Å; L520-I523 PolarHBondContact O-N 3.24Å; L520-R524 WeakPolarHBondContact O-CB 3.2Å; L520-R524 VanDerWaalsContact O-CG 3.22Å; L520-R524 WeakPolarHBondContact O-CG 3.4Å; L520-R524 PolarHBondContact O-N 2.9Å; L520-V530 HydrophobicContact CB-CG2 4.44Å; L520-V530 HydrophobicContact CD1-CG1 4.16Å; L520-V530 HydrophobicContact CD2-CG1 3.7Å; L520-V530 HydrophobicContact CD2-CG2 4.06Å; L520-V530 HydrophobicContact CG-CG1 4.44Å; L520-A558 HydrophobicContact CD2-CB 3.67Å; L520-A558 HydrophobicContact CG-CB 4.05Å
521	N	85.1	Confident	80.3	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.064	24%	0.237	C	C	.	.	H	α-helix	trans	-73.9	-31.6	177.5	-78.3	-32.5	0	0	0	113.4	W456 G460 W491 Y495 G517 K518 Y519 R524 Q525	W456-N521 VanDerWaalsContact CZ3-ND2 3.3Å; W456-N521 WeakPolarHBondContact CZ3-ND2 3.28Å; G460-N521 PolarHBondContact O-ND2 3.36Å; G460-N521 PolarHBondContact O-OD1 3.38Å; G460-N521 VanDerWaalsContact O-OD1 3.05Å; W491-N521 HydrophobicContact CH2-CB 4.38Å; W491-N521 HydrophobicContact CZ3-CB 4.07Å; Y495-N521 PolarHBondContact OH-ND2 3.2Å; G517-N521 WeakPolarHBondContact O-CB 3.36Å; G517-N521 PolarHBondContact O-N 3.09Å; G517-N521 PolarHBondContact O-ND2 3.06Å; K518-N521 PolarHBondContact O-N 2.81Å; Y519-N521 VanDerWaalsContact C-N 3.3Å; Y519-N521 PolarHBondContact O-N 3.31Å; N521-R524 PolarHBondContact O-N 3Å; N521-R524 WeakPolarHBondContact OD1-CD 3.26Å; N521-Q525 WeakPolarHBondContact O-CG 3.49Å; N521-Q525 PolarHBondContact O-N 3.43Å; N521-Q525 VanDerWaalsContact O-N 3.13Å
522	V	81.9	Confident	78.8	Confident	4 Å²	4	47.1 Å²	47.1	2%	0.024	23%	0.231	C	C	.	.	H	α-helix	trans	-62.3	-50.1	166.6	178.2	0	0	0	0	109.9	W491 K518 Y519 R524 Q525 C526 L562 W681 L685	W491-V522 HydrophobicContact CD2-CG2 4.27Å; W491-V522 HydrophobicContact CE3-CG2 4.22Å; W491-V522 HydrophobicContact CH2-CB 4.43Å; W491-V522 HydrophobicContact CH2-CG2 3.68Å; W491-V522 HydrophobicContact CZ2-CG2 3.77Å; W491-V522 HydrophobicContact CZ3-CG2 3.92Å; K518-V522 WeakPolarHBondContact O-CG2 3.36Å; K518-V522 PolarHBondContact O-N 3.24Å; Y519-V522 PolarHBondContact O-N 2.9Å; V522-R524 VanDerWaalsContact C-N 3.29Å; V522-R524 PolarHBondContact O-N 3.06Å; V522-Q525 PolarHBondContact O-N 3.41Å; V522-Q525 VanDerWaalsContact O-N 3.11Å; V522-C526 PolarHBondContact O-N 2.97Å; V522-L562 HydrophobicContact CB-CD1 4.08Å; V522-L562 HydrophobicContact CG1-CD1 3.58Å; V522-W681 HydrophobicContact CG1-CZ2 4.02Å; V522-W681 VanDerWaalsContact O-CH2 3.28Å; V522-W681 WeakPolarHBondContact O-CH2 3.43Å; V522-L685 HydrophobicContact CB-CD2 4.49Å; V522-L685 HydrophobicContact CG1-CD1 4.25Å; V522-L685 HydrophobicContact CG1-CD2 4.03Å; V522-L685 HydrophobicContact CG2-CD2 3.58Å
523	I	84	Confident	77	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.1	-40.4	177.9	-64.1	160.7	0	0	0	111.8	Y519 L520 Q525 C526 K528 V530 M561 L562	Y519-I523 VanDerWaalsContact O-CG1 3.31Å; Y519-I523 WeakPolarHBondContact O-CG1 3.35Å; Y519-I523 PolarHBondContact O-N 2.9Å; L520-I523 HydrophobicContact CD2-CD1 4.12Å; L520-I523 PolarHBondContact O-N 3.24Å; I523-Q525 VanDerWaalsContact C-N 3.35Å; I523-Q525 PolarHBondContact O-N 3.47Å; I523-C526 VanDerWaalsContact O-CB 3.26Å; I523-C526 WeakPolarHBondContact O-CB 3.36Å; I523-C526 PolarHBondContact O-N 3.41Å; I523-C526 VanDerWaalsContact O-N 3.09Å; I523-K528 HydrophobicContact CG2-CB 3.79Å; I523-K528 HydrophobicContact CG2-CD 4.4Å; I523-V530 HydrophobicContact CB-CG2 4.22Å; I523-V530 HydrophobicContact CG2-CG2 3.86Å; I523-M561 HydrophobicContact CD1-CB 3.72Å; I523-L562 HydrophobicContact CD1-CB 4.02Å; I523-L562 HydrophobicContact CG1-CB 4.11Å; I523-L562 HydrophobicContact CG1-CD1 3.98Å
524	R	81.1	Confident	75.4	Confident	113 Å²	113	56.9 Å²	56.9	43%	0.426	29%	0.285	S	S	.	.	H	α-helix	trans	-64.5	-36.8	177.9	-76.9	167.7	57.2	118.7	5	113	K459 L520 N521 V522 C526 G527 V530	K459-R524 VanDerWaalsContact O-CD 3.25Å; K459-R524 WeakPolarHBondContact O-CD 3.36Å; K459-R524 PolarHBondContact O-NH1 2.94Å; L520-R524 WeakPolarHBondContact O-CB 3.2Å; L520-R524 VanDerWaalsContact O-CG 3.22Å; L520-R524 WeakPolarHBondContact O-CG 3.4Å; L520-R524 PolarHBondContact O-N 2.9Å; N521-R524 PolarHBondContact O-N 3Å; N521-R524 WeakPolarHBondContact OD1-CD 3.26Å; V522-R524 VanDerWaalsContact C-N 3.29Å; V522-R524 PolarHBondContact O-N 3.06Å; R524-C526 PolarHBondContact O-N 2.94Å; R524-G527 PolarHBondContact O-N 3.34Å; R524-G527 VanDerWaalsContact O-N 3.09Å; R524-V530 HydrophobicContact CG-CG2 3.88Å
525	Q	77.3	Confident	73.9	Confident	88 Å²	88	64.3 Å²	64.3	41%	0.411	32%	0.32	S	S	.	.	H	α-helix	trans	-66.8	-21.5	174.5	-73	-178.6	21.8	0	0	112.1	W491 N521 V522 I523 G527 W681	W491-Q525 VanDerWaalsContact CZ2-OE1 3.27Å; N521-Q525 WeakPolarHBondContact O-CG 3.49Å; N521-Q525 PolarHBondContact O-N 3.43Å; N521-Q525 VanDerWaalsContact O-N 3.13Å; V522-Q525 PolarHBondContact O-N 3.41Å; V522-Q525 VanDerWaalsContact O-N 3.11Å; I523-Q525 VanDerWaalsContact C-N 3.35Å; I523-Q525 PolarHBondContact O-N 3.47Å; Q525-G527 PolarHBondContact O-N 2.9Å; Q525-W681 HydrophobicContact CB-CH2 3.43Å; Q525-W681 VanDerWaalsContact CB-CH2 3.43Å; Q525-W681 HydrophobicContact CB-CZ2 3.39Å; Q525-W681 HydrophobicContact CB-CZ3 4.34Å
526	C	73.5	Confident	72.8	Confident	41 Å²	41	63 Å²	63	28%	0.277	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	3.3	170.8	-56.1	0	0	0	0	113	V522 I523 R524 K528 W681	V522-C526 PolarHBondContact O-N 2.97Å; I523-C526 VanDerWaalsContact O-CB 3.26Å; I523-C526 WeakPolarHBondContact O-CB 3.36Å; I523-C526 PolarHBondContact O-N 3.41Å; I523-C526 VanDerWaalsContact O-N 3.09Å; R524-C526 PolarHBondContact O-N 2.94Å; C526-K528 PolarHBondContact O-N 3.46Å; C526-W681 HydrophobicContact CB-CH2 4.13Å; C526-W681 HydrophobicContact CB-CZ3 4.13Å; C526-W681 WeakPolarHBondContact SG-CH2 3.38Å; C526-W681 VanDerWaalsContact SG-CZ3 3.52Å
527	G	68	Low	71.8	Confident	69 Å²	69	68.5 Å²	68.5	71%	0.711	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.2	4	-171.7	0	0	0	0	0	113.7	R524 Q525	R524-G527 PolarHBondContact O-N 3.34Å; R524-G527 VanDerWaalsContact O-N 3.09Å; Q525-G527 PolarHBondContact O-N 2.9Å
528	K	69.6	Low	71.2	Confident	58 Å²	58	69 Å²	69	25%	0.252	35%	0.349	S	S	.	.			trans	-77.7	130.9	176.7	-86	-177.7	159.1	177.8	0	111	I523 C526 V530 V565 E569	I523-K528 HydrophobicContact CG2-CB 3.79Å; I523-K528 HydrophobicContact CG2-CD 4.4Å; C526-K528 PolarHBondContact O-N 3.46Å; K528-V530 PolarHBondContact O-N 2.94Å; K528-V565 HydrophobicContact CD-CG2 3.73Å; K528-E569 VanDerWaalsContact CE-CD 3.47Å; K528-E569 WeakPolarHBondContact CE-OE1 3.42Å; K528-E569 WeakPolarHBondContact CE-OE2 3.34Å; K528-E569 IonicContact NZ-OE1 2.63Å; K528-E569 PolarHBondContact NZ-OE1 3.12Å; K528-E569 IonicContact NZ-OE2 2.73Å; K528-E569 PolarHBondContact NZ-OE2 3.46Å
529	R	62	Low	70.7	Confident	216 Å²	216	73.1 Å²	73.1	82%	0.815	37%	0.369	S	S	*	.			trans	-74.8	111.9	166.4	-67.3	-170	-179.8	-144	-0.5	108.5	M531	R529-M531 VanDerWaalsContact C-N 3.32Å; R529-M531 HydrophobicContact CB-CG 4.13Å; R529-M531 HydrophobicContact CB-SD 4.24Å; R529-M531 PolarHBondContact O-N 2.86Å
530	V	63	Low	70.1	Confident	17 Å²	17	72.4 Å²	72.4	10%	0.103	37%	0.366	C	S	.	.			trans	-65.7	97.9	163.4	-179	0	0	0	0	107	Q458 L520 I523 R524 K528	Q458-V530 VanDerWaalsContact O-CG1 3.31Å; Q458-V530 WeakPolarHBondContact O-CG1 3.26Å; L520-V530 HydrophobicContact CB-CG2 4.44Å; L520-V530 HydrophobicContact CD1-CG1 4.16Å; L520-V530 HydrophobicContact CD2-CG1 3.7Å; L520-V530 HydrophobicContact CD2-CG2 4.06Å; L520-V530 HydrophobicContact CG-CG1 4.44Å; I523-V530 HydrophobicContact CB-CG2 4.22Å; I523-V530 HydrophobicContact CG2-CG2 3.86Å; R524-V530 HydrophobicContact CG-CG2 3.88Å; K528-V530 PolarHBondContact O-N 2.94Å
531	M	54.8	Low	69.5	Low	131 Å²	131	73.4 Å²	73.4	65%	0.645	37%	0.371	S	S	*	.			trans	-101.9	106.6	167.8	-56	-66.8	-88.6	0	0	105.7	R529 T533	R529-M531 VanDerWaalsContact C-N 3.32Å; R529-M531 HydrophobicContact CB-CG 4.13Å; R529-M531 HydrophobicContact CB-SD 4.24Å; R529-M531 PolarHBondContact O-N 2.86Å; M531-T533 PolarHBondContact O-N 3.34Å
532	P	56.4	Low	68.6	Low	42 Å²	42	74.3 Å²	74.3	27%	0.273	38%	0.378	S	S	.	.			trans	-56.8	125.6	164.5	-17.6	30	0	0	0	107.4	Q458 Q534	Q458-P532 HydrophobicContact CB-CG 3.88Å; Q458-P532 HydrophobicContact CG-CG 4.4Å; Q458-P532 WeakPolarHBondContact O-CG 3.48Å; P532-Q534 WeakPolarHBondContact CB-O 3.48Å; P532-Q534 PolarHBondContact O-N 2.99Å
533	T	52	Low	67.8	Low	124 Å²	124	79 Å²	79	76%	0.761	41%	0.407	S	S	*	.	S	Bend	trans	-68.9	-7.1	173.6	29.5	0	0	0	0	112.6	M531	M531-T533 PolarHBondContact O-N 3.34Å
534	Q	57.1	Low	66.9	Low	138 Å²	138	80.9 Å²	80.9	65%	0.645	42%	0.42	S	S	*	.	S	Bend	trans	-140.4	128.2	176.8	-64.8	175.2	-8.7	0	0	109.3	P532 M536	P532-Q534 WeakPolarHBondContact CB-O 3.48Å; P532-Q534 PolarHBondContact O-N 2.99Å; Q534-M536 PolarHBondContact O-N 2.89Å; Q534-M536 VanDerWaalsContact O-N 3.14Å
535	E	59.6	Low	66.5	Low	174 Å²	174	82.1 Å²	82.1	81%	0.813	43%	0.431	S	S	*	.			trans	-72.6	100.4	165.4	-67.4	-172.9	148.8	0	0	108.2	N537	E535-N537 PolarHBondContact O-N 3.38Å
536	M	65	Low	66.5	Low	36 Å²	36	85.6 Å²	85.6	18%	0.177	44%	0.44	C	S	.	.			trans	-84.1	108.7	178.3	-41.6	-177.3	79.8	0	0	108.9	Q454 Q458 Q534 L538 V550 D553 A554	Q454-M536 PolarHBondContact NE2-O 3.28Å; Q458-M536 VanDerWaalsContact NE2-N 3.16Å; Q458-M536 PolarHBondContact NE2-O 2.91Å; Q534-M536 PolarHBondContact O-N 2.89Å; Q534-M536 VanDerWaalsContact O-N 3.14Å; M536-L538 PolarHBondContact O-N 3.25Å; M536-L538 VanDerWaalsContact O-N 3.17Å; M536-V550 HydrophobicContact CB-CG1 3.83Å; M536-V550 HydrophobicContact CE-CB 4.28Å; M536-V550 HydrophobicContact CE-CG1 3.97Å; M536-V550 HydrophobicContact CE-CG2 4.25Å; M536-V550 HydrophobicContact SD-CG1 4.14Å; M536-D553 HydrophobicContact CE-CB 3.84Å; M536-A554 HydrophobicContact SD-CB 4.17Å
537	N	68.6	Low	66.9	Low	114 Å²	114	84.4 Å²	84.4	61%	0.61	43%	0.43	S	S	*	.			trans	-72.5	110.5	175.5	-69.7	-15.9	0	0	0	109.3	E535 E539	E535-N537 PolarHBondContact O-N 3.38Å; N537-E539 PolarHBondContact O-N 2.91Å
538	L	76.1	Confident	67.7	Low	12 Å²	12	81.7 Å²	81.7	6%	0.063	40%	0.4	C	S	.	.			trans	-90.7	90.6	178.7	-172.8	68	0	0	0	109.4	M450 L453 Q454 M536 H547 V550	M450-L538 HydrophobicContact CB-CG 4.49Å; M450-L538 WeakPolarHBondContact CB-O 3.28Å; M450-L538 HydrophobicContact SD-CD2 4.08Å; M450-L538 HydrophobicContact SD-CG 4.14Å; L453-L538 HydrophobicContact CB-CD2 4Å; L453-L538 HydrophobicContact CD2-CD2 3.79Å; L453-L538 HydrophobicContact CG-CD2 3.71Å; Q454-L538 HydrophobicContact CB-CB 4.24Å; Q454-L538 HydrophobicContact CB-CD2 4.44Å; M536-L538 PolarHBondContact O-N 3.25Å; M536-L538 VanDerWaalsContact O-N 3.17Å; L538-H547 HydrophobicContact CD1-CB 4.01Å; L538-V550 HydrophobicContact CD1-CB 4.16Å; L538-V550 HydrophobicContact CD1-CG1 3.86Å
539	E	75.2	Confident	68.4	Low	125 Å²	125	81.7 Å²	81.7	58%	0.584	41%	0.407	S	S	*	.			trans	-100.5	137.4	174.2	-66.8	-178	-171.1	0	0	110.6	N537 D541	N537-E539 PolarHBondContact O-N 2.91Å; E539-D541 PolarHBondContact O-N 3.34Å
540	F	74.8	Confident	69.5	Low	5 Å²	5	72.6 Å²	72.6	2%	0.022	38%	0.376	C	S	.	.			trans	-83.6	105.6	175.1	179.8	-101.8	0	0	0	110.5	V442 A446 M450 F505 P542	V442-F540 HydrophobicContact CG1-CD1 3.89Å; V442-F540 HydrophobicContact CG1-CE1 3.45Å; V442-F540 VanDerWaalsContact CG1-CE1 3.45Å; V442-F540 HydrophobicContact CG1-CZ 4.4Å; A446-F540 HydrophobicContact CB-CB 3.95Å; A446-F540 HydrophobicContact CB-CD1 4.11Å; A446-F540 HydrophobicContact CB-CG 4.11Å; M450-F540 HydrophobicContact CE-CB 4.17Å; M450-F540 HydrophobicContact CE-CD2 4.12Å; M450-F540 HydrophobicContact CE-CG 4.41Å; M450-F540 HydrophobicContact CG-CB 3.9Å; M450-F540 HydrophobicContact SD-CB 4.28Å; F505-F540 HydrophobicContact CD1-CE2 4.07Å; F505-F540 HydrophobicContact CD1-CZ 4.29Å; F505-F540 HydrophobicContact CD2-CD2 4.05Å; F505-F540 AromaticContact CD2-CE2 3.47Å; F505-F540 HydrophobicContact CD2-CE2 3.47Å; F505-F540 VanDerWaalsContact CD2-CE2 3.47Å; F505-F540 HydrophobicContact CD2-CZ 4.43Å; F505-F540 HydrophobicContact CE1-CE2 4.03Å; F505-F540 HydrophobicContact CE1-CZ 4.3Å; F505-F540 AromaticContact CE2-CD2 3.59Å; F505-F540 HydrophobicContact CE2-CD2 3.59Å; F505-F540 AromaticContact CE2-CE2 3.43Å; F505-F540 HydrophobicContact CE2-CE2 3.43Å; F505-F540 VanDerWaalsContact CE2-CE2 3.43Å; F505-F540 HydrophobicContact CE2-CZ 4.43Å; F505-F540 AromaticContact CG-CE2 3.81Å; F505-F540 HydrophobicContact CG-CE2 3.81Å; F505-F540 HydrophobicContact CG-CZ 4.36Å; F505-F540 AromaticContact CZ-CD2 3.94Å; F505-F540 HydrophobicContact CZ-CD2 3.94Å; F505-F540 AromaticContact CZ-CE2 3.74Å; F505-F540 HydrophobicContact CZ-CE2 3.74Å; F505-F540 HydrophobicContact CZ-CZ 4.38Å; F540-P542 HydrophobicContact CE1-CB 3.73Å; F540-P542 HydrophobicContact CE1-CG 4.02Å; F540-P542 HydrophobicContact CZ-CB 3.83Å
541	D	73.3	Confident	70.7	Confident	23 Å²	23	71.9 Å²	71.9	12%	0.123	37%	0.371	C	S	.	.			trans	-105.7	112.9	165.7	-85.3	-30.4	0	0	0	110	R443 E539 T543 S544	R443-D541 IonicContact CZ-OD1 2.64Å; R443-D541 IonicContact NE-OD1 2.66Å; R443-D541 PolarHBondContact NE-OD1 3.42Å; R443-D541 VanDerWaalsContact NE-OD1 3.1Å; R443-D541 IonicContact NH2-OD1 3.9Å; R443-D541 PolarHBondContact NH2-OD1 3.13Å; E539-D541 PolarHBondContact O-N 3.34Å; D541-T543 PolarHBondContact O-N 2.81Å; D541-S544 PolarHBondContact O-N 3.42Å
542	P	67.1	Low	72.4	Confident	30 Å²	30	67 Å²	67	20%	0.195	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.5	177.9	27	-33.3	0	0	0	113.4	I425 I439 F540	I425-P542 HydrophobicContact CD1-CB 4.16Å; I425-P542 HydrophobicContact CD1-CG 4.25Å; I439-P542 HydrophobicContact CB-CG 4.1Å; I439-P542 HydrophobicContact CD1-CG 4.36Å; I439-P542 HydrophobicContact CG1-CG 3.69Å; I439-P542 HydrophobicContact CG2-CG 3.64Å; F540-P542 HydrophobicContact CE1-CB 3.73Å; F540-P542 HydrophobicContact CE1-CG 4.02Å; F540-P542 HydrophobicContact CZ-CB 3.83Å
543	T	64.5	Low	73.8	Confident	103 Å²	103	69.1 Å²	69.1	63%	0.632	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-7.8	177.7	53.6	0	0	0	0	113.5	I439 D541	I439-T543 HydrophobicContact CD1-CG2 3.96Å; D541-T543 PolarHBondContact O-N 2.81Å
544	S	65.4	Low	75.5	Confident	40 Å²	40	63.5 Å²	63.5	28%	0.28	32%	0.322	S	S	.	.			trans	-143.3	118.2	-174.2	-156.3	0	0	0	0	111.5	D541 R546 H547	D541-S544 PolarHBondContact O-N 3.42Å; S544-R546 PolarHBondContact O-N 3.12Å; S544-H547 PolarHBondContact O-ND1 3.09Å
545	E	72.4	Confident	77	Confident	139 Å²	139	57.9 Å²	57.9	65%	0.65	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	23.6	178.9	-60	-170.8	158.6	0	0	113.8	H547 V548 S549	E545-H547 PolarHBondContact O-N 3.21Å; E545-V548 HydrophobicContact CB-CB 4.16Å; E545-V548 HydrophobicContact CB-CG2 4.02Å; E545-V548 HydrophobicContact CG-CG2 4.49Å; E545-V548 WeakPolarHBondContact O-CA 3.49Å; E545-V548 VanDerWaalsContact O-CB 3.23Å; E545-V548 WeakPolarHBondContact O-CB 3.28Å; E545-V548 PolarHBondContact O-N 2.93Å; E545-S549 PolarHBondContact O-N 3.21Å
546	R	79	Confident	78.4	Confident	161 Å²	161	54.9 Å²	54.9	61%	0.608	28%	0.278	S	S	*	.	H	α-helix	trans	-55.8	-37.2	173.9	-71.1	169.4	178.5	-173.5	-3.3	112.6	S544 V548 S549 V550	S544-R546 PolarHBondContact O-N 3.12Å; R546-V548 PolarHBondContact O-N 3.23Å; R546-S549 PolarHBondContact O-N 3.42Å; R546-S549 PolarHBondContact O-OG 3Å; R546-V550 WeakPolarHBondContact O-CG2 3.5Å; R546-V550 PolarHBondContact O-N 3.36Å; R546-V550 VanDerWaalsContact O-N 3.11Å
547	H	80.2	Confident	79.5	Confident	15 Å²	15	56.6 Å²	56.6	7%	0.069	28%	0.284	C	S	.	.	H	α-helix	trans	-61.3	-34	174	60.6	-86.3	0	0	0	111.6	L538 S544 E545 I551	L538-H547 HydrophobicContact CD1-CB 4.01Å; S544-H547 PolarHBondContact O-ND1 3.09Å; E545-H547 PolarHBondContact O-N 3.21Å; H547-I551 VanDerWaalsContact O-CD1 3.28Å; H547-I551 WeakPolarHBondContact O-CD1 3.18Å; H547-I551 WeakPolarHBondContact O-CG1 3.4Å; H547-I551 PolarHBondContact O-N 2.9Å; H547-I551 VanDerWaalsContact O-N 3.11Å
548	V	84.6	Confident	80.4	Confident	13 Å²	13	51.2 Å²	51.2	8%	0.079	26%	0.255	C	S	.	.	H	α-helix	trans	-70.5	-41.8	176.1	-179.1	0	0	0	0	111.7	Y509 E545 R546 I551 N552	Y509-V548 HydrophobicContact CD1-CG1 4.41Å; Y509-V548 HydrophobicContact CD2-CG1 4.3Å; Y509-V548 HydrophobicContact CD2-CG2 4.38Å; Y509-V548 HydrophobicContact CE1-CG1 3.75Å; Y509-V548 HydrophobicContact CE2-CB 4.4Å; Y509-V548 HydrophobicContact CE2-CG1 3.63Å; Y509-V548 HydrophobicContact CE2-CG2 3.84Å; Y509-V548 WeakPolarHBondContact OH-CG1 3.31Å; E545-V548 HydrophobicContact CB-CB 4.16Å; E545-V548 HydrophobicContact CB-CG2 4.02Å; E545-V548 HydrophobicContact CG-CG2 4.49Å; E545-V548 WeakPolarHBondContact O-CA 3.49Å; E545-V548 VanDerWaalsContact O-CB 3.23Å; E545-V548 WeakPolarHBondContact O-CB 3.28Å; E545-V548 PolarHBondContact O-N 2.93Å; R546-V548 PolarHBondContact O-N 3.23Å; V548-I551 PolarHBondContact O-N 3.37Å; V548-N552 WeakPolarHBondContact CG1-ND2 2.7Å; V548-N552 PolarHBondContact O-N 2.01Å; V548-N552 VanDerWaalsContact O-N 3.07Å; V548-N552 PolarHBondContact O-ND2 3.22Å
549	S	85.1	Confident	81	Confident	58 Å²	58	50.6 Å²	50.6	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-62.5	-46.5	176.3	61.9	0	0	0	0	111	E545 R546 I551 N552 D553	E545-S549 PolarHBondContact O-N 3.21Å; R546-S549 PolarHBondContact O-N 3.42Å; R546-S549 PolarHBondContact O-OG 3Å; S549-I551 VanDerWaalsContact C-N 3.31Å; S549-I551 PolarHBondContact O-N 2.86Å; S549-N552 PolarHBondContact O-N 3.33Å; S549-D553 WeakPolarHBondContact O-CB 3.12Å; S549-D553 VanDerWaalsContact O-CG 3.22Å; S549-D553 PolarHBondContact O-N 3.48Å
550	V	86.3	Confident	81.6	Confident	25 Å²	25	53.9 Å²	53.9	15%	0.152	26%	0.259	C	S	.	.	H	α-helix	trans	-55.9	-42	175.8	171.5	0	0	0	0	112.4	M536 L538 R546 A554	M536-V550 HydrophobicContact CB-CG1 3.83Å; M536-V550 HydrophobicContact CE-CB 4.28Å; M536-V550 HydrophobicContact CE-CG1 3.97Å; M536-V550 HydrophobicContact CE-CG2 4.25Å; M536-V550 HydrophobicContact SD-CG1 4.14Å; L538-V550 HydrophobicContact CD1-CB 4.16Å; L538-V550 HydrophobicContact CD1-CG1 3.86Å; R546-V550 WeakPolarHBondContact O-CG2 3.5Å; R546-V550 PolarHBondContact O-N 3.36Å; R546-V550 VanDerWaalsContact O-N 3.11Å; V550-A554 WeakPolarHBondContact O-CB 3.3Å; V550-A554 PolarHBondContact O-N 3.4Å
551	I	87.9	Confident	82.1	Confident	1 Å²	1	56 Å²	56	1%	0.005	27%	0.27	C	S	.	.	H	α-helix	trans	-64.4	-42.1	176.6	-69.4	161.2	0	0	0	111.6	I457 L506 I513 H547 V548 S549 Y555	I457-I551 HydrophobicContact CD1-CB 4.48Å; I457-I551 HydrophobicContact CD1-CG1 3.8Å; I457-I551 HydrophobicContact CD1-CG2 4.42Å; L506-I551 HydrophobicContact CD2-CD1 3.95Å; I513-I551 HydrophobicContact CD1-CD1 4.34Å; I513-I551 HydrophobicContact CD1-CG2 4.47Å; I513-I551 HydrophobicContact CG1-CG2 3.8Å; H547-I551 VanDerWaalsContact O-CD1 3.28Å; H547-I551 WeakPolarHBondContact O-CD1 3.18Å; H547-I551 WeakPolarHBondContact O-CG1 3.4Å; H547-I551 PolarHBondContact O-N 2.9Å; H547-I551 VanDerWaalsContact O-N 3.11Å; V548-I551 PolarHBondContact O-N 3.37Å; S549-I551 VanDerWaalsContact C-N 3.31Å; S549-I551 PolarHBondContact O-N 2.86Å; I551-Y555 WeakPolarHBondContact O-CB 3.48Å; I551-Y555 PolarHBondContact O-N 2.97Å
552	N	88.9	Confident	82.8	Confident	28 Å²	28	55 Å²	55	15%	0.15	26%	0.264	C	S	.	.	H	α-helix	trans	-70.4	-43.6	179.4	-73.4	-72.7	0	0	0	112	K512 V548 S549 A554 Y555 Y556	K512-N552 PolarHBondContact NZ-OD1 2.98Å; V548-N552 WeakPolarHBondContact CG1-ND2 2.7Å; V548-N552 PolarHBondContact O-N 2.01Å; V548-N552 VanDerWaalsContact O-N 3.07Å; V548-N552 PolarHBondContact O-ND2 3.22Å; S549-N552 PolarHBondContact O-N 3.33Å; N552-A554 VanDerWaalsContact C-N 3.34Å; N552-A554 PolarHBondContact O-N 3.02Å; N552-Y555 WeakPolarHBondContact O-CB 3.48Å; N552-Y555 PolarHBondContact O-N 3.29Å; N552-Y556 HydrophobicContact CB-CE2 4.37Å; N552-Y556 WeakPolarHBondContact O-CD2 2.85Å; N552-Y556 PolarHBondContact O-N 2.95Å
553	D	87.3	Confident	83.8	Confident	88 Å²	88	54.3 Å²	54.3	47%	0.471	26%	0.259	S	S	.	.	H	α-helix	trans	-59.6	-45.3	177.7	-68.1	-23.4	0	0	0	111	M536 S549 Y556 F557	M536-D553 HydrophobicContact CE-CB 3.84Å; S549-D553 WeakPolarHBondContact O-CB 3.12Å; S549-D553 VanDerWaalsContact O-CG 3.22Å; S549-D553 PolarHBondContact O-N 3.48Å; D553-Y556 PolarHBondContact O-N 3.46Å; D553-F557 WeakPolarHBondContact O-CB 3.27Å; D553-F557 PolarHBondContact O-N 3.48Å
554	A	87.6	Confident	84.9	Confident	5 Å²	5	53.3 Å²	53.3	4%	0.041	25%	0.25	C	C	.	.	H	α-helix	trans	-67.9	-33.9	176.5	0	0	0	0	0	113.1	I457 M536 V550 N552 A558	I457-A554 HydrophobicContact CG2-CB 3.22Å; M536-A554 HydrophobicContact SD-CB 4.17Å; V550-A554 WeakPolarHBondContact O-CB 3.3Å; V550-A554 PolarHBondContact O-N 3.4Å; N552-A554 VanDerWaalsContact C-N 3.34Å; N552-A554 PolarHBondContact O-N 3.02Å; A554-A558 WeakPolarHBondContact O-CB 3.43Å; A554-A558 PolarHBondContact O-N 3.48Å
555	Y	89.3	Confident	85.9	Confident	20 Å²	20	51.4 Å²	51.4	8%	0.078	24%	0.237	C	C	.	.	H	α-helix	trans	-60.7	-51.4	170.9	169.2	-89.2	0	0	0	111.4	K512 R515 T516 Y519 I551 N552 F557 A558 A559 D777	K512-Y555 HydrophobicContact CB-CD2 4.14Å; R515-Y555 HydrophobicContact CB-CD2 4.43Å; R515-Y555 HydrophobicContact CB-CE2 3.97Å; T516-Y555 WeakPolarHBondContact OG1-CA 3.04Å; T516-Y555 WeakPolarHBondContact OG1-CB 3.48Å; Y519-Y555 HydrophobicContact CE2-CE2 4Å; I551-Y555 WeakPolarHBondContact O-CB 3.48Å; I551-Y555 PolarHBondContact O-N 2.97Å; N552-Y555 WeakPolarHBondContact O-CB 3.48Å; N552-Y555 PolarHBondContact O-N 3.29Å; Y555-F557 VanDerWaalsContact C-N 3.32Å; Y555-F557 PolarHBondContact O-N 3.41Å; Y555-A558 PolarHBondContact O-N 3.36Å; Y555-A559 VanDerWaalsContact O-CB 3.32Å; Y555-A559 WeakPolarHBondContact O-CB 3.44Å; Y555-A559 PolarHBondContact O-N 3Å; Y555-D777 PolarHBondContact OH-OD2 3.11Å
556	Y	88.1	Confident	86.6	Confident	112 Å²	112	45 Å²	45	44%	0.439	21%	0.207	S	C	.	.	H	α-helix	trans	-65.8	-35.9	179.6	-69.9	-61.3	0	0	0	112.1	N552 D553 R560	N552-Y556 HydrophobicContact CB-CE2 4.37Å; N552-Y556 WeakPolarHBondContact O-CD2 2.85Å; N552-Y556 PolarHBondContact O-N 2.95Å; D553-Y556 PolarHBondContact O-N 3.46Å; Y556-R560 WeakPolarHBondContact O-CB 3.31Å; Y556-R560 PolarHBondContact O-N 3.07Å
557	F	87.2	Confident	86.9	Confident	72 Å²	72	39.8 Å²	39.8	32%	0.316	19%	0.191	S	C	.	.	H	α-helix	trans	-60.5	-51.7	172.3	179.2	-103.5	0	0	0	111.7	D553 Y555 R560 M561	D553-F557 WeakPolarHBondContact O-CB 3.27Å; D553-F557 PolarHBondContact O-N 3.48Å; Y555-F557 VanDerWaalsContact C-N 3.32Å; Y555-F557 PolarHBondContact O-N 3.41Å; F557-R560 PolarHBondContact O-N 3.05Å; F557-M561 HydrophobicContact CD1-SD 4.05Å; F557-M561 HydrophobicContact CE1-CG 4.35Å; F557-M561 HydrophobicContact CE1-SD 3.36Å; F557-M561 WeakPolarHBondContact CE1-SD 3.46Å; F557-M561 HydrophobicContact CE2-CG 4.35Å; F557-M561 HydrophobicContact CE2-SD 4.05Å; F557-M561 HydrophobicContact CZ-CG 4.23Å; F557-M561 HydrophobicContact CZ-SD 3.36Å; F557-M561 WeakPolarHBondContact CZ-SD 3.13Å; F557-M561 WeakPolarHBondContact O-CB 3.46Å; F557-M561 WeakPolarHBondContact O-CG 3.26Å; F557-M561 PolarHBondContact O-N 3.39Å
558	A	88.4	Confident	87.1	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-63.3	-42.9	179	0	0	0	0	0	112.5	T516 L520 A554 Y555 M561 L562	T516-A558 HydrophobicContact CG2-CB 3.9Å; L520-A558 HydrophobicContact CD2-CB 3.67Å; L520-A558 HydrophobicContact CG-CB 4.05Å; A554-A558 WeakPolarHBondContact O-CB 3.43Å; A554-A558 PolarHBondContact O-N 3.48Å; Y555-A558 PolarHBondContact O-N 3.36Å; A558-M561 PolarHBondContact O-N 2.94Å; A558-L562 PolarHBondContact O-N 3.41Å
559	A	88.3	Confident	87	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-45.2	177.4	0	0	0	0	0	111.8	Y519 Y555 L562 L563	Y519-A559 HydrophobicContact CD2-CB 4.16Å; Y519-A559 HydrophobicContact CE2-CB 4.08Å; Y555-A559 VanDerWaalsContact O-CB 3.32Å; Y555-A559 WeakPolarHBondContact O-CB 3.44Å; Y555-A559 PolarHBondContact O-N 3Å; A559-L562 PolarHBondContact O-N 3.28Å; A559-L563 WeakPolarHBondContact O-CB 3.41Å; A559-L563 PolarHBondContact O-N 2.86Å
560	R	87.6	Confident	86.8	Confident	194 Å²	194	47.7 Å²	47.7	73%	0.732	23%	0.228	S	C	*	.	H	α-helix	trans	-67.1	-39.1	177.3	-177.6	174.2	175.6	153.5	0.8	112.3	Y556 F557 L563 D564	Y556-R560 WeakPolarHBondContact O-CB 3.31Å; Y556-R560 PolarHBondContact O-N 3.07Å; F557-R560 PolarHBondContact O-N 3.05Å; R560-L563 PolarHBondContact O-N 3.2Å; R560-D564 WeakPolarHBondContact O-CB 3.48Å; R560-D564 PolarHBondContact O-N 2.64Å
561	M	86.3	Confident	86.9	Confident	48 Å²	48	49.4 Å²	49.4	24%	0.236	24%	0.237	C	C	.	.	H	α-helix	trans	-63.2	-43.3	174.5	-78	-166.1	76.3	0	0	112	I523 F557 A558 D564 V565	I523-M561 HydrophobicContact CD1-CB 3.72Å; F557-M561 HydrophobicContact CD1-SD 4.05Å; F557-M561 HydrophobicContact CE1-CG 4.35Å; F557-M561 HydrophobicContact CE1-SD 3.36Å; F557-M561 WeakPolarHBondContact CE1-SD 3.46Å; F557-M561 HydrophobicContact CE2-CG 4.35Å; F557-M561 HydrophobicContact CE2-SD 4.05Å; F557-M561 HydrophobicContact CZ-CG 4.23Å; F557-M561 HydrophobicContact CZ-SD 3.36Å; F557-M561 WeakPolarHBondContact CZ-SD 3.13Å; F557-M561 WeakPolarHBondContact O-CB 3.46Å; F557-M561 WeakPolarHBondContact O-CG 3.26Å; F557-M561 PolarHBondContact O-N 3.39Å; A558-M561 PolarHBondContact O-N 2.94Å; M561-D564 PolarHBondContact O-N 2.86Å; M561-V565 VanDerWaalsContact O-CG2 3.26Å; M561-V565 WeakPolarHBondContact O-CG2 3.05Å; M561-V565 PolarHBondContact O-N 3.4Å
562	L	87.7	Confident	87	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	24%	0.237	C	C	.	.	H	α-helix	trans	-67.8	-38.6	177.7	-179.1	61.9	0	0	0	111.2	Y519 V522 I523 A558 A559 V565 L566 V776	Y519-L562 HydrophobicContact CD1-CD2 3.41Å; Y519-L562 VanDerWaalsContact CD1-CD2 3.41Å; Y519-L562 HydrophobicContact CE1-CD2 4.14Å; Y519-L562 HydrophobicContact CG-CD2 3.87Å; V522-L562 HydrophobicContact CB-CD1 4.08Å; V522-L562 HydrophobicContact CG1-CD1 3.58Å; I523-L562 HydrophobicContact CD1-CB 4.02Å; I523-L562 HydrophobicContact CG1-CB 4.11Å; I523-L562 HydrophobicContact CG1-CD1 3.98Å; A558-L562 PolarHBondContact O-N 3.41Å; A559-L562 PolarHBondContact O-N 3.28Å; L562-V565 PolarHBondContact O-N 3.35Å; L562-L566 HydrophobicContact CD1-CD1 4.22Å; L562-L566 HydrophobicContact CD1-CG 4.28Å; L562-L566 HydrophobicContact CG-CD1 3.97Å; L562-L566 HydrophobicContact CG-CG 4.46Å; L562-L566 WeakPolarHBondContact O-CB 2.88Å; L562-L566 WeakPolarHBondContact O-CG 3.21Å; L562-L566 PolarHBondContact O-N 2.95Å; L562-V776 HydrophobicContact CB-CG2 4.01Å; L562-V776 HydrophobicContact CD2-CB 4.39Å; L562-V776 HydrophobicContact CD2-CG1 4.22Å; L562-V776 HydrophobicContact CD2-CG2 4Å; L562-V776 HydrophobicContact CG-CG2 3.87Å
563	L	88.6	Confident	87.1	Confident	16 Å²	16	50 Å²	50	8%	0.084	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-43.9	175.8	-174.3	66	0	0	0	111.9	A559 R560 L566 L567 V773 V776 V779	A559-L563 WeakPolarHBondContact O-CB 3.41Å; A559-L563 PolarHBondContact O-N 2.86Å; R560-L563 PolarHBondContact O-N 3.2Å; L563-L566 PolarHBondContact O-N 3.11Å; L563-L567 HydrophobicContact CD1-CD1 3.72Å; L563-L567 HydrophobicContact CD1-CG 3.99Å; L563-L567 HydrophobicContact CD2-CD1 4.46Å; L563-L567 HydrophobicContact CG-CD1 3.82Å; L563-L567 HydrophobicContact CG-CG 4.32Å; L563-L567 WeakPolarHBondContact O-CB 3.39Å; L563-L567 WeakPolarHBondContact O-CG 3.33Å; L563-L567 PolarHBondContact O-N 3.21Å; L563-V773 HydrophobicContact CD2-CG1 4.37Å; L563-V773 VanDerWaalsContact CD2-O 3.29Å; L563-V773 WeakPolarHBondContact CD2-O 3.24Å; L563-V776 HydrophobicContact CB-CG2 3.85Å; L563-V776 HydrophobicContact CD1-CG2 4.26Å; L563-V779 HydrophobicContact CD1-CG2 3.73Å
564	D	86.9	Confident	87.2	Confident	81 Å²	81	46.2 Å²	46.2	43%	0.433	22%	0.221	S	C	.	.	H	α-helix	trans	-60.3	-49.3	174.5	-177.7	40.3	0	0	0	111.1	R560 M561 L566 L567 T568	R560-D564 WeakPolarHBondContact O-CB 3.48Å; R560-D564 PolarHBondContact O-N 2.64Å; M561-D564 PolarHBondContact O-N 2.86Å; D564-L566 VanDerWaalsContact C-N 3.3Å; D564-L566 PolarHBondContact O-N 2.81Å; D564-L567 PolarHBondContact O-N 3.39Å; D564-T568 PolarHBondContact O-N 3.47Å; D564-T568 PolarHBondContact O-OG1 2.97Å; D564-T568 WeakPolarHBondContact OD1-CG2 3.34Å; D564-T568 PolarHBondContact OD1-OG1 3.22Å
565	V	87.4	Confident	87.4	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.006	22%	0.222	C	C	.	.	I	π-helix	trans	-54.5	-43.8	175.2	171.4	0	0	0	0	112.3	K528 M561 L562 N570	K528-V565 HydrophobicContact CD-CG2 3.73Å; M561-V565 VanDerWaalsContact O-CG2 3.26Å; M561-V565 WeakPolarHBondContact O-CG2 3.05Å; M561-V565 PolarHBondContact O-N 3.4Å; L562-V565 PolarHBondContact O-N 3.35Å; V565-N570 PolarHBondContact O-N 3.04Å; V565-N570 PolarHBondContact O-ND2 2.96Å
566	L	86.2	Confident	87.5	Confident	5 Å²	5	45.8 Å²	45.8	3%	0.026	22%	0.219	C	C	.	.	I	π-helix	trans	-72.4	-39.6	-179.3	-72.5	169.3	0	0	0	112.8	L562 L563 D564 L572 P682 V776	L562-L566 HydrophobicContact CD1-CD1 4.22Å; L562-L566 HydrophobicContact CD1-CG 4.28Å; L562-L566 HydrophobicContact CG-CD1 3.97Å; L562-L566 HydrophobicContact CG-CG 4.46Å; L562-L566 WeakPolarHBondContact O-CB 2.88Å; L562-L566 WeakPolarHBondContact O-CG 3.21Å; L562-L566 PolarHBondContact O-N 2.95Å; L563-L566 PolarHBondContact O-N 3.11Å; D564-L566 VanDerWaalsContact C-N 3.3Å; D564-L566 PolarHBondContact O-N 2.81Å; L566-L572 HydrophobicContact CB-CD2 4.46Å; L566-L572 VanDerWaalsContact O-CB 3.31Å; L566-L572 WeakPolarHBondContact O-CB 3.47Å; L566-L572 PolarHBondContact O-N 2.96Å; L566-L572 VanDerWaalsContact O-N 3.16Å; L566-P682 HydrophobicContact CD2-CB 4.2Å; L566-P682 HydrophobicContact CD2-CG 4.06Å; L566-V776 HydrophobicContact CD1-CG1 3.88Å; L566-V776 HydrophobicContact CD1-CG2 4.21Å
567	L	86.1	Confident	87.6	Confident	50 Å²	50	44.4 Å²	44.4	26%	0.262	22%	0.216	S	C	.	.	I	π-helix	trans	-85.9	-40	-175	-67.1	-177.5	0	0	0	114.2	L563 D564 L572 M573 M770	L563-L567 HydrophobicContact CD1-CD1 3.72Å; L563-L567 HydrophobicContact CD1-CG 3.99Å; L563-L567 HydrophobicContact CD2-CD1 4.46Å; L563-L567 HydrophobicContact CG-CD1 3.82Å; L563-L567 HydrophobicContact CG-CG 4.32Å; L563-L567 WeakPolarHBondContact O-CB 3.39Å; L563-L567 WeakPolarHBondContact O-CG 3.33Å; L563-L567 PolarHBondContact O-N 3.21Å; D564-L567 PolarHBondContact O-N 3.39Å; L567-L572 HydrophobicContact CD2-CB 4.39Å; L567-L572 HydrophobicContact CD2-CD2 4.44Å; L567-M573 HydrophobicContact CD2-CG 4.06Å; L567-M573 HydrophobicContact CD2-SD 4.28Å; L567-M770 HydrophobicContact CD2-CE 3.75Å
568	T	83.8	Confident	87.8	Confident	95 Å²	95	41 Å²	41	58%	0.583	20%	0.201	S	C	*	.	I	π-helix	trans	-98.1	-33	-170.9	67	0	0	0	0	113.7	D564	D564-T568 PolarHBondContact O-N 3.47Å; D564-T568 PolarHBondContact O-OG1 2.97Å; D564-T568 WeakPolarHBondContact OD1-CG2 3.34Å; D564-T568 PolarHBondContact OD1-OG1 3.22Å
569	E	82.3	Confident	88	Confident	112 Å²	112	41 Å²	41	52%	0.523	20%	0.202	S	C	.	.	I	π-helix	trans	-97	-37.7	-178.6	-68.5	-178.4	160.4	0	0	113.8	K528	K528-E569 VanDerWaalsContact CE-CD 3.47Å; K528-E569 WeakPolarHBondContact CE-OE1 3.42Å; K528-E569 WeakPolarHBondContact CE-OE2 3.34Å; K528-E569 IonicContact NZ-OE1 2.63Å; K528-E569 PolarHBondContact NZ-OE1 3.12Å; K528-E569 IonicContact NZ-OE2 2.73Å; K528-E569 PolarHBondContact NZ-OE2 3.46Å
570	N	81.8	Confident	88.2	Confident	45 Å²	45	41.5 Å²	41.5	24%	0.241	20%	0.204	C	C	.	.	S	Bend	trans	-102.6	4	-178.1	-60.5	-81.9	0	0	0	113.3	V565 L572 H575 P682	V565-N570 PolarHBondContact O-N 3.04Å; V565-N570 PolarHBondContact O-ND2 2.96Å; N570-L572 VanDerWaalsContact C-N 3.31Å; N570-L572 PolarHBondContact O-N 3.41Å; N570-L572 VanDerWaalsContact O-N 3.15Å; N570-H575 PolarHBondContact O-CD2 2.76Å; N570-H575 VanDerWaalsContact O-CD2 3.28Å; N570-P682 HydrophobicContact CB-CG 4.43Å; N570-P682 VanDerWaalsContact OD1-CD 3.28Å; N570-P682 WeakPolarHBondContact OD1-CD 3.22Å
571	D	87.8	Confident	88.3	Confident	61 Å²	61	35.3 Å²	35.3	33%	0.326	18%	0.18	S	C	.	.			trans	37.7	56.4	178.6	-173.3	20.8	0	0	0	113.7	M573 G574 H575 Y632	D571-M573 PolarHBondContact O-N 3.01Å; D571-G574 WeakPolarHBondContact O-CA 3.49Å; D571-G574 PolarHBondContact O-N 2.7Å; D571-G574 PolarHBondContact OD1-N 3.38Å; D571-G574 WeakPolarHBondContact OD2-CA 3.37Å; D571-H575 PolarHBondContact O-CD2 3.22Å; D571-H575 PolarHBondContact O-N 3Å; D571-H575 VanDerWaalsContact O-N 3.14Å; D571-Y632 WeakPolarHBondContact CB-OH 3.41Å; D571-Y632 PolarHBondContact OD2-OH 3.41Å
572	L	89.5	Confident	88.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-53	-28.6	175.8	176.8	64.4	0	0	0	112.2	L566 L567 N570 L576 C683 V686 M770 V779	L566-L572 HydrophobicContact CB-CD2 4.46Å; L566-L572 VanDerWaalsContact O-CB 3.31Å; L566-L572 WeakPolarHBondContact O-CB 3.47Å; L566-L572 PolarHBondContact O-N 2.96Å; L566-L572 VanDerWaalsContact O-N 3.16Å; L567-L572 HydrophobicContact CD2-CB 4.39Å; L567-L572 HydrophobicContact CD2-CD2 4.44Å; N570-L572 VanDerWaalsContact C-N 3.31Å; N570-L572 PolarHBondContact O-N 3.41Å; N570-L572 VanDerWaalsContact O-N 3.15Å; L572-L576 HydrophobicContact CD1-CD1 4.39Å; L572-L576 HydrophobicContact CD1-CG 4.45Å; L572-L576 HydrophobicContact CG-CD1 4.04Å; L572-L576 WeakPolarHBondContact O-CB 3.26Å; L572-L576 WeakPolarHBondContact O-CD1 3.17Å; L572-L576 VanDerWaalsContact O-CG 3.3Å; L572-L576 WeakPolarHBondContact O-CG 3.4Å; L572-L576 PolarHBondContact O-N 3.25Å; L572-C683 HydrophobicContact CD1-CB 4.35Å; L572-V686 HydrophobicContact CD1-CB 4.13Å; L572-V686 HydrophobicContact CD1-CG1 4.3Å; L572-V686 HydrophobicContact CD2-CB 4.31Å; L572-V686 HydrophobicContact CD2-CG1 4.25Å; L572-V686 HydrophobicContact CD2-CG2 3.96Å; L572-M770 HydrophobicContact CD2-CE 4.41Å; L572-V779 HydrophobicContact CD2-CG1 4.21Å
573	M	90.3	Very high	88.7	Confident	41 Å²	41	33 Å²	33	20%	0.202	17%	0.169	C	C	.	.	H	α-helix	trans	-70.5	-38.1	176.4	-63.7	-55.4	-60.7	0	0	112.6	L567 D571 L576 Q577 I767 M770	L567-M573 HydrophobicContact CD2-CG 4.06Å; L567-M573 HydrophobicContact CD2-SD 4.28Å; D571-M573 PolarHBondContact O-N 3.01Å; M573-L576 HydrophobicContact SD-CD1 4.35Å; M573-Q577 WeakPolarHBondContact O-CB 3.29Å; M573-Q577 VanDerWaalsContact O-CG 3.28Å; M573-Q577 WeakPolarHBondContact O-CG 3.48Å; M573-Q577 PolarHBondContact O-N 3.01Å; M573-I767 HydrophobicContact CE-CD1 3.51Å; M573-M770 HydrophobicContact CE-CG 4.01Å; M573-M770 HydrophobicContact SD-CE 3.78Å; M573-M770 HydrophobicContact SD-CG 3.64Å
574	G	90.1	Very high	88.8	Confident	8 Å²	8	32.5 Å²	32.5	8%	0.082	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-52.3	169.6	0	0	0	0	0	111.8	D571 L576 Q577 S578	D571-G574 WeakPolarHBondContact O-CA 3.49Å; D571-G574 PolarHBondContact O-N 2.7Å; D571-G574 PolarHBondContact OD1-N 3.38Å; D571-G574 WeakPolarHBondContact OD2-CA 3.37Å; G574-L576 PolarHBondContact O-N 3.41Å; G574-Q577 WeakPolarHBondContact O-CB 3.23Å; G574-Q577 PolarHBondContact O-N 3.19Å; G574-S578 PolarHBondContact O-N 3.35Å; G574-S578 PolarHBondContact O-OG 2.78Å
575	H	91.2	Very high	89	Confident	16 Å²	16	29.1 Å²	29.1	7%	0.074	15%	0.148	C	C	.	.	H	α-helix	trans	-56.5	-46.5	176.1	-74.5	-71.9	0	0	0	112.7	N570 D571 Q577 S578 V579 Y632 D635 Y677 L687	N570-H575 PolarHBondContact O-CD2 2.76Å; N570-H575 VanDerWaalsContact O-CD2 3.28Å; D571-H575 PolarHBondContact O-CD2 3.22Å; D571-H575 PolarHBondContact O-N 3Å; D571-H575 VanDerWaalsContact O-N 3.14Å; H575-Q577 VanDerWaalsContact C-N 3.31Å; H575-Q577 PolarHBondContact O-N 3.32Å; H575-S578 PolarHBondContact O-N 3.1Å; H575-V579 WeakPolarHBondContact O-CG2 3.35Å; H575-V579 PolarHBondContact O-N 3.15Å; H575-Y632 AromaticContact CE1-CD1 3.26Å; H575-Y632 WeakPolarHBondContact CE1-CD1 3.5Å; H575-Y632 AromaticContact CE1-CE1 3.56Å; H575-Y632 AromaticContact CE1-CG 3.89Å; H575-Y632 AromaticContact ND1-CD1 3.72Å; H575-Y632 AromaticContact ND1-CG 3.86Å; H575-Y632 AromaticContact NE2-CD1 3.77Å; H575-Y632 AromaticContact NE2-CE1 3.55Å; H575-D635 IonicContact CE1-OD2 2.67Å; H575-Y677 HydrophobicContact CB-CE1 4.46Å; H575-Y677 AromaticContact ND1-CZ 3.88Å; H575-Y677 PolarHBondContact ND1-OH 3.25Å; H575-L687 HydrophobicContact CB-CD1 4.09Å
576	L	91.4	Very high	89	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-39	175.5	-79.5	166	0	0	0	112.2	L572 M573 G574 V579 K580 L687 W763 F766	L572-L576 HydrophobicContact CD1-CD1 4.39Å; L572-L576 HydrophobicContact CD1-CG 4.45Å; L572-L576 HydrophobicContact CG-CD1 4.04Å; L572-L576 WeakPolarHBondContact O-CB 3.26Å; L572-L576 WeakPolarHBondContact O-CD1 3.17Å; L572-L576 VanDerWaalsContact O-CG 3.3Å; L572-L576 WeakPolarHBondContact O-CG 3.4Å; L572-L576 PolarHBondContact O-N 3.25Å; M573-L576 HydrophobicContact SD-CD1 4.35Å; G574-L576 PolarHBondContact O-N 3.41Å; L576-V579 PolarHBondContact O-N 2.93Å; L576-K580 PolarHBondContact O-N 2.89Å; L576-L687 HydrophobicContact CD2-CD2 3.81Å; L576-W763 HydrophobicContact CB-CH2 4.15Å; L576-W763 WeakPolarHBondContact O-CH2 3.3Å; L576-F766 HydrophobicContact CD1-CE1 4.2Å; L576-F766 HydrophobicContact CD1-CZ 4.09Å
577	Q	91.1	Very high	89.1	Confident	82 Å²	82	35.4 Å²	35.4	38%	0.383	18%	0.18	S	C	.	.	H	α-helix	trans	-65.7	-41.4	174.4	-76.5	176.2	49	0	0	112.4	M573 G574 H575 K580 R581	M573-Q577 WeakPolarHBondContact O-CB 3.29Å; M573-Q577 VanDerWaalsContact O-CG 3.28Å; M573-Q577 WeakPolarHBondContact O-CG 3.48Å; M573-Q577 PolarHBondContact O-N 3.01Å; G574-Q577 WeakPolarHBondContact O-CB 3.23Å; G574-Q577 PolarHBondContact O-N 3.19Å; H575-Q577 VanDerWaalsContact C-N 3.31Å; H575-Q577 PolarHBondContact O-N 3.32Å; Q577-K580 PolarHBondContact O-N 3.49Å; Q577-R581 VanDerWaalsContact O-CG 3.31Å; Q577-R581 WeakPolarHBondContact O-CG 3.36Å; Q577-R581 PolarHBondContact O-N 3.39Å
578	S	91.3	Very high	89.2	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.2	-43.4	174.7	-61.5	0	0	0	0	111.4	G574 H575 K580 R581 Y582 D630	G574-S578 PolarHBondContact O-N 3.35Å; G574-S578 PolarHBondContact O-OG 2.78Å; H575-S578 PolarHBondContact O-N 3.1Å; S578-K580 VanDerWaalsContact C-N 3.31Å; S578-K580 PolarHBondContact O-N 3.36Å; S578-R581 PolarHBondContact O-N 3.15Å; S578-Y582 WeakPolarHBondContact O-CD2 3.4Å; S578-Y582 PolarHBondContact O-N 2.71Å; S578-D630 WeakPolarHBondContact CB-OD2 3.31Å; S578-D630 VanDerWaalsContact OG-CG 3.25Å; S578-D630 PolarHBondContact OG-OD1 3.46Å; S578-D630 PolarHBondContact OG-OD2 2.89Å
579	V	92.3	Very high	89.5	Confident	2 Å²	2	32.6 Å²	32.6	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-56.2	-43.8	172.3	172.1	0	0	0	0	111.4	H575 L576 L583 Y677 L687 Y695	H575-V579 WeakPolarHBondContact O-CG2 3.35Å; H575-V579 PolarHBondContact O-N 3.15Å; L576-V579 PolarHBondContact O-N 2.93Å; V579-L583 HydrophobicContact CG1-CB 4.46Å; V579-L583 HydrophobicContact CG1-CD1 4.48Å; V579-L583 WeakPolarHBondContact O-CB 3.44Å; V579-L583 PolarHBondContact O-N 3.3Å; V579-Y677 HydrophobicContact CG2-CD1 3.42Å; V579-Y677 VanDerWaalsContact CG2-CD1 3.42Å; V579-Y677 HydrophobicContact CG2-CE1 3.63Å; V579-Y677 HydrophobicContact CG2-CG 4.01Å; V579-L687 HydrophobicContact CG2-CD1 4.29Å; V579-Y695 HydrophobicContact CG1-CD1 3.89Å; V579-Y695 HydrophobicContact CG1-CD2 3.8Å; V579-Y695 HydrophobicContact CG1-CE1 3.84Å; V579-Y695 HydrophobicContact CG1-CE2 3.76Å; V579-Y695 HydrophobicContact CG1-CG 3.88Å
580	K	92.5	Very high	89.9	Confident	10 Å²	10	27.2 Å²	27.2	4%	0.043	15%	0.145	C	C	.	.	H	α-helix	trans	-64.8	-40.9	173.4	173.3	170.1	177.5	178.9	0	113	L576 Q577 S578 Y582 L584 N586 E760 W763	L576-K580 PolarHBondContact O-N 2.89Å; Q577-K580 PolarHBondContact O-N 3.49Å; S578-K580 VanDerWaalsContact C-N 3.31Å; S578-K580 PolarHBondContact O-N 3.36Å; K580-Y582 VanDerWaalsContact C-N 3.34Å; K580-Y582 PolarHBondContact O-N 3.44Å; K580-L584 HydrophobicContact CB-CD1 4.25Å; K580-L584 HydrophobicContact CG-CB 4.36Å; K580-L584 HydrophobicContact CG-CD1 4.24Å; K580-L584 WeakPolarHBondContact O-CB 3.22Å; K580-L584 PolarHBondContact O-N 2.92Å; K580-N586 HydrophobicContact CG-CB 4.01Å; K580-N586 WeakPolarHBondContact O-CB 3.46Å; K580-E760 WeakPolarHBondContact CE-OE2 3.25Å; K580-E760 IonicContact NZ-OE1 3.64Å; K580-E760 PolarHBondContact NZ-OE1 3.22Å; K580-E760 IonicContact NZ-OE2 3.71Å; K580-E760 PolarHBondContact NZ-OE2 2.94Å; K580-W763 HydrophobicContact CB-CH2 3.89Å; K580-W763 HydrophobicContact CB-CZ2 4.03Å; K580-W763 HydrophobicContact CB-CZ3 4.17Å; K580-W763 HydrophobicContact CD-CD2 3.49Å; K580-W763 VanDerWaalsContact CD-CD2 3.49Å; K580-W763 HydrophobicContact CD-CE3 4.07Å; K580-W763 HydrophobicContact CD-CG 3.74Å; K580-W763 HydrophobicContact CD-CH2 4.35Å; K580-W763 HydrophobicContact CD-CZ2 3.83Å; K580-W763 HydrophobicContact CD-CZ3 4.46Å
581	R	90.5	Very high	90.3	Very high	63 Å²	63	25.4 Å²	25.4	24%	0.238	14%	0.136	C	C	.	.	H	α-helix	trans	-60.4	-43.5	-179.1	-74.8	171.1	-164.8	168.1	8.8	111.8	Q577 S578 N586 Q587 D630	Q577-R581 VanDerWaalsContact O-CG 3.31Å; Q577-R581 WeakPolarHBondContact O-CG 3.36Å; Q577-R581 PolarHBondContact O-N 3.39Å; S578-R581 PolarHBondContact O-N 3.15Å; R581-N586 PolarHBondContact O-N 2.93Å; R581-Q587 HydrophobicContact CB-CB 4.18Å; R581-Q587 WeakPolarHBondContact O-CB 3.45Å; R581-Q587 PolarHBondContact O-N 2.97Å; R581-D630 IonicContact CZ-OD1 3.89Å; R581-D630 IonicContact NH1-OD1 3.17Å; R581-D630 PolarHBondContact NH1-OD1 3.27Å; R581-D630 IonicContact NH1-OD2 2.7Å; R581-D630 PolarHBondContact NH1-OD2 3.42Å
582	Y	90.9	Very high	90.3	Very high	1 Å²	1	26 Å²	26	0%	0.004	14%	0.137	C	C	.	.	H	α-helix	trans	-97.6	-54.5	-173.7	-53.2	-60.9	0	0	0	113.7	S578 K580 L585 F590 L622 A627 D630 K633 L636	S578-Y582 WeakPolarHBondContact O-CD2 3.4Å; S578-Y582 PolarHBondContact O-N 2.71Å; K580-Y582 VanDerWaalsContact C-N 3.34Å; K580-Y582 PolarHBondContact O-N 3.44Å; Y582-L585 PolarHBondContact O-N 3.45Å; Y582-F590 AromaticContact CD1-CD1 3.79Å; Y582-F590 HydrophobicContact CD1-CD1 3.79Å; Y582-F590 AromaticContact CD1-CE1 3.74Å; Y582-F590 HydrophobicContact CD1-CE1 3.74Å; Y582-F590 HydrophobicContact CD1-CZ 4.46Å; Y582-F590 HydrophobicContact CE1-CD1 4.2Å; Y582-F590 HydrophobicContact CE1-CE1 4.39Å; Y582-L622 HydrophobicContact CD1-CD2 4.37Å; Y582-L622 HydrophobicContact CE1-CD2 3.66Å; Y582-A627 HydrophobicContact CE1-CB 3.89Å; Y582-D630 WeakPolarHBondContact CE2-OD2 3.41Å; Y582-D630 WeakPolarHBondContact OH-CB 3.16Å; Y582-D630 PolarHBondContact OH-OD2 2.73Å; Y582-K633 WeakPolarHBondContact OH-CB 3.49Å; Y582-L636 HydrophobicContact CD1-CD2 3.83Å; Y582-L636 HydrophobicContact CD2-CD1 4.46Å; Y582-L636 HydrophobicContact CD2-CD2 4.1Å; Y582-L636 HydrophobicContact CE1-CD2 4.39Å; Y582-L636 HydrophobicContact CG-CD1 4.31Å; Y582-L636 HydrophobicContact CG-CD2 3.67Å
583	L	91	Very high	90.3	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-26.4	-173.7	-72.3	80.4	0	0	0	112.8	V579 L636 F675 Y695 F699	V579-L583 HydrophobicContact CG1-CB 4.46Å; V579-L583 HydrophobicContact CG1-CD1 4.48Å; V579-L583 WeakPolarHBondContact O-CB 3.44Å; V579-L583 PolarHBondContact O-N 3.3Å; L583-L636 HydrophobicContact CD1-CD1 4.15Å; L583-F675 HydrophobicContact CG-CB 4.4Å; L583-Y695 HydrophobicContact CD2-CG 4.49Å; L583-F699 WeakPolarHBondContact O-CA 3.43Å; L583-F699 VanDerWaalsContact O-CB 3.31Å; L583-F699 WeakPolarHBondContact O-CB 3.43Å
584	L	91.4	Very high	90.4	Very high	6 Å²	6	26.8 Å²	26.8	3%	0.031	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.9	13	174.6	-57.9	176.8	0	0	0	113.5	K580 N586 Y695 L698 I759 F786	K580-L584 HydrophobicContact CB-CD1 4.25Å; K580-L584 HydrophobicContact CG-CB 4.36Å; K580-L584 HydrophobicContact CG-CD1 4.24Å; K580-L584 WeakPolarHBondContact O-CB 3.22Å; K580-L584 PolarHBondContact O-N 2.92Å; L584-N586 PolarHBondContact O-N 2.8Å; L584-N586 VanDerWaalsContact O-N 3.1Å; L584-Y695 HydrophobicContact CD1-CE1 4.15Å; L584-Y695 HydrophobicContact CD2-CD1 4.11Å; L584-Y695 HydrophobicContact CD2-CE1 4.47Å; L584-Y695 HydrophobicContact CG-CD1 4.29Å; L584-Y695 HydrophobicContact CG-CE1 4.4Å; L584-L698 HydrophobicContact CD2-CB 4.18Å; L584-L698 HydrophobicContact CD2-CD1 3.99Å; L584-I759 HydrophobicContact CB-CG2 4.35Å; L584-I759 HydrophobicContact CD1-CG2 3.97Å; L584-I759 HydrophobicContact CD2-CD1 4.38Å; L584-F786 HydrophobicContact CD1-CZ 4.15Å
585	L	89.4	Confident	90.4	Very high	11 Å²	11	26.5 Å²	26.5	6%	0.058	14%	0.137	C	C	.	.			trans	55.6	21.3	176.2	-53.7	-171.5	0	0	0	116.3	Y582 Q587 T591 F699 L702 K706 M755	Y582-L585 PolarHBondContact O-N 3.45Å; L585-Q587 PolarHBondContact O-N 3.19Å; L585-T591 HydrophobicContact CD1-CG2 4.41Å; L585-T591 HydrophobicContact CD2-CG2 3.83Å; L585-F699 HydrophobicContact CD2-CD2 3.81Å; L585-F699 HydrophobicContact CD2-CE2 3.57Å; L585-L702 HydrophobicContact CD1-CB 3.63Å; L585-L702 HydrophobicContact CG-CB 4.22Å; L585-K706 HydrophobicContact CD1-CG 4.21Å; L585-M755 HydrophobicContact CB-CE 4.07Å; L585-M755 HydrophobicContact CD1-CE 4Å
586	N	89.3	Confident	90.2	Very high	89 Å²	89	30.2 Å²	30.2	48%	0.476	16%	0.158	S	C	.	.			trans	-63.4	-30.8	179.2	-175.1	42.6	0	0	0	112.1	K580 R581 L584 G588	K580-N586 HydrophobicContact CG-CB 4.01Å; K580-N586 WeakPolarHBondContact O-CB 3.46Å; R581-N586 PolarHBondContact O-N 2.93Å; L584-N586 PolarHBondContact O-N 2.8Å; L584-N586 VanDerWaalsContact O-N 3.1Å; N586-G588 PolarHBondContact O-N 3.39Å; N586-G588 VanDerWaalsContact O-N 3.13Å
587	Q	87.7	Confident	90.1	Very high	48 Å²	48	32 Å²	32	22%	0.224	17%	0.172	C	C	.	.			trans	-86.4	79.3	175.9	-159	62.9	42.5	0	0	110.8	R581 L585 D589 F590 T591	R581-Q587 HydrophobicContact CB-CB 4.18Å; R581-Q587 WeakPolarHBondContact O-CB 3.45Å; R581-Q587 PolarHBondContact O-N 2.97Å; L585-Q587 PolarHBondContact O-N 3.19Å; Q587-D589 WeakPolarHBondContact CG-OD1 3.16Å; Q587-D589 PolarHBondContact NE2-OD1 3.44Å; Q587-D589 PolarHBondContact O-N 3.45Å; Q587-F590 HydrophobicContact CB-CB 4.41Å; Q587-F590 HydrophobicContact CG-CB 4Å; Q587-F590 PolarHBondContact O-N 2.9Å; Q587-T591 PolarHBondContact O-N 3.47Å; Q587-T591 VanDerWaalsContact O-N 3.14Å; Q587-T591 PolarHBondContact O-OG1 2.87Å
588	G	86.9	Confident	90	Very high	37 Å²	37	28 Å²	28	38%	0.381	15%	0.154	S	C	.	.	H	α-helix	trans	-65.1	-31.3	-173.2	0	0	0	0	0	115.5	N586 T591 M592	N586-G588 PolarHBondContact O-N 3.39Å; N586-G588 VanDerWaalsContact O-N 3.13Å; G588-T591 PolarHBondContact O-N 3.15Å; G588-M592 WeakPolarHBondContact O-CB 3.35Å; G588-M592 VanDerWaalsContact O-CG 3.26Å; G588-M592 WeakPolarHBondContact O-CG 3.4Å; G588-M592 PolarHBondContact O-N 2.79Å
589	D	89.9	Confident	89.7	Confident	49 Å²	49	29.2 Å²	29.2	26%	0.262	16%	0.159	S	C	.	.	H	α-helix	trans	-68.3	-44.4	178.6	69.9	-41.5	0	0	0	112	Q587 Q593 S626	Q587-D589 WeakPolarHBondContact CG-OD1 3.16Å; Q587-D589 PolarHBondContact NE2-OD1 3.44Å; Q587-D589 PolarHBondContact O-N 3.45Å; D589-Q593 VanDerWaalsContact O-CG 3.3Å; D589-Q593 WeakPolarHBondContact O-CG 3.41Å; D589-Q593 PolarHBondContact O-N 2.83Å; D589-Q593 VanDerWaalsContact O-N 3.09Å; D589-S626 WeakPolarHBondContact OD2-CB 3.29Å; D589-S626 PolarHBondContact OD2-N 3.33Å; D589-S626 PolarHBondContact OD2-OG 2.86Å
590	F	91.9	Very high	89.3	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-51.3	170.4	162.4	-107.4	0	0	0	111	Y582 Q587 M592 Q593 F594 L618 L622 A627 L636 F675	Y582-F590 AromaticContact CD1-CD1 3.79Å; Y582-F590 HydrophobicContact CD1-CD1 3.79Å; Y582-F590 AromaticContact CD1-CE1 3.74Å; Y582-F590 HydrophobicContact CD1-CE1 3.74Å; Y582-F590 HydrophobicContact CD1-CZ 4.46Å; Y582-F590 HydrophobicContact CE1-CD1 4.2Å; Y582-F590 HydrophobicContact CE1-CE1 4.39Å; Q587-F590 HydrophobicContact CB-CB 4.41Å; Q587-F590 HydrophobicContact CG-CB 4Å; Q587-F590 PolarHBondContact O-N 2.9Å; F590-M592 VanDerWaalsContact C-N 3.32Å; F590-M592 PolarHBondContact O-N 3.28Å; F590-Q593 PolarHBondContact O-N 3.26Å; F590-F594 HydrophobicContact CE2-CB 4.09Å; F590-F594 HydrophobicContact CE2-CD2 4.49Å; F590-F594 HydrophobicContact CZ-CB 4.19Å; F590-F594 HydrophobicContact CZ-CD2 4.44Å; F590-F594 HydrophobicContact CZ-CG 4.33Å; F590-F594 WeakPolarHBondContact O-CB 3.32Å; F590-F594 PolarHBondContact O-N 3.28Å; F590-L618 HydrophobicContact CE2-CD1 3.85Å; F590-L618 HydrophobicContact CZ-CD1 3.58Å; F590-L622 HydrophobicContact CD2-CD2 3.77Å; F590-L622 HydrophobicContact CD2-CG 4.33Å; F590-L622 HydrophobicContact CE2-CD2 3.49Å; F590-L622 VanDerWaalsContact CE2-CD2 3.49Å; F590-L622 HydrophobicContact CE2-CG 3.78Å; F590-L622 HydrophobicContact CG-CD2 4.45Å; F590-L622 HydrophobicContact CZ-CD2 3.96Å; F590-L622 HydrophobicContact CZ-CG 4.43Å; F590-A627 HydrophobicContact CB-CB 4.27Å; F590-A627 HydrophobicContact CG-CB 4.5Å; F590-L636 HydrophobicContact CZ-CD2 4.27Å; F590-F675 HydrophobicContact CE1-CE2 4.11Å; F590-F675 HydrophobicContact CE1-CZ 4.11Å; F590-F675 HydrophobicContact CZ-CE2 4.35Å; F590-F675 AromaticContact CZ-CZ 3.89Å; F590-F675 HydrophobicContact CZ-CZ 3.89Å
591	T	89.3	Confident	88.9	Confident	7 Å²	7	36.5 Å²	36.5	4%	0.043	20%	0.198	C	C	.	.	H	α-helix	trans	-58.1	-45.3	-176.9	-55.7	0	0	0	0	111.3	L585 Q587 G588 F594 M595	L585-T591 HydrophobicContact CD1-CG2 4.41Å; L585-T591 HydrophobicContact CD2-CG2 3.83Å; Q587-T591 PolarHBondContact O-N 3.47Å; Q587-T591 VanDerWaalsContact O-N 3.14Å; Q587-T591 PolarHBondContact O-OG1 2.87Å; G588-T591 PolarHBondContact O-N 3.15Å; T591-F594 PolarHBondContact O-N 3.44Å; T591-M595 HydrophobicContact CG2-SD 4.09Å; T591-M595 WeakPolarHBondContact O-CB 3.43Å; T591-M595 VanDerWaalsContact O-CG 3.25Å; T591-M595 WeakPolarHBondContact O-CG 3.5Å; T591-M595 PolarHBondContact O-N 3.22Å
592	M	88.5	Confident	88.6	Confident	72 Å²	72	33.8 Å²	33.8	36%	0.355	19%	0.188	S	C	.	.	H	α-helix	trans	-64.6	-46.8	178.1	-69.7	-68.8	167.1	0	0	112	G588 F590 F594 M595 D596 K706	G588-M592 WeakPolarHBondContact O-CB 3.35Å; G588-M592 VanDerWaalsContact O-CG 3.26Å; G588-M592 WeakPolarHBondContact O-CG 3.4Å; G588-M592 PolarHBondContact O-N 2.79Å; F590-M592 VanDerWaalsContact C-N 3.32Å; F590-M592 PolarHBondContact O-N 3.28Å; M592-F594 VanDerWaalsContact C-N 3.32Å; M592-F594 PolarHBondContact O-N 2.88Å; M592-M595 PolarHBondContact O-N 3.45Å; M592-D596 WeakPolarHBondContact O-CB 3.36Å; M592-D596 VanDerWaalsContact O-CG 3.27Å; M592-D596 PolarHBondContact O-N 3.29Å; M592-K706 HydrophobicContact CE-CD 4.45Å
593	Q	90.5	Very high	88.2	Confident	58 Å²	58	37.5 Å²	37.5	27%	0.271	21%	0.211	S	C	.	.	H	α-helix	trans	-61.7	-38.8	177.1	-70.9	176.4	16.6	0	0	112.5	D589 F590 A597 S625	D589-Q593 VanDerWaalsContact O-CG 3.3Å; D589-Q593 WeakPolarHBondContact O-CG 3.41Å; D589-Q593 PolarHBondContact O-N 2.83Å; D589-Q593 VanDerWaalsContact O-N 3.09Å; F590-Q593 PolarHBondContact O-N 3.26Å; Q593-A597 VanDerWaalsContact O-CB 3.32Å; Q593-A597 WeakPolarHBondContact O-CB 3.24Å; Q593-A597 PolarHBondContact O-N 3.21Å; Q593-S625 VanDerWaalsContact OE1-N 3.17Å
594	F	91.6	Very high	87.9	Confident	1 Å²	1	41 Å²	41	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-65.5	-44.9	176	-179.8	-96.5	0	0	0	112	F590 T591 M592 A597 C598 L618 F673 F675 F703	F590-F594 HydrophobicContact CE2-CB 4.09Å; F590-F594 HydrophobicContact CE2-CD2 4.49Å; F590-F594 HydrophobicContact CZ-CB 4.19Å; F590-F594 HydrophobicContact CZ-CD2 4.44Å; F590-F594 HydrophobicContact CZ-CG 4.33Å; F590-F594 WeakPolarHBondContact O-CB 3.32Å; F590-F594 PolarHBondContact O-N 3.28Å; T591-F594 PolarHBondContact O-N 3.44Å; M592-F594 VanDerWaalsContact C-N 3.32Å; M592-F594 PolarHBondContact O-N 2.88Å; F594-A597 PolarHBondContact O-N 3.4Å; F594-C598 HydrophobicContact CE1-CB 4.49Å; F594-C598 WeakPolarHBondContact CE2-SG 3.42Å; F594-C598 HydrophobicContact CZ-CB 4.4Å; F594-C598 VanDerWaalsContact CZ-SG 3.56Å; F594-C598 WeakPolarHBondContact O-CB 3.48Å; F594-C598 PolarHBondContact O-N 2.95Å; F594-C598 PolarHBondContact O-SG 3.39Å; F594-L618 HydrophobicContact CD2-CB 4.49Å; F594-L618 HydrophobicContact CD2-CD1 4.02Å; F594-L618 HydrophobicContact CE2-CB 3.97Å; F594-L618 HydrophobicContact CE2-CD1 4Å; F594-F673 AromaticContact CE1-CE1 3.6Å; F594-F673 HydrophobicContact CE1-CE1 3.6Å; F594-F673 HydrophobicContact CE1-CE2 4.36Å; F594-F673 AromaticContact CE1-CZ 3.45Å; F594-F673 HydrophobicContact CE1-CZ 3.45Å; F594-F673 VanDerWaalsContact CE1-CZ 3.45Å; F594-F673 AromaticContact CZ-CE1 4Å; F594-F673 HydrophobicContact CZ-CE1 4Å; F594-F673 AromaticContact CZ-CE2 3.96Å; F594-F673 HydrophobicContact CZ-CE2 3.96Å; F594-F673 AromaticContact CZ-CZ 3.33Å; F594-F673 HydrophobicContact CZ-CZ 3.33Å; F594-F675 AromaticContact CD1-CZ 3.86Å; F594-F675 HydrophobicContact CD1-CZ 3.86Å; F594-F675 HydrophobicContact CD2-CZ 4.37Å; F594-F675 HydrophobicContact CE1-CE1 4.2Å; F594-F675 AromaticContact CE1-CZ 3.71Å; F594-F675 HydrophobicContact CE1-CZ 3.71Å; F594-F675 HydrophobicContact CE2-CE1 4.27Å; F594-F675 HydrophobicContact CE2-CZ 4.25Å; F594-F675 HydrophobicContact CG-CZ 4.2Å; F594-F675 AromaticContact CZ-CE1 3.99Å; F594-F675 HydrophobicContact CZ-CE1 3.99Å; F594-F675 AromaticContact CZ-CZ 3.93Å; F594-F675 HydrophobicContact CZ-CZ 3.93Å; F594-F703 HydrophobicContact CD1-CE2 4.29Å; F594-F703 HydrophobicContact CE1-CE2 4.38Å; F594-F703 HydrophobicContact CE1-CZ 4.26Å
595	M	88.9	Confident	87.4	Confident	3 Å²	3	44.9 Å²	44.9	2%	0.015	25%	0.247	C	C	.	.	H	α-helix	trans	-68.6	-31.9	177	-69.1	-175.8	96.3	0	0	113.3	T591 M592 E599 F703 K706 H707 R710	T591-M595 HydrophobicContact CG2-SD 4.09Å; T591-M595 WeakPolarHBondContact O-CB 3.43Å; T591-M595 VanDerWaalsContact O-CG 3.25Å; T591-M595 WeakPolarHBondContact O-CG 3.5Å; T591-M595 PolarHBondContact O-N 3.22Å; M592-M595 PolarHBondContact O-N 3.45Å; M595-E599 PolarHBondContact O-N 3.14Å; M595-F703 HydrophobicContact CE-CD2 3.94Å; M595-F703 HydrophobicContact CE-CE1 4.36Å; M595-F703 HydrophobicContact CE-CE2 3.69Å; M595-F703 HydrophobicContact CE-CG 4.39Å; M595-F703 HydrophobicContact CE-CZ 3.92Å; M595-F703 HydrophobicContact CG-CD2 4.34Å; M595-F703 HydrophobicContact CG-CE2 3.49Å; M595-F703 VanDerWaalsContact CG-CE2 3.49Å; M595-F703 HydrophobicContact CG-CZ 4Å; M595-F703 HydrophobicContact SD-CD2 4.1Å; M595-F703 HydrophobicContact SD-CE2 3.82Å; M595-K706 HydrophobicContact CE-CB 4.47Å; M595-K706 HydrophobicContact SD-CB 4.33Å; M595-H707 HydrophobicContact CE-CB 3.58Å; M595-R710 PolarHBondContact O-NH1 3.36Å
596	D	88.8	Confident	86.8	Confident	93 Å²	93	46.2 Å²	46.2	50%	0.497	26%	0.255	S	S	.	.	H	α-helix	trans	-65.8	-46.2	170.8	-71.9	-25.4	0	0	0	110.8	M592 R710	M592-D596 WeakPolarHBondContact O-CB 3.36Å; M592-D596 VanDerWaalsContact O-CG 3.27Å; M592-D596 PolarHBondContact O-N 3.29Å; D596-R710 IonicContact OD1-CZ 3.83Å; D596-R710 IonicContact OD1-NE 2.68Å; D596-R710 PolarHBondContact OD1-NE 2.95Å; D596-R710 IonicContact OD1-NH2 2.67Å; D596-R710 PolarHBondContact OD1-NH2 3.46Å
597	A	88.9	Confident	86.2	Confident	38 Å²	38	47.8 Å²	47.8	31%	0.314	26%	0.263	S	S	.	.	H	α-helix	trans	-72	-29.5	-176.8	0	0	0	0	0	114.2	Q593 F594 L617 T621	Q593-A597 VanDerWaalsContact O-CB 3.32Å; Q593-A597 WeakPolarHBondContact O-CB 3.24Å; Q593-A597 PolarHBondContact O-N 3.21Å; F594-A597 PolarHBondContact O-N 3.4Å; A597-L617 HydrophobicContact CB-CD2 4.34Å; A597-T621 HydrophobicContact CB-CG2 3.72Å
598	C	87.9	Confident	85.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	4.2	-175.2	-56.2	0	0	0	0	114.3	F594 D600 E601 L602 L614	F594-C598 HydrophobicContact CE1-CB 4.49Å; F594-C598 WeakPolarHBondContact CE2-SG 3.42Å; F594-C598 HydrophobicContact CZ-CB 4.4Å; F594-C598 VanDerWaalsContact CZ-SG 3.56Å; F594-C598 WeakPolarHBondContact O-CB 3.48Å; F594-C598 PolarHBondContact O-N 2.95Å; F594-C598 PolarHBondContact O-SG 3.39Å; C598-D600 VanDerWaalsContact C-N 3.34Å; C598-D600 PolarHBondContact O-N 2.91Å; C598-E601 PolarHBondContact O-N 3.19Å; C598-L602 HydrophobicContact CB-CD1 3.67Å; C598-L602 HydrophobicContact CB-CG 3.97Å; C598-L602 WeakPolarHBondContact O-CB 3.42Å; C598-L602 WeakPolarHBondContact O-CG 3.38Å; C598-L602 PolarHBondContact O-N 2.8Å; C598-L614 HydrophobicContact CB-CD2 4.27Å
599	E	85.1	Confident	85.7	Confident	24 Å²	24	50.2 Å²	50.2	11%	0.112	27%	0.266	C	S	.	.	H	α-helix	trans	-57.5	-44.5	-176.7	-172	171.8	173.5	0	0	112.5	M595 E601 T603 R710 Q711 K714	M595-E599 PolarHBondContact O-N 3.14Å; E599-E601 VanDerWaalsContact C-N 3.33Å; E599-E601 PolarHBondContact O-N 2.89Å; E599-T603 WeakPolarHBondContact O-CB 3.26Å; E599-T603 VanDerWaalsContact O-CG2 3.24Å; E599-T603 WeakPolarHBondContact O-CG2 3.3Å; E599-T603 PolarHBondContact O-N 3.21Å; E599-T603 PolarHBondContact O-OG1 3.32Å; E599-R710 IonicContact OE2-CZ 2.68Å; E599-R710 VanDerWaalsContact OE2-CZ 3.22Å; E599-R710 IonicContact OE2-NH1 2.68Å; E599-R710 PolarHBondContact OE2-NH1 3.2Å; E599-R710 IonicContact OE2-NH2 3.31Å; E599-R710 PolarHBondContact OE2-NH2 3.16Å; E599-Q711 PolarHBondContact OE1-NE2 3.04Å; E599-K714 IonicContact OE1-NZ 2.82Å; E599-K714 PolarHBondContact OE1-NZ 2.95Å; E599-K714 IonicContact OE2-NZ 2.84Å
600	D	84.1	Confident	85.4	Confident	129 Å²	129	53 Å²	53	69%	0.69	28%	0.279	S	S	*	.	H	α-helix	trans	-71.5	-25.2	-178.7	-65.4	-24.1	0	0	0	113.3	C598 T603 K604	C598-D600 VanDerWaalsContact C-N 3.34Å; C598-D600 PolarHBondContact O-N 2.91Å; D600-T603 PolarHBondContact O-OG1 2.76Å; D600-K604 WeakPolarHBondContact O-CE 3.35Å
601	E	84.3	Confident	85.1	Confident	37 Å²	37	56.2 Å²	56.2	17%	0.173	30%	0.3	C	S	.	.	H	α-helix	trans	-86.5	-44.6	176.4	-67.7	-58.9	137.7	0	0	111.6	C598 E599 T603 K604 L614 L617	C598-E601 PolarHBondContact O-N 3.19Å; E599-E601 VanDerWaalsContact C-N 3.33Å; E599-E601 PolarHBondContact O-N 2.89Å; E601-T603 VanDerWaalsContact C-N 3.3Å; E601-T603 PolarHBondContact O-N 3.09Å; E601-K604 WeakPolarHBondContact O-CB 3.17Å; E601-K604 PolarHBondContact O-N 3.4Å; E601-K604 IonicContact OE1-NZ 2.71Å; E601-K604 PolarHBondContact OE1-NZ 3.39Å; E601-K604 IonicContact OE2-NZ 3.82Å; E601-K604 PolarHBondContact OE2-NZ 3.07Å; E601-L614 HydrophobicContact CB-CD2 3.98Å; E601-L617 HydrophobicContact CG-CD1 4.2Å
602	L	84.8	Confident	85	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.026	33%	0.33	C	S	.	.	H	α-helix	trans	-72.1	-21.3	-176.6	-67.9	172.5	0	0	0	113.5	C598 K604 L614 S668 G669 L670 F673 F703	C598-L602 HydrophobicContact CB-CD1 3.67Å; C598-L602 HydrophobicContact CB-CG 3.97Å; C598-L602 WeakPolarHBondContact O-CB 3.42Å; C598-L602 WeakPolarHBondContact O-CG 3.38Å; C598-L602 PolarHBondContact O-N 2.8Å; L602-K604 VanDerWaalsContact C-N 3.29Å; L602-L614 HydrophobicContact CD2-CD1 4.42Å; L602-L614 HydrophobicContact CD2-CD2 4.2Å; L602-L614 HydrophobicContact CG-CD2 4.42Å; L602-S668 PolarHBondContact O-OG 3.03Å; L602-G669 CarbonylContact O-C 3.57Å; L602-G669 WeakPolarHBondContact O-CA 3.22Å; L602-G669 PolarHBondContact O-N 2.84Å; L602-L670 HydrophobicContact CB-CB 4.46Å; L602-L670 HydrophobicContact CB-CD1 4.41Å; L602-L670 HydrophobicContact CD1-CD1 4.37Å; L602-L670 PolarHBondContact O-N 3.2Å; L602-F673 HydrophobicContact CD2-CB 3.87Å; L602-F673 HydrophobicContact CD2-CD2 3.94Å; L602-F673 HydrophobicContact CD2-CG 3.9Å; L602-F703 HydrophobicContact CD1-CE1 4.28Å; L602-F703 HydrophobicContact CD1-CZ 3.99Å
603	T	81.5	Confident	85	Confident	79 Å²	79	61 Å²	61	49%	0.485	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-16.6	174.1	45.2	0	0	0	0	113.4	E599 D600 E601	E599-T603 WeakPolarHBondContact O-CB 3.26Å; E599-T603 VanDerWaalsContact O-CG2 3.24Å; E599-T603 WeakPolarHBondContact O-CG2 3.3Å; E599-T603 PolarHBondContact O-N 3.21Å; E599-T603 PolarHBondContact O-OG1 3.32Å; D600-T603 PolarHBondContact O-OG1 2.76Å; E601-T603 VanDerWaalsContact C-N 3.3Å; E601-T603 PolarHBondContact O-N 3.09Å
604	K	84.3	Confident	84.8	Confident	75 Å²	75	58.2 Å²	58.2	33%	0.326	31%	0.313	S	S	.	.	S	Bend	trans	-70.7	161.4	175.5	-57.2	174.5	-170.7	170	0	111.4	D600 E601 L602 H608 V609 G669	D600-K604 WeakPolarHBondContact O-CE 3.35Å; E601-K604 WeakPolarHBondContact O-CB 3.17Å; E601-K604 PolarHBondContact O-N 3.4Å; E601-K604 IonicContact OE1-NZ 2.71Å; E601-K604 PolarHBondContact OE1-NZ 3.39Å; E601-K604 IonicContact OE2-NZ 3.82Å; E601-K604 PolarHBondContact OE2-NZ 3.07Å; L602-K604 VanDerWaalsContact C-N 3.29Å; K604-H608 HydrophobicContact CB-CB 4.31Å; K604-V609 HydrophobicContact CB-CG2 4.21Å; K604-G669 PolarHBondContact O-N 3.17Å
605	N	81.4	Confident	84.7	Confident	87 Å²	87	60.9 Å²	60.9	47%	0.465	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-66.8	147	167	-64.3	-17.1	0	0	0	109.9	D607 H608 V609	N605-D607 VanDerWaalsContact C-N 3.28Å; N605-D607 PolarHBondContact O-N 3.29Å; N605-D607 VanDerWaalsContact O-N 3.17Å; N605-H608 PolarHBondContact O-N 3.41Å; N605-V609 PolarHBondContact O-N 2.93Å
606	V	76.3	Confident	84.8	Confident	39 Å²	39	66.3 Å²	66.3	24%	0.236	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-51.9	-41.6	-174.7	171	0	0	0	0	113.6	H608 V609 L667 C672	V606-H608 PolarHBondContact O-N 3.06Å; V606-V609 PolarHBondContact O-N 3.13Å; V606-V609 VanDerWaalsContact O-N 3.09Å; V606-L667 HydrophobicContact CG2-CB 4.18Å; V606-L667 WeakPolarHBondContact CG2-O 3.47Å; V606-L667 PolarHBondContact N-O 2.84Å; V606-C672 HydrophobicContact CG2-CB 3.62Å; V606-C672 VanDerWaalsContact CG2-SG 3.55Å
607	D	77.7	Confident	84.9	Confident	122 Å²	122	63.9 Å²	63.9	65%	0.652	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-63.6	-10.9	178.4	-73	-19.4	0	0	0	114	N605 R664	N605-D607 VanDerWaalsContact C-N 3.28Å; N605-D607 PolarHBondContact O-N 3.29Å; N605-D607 VanDerWaalsContact O-N 3.17Å; D607-R664 IonicContact OD1-NH1 2.86Å; D607-R664 IonicContact OD2-NH1 2.76Å
608	H	81.1	Confident	85	Confident	127 Å²	127	62.2 Å²	62.2	59%	0.588	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-110.7	-2.4	177.4	-60.9	-36	0	0	0	113.9	K604 N605 V606	K604-H608 HydrophobicContact CB-CB 4.31Å; N605-H608 PolarHBondContact O-N 3.41Å; V606-H608 PolarHBondContact O-N 3.06Å
609	V	82.3	Confident	85.1	Confident	10 Å²	10	63.4 Å²	63.4	6%	0.061	34%	0.339	C	S	.	.			trans	-84.4	127.3	177	-174.6	0	0	0	0	109	K604 N605 V606 P611 L614 L640	K604-V609 HydrophobicContact CB-CG2 4.21Å; N605-V609 PolarHBondContact O-N 2.93Å; V606-V609 PolarHBondContact O-N 3.13Å; V606-V609 VanDerWaalsContact O-N 3.09Å; V609-P611 WeakPolarHBondContact O-CD 3.34Å; V609-L614 HydrophobicContact CG1-CD1 3.64Å; V609-L614 HydrophobicContact CG1-CG 4.05Å; V609-L640 HydrophobicContact CB-CD1 4.24Å; V609-L640 HydrophobicContact CG1-CD1 3.87Å; V609-L640 HydrophobicContact CG1-CD2 4.37Å
610	L	83.4	Confident	85.3	Confident	106 Å²	106	66 Å²	66	56%	0.555	35%	0.354	S	S	*	.			trans	-92.7	117.1	177	-65.6	174	0	0	0	109.7	M612 T613 L614	L610-M612 PolarHBondContact O-N 3.39Å; L610-T613 HydrophobicContact CB-CG2 3.93Å; L610-T613 HydrophobicContact CD1-CG2 4.09Å; L610-T613 PolarHBondContact O-N 3.28Å; L610-T613 PolarHBondContact O-OG1 3.47Å; L610-L614 PolarHBondContact O-N 2.95Å
611	P	85.5	Confident	85.6	Confident	68 Å²	68	60 Å²	60	44%	0.442	32%	0.322	S	S	.	.	H	α-helix	trans	-57.3	-38.8	179.7	-22.7	30.7	0	0	0	112.3	V609 T613 L614 E615 L640	V609-P611 WeakPolarHBondContact O-CD 3.34Å; P611-T613 VanDerWaalsContact C-N 3.29Å; P611-T613 PolarHBondContact O-N 3.31Å; P611-L614 PolarHBondContact O-N 3.42Å; P611-E615 PolarHBondContact O-N 2.68Å; P611-L640 HydrophobicContact CB-CD1 4.5Å; P611-L640 HydrophobicContact CG-CD1 4.09Å
612	M	87	Confident	85.9	Confident	136 Å²	136	58.8 Å²	58.8	67%	0.67	32%	0.316	S	S	*	.	H	α-helix	trans	-63.1	-29.1	178.4	-61.7	-70.5	108.4	0	0	113.5	L610 N616	L610-M612 PolarHBondContact O-N 3.39Å; M612-N616 WeakPolarHBondContact O-CB 3.42Å; M612-N616 PolarHBondContact O-N 3.06Å; M612-N616 PolarHBondContact O-ND2 2.97Å
613	T	88.6	Confident	86.1	Confident	43 Å²	43	66.6 Å²	66.6	26%	0.264	35%	0.346	S	S	.	.	H	α-helix	trans	-76.9	-42.1	176.7	58.2	0	0	0	0	110.4	L610 P611 E615 N616 L617	L610-T613 HydrophobicContact CB-CG2 3.93Å; L610-T613 HydrophobicContact CD1-CG2 4.09Å; L610-T613 PolarHBondContact O-N 3.28Å; L610-T613 PolarHBondContact O-OG1 3.47Å; P611-T613 VanDerWaalsContact C-N 3.29Å; P611-T613 PolarHBondContact O-N 3.31Å; T613-E615 VanDerWaalsContact C-N 3.34Å; T613-E615 PolarHBondContact O-N 2.98Å; T613-N616 PolarHBondContact O-N 3.39Å; T613-L617 WeakPolarHBondContact O-CB 3.3Å; T613-L617 VanDerWaalsContact O-CG 3.24Å; T613-L617 WeakPolarHBondContact O-CG 3.35Å; T613-L617 PolarHBondContact O-N 2.94Å
614	L	87.8	Confident	86.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-57.6	-45	172.9	-66.2	-178.4	0	0	0	111.9	C598 E601 L602 V609 L610 P611 N616 L617 L618 C638 L640 F673	C598-L614 HydrophobicContact CB-CD2 4.27Å; E601-L614 HydrophobicContact CB-CD2 3.98Å; L602-L614 HydrophobicContact CD2-CD1 4.42Å; L602-L614 HydrophobicContact CD2-CD2 4.2Å; L602-L614 HydrophobicContact CG-CD2 4.42Å; V609-L614 HydrophobicContact CG1-CD1 3.64Å; V609-L614 HydrophobicContact CG1-CG 4.05Å; L610-L614 PolarHBondContact O-N 2.95Å; P611-L614 PolarHBondContact O-N 3.42Å; L614-N616 PolarHBondContact O-N 2.89Å; L614-L617 PolarHBondContact O-N 3.18Å; L614-L618 WeakPolarHBondContact O-CB 3.38Å; L614-L618 PolarHBondContact O-N 3.02Å; L614-C638 HydrophobicContact CB-CB 4.14Å; L614-L640 HydrophobicContact CD1-CD1 4.14Å; L614-L640 HydrophobicContact CD1-CD2 4.4Å; L614-L640 HydrophobicContact CD1-CG 4.35Å; L614-F673 HydrophobicContact CD1-CD2 4.07Å; L614-F673 HydrophobicContact CD1-CE2 4.21Å
615	E	89.3	Confident	86.6	Confident	58 Å²	58	65 Å²	65	27%	0.271	34%	0.337	S	S	.	.	H	α-helix	trans	-63.7	-39.9	179.7	-156.2	67.1	-170.4	0	0	112.1	P611 T613 L618 G619 H637 C638	P611-E615 PolarHBondContact O-N 2.68Å; T613-E615 VanDerWaalsContact C-N 3.34Å; T613-E615 PolarHBondContact O-N 2.98Å; E615-L618 PolarHBondContact O-N 3.21Å; E615-G619 PolarHBondContact O-N 2.95Å; E615-H637 WeakPolarHBondContact OE1-CA 3.49Å; E615-H637 IonicContact OE1-CE1 3.54Å; E615-H637 IonicContact OE1-CG 3.9Å; E615-H637 IonicContact OE1-ND1 2.79Å; E615-H637 PolarHBondContact OE1-ND1 2.99Å; E615-C638 VanDerWaalsContact OE2-CB 3.28Å; E615-C638 WeakPolarHBondContact OE2-CB 3.43Å; E615-C638 PolarHBondContact OE2-N 3.44Å
616	N	91.2	Very high	86.8	Confident	116 Å²	116	64.2 Å²	64.2	62%	0.62	34%	0.338	S	S	*	.	H	α-helix	trans	-67.4	-37.6	174.4	-80.2	-57.1	0	0	0	112.5	M612 T613 L614 L620	M612-N616 WeakPolarHBondContact O-CB 3.42Å; M612-N616 PolarHBondContact O-N 3.06Å; M612-N616 PolarHBondContact O-ND2 2.97Å; T613-N616 PolarHBondContact O-N 3.39Å; L614-N616 PolarHBondContact O-N 2.89Å; N616-L620 WeakPolarHBondContact O-CB 3.5Å; N616-L620 PolarHBondContact O-N 3.21Å
617	L	91.1	Very high	87.2	Confident	42 Å²	42	62.6 Å²	62.6	22%	0.22	33%	0.329	C	S	.	.	H	α-helix	trans	-69.3	-38.4	175.4	-69	168	0	0	0	111.6	A597 E601 T613 L614 L620 T621	A597-L617 HydrophobicContact CB-CD2 4.34Å; E601-L617 HydrophobicContact CG-CD1 4.2Å; T613-L617 WeakPolarHBondContact O-CB 3.3Å; T613-L617 VanDerWaalsContact O-CG 3.24Å; T613-L617 WeakPolarHBondContact O-CG 3.35Å; T613-L617 PolarHBondContact O-N 2.94Å; L614-L617 PolarHBondContact O-N 3.18Å; L617-L620 PolarHBondContact O-N 3.28Å; L617-T621 WeakPolarHBondContact O-CB 3.43Å; L617-T621 VanDerWaalsContact O-CG2 3.24Å; L617-T621 WeakPolarHBondContact O-CG2 3.43Å; L617-T621 PolarHBondContact O-N 3.04Å; L617-T621 PolarHBondContact O-OG1 3.39Å
618	L	90.7	Very high	87.5	Confident	3 Å²	3	64.9 Å²	64.9	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-59	-54.2	170.5	179.5	58.9	0	0	0	110.6	F590 F594 L614 E615 L620 T621 L622 L636 F675	F590-L618 HydrophobicContact CE2-CD1 3.85Å; F590-L618 HydrophobicContact CZ-CD1 3.58Å; F594-L618 HydrophobicContact CD2-CB 4.49Å; F594-L618 HydrophobicContact CD2-CD1 4.02Å; F594-L618 HydrophobicContact CE2-CB 3.97Å; F594-L618 HydrophobicContact CE2-CD1 4Å; L614-L618 WeakPolarHBondContact O-CB 3.38Å; L614-L618 PolarHBondContact O-N 3.02Å; E615-L618 PolarHBondContact O-N 3.21Å; L618-L620 PolarHBondContact O-N 3.41Å; L618-T621 PolarHBondContact O-N 3Å; L618-T621 VanDerWaalsContact O-N 3.17Å; L618-T621 PolarHBondContact O-OG1 3Å; L618-L622 HydrophobicContact CD1-CD1 3.9Å; L618-L622 HydrophobicContact CD1-CG 3.99Å; L618-L622 HydrophobicContact CG-CD1 3.87Å; L618-L622 HydrophobicContact CG-CG 4.39Å; L618-L622 WeakPolarHBondContact O-CB 3.47Å; L618-L622 WeakPolarHBondContact O-CG 3.31Å; L618-L622 PolarHBondContact O-N 3.13Å; L618-L636 HydrophobicContact CD1-CD2 4.03Å; L618-L636 HydrophobicContact CD2-CD2 4.43Å; L618-L636 HydrophobicContact CD2-CG 4.25Å; L618-L636 WeakPolarHBondContact CD2-O 3.4Å; L618-F675 HydrophobicContact CD1-CE1 3.72Å; L618-F675 HydrophobicContact CD1-CZ 4.14Å; L618-F675 HydrophobicContact CD2-CD1 4.5Å; L618-F675 HydrophobicContact CD2-CE1 4.16Å
619	G	88.9	Confident	87.6	Confident	25 Å²	25	65.5 Å²	65.5	26%	0.258	34%	0.336	S	S	.	.	H	α-helix	trans	-60.6	-28	177.9	0	0	0	0	0	113.6	E615 R623	E615-G619 PolarHBondContact O-N 2.95Å; G619-R623 WeakPolarHBondContact O-CG 3.36Å; G619-R623 PolarHBondContact O-NE 2.91Å; G619-R623 PolarHBondContact O-NH2 3.5Å
620	L	90.5	Very high	87.9	Confident	79 Å²	79	65.4 Å²	65.4	41%	0.414	34%	0.335	S	S	.	.	H	α-helix	trans	-74.7	-48.2	173.4	179.5	149.4	0	0	0	111.6	N616 L617 L618 R623 I624	N616-L620 WeakPolarHBondContact O-CB 3.5Å; N616-L620 PolarHBondContact O-N 3.21Å; L617-L620 PolarHBondContact O-N 3.28Å; L618-L620 PolarHBondContact O-N 3.41Å; L620-R623 WeakPolarHBondContact O-CB 3.37Å; L620-R623 PolarHBondContact O-N 2.96Å; L620-R623 VanDerWaalsContact O-N 3.09Å; L620-I624 HydrophobicContact CD2-CD1 3.49Å; L620-I624 VanDerWaalsContact CD2-CD1 3.49Å; L620-I624 HydrophobicContact CD2-CG1 4.43Å; L620-I624 HydrophobicContact CG-CD1 4.17Å; L620-I624 WeakPolarHBondContact O-CG1 3.24Å; L620-I624 PolarHBondContact O-N 3.19Å
621	T	90.1	Very high	88.1	Confident	3 Å²	3	65 Å²	65	2%	0.018	34%	0.339	C	S	.	.	H	α-helix	trans	-71.1	-34	-175.7	52.7	0	0	0	0	112.8	A597 L617 L618 R623 I624 S625	A597-T621 HydrophobicContact CB-CG2 3.72Å; L617-T621 WeakPolarHBondContact O-CB 3.43Å; L617-T621 VanDerWaalsContact O-CG2 3.24Å; L617-T621 WeakPolarHBondContact O-CG2 3.43Å; L617-T621 PolarHBondContact O-N 3.04Å; L617-T621 PolarHBondContact O-OG1 3.39Å; L618-T621 PolarHBondContact O-N 3Å; L618-T621 VanDerWaalsContact O-N 3.17Å; L618-T621 PolarHBondContact O-OG1 3Å; T621-R623 PolarHBondContact O-N 3.39Å; T621-I624 PolarHBondContact O-N 3.38Å; T621-S625 WeakPolarHBondContact O-CB 3.43Å; T621-S625 PolarHBondContact O-N 3.2Å; T621-S625 PolarHBondContact O-OG 2.84Å
622	L	90.2	Very high	88.2	Confident	11 Å²	11	64.1 Å²	64.1	6%	0.058	33%	0.327	C	S	.	.	H	α-helix	trans	-61.8	-24.9	168.6	-72.3	172.1	0	0	0	113.4	Y582 F590 L618 A627 R628 K633 L636	Y582-L622 HydrophobicContact CD1-CD2 4.37Å; Y582-L622 HydrophobicContact CE1-CD2 3.66Å; F590-L622 HydrophobicContact CD2-CD2 3.77Å; F590-L622 HydrophobicContact CD2-CG 4.33Å; F590-L622 HydrophobicContact CE2-CD2 3.49Å; F590-L622 VanDerWaalsContact CE2-CD2 3.49Å; F590-L622 HydrophobicContact CE2-CG 3.78Å; F590-L622 HydrophobicContact CG-CD2 4.45Å; F590-L622 HydrophobicContact CZ-CD2 3.96Å; F590-L622 HydrophobicContact CZ-CG 4.43Å; L618-L622 HydrophobicContact CD1-CD1 3.9Å; L618-L622 HydrophobicContact CD1-CG 3.99Å; L618-L622 HydrophobicContact CG-CD1 3.87Å; L618-L622 HydrophobicContact CG-CG 4.39Å; L618-L622 WeakPolarHBondContact O-CB 3.47Å; L618-L622 WeakPolarHBondContact O-CG 3.31Å; L618-L622 PolarHBondContact O-N 3.13Å; L622-A627 HydrophobicContact CD2-CB 4Å; L622-R628 PolarHBondContact O-N 3.04Å; L622-K633 HydrophobicContact CD2-CB 4.48Å; L622-L636 HydrophobicContact CD1-CD2 4.41Å; L622-L636 HydrophobicContact CD2-CD2 4.28Å
623	R	89	Confident	88.1	Confident	169 Å²	169	59.7 Å²	59.7	64%	0.638	30%	0.304	S	S	*	.	H	α-helix	trans	-86.9	-27.5	177.2	-79	-179.1	-76.7	179.7	-6.9	113.8	G619 L620 T621	G619-R623 WeakPolarHBondContact O-CG 3.36Å; G619-R623 PolarHBondContact O-NE 2.91Å; G619-R623 PolarHBondContact O-NH2 3.5Å; L620-R623 WeakPolarHBondContact O-CB 3.37Å; L620-R623 PolarHBondContact O-N 2.96Å; L620-R623 VanDerWaalsContact O-N 3.09Å; T621-R623 PolarHBondContact O-N 3.39Å
624	I	88.5	Confident	88	Confident	115 Å²	115	63.4 Å²	63.4	59%	0.59	32%	0.323	S	S	*	.	H	α-helix	trans	-85.6	-35.5	179.7	-63	177.7	0	0	0	111.7	L620 T621	L620-I624 HydrophobicContact CD2-CD1 3.49Å; L620-I624 VanDerWaalsContact CD2-CD1 3.49Å; L620-I624 HydrophobicContact CD2-CG1 4.43Å; L620-I624 HydrophobicContact CG-CD1 4.17Å; L620-I624 WeakPolarHBondContact O-CG1 3.24Å; L620-I624 PolarHBondContact O-N 3.19Å; T621-I624 PolarHBondContact O-N 3.38Å
625	S	88	Confident	88.1	Confident	6 Å²	6	64.1 Å²	64.1	4%	0.042	33%	0.326	C	S	.	.	S	Bend	trans	-79.7	169.5	-178.6	58.4	0	0	0	0	113.7	Q593 T621 A627 R628	Q593-S625 VanDerWaalsContact OE1-N 3.17Å; T621-S625 WeakPolarHBondContact O-CB 3.43Å; T621-S625 PolarHBondContact O-N 3.2Å; T621-S625 PolarHBondContact O-OG 2.84Å; S625-A627 PolarHBondContact O-N 3.38Å; S625-A627 VanDerWaalsContact O-N 3.09Å; S625-A627 WeakPolarHBondContact OG-CB 3.44Å; S625-R628 PolarHBondContact O-N 2.94Å; S625-R628 VanDerWaalsContact O-N 3.15Å
626	S	85.6	Confident	88.1	Confident	71 Å²	71	61.6 Å²	61.6	50%	0.497	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-61.8	-15.6	174.9	-47.7	0	0	0	0	113	D589 R628 N629	D589-S626 WeakPolarHBondContact OD2-CB 3.29Å; D589-S626 PolarHBondContact OD2-N 3.33Å; D589-S626 PolarHBondContact OD2-OG 2.86Å; S626-R628 PolarHBondContact O-N 2.76Å; S626-R628 VanDerWaalsContact O-N 3.12Å; S626-N629 PolarHBondContact O-N 2.94Å
627	A	84.2	Confident	88.1	Confident	5 Å²	5	59 Å²	59	4%	0.041	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-57.9	-17.8	171.9	0	0	0	0	0	113.7	Y582 F590 L622 S625 N629 D630	Y582-A627 HydrophobicContact CE1-CB 3.89Å; F590-A627 HydrophobicContact CB-CB 4.27Å; F590-A627 HydrophobicContact CG-CB 4.5Å; L622-A627 HydrophobicContact CD2-CB 4Å; S625-A627 PolarHBondContact O-N 3.38Å; S625-A627 VanDerWaalsContact O-N 3.09Å; S625-A627 WeakPolarHBondContact OG-CB 3.44Å; A627-N629 PolarHBondContact O-N 3.09Å; A627-D630 WeakPolarHBondContact O-CB 3.24Å; A627-D630 PolarHBondContact O-N 3.44Å
628	R	84.1	Confident	87.9	Confident	169 Å²	169	58 Å²	58	64%	0.638	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-50.7	-32	174.3	178.4	176.4	176.3	-179.6	-0.2	113.4	L622 S625 S626 D630 K633	L622-R628 PolarHBondContact O-N 3.04Å; S625-R628 PolarHBondContact O-N 2.94Å; S625-R628 VanDerWaalsContact O-N 3.15Å; S626-R628 PolarHBondContact O-N 2.76Å; S626-R628 VanDerWaalsContact O-N 3.12Å; R628-D630 VanDerWaalsContact C-N 3.29Å; R628-D630 PolarHBondContact O-N 3.06Å; R628-K633 PolarHBondContact O-NZ 3.43Å
629	N	84.6	Confident	87.7	Confident	141 Å²	141	61.3 Å²	61.3	75%	0.754	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-78.3	-7.8	-176.7	-64.6	-22.4	0	0	0	114.1	S626 A627	S626-N629 PolarHBondContact O-N 2.94Å; A627-N629 PolarHBondContact O-N 3.09Å
630	D	87.3	Confident	87.5	Confident	7 Å²	7	62.1 Å²	62.1	4%	0.037	31%	0.308	C	S	.	.			trans	-81.4	129.6	-179.5	-161.5	13.7	0	0	0	111.6	S578 R581 Y582 A627 R628 Y632 K633	S578-D630 WeakPolarHBondContact CB-OD2 3.31Å; S578-D630 VanDerWaalsContact OG-CG 3.25Å; S578-D630 PolarHBondContact OG-OD1 3.46Å; S578-D630 PolarHBondContact OG-OD2 2.89Å; R581-D630 IonicContact CZ-OD1 3.89Å; R581-D630 IonicContact NH1-OD1 3.17Å; R581-D630 PolarHBondContact NH1-OD1 3.27Å; R581-D630 IonicContact NH1-OD2 2.7Å; R581-D630 PolarHBondContact NH1-OD2 3.42Å; Y582-D630 WeakPolarHBondContact CE2-OD2 3.41Å; Y582-D630 WeakPolarHBondContact OH-CB 3.16Å; Y582-D630 PolarHBondContact OH-OD2 2.73Å; A627-D630 WeakPolarHBondContact O-CB 3.24Å; A627-D630 PolarHBondContact O-N 3.44Å; R628-D630 VanDerWaalsContact C-N 3.29Å; R628-D630 PolarHBondContact O-N 3.06Å; D630-Y632 VanDerWaalsContact C-N 3.33Å; D630-Y632 PolarHBondContact O-N 2.95Å; D630-K633 HydrophobicContact CB-CB 4.3Å; D630-K633 WeakPolarHBondContact O-CD 3.45Å
631	P	87.1	Confident	87	Confident	97 Å²	97	58.4 Å²	58.4	63%	0.63	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-33.9	176.4	-24.2	35.6	0	0	0	113.9
632	Y	88	Confident	86.3	Confident	51 Å²	51	63.6 Å²	63.6	20%	0.2	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	21	-170	-48.5	-73.9	0	0	0	114.2	D571 H575 D630 D634 Y677	D571-Y632 WeakPolarHBondContact CB-OH 3.41Å; D571-Y632 PolarHBondContact OD2-OH 3.41Å; H575-Y632 AromaticContact CE1-CD1 3.26Å; H575-Y632 WeakPolarHBondContact CE1-CD1 3.5Å; H575-Y632 AromaticContact CE1-CE1 3.56Å; H575-Y632 AromaticContact CE1-CG 3.89Å; H575-Y632 AromaticContact ND1-CD1 3.72Å; H575-Y632 AromaticContact ND1-CG 3.86Å; H575-Y632 AromaticContact NE2-CD1 3.77Å; H575-Y632 AromaticContact NE2-CE1 3.55Å; D630-Y632 VanDerWaalsContact C-N 3.33Å; D630-Y632 PolarHBondContact O-N 2.95Å; Y632-D634 VanDerWaalsContact C-N 3.27Å; Y632-D634 PolarHBondContact O-N 3.48Å; Y632-Y677 VanDerWaalsContact CB-OH 3.3Å; Y632-Y677 WeakPolarHBondContact CB-OH 3.29Å
633	K	85.3	Confident	85.6	Confident	43 Å²	43	65.8 Å²	65.8	19%	0.187	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-67.9	-25.8	178.9	72.1	-162.9	167.4	-165.2	0	113.7	Y582 L622 R628 D630 D635 L636	Y582-K633 WeakPolarHBondContact OH-CB 3.49Å; L622-K633 HydrophobicContact CD2-CB 4.48Å; R628-K633 PolarHBondContact O-NZ 3.43Å; D630-K633 HydrophobicContact CB-CB 4.3Å; D630-K633 WeakPolarHBondContact O-CD 3.45Å; K633-D635 PolarHBondContact O-N 2.99Å; K633-L636 WeakPolarHBondContact O-CB 3.18Å; K633-L636 PolarHBondContact O-N 3.3Å
634	D	86.6	Confident	84.9	Confident	121 Å²	121	59.5 Å²	59.5	65%	0.647	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-79	-10.8	-175.3	-60.4	-23.9	0	0	0	111.5	Y632 L636	Y632-D634 VanDerWaalsContact C-N 3.27Å; Y632-D634 PolarHBondContact O-N 3.48Å; D634-L636 VanDerWaalsContact C-N 3.27Å
635	D	88.9	Confident	84.3	Confident	15 Å²	15	54.4 Å²	54.4	8%	0.08	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-83.5	3	173.2	-58.6	-43.3	0	0	0	112.5	H575 K633 Y677 E678 K680	H575-D635 IonicContact CE1-OD2 2.67Å; K633-D635 PolarHBondContact O-N 2.99Å; D635-Y677 HydrophobicContact CB-CD2 4.12Å; D635-Y677 HydrophobicContact CB-CE2 3.62Å; D635-Y677 CarbonylContact O-C 3.51Å; D635-Y677 WeakPolarHBondContact O-CA 3.48Å; D635-Y677 WeakPolarHBondContact O-CD2 3.29Å; D635-E678 PolarHBondContact O-N 3.32Å; D635-K680 IonicContact OD1-NZ 3.75Å; D635-K680 PolarHBondContact OD1-NZ 3.42Å
636	L	90.6	Very high	83.4	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	126.3	-178.6	-174.6	73.4	0	0	0	111.2	Y582 L583 F590 L618 L622 K633 D634 F675	Y582-L636 HydrophobicContact CD1-CD2 3.83Å; Y582-L636 HydrophobicContact CD2-CD1 4.46Å; Y582-L636 HydrophobicContact CD2-CD2 4.1Å; Y582-L636 HydrophobicContact CE1-CD2 4.39Å; Y582-L636 HydrophobicContact CG-CD1 4.31Å; Y582-L636 HydrophobicContact CG-CD2 3.67Å; L583-L636 HydrophobicContact CD1-CD1 4.15Å; F590-L636 HydrophobicContact CZ-CD2 4.27Å; L618-L636 HydrophobicContact CD1-CD2 4.03Å; L618-L636 HydrophobicContact CD2-CD2 4.43Å; L618-L636 HydrophobicContact CD2-CG 4.25Å; L618-L636 WeakPolarHBondContact CD2-O 3.4Å; L622-L636 HydrophobicContact CD1-CD2 4.41Å; L622-L636 HydrophobicContact CD2-CD2 4.28Å; K633-L636 WeakPolarHBondContact O-CB 3.18Å; K633-L636 PolarHBondContact O-N 3.3Å; D634-L636 VanDerWaalsContact C-N 3.27Å; L636-F675 HydrophobicContact CD1-CB 3.93Å; L636-F675 HydrophobicContact CD1-CD1 4.25Å; L636-F675 HydrophobicContact CD1-CG 4.08Å; L636-F675 HydrophobicContact CD2-CD1 4.44Å; L636-F675 HydrophobicContact CD2-CE1 4.48Å; L636-F675 HydrophobicContact CG-CD1 4.28Å
637	H	89.9	Confident	82.8	Confident	61 Å²	61	54.4 Å²	54.4	28%	0.282	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	155	-176.1	-62.5	-58.1	0	0	0	112.9	E615 T676	E615-H637 WeakPolarHBondContact OE1-CA 3.49Å; E615-H637 IonicContact OE1-CE1 3.54Å; E615-H637 IonicContact OE1-CG 3.9Å; E615-H637 IonicContact OE1-ND1 2.79Å; E615-H637 PolarHBondContact OE1-ND1 2.99Å; H637-T676 PolarHBondContact N-O 3.13Å; H637-T676 PolarHBondContact O-N 3.31Å
638	C	88.5	Confident	82.3	Confident	20 Å²	20	54.2 Å²	54.2	14%	0.135	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	123.4	172	-68.6	0	0	0	0	111.7	L614 E615 F673	L614-C638 HydrophobicContact CB-CB 4.14Å; E615-C638 VanDerWaalsContact OE2-CB 3.28Å; E615-C638 WeakPolarHBondContact OE2-CB 3.43Å; E615-C638 PolarHBondContact OE2-N 3.44Å; C638-F673 HydrophobicContact CB-CE2 3.87Å
639	E	85.4	Confident	81.7	Confident	74 Å²	74	46.8 Å²	46.8	35%	0.346	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.5	173.1	-169.3	177.9	171.5	0	0	111	L641 A674 T676 Q696	E639-L641 HydrophobicContact CG-CD2 4.12Å; E639-L641 VanDerWaalsContact OE1-CD2 3.25Å; E639-L641 WeakPolarHBondContact OE1-CD2 3.26Å; E639-A674 PolarHBondContact N-O 2.97Å; E639-A674 PolarHBondContact O-N 3.38Å; E639-T676 VanDerWaalsContact CB-OG1 3.3Å; E639-T676 WeakPolarHBondContact CB-OG1 3.48Å; E639-T676 PolarHBondContact OE2-OG1 2.99Å; E639-Q696 PolarHBondContact OE2-NE2 3.03Å; E639-Q696 VanDerWaalsContact OE2-NE2 3.08Å
640	L	84.6	Confident	80.7	Confident	41 Å²	41	43.1 Å²	43.1	22%	0.215	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	97.5	173.9	-78.8	160.6	0	0	0	108.8	V609 P611 L614 C672	V609-L640 HydrophobicContact CB-CD1 4.24Å; V609-L640 HydrophobicContact CG1-CD1 3.87Å; V609-L640 HydrophobicContact CG1-CD2 4.37Å; P611-L640 HydrophobicContact CB-CD1 4.5Å; P611-L640 HydrophobicContact CG-CD1 4.09Å; L614-L640 HydrophobicContact CD1-CD1 4.14Å; L614-L640 HydrophobicContact CD1-CD2 4.4Å; L614-L640 HydrophobicContact CD1-CG 4.35Å; L640-C672 HydrophobicContact CD2-CB 4.4Å
641	L	81.4	Confident	79.8	Confident	2 Å²	2	46.3 Å²	46.3	1%	0.01	25%	0.25	C	S	.	.			trans	-73.8	129.2	-178.2	-65.1	173	0	0	0	110.1	E639 Y643 C672 A674	E639-L641 HydrophobicContact CG-CD2 4.12Å; E639-L641 VanDerWaalsContact OE1-CD2 3.25Å; E639-L641 WeakPolarHBondContact OE1-CD2 3.26Å; L641-Y643 HydrophobicContact CB-CE1 4.45Å; L641-Y643 HydrophobicContact CD2-CE1 4.37Å; L641-Y643 PolarHBondContact O-N 3.45Å; L641-C672 PolarHBondContact N-O 3.16Å; L641-C672 VanDerWaalsContact O-CB 3.28Å; L641-C672 WeakPolarHBondContact O-CB 3.26Å; L641-C672 PolarHBondContact O-SG 3.33Å; L641-A674 HydrophobicContact CD1-CB 3.8Å; L641-A674 HydrophobicContact CG-CB 4.2Å
642	P	74.6	Confident	78.9	Confident	112 Å²	112	44.5 Å²	44.5	73%	0.727	24%	0.235	S	C	*	.	S	Bend	trans	-75.8	23.5	-177.1	27.9	-31.2	0	0	0	113.7
643	Y	76.3	Confident	77.5	Confident	56 Å²	56	47.1 Å²	47.1	22%	0.22	25%	0.25	C	C	.	.	S	Bend	trans	-159	150.8	-172	56.5	-96.2	0	0	0	111.7	L641 T647 Q648 K651 R700	L641-Y643 HydrophobicContact CB-CE1 4.45Å; L641-Y643 HydrophobicContact CD2-CE1 4.37Å; L641-Y643 PolarHBondContact O-N 3.45Å; Y643-T647 WeakPolarHBondContact CB-OG1 3.5Å; Y643-Q648 HydrophobicContact CD2-CB 3.95Å; Y643-Q648 HydrophobicContact CE2-CB 3.6Å; Y643-Q648 HydrophobicContact CE2-CG 3.84Å; Y643-K651 HydrophobicContact CD2-CD 4.5Å; Y643-K651 VanDerWaalsContact CE1-NZ 3.26Å; Y643-K651 HydrophobicContact CE2-CD 4.31Å; Y643-K651 VanDerWaalsContact CG-NZ 3.29Å; Y643-R700 PolarHBondContact O-NH1 3.41Å; Y643-R700 PolarHBondContact O-NH2 2.9Å
644	D	73.3	Confident	76	Confident	38 Å²	38	52.7 Å²	52.7	20%	0.203	27%	0.274	C	S	.	.			trans	-73.8	178	-176.4	82.5	-20.5	0	0	0	113.3	V646 T647 Q648 L667 R700	D644-V646 VanDerWaalsContact C-N 3.34Å; D644-V646 PolarHBondContact OD1-N 2.92Å; D644-T647 PolarHBondContact N-OG1 3.35Å; D644-T647 VanDerWaalsContact N-OG1 3.13Å; D644-T647 PolarHBondContact O-OG1 3.07Å; D644-T647 VanDerWaalsContact O-OG1 3.04Å; D644-T647 VanDerWaalsContact OD1-CB 3.26Å; D644-T647 WeakPolarHBondContact OD1-CB 3.22Å; D644-T647 VanDerWaalsContact OD1-CG2 3.28Å; D644-T647 WeakPolarHBondContact OD1-CG2 3.39Å; D644-T647 PolarHBondContact OD1-N 3.17Å; D644-T647 PolarHBondContact OD1-OG1 3.11Å; D644-Q648 PolarHBondContact O-N 2.97Å; D644-L667 HydrophobicContact CB-CD1 4.37Å; D644-L667 HydrophobicContact CB-CD2 4.31Å; D644-R700 VanDerWaalsContact C-NH2 3.3Å; D644-R700 PolarHBondContact O-NH1 3.27Å
645	L	75.7	Confident	74.3	Confident	8 Å²	8	56.6 Å²	56.6	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-68.8	-33.2	-179.5	-176.2	57.7	0	0	0	112.4	Q648 M649 M697 R700 Q701 F807	L645-Q648 WeakPolarHBondContact O-CB 3.47Å; L645-Q648 PolarHBondContact O-N 3.37Å; L645-M649 HydrophobicContact CD1-CE 3.69Å; L645-M649 HydrophobicContact CD2-CE 3.69Å; L645-M649 HydrophobicContact CG-CE 3.41Å; L645-M649 VanDerWaalsContact CG-CE 3.41Å; L645-M649 HydrophobicContact CG-SD 4.21Å; L645-M649 WeakPolarHBondContact O-CG 3.4Å; L645-M649 PolarHBondContact O-N 3.45Å; L645-M697 HydrophobicContact CD1-CB 4.03Å; L645-M697 HydrophobicContact CD1-CG 3.97Å; L645-R700 HydrophobicContact CD1-CB 4.04Å; L645-R700 HydrophobicContact CD2-CB 4.16Å; L645-Q701 HydrophobicContact CD2-CB 4.01Å; L645-F807 HydrophobicContact CB-CE2 4.45Å; L645-F807 HydrophobicContact CB-CZ 4.13Å; L645-F807 HydrophobicContact CD2-CE2 3.9Å; L645-F807 HydrophobicContact CD2-CZ 3.7Å; L645-F807 HydrophobicContact CG-CZ 4.46Å
646	V	69.6	Low	72.4	Confident	44 Å²	44	64.1 Å²	64.1	27%	0.267	32%	0.32	S	S	.	.	H	α-helix	trans	-71.6	-36.5	-177.9	-176	0	0	0	0	111.4	D644 S650	D644-V646 VanDerWaalsContact C-N 3.34Å; D644-V646 PolarHBondContact OD1-N 2.92Å; V646-S650 WeakPolarHBondContact O-CB 3.19Å; V646-S650 PolarHBondContact O-N 3.32Å; V646-S650 PolarHBondContact O-OG 3.05Å
647	T	72.8	Confident	69.8	Low	32 Å²	32	72.3 Å²	72.3	20%	0.196	36%	0.358	C	S	.	.	H	α-helix	trans	-74.1	-33.7	171.5	52.3	0	0	0	0	112.1	Y643 D644 S650 K651	Y643-T647 WeakPolarHBondContact CB-OG1 3.5Å; D644-T647 PolarHBondContact N-OG1 3.35Å; D644-T647 VanDerWaalsContact N-OG1 3.13Å; D644-T647 PolarHBondContact O-OG1 3.07Å; D644-T647 VanDerWaalsContact O-OG1 3.04Å; D644-T647 VanDerWaalsContact OD1-CB 3.26Å; D644-T647 WeakPolarHBondContact OD1-CB 3.22Å; D644-T647 VanDerWaalsContact OD1-CG2 3.28Å; D644-T647 WeakPolarHBondContact OD1-CG2 3.39Å; D644-T647 PolarHBondContact OD1-N 3.17Å; D644-T647 PolarHBondContact OD1-OG1 3.11Å; T647-S650 PolarHBondContact O-N 3.06Å; T647-K651 VanDerWaalsContact O-CG 3.31Å; T647-K651 WeakPolarHBondContact O-CG 3.3Å; T647-K651 PolarHBondContact O-N 3.26Å
648	Q	74.5	Confident	67.1	Low	1 Å²	1	76.5 Å²	76.5	1%	0.005	38%	0.383	C	S	.	.	H	α-helix	trans	-58.3	-50	169.7	-171.4	168.7	25.4	0	0	111.3	Y643 D644 L645 S650 K651 I652 M697	Y643-Q648 HydrophobicContact CD2-CB 3.95Å; Y643-Q648 HydrophobicContact CE2-CB 3.6Å; Y643-Q648 HydrophobicContact CE2-CG 3.84Å; D644-Q648 PolarHBondContact O-N 2.97Å; L645-Q648 WeakPolarHBondContact O-CB 3.47Å; L645-Q648 PolarHBondContact O-N 3.37Å; Q648-S650 VanDerWaalsContact C-N 3.31Å; Q648-S650 PolarHBondContact O-N 2.96Å; Q648-K651 PolarHBondContact O-N 3.32Å; Q648-I652 HydrophobicContact CG-CD1 3.77Å; Q648-I652 PolarHBondContact O-N 3.39Å; Q648-I652 VanDerWaalsContact O-N 3.09Å; Q648-M697 HydrophobicContact CG-CG 3.82Å; Q648-M697 HydrophobicContact CG-SD 4.27Å
649	M	70.1	Confident	64.7	Low	13 Å²	13	85.2 Å²	85.2	6%	0.064	41%	0.413	C	S	.	.	H	α-helix	trans	-54.6	-47.3	173.8	-75.6	157.5	-172.6	0	0	111.9	L645 K651 I652 M653 M697 L796	L645-M649 HydrophobicContact CD1-CE 3.69Å; L645-M649 HydrophobicContact CD2-CE 3.69Å; L645-M649 HydrophobicContact CG-CE 3.41Å; L645-M649 VanDerWaalsContact CG-CE 3.41Å; L645-M649 HydrophobicContact CG-SD 4.21Å; L645-M649 WeakPolarHBondContact O-CG 3.4Å; L645-M649 PolarHBondContact O-N 3.45Å; M649-K651 VanDerWaalsContact C-N 3.32Å; M649-K651 PolarHBondContact O-N 2.75Å; M649-I652 PolarHBondContact O-N 3.42Å; M649-M653 VanDerWaalsContact O-CB 3.3Å; M649-M653 WeakPolarHBondContact O-CB 3.39Å; M649-M653 VanDerWaalsContact O-CG 3.3Å; M649-M653 WeakPolarHBondContact O-CG 3.31Å; M649-M653 PolarHBondContact O-N 3.38Å; M649-M697 HydrophobicContact CB-CE 4.37Å; M649-M697 HydrophobicContact CE-CE 4.08Å; M649-M697 HydrophobicContact CG-CE 3.44Å; M649-M697 VanDerWaalsContact CG-CE 3.44Å; M649-M697 HydrophobicContact CG-SD 4.38Å; M649-L796 HydrophobicContact CE-CB 3.92Å; M649-L796 HydrophobicContact CE-CD1 3.82Å; M649-L796 HydrophobicContact CE-CD2 3.33Å; M649-L796 HydrophobicContact CE-CG 3.87Å
650	S	64.1	Low	62.5	Low	65 Å²	65	90 Å²	90	46%	0.455	44%	0.436	S	S	.	.	H	α-helix	trans	-62.4	-38.6	-178.2	-59.2	0	0	0	0	112.4	V646 T647 Q648 K654	V646-S650 WeakPolarHBondContact O-CB 3.19Å; V646-S650 PolarHBondContact O-N 3.32Å; V646-S650 PolarHBondContact O-OG 3.05Å; T647-S650 PolarHBondContact O-N 3.06Å; Q648-S650 VanDerWaalsContact C-N 3.31Å; Q648-S650 PolarHBondContact O-N 2.96Å; S650-K654 WeakPolarHBondContact O-CB 3.28Å; S650-K654 PolarHBondContact O-N 3.33Å; S650-K654 VanDerWaalsContact O-N 3.14Å
651	K	68.3	Low	60.4	Low	74 Å²	74	92.9 Å²	92.9	32%	0.322	47%	0.465	S	S	.	.	H	α-helix	trans	-68.5	-39.7	176.7	-71.4	171.3	-176.4	-175.5	0	113.2	Y643 T647 Q648 M649 W659	Y643-K651 HydrophobicContact CD2-CD 4.5Å; Y643-K651 VanDerWaalsContact CE1-NZ 3.26Å; Y643-K651 HydrophobicContact CE2-CD 4.31Å; Y643-K651 VanDerWaalsContact CG-NZ 3.29Å; T647-K651 VanDerWaalsContact O-CG 3.31Å; T647-K651 WeakPolarHBondContact O-CG 3.3Å; T647-K651 PolarHBondContact O-N 3.26Å; Q648-K651 PolarHBondContact O-N 3.32Å; M649-K651 VanDerWaalsContact C-N 3.32Å; M649-K651 PolarHBondContact O-N 2.75Å; K651-W659 HydrophobicContact CD-CH2 3.95Å; K651-W659 HydrophobicContact CD-CZ3 4.42Å; K651-W659 VanDerWaalsContact CE-CH2 3.49Å; K651-W659 VanDerWaalsContact CE-CZ3 3.49Å; K651-W659 HydrophobicContact CG-CH2 4.41Å
652	I	67.6	Low	58.6	Low	58 Å²	58	99.3 Å²	99.3	30%	0.297	50%	0.495	S	S	.	.	H	α-helix	trans	-81.6	-34.3	-175.6	-68.5	165.3	0	0	0	111.4	Q648 M649 M697	Q648-I652 HydrophobicContact CG-CD1 3.77Å; Q648-I652 PolarHBondContact O-N 3.39Å; Q648-I652 VanDerWaalsContact O-N 3.09Å; M649-I652 PolarHBondContact O-N 3.42Å; I652-M697 HydrophobicContact CB-SD 4.41Å; I652-M697 HydrophobicContact CD1-CG 4.4Å; I652-M697 HydrophobicContact CD1-SD 3.53Å; I652-M697 VanDerWaalsContact CD1-SD 3.53Å; I652-M697 HydrophobicContact CG2-SD 4.5Å
653	M	59.6	Low	57.2	Low	106 Å²	106	99.2 Å²	99.2	52%	0.522	49%	0.494	S	S	.	.	H	α-helix	trans	-83.5	-28.3	-179.8	-65.7	-176.8	69.8	0	0	113.9	M649 T797	M649-M653 VanDerWaalsContact O-CB 3.3Å; M649-M653 WeakPolarHBondContact O-CB 3.39Å; M649-M653 VanDerWaalsContact O-CG 3.3Å; M649-M653 WeakPolarHBondContact O-CG 3.31Å; M649-M653 PolarHBondContact O-N 3.38Å; M653-T797 HydrophobicContact CE-CG2 3.76Å; M653-T797 WeakPolarHBondContact CE-O 3.47Å
654	K	53.4	Low	56.1	Low	161 Å²	161	106.5 Å²	106.5	70%	0.7	52%	0.521	S	S	*	.	S	Bend	trans	-108	95.2	172	-62	-176.6	178.3	-174.3	0	108.8	S650 E656	S650-K654 WeakPolarHBondContact O-CB 3.28Å; S650-K654 PolarHBondContact O-N 3.33Å; S650-K654 VanDerWaalsContact O-N 3.14Å; K654-E656 PolarHBondContact O-N 3.2Å
655	K	50.5	Low	55.3	Low	202 Å²	202	108.9 Å²	108.9	88%	0.878	53%	0.534	S	S	*	.			trans	-51.5	111.9	165.2	-83.7	-169.9	170.8	-171	0	108.3
656	E	50.5	Low	54.5	Low	174 Å²	174	116.1 Å²	116.1	81%	0.813	57%	0.572	S	S	*	*	S	Bend	trans	30.9	94.5	168.5	-60.2	-172.6	129.9	0	0	117.6	K654	K654-E656 PolarHBondContact O-N 3.2Å
657	E	35.6	Very low	54.6	Low	177 Å²	177	114.9 Å²	114.9	83%	0.827	56%	0.564	S	S	*	*			trans	-155.4	129.6	145.5	-117.6	171.8	-148	0	0	111.3
658	N	33.2	Very low	54.8	Low	149 Å²	149	115 Å²	115	80%	0.797	57%	0.566	S	S	*	*			trans	66.3	81	175.9	-61.3	-49.1	0	0	0	118.2	Q660	N658-Q660 PolarHBondContact O-N 3.09Å; N658-Q660 VanDerWaalsContact O-N 3.09Å
659	W	38.6	Very low	54.9	Low	203 Å²	203	115 Å²	115	77%	0.769	57%	0.566	S	S	*	*			trans	-68.2	94.9	151.8	-68.4	101.8	0	0	0	110.8	K651	K651-W659 HydrophobicContact CD-CH2 3.95Å; K651-W659 HydrophobicContact CD-CZ3 4.42Å; K651-W659 VanDerWaalsContact CE-CH2 3.49Å; K651-W659 VanDerWaalsContact CE-CZ3 3.49Å; K651-W659 HydrophobicContact CG-CH2 4.41Å
660	Q	38.1	Very low	55.5	Low	175 Å²	175	115 Å²	115	82%	0.818	57%	0.566	S	S	*	*			trans	-98.7	120.3	146.6	-73.3	-171.1	-5.6	0	0	107.6	N658 Q662	N658-Q660 PolarHBondContact O-N 3.09Å; N658-Q660 VanDerWaalsContact O-N 3.09Å; Q660-Q662 VanDerWaalsContact C-N 3.34Å; Q660-Q662 PolarHBondContact O-N 3.19Å
661	A	40.7	Very low	56.2	Low	101 Å²	101	113.7 Å²	113.7	84%	0.835	55%	0.553	S	S	*	*			trans	-62.5	98.4	171.2	0	0	0	0	0	108.3
662	Q	44	Very low	56.8	Low	137 Å²	137	110.2 Å²	110.2	64%	0.64	54%	0.538	S	S	*	.			trans	-56.1	142.7	163.8	-71.1	-174.1	-14.6	0	0	107.6	Q660	Q660-Q662 VanDerWaalsContact C-N 3.34Å; Q660-Q662 PolarHBondContact O-N 3.19Å
663	P	45.9	Very low	57.8	Low	109 Å²	109	107.5 Å²	107.5	71%	0.708	52%	0.524	S	S	*	.			trans	-54.1	147.4	179.8	24.8	-34.7	0	0	0	109.3	L665	P663-L665 PolarHBondContact O-N 3.33Å
664	R	51.7	Low	59.2	Low	210 Å²	210	102.5 Å²	102.5	79%	0.792	50%	0.5	S	S	*	.			trans	-48	110.7	173	-70.6	-175.7	-177	-176.8	0.5	107.6	D607	D607-R664 IonicContact OD1-NH1 2.86Å; D607-R664 IonicContact OD2-NH1 2.76Å
665	L	56.9	Low	61	Low	88 Å²	88	95 Å²	95	46%	0.461	47%	0.467	S	S	.	.			trans	-66.2	135.7	172.4	-70.3	164.1	0	0	0	106	P663 L667	P663-L665 PolarHBondContact O-N 3.33Å; L665-L667 HydrophobicContact CB-CD1 3.95Å; L665-L667 HydrophobicContact CB-CD2 3.86Å; L665-L667 HydrophobicContact CB-CG 3.58Å; L665-L667 HydrophobicContact CD1-CD1 4.43Å; L665-L667 HydrophobicContact CD1-CD2 4.4Å; L665-L667 PolarHBondContact O-N 3.28Å
666	D	59.5	Low	62.9	Low	159 Å²	159	87 Å²	87	85%	0.85	44%	0.435	S	S	*	.			trans	-68.6	75.3	169.8	-69.7	-38.3	0	0	0	108.6
667	L	70.6	Confident	64.8	Low	18 Å²	18	78.8 Å²	78.8	9%	0.094	40%	0.397	C	S	.	.			trans	-87.1	138.5	-179	-63.2	171.3	0	0	0	109.1	V606 D644 L665 E671 C672	V606-L667 HydrophobicContact CG2-CB 4.18Å; V606-L667 WeakPolarHBondContact CG2-O 3.47Å; V606-L667 PolarHBondContact N-O 2.84Å; D644-L667 HydrophobicContact CB-CD1 4.37Å; D644-L667 HydrophobicContact CB-CD2 4.31Å; L665-L667 HydrophobicContact CB-CD1 3.95Å; L665-L667 HydrophobicContact CB-CD2 3.86Å; L665-L667 HydrophobicContact CB-CG 3.58Å; L665-L667 HydrophobicContact CD1-CD1 4.43Å; L665-L667 HydrophobicContact CD1-CD2 4.4Å; L665-L667 PolarHBondContact O-N 3.28Å; L667-E671 HydrophobicContact CD2-CB 4.34Å; L667-E671 WeakPolarHBondContact CD2-OE2 3.39Å; L667-C672 WeakPolarHBondContact CD1-SG 3.45Å
668	S	77.8	Confident	67.2	Low	35 Å²	35	75.2 Å²	75.2	25%	0.245	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-71.9	149.3	165.8	169.8	0	0	0	0	109.3	L602 L670 E671 C672	L602-S668 PolarHBondContact O-OG 3.03Å; S668-L670 PolarHBondContact O-N 2.67Å; S668-L670 VanDerWaalsContact O-N 3.12Å; S668-L670 PolarHBondContact OG-N 2.73Å; S668-E671 PolarHBondContact O-N 3.48Å; S668-C672 PolarHBondContact O-N 2.92Å
669	G	77.2	Confident	69.6	Low	0 Å²	0	69 Å²	69	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-49.2	-38	173.5	0	0	0	0	0	112.5	L602 K604 E671 C672 F673	L602-G669 CarbonylContact O-C 3.57Å; L602-G669 WeakPolarHBondContact O-CA 3.22Å; L602-G669 PolarHBondContact O-N 2.84Å; K604-G669 PolarHBondContact O-N 3.17Å; G669-E671 VanDerWaalsContact C-N 3.32Å; G669-E671 PolarHBondContact O-N 2.91Å; G669-C672 PolarHBondContact O-N 3.23Å; G669-F673 VanDerWaalsContact O-CB 3.28Å; G669-F673 WeakPolarHBondContact O-CB 3.22Å; G669-F673 PolarHBondContact O-N 3.4Å
670	L	81.8	Confident	71.7	Confident	14 Å²	14	64.7 Å²	64.7	7%	0.073	33%	0.334	C	S	.	.	H	α-helix	trans	-56.7	-38	174.4	-169.4	80.5	0	0	0	114	L602 S668 F703 Y704 H707	L602-L670 HydrophobicContact CB-CB 4.46Å; L602-L670 HydrophobicContact CB-CD1 4.41Å; L602-L670 HydrophobicContact CD1-CD1 4.37Å; L602-L670 PolarHBondContact O-N 3.2Å; S668-L670 PolarHBondContact O-N 2.67Å; S668-L670 VanDerWaalsContact O-N 3.12Å; S668-L670 PolarHBondContact OG-N 2.73Å; L670-F703 HydrophobicContact CD1-CD1 4.38Å; L670-F703 HydrophobicContact CD1-CE1 3.74Å; L670-Y704 HydrophobicContact CD2-CD2 3.91Å; L670-Y704 HydrophobicContact CD2-CE2 4.02Å; L670-Y704 HydrophobicContact CG-CD2 4.5Å; L670-H707 HydrophobicContact CD1-CB 4.1Å; L670-H707 WeakPolarHBondContact CD1-ND1 3.31Å; L670-H707 HydrophobicContact CD2-CB 4.03Å; L670-H707 VanDerWaalsContact CD2-CD2 3.44Å; L670-H707 WeakPolarHBondContact CD2-CD2 3.41Å
671	E	78.8	Confident	73.5	Confident	37 Å²	37	60.7 Å²	60.7	17%	0.173	31%	0.312	C	S	.	.	H	α-helix	trans	-78.4	-27.8	-178.6	-59.5	-159.2	136.3	0	0	112	L667 S668 G669 R700 K811	L667-E671 HydrophobicContact CD2-CB 4.34Å; L667-E671 WeakPolarHBondContact CD2-OE2 3.39Å; S668-E671 PolarHBondContact O-N 3.48Å; G669-E671 VanDerWaalsContact C-N 3.32Å; G669-E671 PolarHBondContact O-N 2.91Å; E671-R700 PolarHBondContact O-NH2 2.85Å; E671-K811 VanDerWaalsContact CD-NZ 3.27Å; E671-K811 WeakPolarHBondContact OE1-CE 3.44Å; E671-K811 IonicContact OE1-NZ 3.46Å; E671-K811 PolarHBondContact OE1-NZ 3.24Å; E671-K811 IonicContact OE2-NZ 3.84Å; E671-K811 PolarHBondContact OE2-NZ 3.01Å
672	C	81.5	Confident	75.2	Confident	2 Å²	2	56 Å²	56	1%	0.014	27%	0.273	C	S	.	.	H	α-helix	trans	-92	-17.9	-180	-79	0	0	0	0	114.8	V606 L640 L641 L667 S668 G669	V606-C672 HydrophobicContact CG2-CB 3.62Å; V606-C672 VanDerWaalsContact CG2-SG 3.55Å; L640-C672 HydrophobicContact CD2-CB 4.4Å; L641-C672 PolarHBondContact N-O 3.16Å; L641-C672 VanDerWaalsContact O-CB 3.28Å; L641-C672 WeakPolarHBondContact O-CB 3.26Å; L641-C672 PolarHBondContact O-SG 3.33Å; L667-C672 WeakPolarHBondContact CD1-SG 3.45Å; S668-C672 PolarHBondContact O-N 2.92Å; G669-C672 PolarHBondContact O-N 3.23Å
673	F	88.6	Confident	77.1	Confident	1 Å²	1	49.6 Å²	49.6	0%	0.004	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	134.9	-177.5	-177.8	-103.7	0	0	0	113.1	F594 L602 L614 C638 G669 F675 F699 F703	F594-F673 AromaticContact CE1-CE1 3.6Å; F594-F673 HydrophobicContact CE1-CE1 3.6Å; F594-F673 HydrophobicContact CE1-CE2 4.36Å; F594-F673 AromaticContact CE1-CZ 3.45Å; F594-F673 HydrophobicContact CE1-CZ 3.45Å; F594-F673 VanDerWaalsContact CE1-CZ 3.45Å; F594-F673 AromaticContact CZ-CE1 4Å; F594-F673 HydrophobicContact CZ-CE1 4Å; F594-F673 AromaticContact CZ-CE2 3.96Å; F594-F673 HydrophobicContact CZ-CE2 3.96Å; F594-F673 AromaticContact CZ-CZ 3.33Å; F594-F673 HydrophobicContact CZ-CZ 3.33Å; L602-F673 HydrophobicContact CD2-CB 3.87Å; L602-F673 HydrophobicContact CD2-CD2 3.94Å; L602-F673 HydrophobicContact CD2-CG 3.9Å; L614-F673 HydrophobicContact CD1-CD2 4.07Å; L614-F673 HydrophobicContact CD1-CE2 4.21Å; C638-F673 HydrophobicContact CB-CE2 3.87Å; G669-F673 VanDerWaalsContact O-CB 3.28Å; G669-F673 WeakPolarHBondContact O-CB 3.22Å; G669-F673 PolarHBondContact O-N 3.4Å; F673-F675 HydrophobicContact CE1-CD1 4.34Å; F673-F675 HydrophobicContact CE1-CE1 4.09Å; F673-F675 HydrophobicContact CE1-CE2 4.4Å; F673-F675 HydrophobicContact CE1-CZ 4.11Å; F673-F675 AromaticContact CZ-CD1 3.87Å; F673-F675 HydrophobicContact CZ-CD1 3.87Å; F673-F675 AromaticContact CZ-CE1 3.55Å; F673-F675 HydrophobicContact CZ-CE1 3.55Å; F673-F675 AromaticContact CZ-CZ 3.96Å; F673-F675 HydrophobicContact CZ-CZ 3.96Å; F673-F699 AromaticContact CD1-CE1 3.98Å; F673-F699 HydrophobicContact CD1-CE1 3.98Å; F673-F699 HydrophobicContact CD1-CZ 4.2Å; F673-F699 AromaticContact CE1-CE1 3.94Å; F673-F699 HydrophobicContact CE1-CE1 3.94Å; F673-F699 AromaticContact CE1-CZ 3.82Å; F673-F699 HydrophobicContact CE1-CZ 3.82Å; F673-F703 HydrophobicContact CD1-CD1 4.18Å; F673-F703 AromaticContact CD1-CE1 3.61Å; F673-F703 HydrophobicContact CD1-CE1 3.61Å; F673-F703 AromaticContact CD1-CZ 3.86Å; F673-F703 HydrophobicContact CD1-CZ 3.86Å; F673-F703 HydrophobicContact CE1-CE1 4.21Å; F673-F703 HydrophobicContact CE1-CE2 4.42Å; F673-F703 AromaticContact CE1-CZ 4Å; F673-F703 HydrophobicContact CE1-CZ 4Å
674	A	88.8	Confident	78.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	153.7	170.3	0	0	0	0	0	110.8	E639 L641 Q696 R700	E639-A674 PolarHBondContact N-O 2.97Å; E639-A674 PolarHBondContact O-N 3.38Å; L641-A674 HydrophobicContact CD1-CB 3.8Å; L641-A674 HydrophobicContact CG-CB 4.2Å; A674-Q696 HydrophobicContact CB-CG 4.31Å; A674-R700 HydrophobicContact CB-CG 4.32Å
675	F	91.1	Very high	80.4	Confident	3 Å²	3	37 Å²	37	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	139.2	163.6	-76.5	-47.2	0	0	0	110.8	L583 F590 F594 L618 L636 F673 Q696 F699	L583-F675 HydrophobicContact CG-CB 4.4Å; F590-F675 HydrophobicContact CE1-CE2 4.11Å; F590-F675 HydrophobicContact CE1-CZ 4.11Å; F590-F675 HydrophobicContact CZ-CE2 4.35Å; F590-F675 AromaticContact CZ-CZ 3.89Å; F590-F675 HydrophobicContact CZ-CZ 3.89Å; F594-F675 AromaticContact CD1-CZ 3.86Å; F594-F675 HydrophobicContact CD1-CZ 3.86Å; F594-F675 HydrophobicContact CD2-CZ 4.37Å; F594-F675 HydrophobicContact CE1-CE1 4.2Å; F594-F675 AromaticContact CE1-CZ 3.71Å; F594-F675 HydrophobicContact CE1-CZ 3.71Å; F594-F675 HydrophobicContact CE2-CE1 4.27Å; F594-F675 HydrophobicContact CE2-CZ 4.25Å; F594-F675 HydrophobicContact CG-CZ 4.2Å; F594-F675 AromaticContact CZ-CE1 3.99Å; F594-F675 HydrophobicContact CZ-CE1 3.99Å; F594-F675 AromaticContact CZ-CZ 3.93Å; F594-F675 HydrophobicContact CZ-CZ 3.93Å; L618-F675 HydrophobicContact CD1-CE1 3.72Å; L618-F675 HydrophobicContact CD1-CZ 4.14Å; L618-F675 HydrophobicContact CD2-CD1 4.5Å; L618-F675 HydrophobicContact CD2-CE1 4.16Å; L636-F675 HydrophobicContact CD1-CB 3.93Å; L636-F675 HydrophobicContact CD1-CD1 4.25Å; L636-F675 HydrophobicContact CD1-CG 4.08Å; L636-F675 HydrophobicContact CD2-CD1 4.44Å; L636-F675 HydrophobicContact CD2-CE1 4.48Å; L636-F675 HydrophobicContact CG-CD1 4.28Å; F673-F675 HydrophobicContact CE1-CD1 4.34Å; F673-F675 HydrophobicContact CE1-CE1 4.09Å; F673-F675 HydrophobicContact CE1-CE2 4.4Å; F673-F675 HydrophobicContact CE1-CZ 4.11Å; F673-F675 AromaticContact CZ-CD1 3.87Å; F673-F675 HydrophobicContact CZ-CD1 3.87Å; F673-F675 AromaticContact CZ-CE1 3.55Å; F673-F675 HydrophobicContact CZ-CE1 3.55Å; F673-F675 AromaticContact CZ-CZ 3.96Å; F673-F675 HydrophobicContact CZ-CZ 3.96Å; F675-Q696 VanDerWaalsContact O-CG 3.31Å; F675-Q696 WeakPolarHBondContact O-CG 3.38Å; F675-F699 AromaticContact CD2-CD2 3.92Å; F675-F699 HydrophobicContact CD2-CD2 3.92Å; F675-F699 HydrophobicContact CD2-CE1 4.01Å; F675-F699 AromaticContact CD2-CE2 3.23Å; F675-F699 HydrophobicContact CD2-CE2 3.23Å; F675-F699 AromaticContact CD2-CZ 3.3Å; F675-F699 HydrophobicContact CD2-CZ 3.3Å; F675-F699 AromaticContact CE2-CE2 3.55Å; F675-F699 HydrophobicContact CE2-CE2 3.55Å; F675-F699 AromaticContact CE2-CZ 3.56Å; F675-F699 HydrophobicContact CE2-CZ 3.56Å; F675-F699 HydrophobicContact CG-CE1 4.38Å; F675-F699 HydrophobicContact CG-CE2 4.3Å; F675-F699 HydrophobicContact CG-CZ 4.08Å
676	T	89.3	Confident	81.7	Confident	34 Å²	34	32.8 Å²	32.8	21%	0.209	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	146	175.5	-59.7	0	0	0	0	108.8	H637 E639 Q696	H637-T676 PolarHBondContact N-O 3.13Å; H637-T676 PolarHBondContact O-N 3.31Å; E639-T676 VanDerWaalsContact CB-OG1 3.3Å; E639-T676 WeakPolarHBondContact CB-OG1 3.48Å; E639-T676 PolarHBondContact OE2-OG1 2.99Å; T676-Q696 PolarHBondContact OG1-NE2 2.87Å
677	Y	90.6	Very high	83	Confident	3 Å²	3	25.4 Å²	25.4	1%	0.012	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	110.6	-174.4	-170.2	-113.5	0	0	0	108.9	H575 V579 Y632 D635 V679 L687 I692	H575-Y677 HydrophobicContact CB-CE1 4.46Å; H575-Y677 AromaticContact ND1-CZ 3.88Å; H575-Y677 PolarHBondContact ND1-OH 3.25Å; V579-Y677 HydrophobicContact CG2-CD1 3.42Å; V579-Y677 VanDerWaalsContact CG2-CD1 3.42Å; V579-Y677 HydrophobicContact CG2-CE1 3.63Å; V579-Y677 HydrophobicContact CG2-CG 4.01Å; Y632-Y677 VanDerWaalsContact CB-OH 3.3Å; Y632-Y677 WeakPolarHBondContact CB-OH 3.29Å; D635-Y677 HydrophobicContact CB-CD2 4.12Å; D635-Y677 HydrophobicContact CB-CE2 3.62Å; D635-Y677 CarbonylContact O-C 3.51Å; D635-Y677 WeakPolarHBondContact O-CA 3.48Å; D635-Y677 WeakPolarHBondContact O-CD2 3.29Å; Y677-V679 HydrophobicContact CD1-CG2 3.42Å; Y677-V679 VanDerWaalsContact CD1-CG2 3.42Å; Y677-V679 HydrophobicContact CE1-CG2 3.73Å; Y677-V679 HydrophobicContact CG-CG2 4.47Å; Y677-V679 PolarHBondContact O-N 2.95Å; Y677-L687 HydrophobicContact CE1-CD1 4.25Å; Y677-I692 WeakPolarHBondContact O-CD1 3.45Å
678	E	87.1	Confident	83.6	Confident	102 Å²	102	25.8 Å²	25.8	48%	0.477	13%	0.127	S	C	.	.			trans	-79.1	102.1	-177.5	-168.9	-157.7	115.4	0	0	110.2	D635 K680	D635-E678 PolarHBondContact O-N 3.32Å; E678-K680 PolarHBondContact O-N 2.85Å; E678-K680 IonicContact OE1-NZ 3.76Å; E678-K680 PolarHBondContact OE1-NZ 3.28Å
679	V	83.4	Confident	83.7	Confident	19 Å²	19	27.5 Å²	27.5	12%	0.115	13%	0.131	C	C	.	.			trans	-92.4	111.9	-178.6	-171.5	0	0	0	0	111	Y677 C683 L687 I692	Y677-V679 HydrophobicContact CD1-CG2 3.42Å; Y677-V679 VanDerWaalsContact CD1-CG2 3.42Å; Y677-V679 HydrophobicContact CE1-CG2 3.73Å; Y677-V679 HydrophobicContact CG-CG2 4.47Å; Y677-V679 PolarHBondContact O-N 2.95Å; V679-C683 VanDerWaalsContact CG1-C 3.44Å; V679-C683 HydrophobicContact CG1-CB 3.41Å; V679-C683 VanDerWaalsContact CG1-CB 3.41Å; V679-L687 HydrophobicContact CB-CB 4.24Å; V679-L687 HydrophobicContact CG1-CB 4.09Å; V679-L687 HydrophobicContact CG1-CD1 4.14Å; V679-L687 HydrophobicContact CG2-CB 3.7Å; V679-L687 HydrophobicContact CG2-CD1 3.77Å; V679-L687 HydrophobicContact CG2-CG 4.39Å; V679-I692 HydrophobicContact CG2-CD1 4.13Å
680	K	83.3	Confident	84.1	Confident	111 Å²	111	31 Å²	31	48%	0.483	15%	0.149	S	C	.	.			trans	-64.1	142.7	174	-65.8	171.4	178.3	55.9	0	110.7	D635 E678 C683	D635-K680 IonicContact OD1-NZ 3.75Å; D635-K680 PolarHBondContact OD1-NZ 3.42Å; E678-K680 PolarHBondContact O-N 2.85Å; E678-K680 IonicContact OE1-NZ 3.76Å; E678-K680 PolarHBondContact OE1-NZ 3.28Å; K680-C683 PolarHBondContact O-N 3.4Å; K680-C683 VanDerWaalsContact O-N 3.09Å
681	W	74.9	Confident	84.4	Confident	92 Å²	92	30.7 Å²	30.7	35%	0.348	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	134.8	172	-173.1	95.9	0	0	0	109.7	V522 Q525 C526	V522-W681 HydrophobicContact CG1-CZ2 4.02Å; V522-W681 VanDerWaalsContact O-CH2 3.28Å; V522-W681 WeakPolarHBondContact O-CH2 3.43Å; Q525-W681 HydrophobicContact CB-CH2 3.43Å; Q525-W681 VanDerWaalsContact CB-CH2 3.43Å; Q525-W681 HydrophobicContact CB-CZ2 3.39Å; Q525-W681 HydrophobicContact CB-CZ3 4.34Å; C526-W681 HydrophobicContact CB-CH2 4.13Å; C526-W681 HydrophobicContact CB-CZ3 4.13Å; C526-W681 WeakPolarHBondContact SG-CH2 3.38Å; C526-W681 VanDerWaalsContact SG-CZ3 3.52Å
682	P	77.5	Confident	84.9	Confident	3 Å²	3	30 Å²	30	2%	0.019	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.5	-1.1	13	37.6	-36.3	0	0	0	115.8	L566 N570 S684 L685	L566-P682 HydrophobicContact CD2-CB 4.2Å; L566-P682 HydrophobicContact CD2-CG 4.06Å; N570-P682 HydrophobicContact CB-CG 4.43Å; N570-P682 VanDerWaalsContact OD1-CD 3.28Å; N570-P682 WeakPolarHBondContact OD1-CD 3.22Å; P682-S684 PolarHBondContact O-N 3.34Å; P682-S684 VanDerWaalsContact O-N 3.11Å; P682-L685 HydrophobicContact CB-CD1 4.25Å; P682-L685 WeakPolarHBondContact O-CD1 3.16Å; P682-L685 PolarHBondContact O-N 3.07Å; P682-L685 VanDerWaalsContact O-N 3.09Å
683	C	83.9	Confident	85.1	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-62.3	-20.6	-178.3	-73	0	0	0	0	113.2	L572 V679 K680 L685 V686 L687	L572-C683 HydrophobicContact CD1-CB 4.35Å; V679-C683 VanDerWaalsContact CG1-C 3.44Å; V679-C683 HydrophobicContact CG1-CB 3.41Å; V679-C683 VanDerWaalsContact CG1-CB 3.41Å; K680-C683 PolarHBondContact O-N 3.4Å; K680-C683 VanDerWaalsContact O-N 3.09Å; C683-L685 PolarHBondContact O-N 3.01Å; C683-V686 PolarHBondContact O-N 3.04Å; C683-L687 PolarHBondContact O-N 3.06Å
684	S	83.4	Confident	85.1	Confident	14 Å²	14	32.8 Å²	32.8	10%	0.098	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-58.2	-21.7	173	68	0	0	0	0	114	P682 V686 L687 N688	P682-S684 PolarHBondContact O-N 3.34Å; P682-S684 VanDerWaalsContact O-N 3.11Å; S684-V686 PolarHBondContact O-N 3.35Å; S684-L687 CarbonylContact O-C 3.59Å; S684-N688 PolarHBondContact O-N 2.93Å
685	L	82.1	Confident	85.3	Confident	39 Å²	39	32.9 Å²	32.9	20%	0.204	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-69.6	-15.9	174.8	-80.6	93	0	0	0	114	V522 P682 C683 N688 L780	V522-L685 HydrophobicContact CB-CD2 4.49Å; V522-L685 HydrophobicContact CG1-CD1 4.25Å; V522-L685 HydrophobicContact CG1-CD2 4.03Å; V522-L685 HydrophobicContact CG2-CD2 3.58Å; P682-L685 HydrophobicContact CB-CD1 4.25Å; P682-L685 WeakPolarHBondContact O-CD1 3.16Å; P682-L685 PolarHBondContact O-N 3.07Å; P682-L685 VanDerWaalsContact O-N 3.09Å; C683-L685 PolarHBondContact O-N 3.01Å; L685-N688 VanDerWaalsContact C-OD1 3.3Å; L685-N688 PolarHBondContact O-OD1 2.84Å; L685-N688 VanDerWaalsContact O-OD1 3.09Å; L685-L780 VanDerWaalsContact O-CD2 3.26Å; L685-L780 WeakPolarHBondContact O-CD2 3.44Å
686	V	85.1	Confident	85.2	Confident	1 Å²	1	33 Å²	33	1%	0.006	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-42.1	176.9	-179.2	0	0	0	0	110.5	L572 C683 S684 N688 V779 L780 H783	L572-V686 HydrophobicContact CD1-CB 4.13Å; L572-V686 HydrophobicContact CD1-CG1 4.3Å; L572-V686 HydrophobicContact CD2-CB 4.31Å; L572-V686 HydrophobicContact CD2-CG1 4.25Å; L572-V686 HydrophobicContact CD2-CG2 3.96Å; C683-V686 PolarHBondContact O-N 3.04Å; S684-V686 PolarHBondContact O-N 3.35Å; V686-N688 VanDerWaalsContact C-OD1 3.23Å; V686-N688 PolarHBondContact O-N 2.67Å; V686-N688 VanDerWaalsContact O-N 3.16Å; V686-N688 PolarHBondContact O-OD1 2.7Å; V686-N688 VanDerWaalsContact O-OD1 3.14Å; V686-V779 HydrophobicContact CG1-CG1 3.98Å; V686-V779 HydrophobicContact CG2-CG1 4.4Å; V686-L780 HydrophobicContact CB-CD2 4.11Å; V686-L780 HydrophobicContact CG1-CD2 4.22Å; V686-L780 HydrophobicContact CG2-CD2 3.85Å; V686-H783 PolarHBondContact O-CE1 2.95Å; V686-H783 VanDerWaalsContact O-CE1 3.23Å; V686-H783 PolarHBondContact O-ND1 2.87Å
687	L	86.3	Confident	85.1	Confident	3 Å²	3	31.7 Å²	31.7	2%	0.016	15%	0.153	C	C	.	.	S	Bend	trans	-90.6	59.4	173.9	-63.4	176.8	0	0	0	110.5	H575 L576 V579 Y677 V679 C683 S684 I692 Y695 H783	H575-L687 HydrophobicContact CB-CD1 4.09Å; L576-L687 HydrophobicContact CD2-CD2 3.81Å; V579-L687 HydrophobicContact CG2-CD1 4.29Å; Y677-L687 HydrophobicContact CE1-CD1 4.25Å; V679-L687 HydrophobicContact CB-CB 4.24Å; V679-L687 HydrophobicContact CG1-CB 4.09Å; V679-L687 HydrophobicContact CG1-CD1 4.14Å; V679-L687 HydrophobicContact CG2-CB 3.7Å; V679-L687 HydrophobicContact CG2-CD1 3.77Å; V679-L687 HydrophobicContact CG2-CG 4.39Å; C683-L687 PolarHBondContact O-N 3.06Å; S684-L687 CarbonylContact O-C 3.59Å; L687-I692 WeakPolarHBondContact O-CD1 3.48Å; L687-Y695 HydrophobicContact CD2-CE2 4.49Å; L687-H783 WeakPolarHBondContact CD2-CE1 3.21Å
688	N	83.9	Confident	85.1	Confident	26 Å²	26	31.5 Å²	31.5	14%	0.139	15%	0.153	C	C	.	.			trans	-52.6	153.7	175.4	-65.6	51.4	0	0	0	112.2	D488 S684 L685 V686 I690 S691 I692	D488-N688 PolarHBondContact OD1-ND2 2.93Å; D488-N688 WeakPolarHBondContact OD2-CA 3.28Å; D488-N688 WeakPolarHBondContact OD2-CB 3.36Å; D488-N688 PolarHBondContact OD2-ND2 2.77Å; S684-N688 PolarHBondContact O-N 2.93Å; L685-N688 VanDerWaalsContact C-OD1 3.3Å; L685-N688 PolarHBondContact O-OD1 2.84Å; L685-N688 VanDerWaalsContact O-OD1 3.09Å; V686-N688 VanDerWaalsContact C-OD1 3.23Å; V686-N688 PolarHBondContact O-N 2.67Å; V686-N688 VanDerWaalsContact O-N 3.16Å; V686-N688 PolarHBondContact O-OD1 2.7Å; V686-N688 VanDerWaalsContact O-OD1 3.14Å; N688-I690 PolarHBondContact O-N 3.47Å; N688-S691 WeakPolarHBondContact O-CA 3.4Å; N688-S691 WeakPolarHBondContact O-CB 3.46Å; N688-S691 PolarHBondContact O-N 2.88Å; N688-I692 PolarHBondContact O-N 3.42Å
689	H	80.3	Confident	85.4	Confident	71 Å²	71	26.7 Å²	26.7	33%	0.329	13%	0.13	S	C	.	.	H	α-helix	trans	-58.3	-33.9	175.1	76	-73.7	0	0	0	112.4	D488 S693	D488-H689 IonicContact OD2-CE1 3.27Å; D488-H689 IonicContact OD2-CG 3.19Å; D488-H689 PolarHBondContact OD2-N 2.91Å; D488-H689 IonicContact OD2-ND1 3.81Å; D488-H689 PolarHBondContact OD2-ND1 2.97Å; H689-S693 WeakPolarHBondContact O-CB 3.3Å; H689-S693 PolarHBondContact O-N 3.06Å; H689-S693 PolarHBondContact O-OG 3.49Å
690	I	83.6	Confident	85.6	Confident	75 Å²	75	26.3 Å²	26.3	39%	0.385	13%	0.126	S	C	.	.	H	α-helix	trans	-63.8	-45.4	172.7	-52.9	-178.8	0	0	0	110.4	N688 S693 K694	N688-I690 PolarHBondContact O-N 3.47Å; I690-S693 WeakPolarHBondContact O-CB 3.45Å; I690-S693 PolarHBondContact O-N 2.86Å; I690-K694 WeakPolarHBondContact O-CG 3.43Å; I690-K694 PolarHBondContact O-N 3.05Å
691	S	88.2	Confident	85.8	Confident	6 Å²	6	21.1 Å²	21.1	4%	0.042	10%	0.104	C	C	.	.	H	α-helix	trans	-63.5	-44.2	178.2	-61.3	0	0	0	0	111.5	N688 S693 K694 Y695 H783	N688-S691 WeakPolarHBondContact O-CA 3.4Å; N688-S691 WeakPolarHBondContact O-CB 3.46Å; N688-S691 PolarHBondContact O-N 2.88Å; S691-S693 VanDerWaalsContact C-N 3.33Å; S691-S693 PolarHBondContact O-N 3.22Å; S691-K694 WeakPolarHBondContact O-CB 3.24Å; S691-K694 PolarHBondContact O-N 3.5Å; S691-Y695 WeakPolarHBondContact O-CD2 3.44Å; S691-Y695 PolarHBondContact O-N 2.99Å; S691-H783 WeakPolarHBondContact CB-CE1 3.37Å; S691-H783 PolarHBondContact OG-CE1 3.44Å
692	I	89.2	Confident	86.6	Confident	22 Å²	22	16.8 Å²	16.8	11%	0.113	9%	0.088	C	C	.	.	H	α-helix	trans	-61.7	-42.2	175	-64.4	163	0	0	0	110.3	Y677 V679 L687 N688 K694 Y695 Q696	Y677-I692 WeakPolarHBondContact O-CD1 3.45Å; V679-I692 HydrophobicContact CG2-CD1 4.13Å; L687-I692 WeakPolarHBondContact O-CD1 3.48Å; N688-I692 PolarHBondContact O-N 3.42Å; I692-K694 VanDerWaalsContact C-N 3.34Å; I692-K694 PolarHBondContact O-N 3.1Å; I692-Y695 CarbonylContact O-C 3.56Å; I692-Y695 WeakPolarHBondContact O-CB 3.49Å; I692-Y695 PolarHBondContact O-N 3.45Å; I692-Y695 VanDerWaalsContact O-N 3.13Å; I692-Q696 PolarHBondContact O-N 3.46Å
693	S	87	Confident	87.2	Confident	32 Å²	32	16.8 Å²	16.8	22%	0.224	9%	0.088	C	C	.	.	H	α-helix	trans	-62.2	-37.9	175.2	-59	0	0	0	0	112.8	H689 I690 S691 Q696 M697	H689-S693 WeakPolarHBondContact O-CB 3.3Å; H689-S693 PolarHBondContact O-N 3.06Å; H689-S693 PolarHBondContact O-OG 3.49Å; I690-S693 WeakPolarHBondContact O-CB 3.45Å; I690-S693 PolarHBondContact O-N 2.86Å; S691-S693 VanDerWaalsContact C-N 3.33Å; S691-S693 PolarHBondContact O-N 3.22Å; S693-Q696 WeakPolarHBondContact O-CB 3.42Å; S693-Q696 PolarHBondContact O-N 3.05Å; S693-M697 WeakPolarHBondContact O-CG 3.32Å; S693-M697 PolarHBondContact O-N 3.41Å; S693-M697 VanDerWaalsContact O-N 3.08Å
694	K	88.2	Confident	87.4	Confident	31 Å²	31	17.2 Å²	17.2	14%	0.135	9%	0.089	C	C	.	.	H	α-helix	trans	-64.1	-41.1	172.1	-70.9	-176.6	-178.9	-173.8	0	111.6	I690 S691 I692 M697 L698 L787 D788 L791	I690-K694 WeakPolarHBondContact O-CG 3.43Å; I690-K694 PolarHBondContact O-N 3.05Å; S691-K694 WeakPolarHBondContact O-CB 3.24Å; S691-K694 PolarHBondContact O-N 3.5Å; I692-K694 VanDerWaalsContact C-N 3.34Å; I692-K694 PolarHBondContact O-N 3.1Å; K694-M697 PolarHBondContact O-N 2.95Å; K694-L698 PolarHBondContact O-N 3.24Å; K694-L787 HydrophobicContact CB-CD1 4.31Å; K694-L787 HydrophobicContact CB-CD2 4.13Å; K694-L787 HydrophobicContact CD-CB 4.21Å; K694-L787 HydrophobicContact CD-CD1 4.28Å; K694-D788 WeakPolarHBondContact CE-OD1 3.38Å; K694-D788 IonicContact NZ-OD1 3.86Å; K694-D788 PolarHBondContact NZ-OD1 3.29Å; K694-D788 IonicContact NZ-OD2 3.2Å; K694-D788 PolarHBondContact NZ-OD2 3.17Å; K694-L791 HydrophobicContact CB-CD1 3.94Å; K694-L791 HydrophobicContact CD-CD1 3.83Å; K694-L791 HydrophobicContact CG-CD1 3.74Å
695	Y	92.1	Very high	87.7	Confident	1 Å²	1	16.6 Å²	16.6	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-65.7	-41.1	172.9	-74.7	-68.7	0	0	0	112.8	V579 L583 L584 L687 S691 I692 M697 L698 F699 H783 F786 L787	V579-Y695 HydrophobicContact CG1-CD1 3.89Å; V579-Y695 HydrophobicContact CG1-CD2 3.8Å; V579-Y695 HydrophobicContact CG1-CE1 3.84Å; V579-Y695 HydrophobicContact CG1-CE2 3.76Å; V579-Y695 HydrophobicContact CG1-CG 3.88Å; L583-Y695 HydrophobicContact CD2-CG 4.49Å; L584-Y695 HydrophobicContact CD1-CE1 4.15Å; L584-Y695 HydrophobicContact CD2-CD1 4.11Å; L584-Y695 HydrophobicContact CD2-CE1 4.47Å; L584-Y695 HydrophobicContact CG-CD1 4.29Å; L584-Y695 HydrophobicContact CG-CE1 4.4Å; L687-Y695 HydrophobicContact CD2-CE2 4.49Å; S691-Y695 WeakPolarHBondContact O-CD2 3.44Å; S691-Y695 PolarHBondContact O-N 2.99Å; I692-Y695 CarbonylContact O-C 3.56Å; I692-Y695 WeakPolarHBondContact O-CB 3.49Å; I692-Y695 PolarHBondContact O-N 3.45Å; I692-Y695 VanDerWaalsContact O-N 3.13Å; Y695-M697 VanDerWaalsContact C-N 3.27Å; Y695-M697 PolarHBondContact O-N 3.25Å; Y695-L698 PolarHBondContact O-N 3.26Å; Y695-F699 WeakPolarHBondContact O-CB 3.37Å; Y695-F699 PolarHBondContact O-N 2.95Å; Y695-H783 AromaticContact CE2-CE1 3.75Å; Y695-H783 AromaticContact CE2-NE2 2.7Å; Y695-H783 WeakPolarHBondContact CE2-NE2 3.33Å; Y695-H783 AromaticContact CZ-NE2 2.71Å; Y695-H783 PolarHBondContact OH-CD2 3.38Å; Y695-H783 PolarHBondContact OH-NE2 3.11Å; Y695-F786 AromaticContact CE1-CE1 3.99Å; Y695-F786 HydrophobicContact CE1-CE1 3.99Å; Y695-L787 HydrophobicContact CD1-CD2 3.71Å; Y695-L787 HydrophobicContact CD2-CD1 4.35Å; Y695-L787 HydrophobicContact CD2-CD2 4Å; Y695-L787 HydrophobicContact CE1-CD2 3.53Å; Y695-L787 HydrophobicContact CE1-CG 4.42Å; Y695-L787 HydrophobicContact CE2-CD1 3.89Å; Y695-L787 HydrophobicContact CE2-CD2 3.82Å; Y695-L787 HydrophobicContact CE2-CG 4.2Å; Y695-L787 HydrophobicContact CG-CD2 3.94Å
696	Q	90.4	Very high	88.1	Confident	7 Å²	7	16.4 Å²	16.4	3%	0.033	8%	0.082	C	C	.	.	H	α-helix	trans	-57	-40.3	174.1	-79	-178.9	-14.3	0	0	111.7	E639 A674 F675 T676 I692 S693 F699 R700	E639-Q696 PolarHBondContact OE2-NE2 3.03Å; E639-Q696 VanDerWaalsContact OE2-NE2 3.08Å; A674-Q696 HydrophobicContact CB-CG 4.31Å; F675-Q696 VanDerWaalsContact O-CG 3.31Å; F675-Q696 WeakPolarHBondContact O-CG 3.38Å; T676-Q696 PolarHBondContact OG1-NE2 2.87Å; I692-Q696 PolarHBondContact O-N 3.46Å; S693-Q696 WeakPolarHBondContact O-CB 3.42Å; S693-Q696 PolarHBondContact O-N 3.05Å; Q696-F699 PolarHBondContact O-N 2.97Å; Q696-R700 WeakPolarHBondContact O-CB 3.46Å; Q696-R700 VanDerWaalsContact O-CG 3.27Å; Q696-R700 WeakPolarHBondContact O-CG 3.07Å; Q696-R700 PolarHBondContact O-N 3.32Å
697	M	87	Confident	88.2	Confident	5 Å²	5	17.1 Å²	17.1	3%	0.025	9%	0.085	C	C	.	.	H	α-helix	trans	-62.8	-43.4	177.3	-74	171.7	44.1	0	0	112.6	L645 Q648 M649 I652 S693 K694 Y695 Q701 L791 L796	L645-M697 HydrophobicContact CD1-CB 4.03Å; L645-M697 HydrophobicContact CD1-CG 3.97Å; Q648-M697 HydrophobicContact CG-CG 3.82Å; Q648-M697 HydrophobicContact CG-SD 4.27Å; M649-M697 HydrophobicContact CB-CE 4.37Å; M649-M697 HydrophobicContact CE-CE 4.08Å; M649-M697 HydrophobicContact CG-CE 3.44Å; M649-M697 VanDerWaalsContact CG-CE 3.44Å; M649-M697 HydrophobicContact CG-SD 4.38Å; I652-M697 HydrophobicContact CB-SD 4.41Å; I652-M697 HydrophobicContact CD1-CG 4.4Å; I652-M697 HydrophobicContact CD1-SD 3.53Å; I652-M697 VanDerWaalsContact CD1-SD 3.53Å; I652-M697 HydrophobicContact CG2-SD 4.5Å; S693-M697 WeakPolarHBondContact O-CG 3.32Å; S693-M697 PolarHBondContact O-N 3.41Å; S693-M697 VanDerWaalsContact O-N 3.08Å; K694-M697 PolarHBondContact O-N 2.95Å; Y695-M697 VanDerWaalsContact C-N 3.27Å; Y695-M697 PolarHBondContact O-N 3.25Å; M697-Q701 PolarHBondContact O-N 2.95Å; M697-L791 HydrophobicContact CB-CD2 4.34Å; M697-L791 HydrophobicContact CE-CD2 4.01Å; M697-L796 HydrophobicContact CB-CD1 4.38Å
698	L	90.8	Very high	88.4	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-63.1	-49.2	173.7	-69.5	167.6	0	0	0	110.7	L584 K694 Y695 R700 Q701 L702 L787 C790 L791 C794 L796	L584-L698 HydrophobicContact CD2-CB 4.18Å; L584-L698 HydrophobicContact CD2-CD1 3.99Å; K694-L698 PolarHBondContact O-N 3.24Å; Y695-L698 PolarHBondContact O-N 3.26Å; L698-R700 PolarHBondContact O-N 3.45Å; L698-Q701 PolarHBondContact O-N 3Å; L698-L702 VanDerWaalsContact O-CG 3.29Å; L698-L702 WeakPolarHBondContact O-CG 3.42Å; L698-L702 PolarHBondContact O-N 3.39Å; L698-L787 HydrophobicContact CD1-CD2 4.4Å; L698-C790 HydrophobicContact CD1-CB 4.04Å; L698-L791 HydrophobicContact CD1-CD2 4.38Å; L698-L791 HydrophobicContact CD2-CD2 3.96Å; L698-L791 HydrophobicContact CG-CD2 3.81Å; L698-C794 HydrophobicContact CD2-CB 3.89Å; L698-L796 HydrophobicContact CD2-CD1 3.98Å
699	F	92.3	Very high	88.7	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-51.9	-52.9	177.2	171.7	-101.2	0	0	0	111.7	L583 L585 F673 F675 Y695 Q696 Q701 L702 F703	L583-F699 WeakPolarHBondContact O-CA 3.43Å; L583-F699 VanDerWaalsContact O-CB 3.31Å; L583-F699 WeakPolarHBondContact O-CB 3.43Å; L585-F699 HydrophobicContact CD2-CD2 3.81Å; L585-F699 HydrophobicContact CD2-CE2 3.57Å; F673-F699 AromaticContact CD1-CE1 3.98Å; F673-F699 HydrophobicContact CD1-CE1 3.98Å; F673-F699 HydrophobicContact CD1-CZ 4.2Å; F673-F699 AromaticContact CE1-CE1 3.94Å; F673-F699 HydrophobicContact CE1-CE1 3.94Å; F673-F699 AromaticContact CE1-CZ 3.82Å; F673-F699 HydrophobicContact CE1-CZ 3.82Å; F675-F699 AromaticContact CD2-CD2 3.92Å; F675-F699 HydrophobicContact CD2-CD2 3.92Å; F675-F699 HydrophobicContact CD2-CE1 4.01Å; F675-F699 AromaticContact CD2-CE2 3.23Å; F675-F699 HydrophobicContact CD2-CE2 3.23Å; F675-F699 AromaticContact CD2-CZ 3.3Å; F675-F699 HydrophobicContact CD2-CZ 3.3Å; F675-F699 AromaticContact CE2-CE2 3.55Å; F675-F699 HydrophobicContact CE2-CE2 3.55Å; F675-F699 AromaticContact CE2-CZ 3.56Å; F675-F699 HydrophobicContact CE2-CZ 3.56Å; F675-F699 HydrophobicContact CG-CE1 4.38Å; F675-F699 HydrophobicContact CG-CE2 4.3Å; F675-F699 HydrophobicContact CG-CZ 4.08Å; Y695-F699 WeakPolarHBondContact O-CB 3.37Å; Y695-F699 PolarHBondContact O-N 2.95Å; Q696-F699 PolarHBondContact O-N 2.97Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 2.97Å; F699-L702 PolarHBondContact O-N 3.03Å; F699-F703 HydrophobicContact CE1-CB 4.14Å; F699-F703 HydrophobicContact CE1-CD1 4.47Å; F699-F703 HydrophobicContact CE1-CD2 4.49Å; F699-F703 HydrophobicContact CE1-CG 4.15Å; F699-F703 HydrophobicContact CE2-CB 4.05Å; F699-F703 AromaticContact CE2-CD2 3.95Å; F699-F703 HydrophobicContact CE2-CD2 3.95Å; F699-F703 HydrophobicContact CE2-CG 4.2Å; F699-F703 HydrophobicContact CZ-CB 3.83Å; F699-F703 HydrophobicContact CZ-CD1 4.28Å; F699-F703 AromaticContact CZ-CD2 3.59Å; F699-F703 HydrophobicContact CZ-CD2 3.59Å; F699-F703 HydrophobicContact CZ-CE2 4.16Å; F699-F703 AromaticContact CZ-CG 3.65Å; F699-F703 HydrophobicContact CZ-CG 3.65Å; F699-F703 WeakPolarHBondContact O-CB 3.41Å; F699-F703 PolarHBondContact O-N 3.41Å
700	R	89.2	Confident	89.1	Confident	11 Å²	11	15.4 Å²	15.4	4%	0.042	8%	0.075	C	C	.	.	H	α-helix	trans	-59.7	-39.5	-176.6	-73.4	175.2	79.3	-173.1	10.9	112.7	Y643 D644 L645 E671 A674 Q696 L698 Y704	Y643-R700 PolarHBondContact O-NH1 3.41Å; Y643-R700 PolarHBondContact O-NH2 2.9Å; D644-R700 VanDerWaalsContact C-NH2 3.3Å; D644-R700 PolarHBondContact O-NH1 3.27Å; L645-R700 HydrophobicContact CD1-CB 4.04Å; L645-R700 HydrophobicContact CD2-CB 4.16Å; E671-R700 PolarHBondContact O-NH2 2.85Å; A674-R700 HydrophobicContact CB-CG 4.32Å; Q696-R700 WeakPolarHBondContact O-CB 3.46Å; Q696-R700 VanDerWaalsContact O-CG 3.27Å; Q696-R700 WeakPolarHBondContact O-CG 3.07Å; Q696-R700 PolarHBondContact O-N 3.32Å; L698-R700 PolarHBondContact O-N 3.45Å; R700-Y704 VanDerWaalsContact O-CB 3.24Å; R700-Y704 WeakPolarHBondContact O-CB 3.36Å; R700-Y704 PolarHBondContact O-N 3.46Å; R700-Y704 VanDerWaalsContact O-N 3.09Å
701	Q	87.4	Confident	89.3	Confident	3 Å²	3	12.5 Å²	12.5	1%	0.014	6%	0.06	C	C	.	.	H	α-helix	trans	-66.6	-49.8	175.4	-176.2	-173.4	12	0	0	111.5	L645 M697 L698 F699 Y704 C705 M754 C794 L796	L645-Q701 HydrophobicContact CD2-CB 4.01Å; M697-Q701 PolarHBondContact O-N 2.95Å; L698-Q701 PolarHBondContact O-N 3Å; F699-Q701 VanDerWaalsContact C-N 3.33Å; F699-Q701 PolarHBondContact O-N 2.97Å; Q701-Y704 PolarHBondContact O-N 3.32Å; Q701-C705 PolarHBondContact O-N 3.42Å; Q701-M754 HydrophobicContact CG-SD 4.22Å; Q701-C794 PolarHBondContact NE2-O 3.36Å; Q701-C794 PolarHBondContact OE1-O 3.35Å; Q701-L796 VanDerWaalsContact CD-CD2 3.49Å; Q701-L796 HydrophobicContact CG-CD2 4.43Å; Q701-L796 VanDerWaalsContact OE1-CG 3.31Å
702	L	90.2	Very high	89.3	Confident	1 Å²	1	12.2 Å²	12.2	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-62.6	-45	-178.5	-65.5	170.5	0	0	0	111.5	L585 L698 F699 C705 K706 M754 M755 I759	L585-L702 HydrophobicContact CD1-CB 3.63Å; L585-L702 HydrophobicContact CG-CB 4.22Å; L698-L702 VanDerWaalsContact O-CG 3.29Å; L698-L702 WeakPolarHBondContact O-CG 3.42Å; L698-L702 PolarHBondContact O-N 3.39Å; F699-L702 PolarHBondContact O-N 3.03Å; L702-C705 PolarHBondContact O-N 3.05Å; L702-K706 WeakPolarHBondContact O-CB 3.28Å; L702-K706 PolarHBondContact O-N 2.96Å; L702-M754 HydrophobicContact CD2-CB 3.8Å; L702-M754 HydrophobicContact CD2-CE 3.91Å; L702-M754 HydrophobicContact CD2-SD 4.14Å; L702-M755 HydrophobicContact CD2-CE 4.25Å; L702-M755 HydrophobicContact CD2-CG 4.36Å; L702-I759 HydrophobicContact CD1-CD1 3.76Å; L702-I759 HydrophobicContact CD2-CD1 4.3Å
703	F	90.4	Very high	89.2	Confident	3 Å²	3	13.1 Å²	13.1	1%	0.013	7%	0.065	C	C	.	.	H	α-helix	trans	-63.6	-41.3	179	-174.1	-105.2	0	0	0	111.8	F594 M595 L602 L670 F673 F699 K706 H707	F594-F703 HydrophobicContact CD1-CE2 4.29Å; F594-F703 HydrophobicContact CE1-CE2 4.38Å; F594-F703 HydrophobicContact CE1-CZ 4.26Å; M595-F703 HydrophobicContact CE-CD2 3.94Å; M595-F703 HydrophobicContact CE-CE1 4.36Å; M595-F703 HydrophobicContact CE-CE2 3.69Å; M595-F703 HydrophobicContact CE-CG 4.39Å; M595-F703 HydrophobicContact CE-CZ 3.92Å; M595-F703 HydrophobicContact CG-CD2 4.34Å; M595-F703 HydrophobicContact CG-CE2 3.49Å; M595-F703 VanDerWaalsContact CG-CE2 3.49Å; M595-F703 HydrophobicContact CG-CZ 4Å; M595-F703 HydrophobicContact SD-CD2 4.1Å; M595-F703 HydrophobicContact SD-CE2 3.82Å; L602-F703 HydrophobicContact CD1-CE1 4.28Å; L602-F703 HydrophobicContact CD1-CZ 3.99Å; L670-F703 HydrophobicContact CD1-CD1 4.38Å; L670-F703 HydrophobicContact CD1-CE1 3.74Å; F673-F703 HydrophobicContact CD1-CD1 4.18Å; F673-F703 AromaticContact CD1-CE1 3.61Å; F673-F703 HydrophobicContact CD1-CE1 3.61Å; F673-F703 AromaticContact CD1-CZ 3.86Å; F673-F703 HydrophobicContact CD1-CZ 3.86Å; F673-F703 HydrophobicContact CE1-CE1 4.21Å; F673-F703 HydrophobicContact CE1-CE2 4.42Å; F673-F703 AromaticContact CE1-CZ 4Å; F673-F703 HydrophobicContact CE1-CZ 4Å; F699-F703 HydrophobicContact CE1-CB 4.14Å; F699-F703 HydrophobicContact CE1-CD1 4.47Å; F699-F703 HydrophobicContact CE1-CD2 4.49Å; F699-F703 HydrophobicContact CE1-CG 4.15Å; F699-F703 HydrophobicContact CE2-CB 4.05Å; F699-F703 AromaticContact CE2-CD2 3.95Å; F699-F703 HydrophobicContact CE2-CD2 3.95Å; F699-F703 HydrophobicContact CE2-CG 4.2Å; F699-F703 HydrophobicContact CZ-CB 3.83Å; F699-F703 HydrophobicContact CZ-CD1 4.28Å; F699-F703 AromaticContact CZ-CD2 3.59Å; F699-F703 HydrophobicContact CZ-CD2 3.59Å; F699-F703 HydrophobicContact CZ-CE2 4.16Å; F699-F703 AromaticContact CZ-CG 3.65Å; F699-F703 HydrophobicContact CZ-CG 3.65Å; F699-F703 WeakPolarHBondContact O-CB 3.41Å; F699-F703 PolarHBondContact O-N 3.41Å; F703-K706 PolarHBondContact O-N 2.9Å; F703-H707 PolarHBondContact O-N 3.05Å
704	Y	88.5	Confident	89.1	Confident	11 Å²	11	15.2 Å²	15.2	4%	0.043	7%	0.071	C	C	.	.	H	α-helix	trans	-65.3	-45.8	176.3	-173.8	-113.2	0	0	0	112.1	L670 R700 Q701 K706 H707 V708 F807 C810 K811 L814	L670-Y704 HydrophobicContact CD2-CD2 3.91Å; L670-Y704 HydrophobicContact CD2-CE2 4.02Å; L670-Y704 HydrophobicContact CG-CD2 4.5Å; R700-Y704 VanDerWaalsContact O-CB 3.24Å; R700-Y704 WeakPolarHBondContact O-CB 3.36Å; R700-Y704 PolarHBondContact O-N 3.46Å; R700-Y704 VanDerWaalsContact O-N 3.09Å; Q701-Y704 PolarHBondContact O-N 3.32Å; Y704-K706 VanDerWaalsContact C-N 3.35Å; Y704-K706 PolarHBondContact O-N 3.07Å; Y704-H707 WeakPolarHBondContact O-CB 3.49Å; Y704-H707 PolarHBondContact O-N 3.34Å; Y704-V708 WeakPolarHBondContact O-CG2 3.33Å; Y704-V708 PolarHBondContact O-N 3.49Å; Y704-F807 AromaticContact CD1-CD1 3.63Å; Y704-F807 HydrophobicContact CD1-CD1 3.63Å; Y704-F807 AromaticContact CD1-CE1 3.35Å; Y704-F807 HydrophobicContact CD1-CE1 3.35Å; Y704-F807 HydrophobicContact CD1-CZ 4.3Å; Y704-F807 AromaticContact CE1-CD1 3.36Å; Y704-F807 HydrophobicContact CE1-CD1 3.36Å; Y704-F807 AromaticContact CE1-CE1 3.58Å; Y704-F807 HydrophobicContact CE1-CE1 3.58Å; Y704-F807 HydrophobicContact CE1-CG 4.44Å; Y704-F807 AromaticContact CG-CE1 3.92Å; Y704-F807 HydrophobicContact CG-CE1 3.92Å; Y704-C810 HydrophobicContact CD1-CB 4.07Å; Y704-C810 HydrophobicContact CE1-CB 3.32Å; Y704-K811 WeakPolarHBondContact OH-CG 3.09Å; Y704-L814 HydrophobicContact CE2-CD1 4.22Å
705	C	89.6	Confident	88.9	Confident	1 Å²	1	13.8 Å²	13.8	1%	0.007	6%	0.064	C	C	.	.	H	α-helix	trans	-56.5	-49.4	173.2	-71.6	0	0	0	0	111.1	Q701 L702 H707 V708 E709 E751 M754	Q701-C705 PolarHBondContact O-N 3.42Å; L702-C705 PolarHBondContact O-N 3.05Å; C705-H707 VanDerWaalsContact C-N 3.25Å; C705-H707 PolarHBondContact O-N 3.17Å; C705-V708 WeakPolarHBondContact O-CA 3.44Å; C705-V708 PolarHBondContact O-N 3.09Å; C705-E709 PolarHBondContact O-N 3.24Å; C705-E751 HydrophobicContact CB-CG 3.8Å; C705-E751 WeakPolarHBondContact CB-OE1 3.45Å; C705-E751 VanDerWaalsContact O-OE1 3.08Å; C705-M754 HydrophobicContact CB-CE 4.36Å
706	K	89.8	Confident	88.5	Confident	35 Å²	35	19.7 Å²	19.7	15%	0.152	9%	0.087	C	C	.	.	H	α-helix	trans	-61.3	-32	-179.6	-79.9	-63.4	-177.6	-157.2	0	113.5	L585 M592 M595 L702 F703 Y704 E709 R710 E751 M755	L585-K706 HydrophobicContact CD1-CG 4.21Å; M592-K706 HydrophobicContact CE-CD 4.45Å; M595-K706 HydrophobicContact CE-CB 4.47Å; M595-K706 HydrophobicContact SD-CB 4.33Å; L702-K706 WeakPolarHBondContact O-CB 3.28Å; L702-K706 PolarHBondContact O-N 2.96Å; F703-K706 PolarHBondContact O-N 2.9Å; Y704-K706 VanDerWaalsContact C-N 3.35Å; Y704-K706 PolarHBondContact O-N 3.07Å; K706-E709 VanDerWaalsContact CD-OE2 3.3Å; K706-E709 WeakPolarHBondContact CD-OE2 3.37Å; K706-E709 IonicContact NZ-OE1 2.67Å; K706-E709 IonicContact NZ-OE2 2.76Å; K706-E709 PolarHBondContact NZ-OE2 2.94Å; K706-R710 VanDerWaalsContact O-CB 3.32Å; K706-R710 WeakPolarHBondContact O-CB 3.25Å; K706-R710 PolarHBondContact O-N 3.31Å; K706-E751 VanDerWaalsContact CA-OE1 3.28Å; K706-E751 WeakPolarHBondContact CA-OE1 3.49Å; K706-E751 WeakPolarHBondContact CE-OE2 3.45Å; K706-E751 PolarHBondContact N-OE1 3.24Å; K706-E751 IonicContact NZ-OE2 2.65Å; K706-E751 PolarHBondContact NZ-OE2 2.79Å; K706-M755 HydrophobicContact CG-CE 4.27Å
707	H	88.5	Confident	88.1	Confident	16 Å²	16	26.4 Å²	26.4	7%	0.074	12%	0.116	C	C	.	.	H	α-helix	trans	-63.6	-44.4	172.5	-175.6	89.9	0	0	0	111.4	M595 L670 F703 Y704 C705 R710 Q711	M595-H707 HydrophobicContact CE-CB 3.58Å; L670-H707 HydrophobicContact CD1-CB 4.1Å; L670-H707 WeakPolarHBondContact CD1-ND1 3.31Å; L670-H707 HydrophobicContact CD2-CB 4.03Å; L670-H707 VanDerWaalsContact CD2-CD2 3.44Å; L670-H707 WeakPolarHBondContact CD2-CD2 3.41Å; F703-H707 PolarHBondContact O-N 3.05Å; Y704-H707 WeakPolarHBondContact O-CB 3.49Å; Y704-H707 PolarHBondContact O-N 3.34Å; C705-H707 VanDerWaalsContact C-N 3.25Å; C705-H707 PolarHBondContact O-N 3.17Å; H707-R710 PolarHBondContact O-N 3.15Å; H707-Q711 WeakPolarHBondContact O-CG 3.48Å; H707-Q711 PolarHBondContact O-N 3.38Å
708	V	89.9	Confident	87.6	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-69.1	-39.1	179.3	-169.4	0	0	0	0	111.7	Y704 C705 R710 Q711 L712 I747 C810 C813 L814	Y704-V708 WeakPolarHBondContact O-CG2 3.33Å; Y704-V708 PolarHBondContact O-N 3.49Å; C705-V708 WeakPolarHBondContact O-CA 3.44Å; C705-V708 PolarHBondContact O-N 3.09Å; V708-R710 VanDerWaalsContact C-N 3.33Å; V708-R710 PolarHBondContact O-N 3.02Å; V708-Q711 PolarHBondContact O-N 2.99Å; V708-L712 HydrophobicContact CG1-CD1 4.17Å; V708-L712 WeakPolarHBondContact O-CG 3.47Å; V708-L712 PolarHBondContact O-N 2.95Å; V708-I747 HydrophobicContact CB-CD1 4.09Å; V708-I747 HydrophobicContact CG1-CD1 3.48Å; V708-I747 VanDerWaalsContact CG1-CD1 3.48Å; V708-C810 HydrophobicContact CG2-CB 3.98Å; V708-C813 HydrophobicContact CG1-CB 3.49Å; V708-C813 VanDerWaalsContact CG1-CB 3.49Å; V708-L814 HydrophobicContact CB-CD2 4.48Å; V708-L814 HydrophobicContact CG1-CD2 4.31Å; V708-L814 HydrophobicContact CG1-CG 4.33Å; V708-L814 HydrophobicContact CG2-CD1 4.07Å; V708-L814 HydrophobicContact CG2-CD2 4Å; V708-L814 HydrophobicContact CG2-CG 3.87Å
709	E	90.4	Very high	86.8	Confident	24 Å²	24	29.7 Å²	29.7	11%	0.112	13%	0.131	C	C	.	.	H	α-helix	trans	-54.7	-50.6	170.4	-170.2	-160.9	-163.5	0	0	110.5	C705 K706 Q711 L712 C713 M744 I747 Q748	C705-E709 PolarHBondContact O-N 3.24Å; K706-E709 VanDerWaalsContact CD-OE2 3.3Å; K706-E709 WeakPolarHBondContact CD-OE2 3.37Å; K706-E709 IonicContact NZ-OE1 2.67Å; K706-E709 IonicContact NZ-OE2 2.76Å; K706-E709 PolarHBondContact NZ-OE2 2.94Å; E709-Q711 PolarHBondContact O-N 2.93Å; E709-L712 PolarHBondContact O-N 2.88Å; E709-C713 WeakPolarHBondContact O-CB 3.48Å; E709-C713 PolarHBondContact O-N 3.44Å; E709-M744 HydrophobicContact CG-SD 4.02Å; E709-I747 HydrophobicContact CB-CG2 4.13Å; E709-Q748 HydrophobicContact CG-CG 4Å; E709-Q748 WeakPolarHBondContact OE1-CG 3.01Å; E709-Q748 PolarHBondContact OE1-NE2 3.49Å
710	R	88.7	Confident	85.6	Confident	40 Å²	40	32.2 Å²	32.2	15%	0.151	15%	0.149	C	C	.	.	H	α-helix	trans	-61.6	-42.6	-178.8	-175.2	169.4	166.7	-78.1	-20.2	112.4	M595 D596 E599 K706 H707 V708 C713 K714	M595-R710 PolarHBondContact O-NH1 3.36Å; D596-R710 IonicContact OD1-CZ 3.83Å; D596-R710 IonicContact OD1-NE 2.68Å; D596-R710 PolarHBondContact OD1-NE 2.95Å; D596-R710 IonicContact OD1-NH2 2.67Å; D596-R710 PolarHBondContact OD1-NH2 3.46Å; E599-R710 IonicContact OE2-CZ 2.68Å; E599-R710 VanDerWaalsContact OE2-CZ 3.22Å; E599-R710 IonicContact OE2-NH1 2.68Å; E599-R710 PolarHBondContact OE2-NH1 3.2Å; E599-R710 IonicContact OE2-NH2 3.31Å; E599-R710 PolarHBondContact OE2-NH2 3.16Å; K706-R710 VanDerWaalsContact O-CB 3.32Å; K706-R710 WeakPolarHBondContact O-CB 3.25Å; K706-R710 PolarHBondContact O-N 3.31Å; H707-R710 PolarHBondContact O-N 3.15Å; V708-R710 VanDerWaalsContact C-N 3.33Å; V708-R710 PolarHBondContact O-N 3.02Å; R710-C713 WeakPolarHBondContact O-CB 3.5Å; R710-C713 PolarHBondContact O-N 3.5Å; R710-K714 PolarHBondContact O-N 2.95Å
711	Q	87.5	Confident	84.4	Confident	14 Å²	14	37 Å²	37	7%	0.065	17%	0.174	C	C	.	.	H	α-helix	trans	-66.3	-40.9	176	-68.9	-59.5	-15.2	0	0	112.7	E599 H707 V708 E709 C713 K714 I715 L814	E599-Q711 PolarHBondContact OE1-NE2 3.04Å; H707-Q711 WeakPolarHBondContact O-CG 3.48Å; H707-Q711 PolarHBondContact O-N 3.38Å; V708-Q711 PolarHBondContact O-N 2.99Å; E709-Q711 PolarHBondContact O-N 2.93Å; Q711-C713 PolarHBondContact O-N 3.37Å; Q711-K714 WeakPolarHBondContact O-CB 3.48Å; Q711-K714 PolarHBondContact O-N 3.29Å; Q711-I715 PolarHBondContact O-N 3.41Å; Q711-I715 VanDerWaalsContact O-N 3.12Å; Q711-L814 HydrophobicContact CB-CD2 4.32Å; Q711-L814 HydrophobicContact CG-CD2 4.19Å
712	L	88.3	Confident	83.1	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.7	-29.5	173.8	-71.8	167.8	0	0	0	112.3	V708 E709 W716 R740 M743 M744 I747 C813 Y816 C817	V708-L712 HydrophobicContact CG1-CD1 4.17Å; V708-L712 WeakPolarHBondContact O-CG 3.47Å; V708-L712 PolarHBondContact O-N 2.95Å; E709-L712 PolarHBondContact O-N 2.88Å; L712-W716 PolarHBondContact O-N 3.26Å; L712-W716 VanDerWaalsContact O-N 3.17Å; L712-R740 HydrophobicContact CD2-CG 4.14Å; L712-M743 HydrophobicContact CD1-CB 4.17Å; L712-M743 HydrophobicContact CD2-CB 4.42Å; L712-M744 VanDerWaalsContact C-CE 3.42Å; L712-M744 HydrophobicContact CB-CE 3.45Å; L712-M744 VanDerWaalsContact CB-CE 3.45Å; L712-M744 HydrophobicContact CB-SD 4.23Å; L712-I747 HydrophobicContact CD1-CD1 3.57Å; L712-C813 HydrophobicContact CD1-CB 4.32Å; L712-Y816 HydrophobicContact CD2-CD1 4.15Å; L712-Y816 HydrophobicContact CD2-CE1 4.45Å; L712-C817 VanDerWaalsContact CD2-SG 3.58Å
713	C	87.1	Confident	81.7	Confident	41 Å²	41	45.7 Å²	45.7	28%	0.277	21%	0.209	S	C	.	.	H	α-helix	trans	-72.9	-42.5	173.6	-83.3	0	0	0	0	112.2	E709 R710 Q711 I715 W716 K717 M744	E709-C713 WeakPolarHBondContact O-CB 3.48Å; E709-C713 PolarHBondContact O-N 3.44Å; R710-C713 WeakPolarHBondContact O-CB 3.5Å; R710-C713 PolarHBondContact O-N 3.5Å; Q711-C713 PolarHBondContact O-N 3.37Å; C713-I715 VanDerWaalsContact C-N 3.34Å; C713-I715 PolarHBondContact O-N 3.38Å; C713-W716 WeakPolarHBondContact O-CB 3.32Å; C713-W716 PolarHBondContact O-N 3.13Å; C713-K717 PolarHBondContact O-N 2.93Å; C713-K717 VanDerWaalsContact O-N 3.13Å; C713-M744 HydrophobicContact CB-CE 4.18Å; C713-M744 WeakPolarHBondContact SG-CE 3.28Å
714	K	85.7	Confident	80.4	Confident	76 Å²	76	53.6 Å²	53.6	33%	0.33	25%	0.246	S	C	.	.	H	α-helix	trans	-55	-50.7	175	-169.4	179.9	-172.7	176.4	0	110.6	E599 R710 Q711 W716 K717 E718	E599-K714 IonicContact OE1-NZ 2.82Å; E599-K714 PolarHBondContact OE1-NZ 2.95Å; E599-K714 IonicContact OE2-NZ 2.84Å; R710-K714 PolarHBondContact O-N 2.95Å; Q711-K714 WeakPolarHBondContact O-CB 3.48Å; Q711-K714 PolarHBondContact O-N 3.29Å; K714-W716 VanDerWaalsContact C-N 3.31Å; K714-W716 PolarHBondContact O-N 3.29Å; K714-K717 WeakPolarHBondContact O-CB 3.36Å; K714-K717 PolarHBondContact O-N 3.41Å; K714-K717 VanDerWaalsContact O-N 3.1Å; K714-E718 PolarHBondContact O-N 2.97Å; K714-E718 VanDerWaalsContact O-N 3.13Å
715	I	83.7	Confident	79.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.1	-27.2	178.5	-73.4	176.7	0	0	0	113.3	Q711 C713 N719 C817 I820 Q821	Q711-I715 PolarHBondContact O-N 3.41Å; Q711-I715 VanDerWaalsContact O-N 3.12Å; C713-I715 VanDerWaalsContact C-N 3.34Å; C713-I715 PolarHBondContact O-N 3.38Å; I715-N719 WeakPolarHBondContact CG2-ND2 3.25Å; I715-N719 VanDerWaalsContact O-CB 3.22Å; I715-N719 WeakPolarHBondContact O-CB 3.26Å; I715-N719 PolarHBondContact O-N 3.22Å; I715-N719 PolarHBondContact O-ND2 3.4Å; I715-C817 HydrophobicContact CD1-CB 3.3Å; I715-C817 WeakPolarHBondContact CD1-O 3.39Å; I715-I820 HydrophobicContact CG2-CB 4.2Å; I715-I820 HydrophobicContact CG2-CG2 3.57Å; I715-Q821 HydrophobicContact CD1-CG 3.81Å; I715-Q821 HydrophobicContact CG1-CG 3.95Å
716	W	83.9	Confident	77.7	Confident	125 Å²	125	64.7 Å²	64.7	47%	0.473	30%	0.297	S	S	.	.	H	α-helix	trans	-67.7	-38.3	171.2	176.2	74.3	0	0	0	112.2	L712 C713 K714 S720	L712-W716 PolarHBondContact O-N 3.26Å; L712-W716 VanDerWaalsContact O-N 3.17Å; C713-W716 WeakPolarHBondContact O-CB 3.32Å; C713-W716 PolarHBondContact O-N 3.13Å; K714-W716 VanDerWaalsContact C-N 3.31Å; K714-W716 PolarHBondContact O-N 3.29Å; W716-S720 PolarHBondContact O-N 3Å
717	K	82.1	Confident	76.4	Confident	148 Å²	148	68.1 Å²	68.1	64%	0.643	32%	0.322	S	S	*	.	H	α-helix	trans	-63.4	-49.6	174.4	-63.9	173.1	-178.3	176.9	0	110.7	C713 K714 S720	C713-K717 PolarHBondContact O-N 2.93Å; C713-K717 VanDerWaalsContact O-N 3.13Å; K714-K717 WeakPolarHBondContact O-CB 3.36Å; K714-K717 PolarHBondContact O-N 3.41Å; K714-K717 VanDerWaalsContact O-N 3.1Å; K717-S720 VanDerWaalsContact O-CB 3.23Å; K717-S720 WeakPolarHBondContact O-CB 3.45Å; K717-S720 PolarHBondContact O-N 3.02Å; K717-S720 VanDerWaalsContact O-N 3.16Å
718	E	76.1	Confident	75.1	Confident	65 Å²	65	75.1 Å²	75.1	30%	0.304	36%	0.355	S	S	.	.	H	α-helix	trans	-58.8	-48.5	178	-67.9	164.3	-170.7	0	0	111.9	K714 S720 I721	K714-E718 PolarHBondContact O-N 2.97Å; K714-E718 VanDerWaalsContact O-N 3.13Å; E718-S720 PolarHBondContact O-N 3.05Å; E718-I721 WeakPolarHBondContact O-CB 3.34Å; E718-I721 PolarHBondContact O-N 3.48Å; E718-I721 VanDerWaalsContact O-N 3.14Å
719	N	73.1	Confident	73.9	Confident	9 Å²	9	77.1 Å²	77.1	5%	0.048	37%	0.372	C	S	.	.	H	α-helix	trans	-68.9	-10.7	178.3	-78.9	-52.5	0	0	0	115	I715 I721 A722 F737 I820	I715-N719 WeakPolarHBondContact CG2-ND2 3.25Å; I715-N719 VanDerWaalsContact O-CB 3.22Å; I715-N719 WeakPolarHBondContact O-CB 3.26Å; I715-N719 PolarHBondContact O-N 3.22Å; I715-N719 PolarHBondContact O-ND2 3.4Å; N719-I721 PolarHBondContact O-N 3.31Å; N719-A722 WeakPolarHBondContact O-CB 3.4Å; N719-A722 PolarHBondContact O-N 2.93Å; N719-F737 HydrophobicContact CB-CD1 4.39Å; N719-F737 HydrophobicContact CB-CE1 3.61Å; N719-F737 HydrophobicContact CB-CZ 4.15Å; N719-I820 WeakPolarHBondContact ND2-CG2 3.47Å
720	S	67.4	Low	72.6	Confident	53 Å²	53	77 Å²	77	37%	0.371	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-32.3	171.2	-160.7	0	0	0	0	111.1	W716 K717 E718 A722 R723	W716-S720 PolarHBondContact O-N 3Å; K717-S720 VanDerWaalsContact O-CB 3.23Å; K717-S720 WeakPolarHBondContact O-CB 3.45Å; K717-S720 PolarHBondContact O-N 3.02Å; K717-S720 VanDerWaalsContact O-N 3.16Å; E718-S720 PolarHBondContact O-N 3.05Å; S720-A722 VanDerWaalsContact C-N 3.35Å; S720-R723 WeakPolarHBondContact O-CB 3.15Å; S720-R723 WeakPolarHBondContact O-CD 3.38Å; S720-R723 VanDerWaalsContact O-CG 3.32Å; S720-R723 WeakPolarHBondContact O-CG 3.32Å; S720-R723 PolarHBondContact O-N 3.46Å
721	I	63.8	Low	71.6	Confident	112 Å²	112	78.2 Å²	78.2	57%	0.574	39%	0.39	S	S	*	.	H	α-helix	trans	-68.6	-35.8	176.3	-52.8	172.7	0	0	0	110.6	E718 N719 R723 Q724	E718-I721 WeakPolarHBondContact O-CB 3.34Å; E718-I721 PolarHBondContact O-N 3.48Å; E718-I721 VanDerWaalsContact O-N 3.14Å; N719-I721 PolarHBondContact O-N 3.31Å; I721-R723 PolarHBondContact O-N 3.46Å; I721-Q724 WeakPolarHBondContact O-CG 3.24Å; I721-Q724 PolarHBondContact O-N 3.47Å; I721-Q724 VanDerWaalsContact O-N 3.13Å
722	A	60	Low	70.8	Confident	10 Å²	10	84 Å²	84	8%	0.083	42%	0.421	C	S	.	.	G	3₁₀ helix	trans	-63.9	-3.8	178.4	0	0	0	0	0	114.8	N719 S720 Q724 F725 F737	N719-A722 WeakPolarHBondContact O-CB 3.4Å; N719-A722 PolarHBondContact O-N 2.93Å; S720-A722 VanDerWaalsContact C-N 3.35Å; A722-Q724 PolarHBondContact O-N 3.2Å; A722-F725 HydrophobicContact CB-CD2 3.71Å; A722-F725 HydrophobicContact CB-CE2 3.58Å; A722-F725 VanDerWaalsContact O-CD2 3.28Å; A722-F725 WeakPolarHBondContact O-CD2 3.43Å; A722-F737 HydrophobicContact CB-CZ 4.4Å
723	R	60.9	Low	70.1	Confident	177 Å²	177	86 Å²	86	67%	0.668	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-70.1	-9.5	170.1	-64	176	175.2	-172.9	-1.7	113.6	S720 I721	S720-R723 WeakPolarHBondContact O-CB 3.15Å; S720-R723 WeakPolarHBondContact O-CD 3.38Å; S720-R723 VanDerWaalsContact O-CG 3.32Å; S720-R723 WeakPolarHBondContact O-CG 3.32Å; S720-R723 PolarHBondContact O-N 3.46Å; I721-R723 PolarHBondContact O-N 3.46Å
724	Q	62.4	Low	69.5	Low	169 Å²	169	91.6 Å²	91.6	79%	0.79	44%	0.444	S	S	*	.	G	3₁₀ helix	trans	-90.1	-3.2	179.6	-61	178.2	9.5	0	0	113.7	I721 A722	I721-Q724 WeakPolarHBondContact O-CG 3.24Å; I721-Q724 PolarHBondContact O-N 3.47Å; I721-Q724 VanDerWaalsContact O-N 3.13Å; A722-Q724 PolarHBondContact O-N 3.2Å
725	F	62.5	Low	69.3	Low	93 Å²	93	91.2 Å²	91.2	41%	0.408	45%	0.454	S	S	.	.	S	Bend	trans	-81.7	160	-176.3	-65.8	-51.7	0	0	0	114.6	A722 Y733	A722-F725 HydrophobicContact CB-CD2 3.71Å; A722-F725 HydrophobicContact CB-CE2 3.58Å; A722-F725 VanDerWaalsContact O-CD2 3.28Å; A722-F725 WeakPolarHBondContact O-CD2 3.43Å; F725-Y733 HydrophobicContact CD2-CE2 4.29Å
726	E	59.8	Low	69.1	Low	151 Å²	151	92.2 Å²	92.2	71%	0.706	46%	0.462	S	S	*	.			trans	-55.2	141.6	-179.4	-160.7	172.7	-151.4	0	0	112.9	Q728 A729 A730	E726-Q728 PolarHBondContact O-N 2.99Å; E726-A729 PolarHBondContact O-N 2.69Å; E726-A729 VanDerWaalsContact O-N 3.16Å; E726-A730 PolarHBondContact O-N 3.42Å
727	P	62.3	Low	69.1	Low	107 Å²	107	88.7 Å²	88.7	70%	0.695	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.7	-167.8	17.2	-33.1	0	0	0	115.8	S731	P727-S731 PolarHBondContact O-N 3.32Å
728	Q	62.1	Low	69.2	Low	164 Å²	164	85.2 Å²	85.2	77%	0.766	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-45.1	-179.8	-159.9	162.2	0.7	0	0	111.5	E726 A730 S731	E726-Q728 PolarHBondContact O-N 2.99Å; Q728-A730 VanDerWaalsContact C-N 3.33Å; Q728-A730 PolarHBondContact O-N 3.02Å; Q728-S731 WeakPolarHBondContact O-CB 3.49Å; Q728-S731 PolarHBondContact O-N 2.96Å; Q728-S731 PolarHBondContact O-OG 2.82Å
729	A	63.4	Low	69.8	Low	41 Å²	41	85.9 Å²	85.9	34%	0.339	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-40.6	170.5	0	0	0	0	0	111.5	E726 S731 L732 Y733	E726-A729 PolarHBondContact O-N 2.69Å; E726-A729 VanDerWaalsContact O-N 3.16Å; A729-S731 PolarHBondContact O-N 2.84Å; A729-L732 PolarHBondContact O-N 3.43Å; A729-L732 VanDerWaalsContact O-N 3.1Å; A729-Y733 WeakPolarHBondContact O-CD2 3.25Å; A729-Y733 PolarHBondContact O-N 3.16Å
730	A	64.6	Low	70.5	Confident	23 Å²	23	86.1 Å²	86.1	19%	0.19	45%	0.447	C	S	.	.	H	α-helix	trans	-60.4	-17.5	177.9	0	0	0	0	0	114.2	E726 Q728 R734	E726-A730 PolarHBondContact O-N 3.42Å; Q728-A730 VanDerWaalsContact C-N 3.33Å; Q728-A730 PolarHBondContact O-N 3.02Å; A730-R734 WeakPolarHBondContact O-CG 3.46Å; A730-R734 PolarHBondContact O-N 2.94Å; A730-R734 PolarHBondContact O-NH1 2.92Å; A730-R734 VanDerWaalsContact O-NH1 3.09Å
731	S	67.5	Low	71.5	Confident	65 Å²	65	88.1 Å²	88.1	46%	0.455	45%	0.451	S	S	.	.	H	α-helix	trans	-70.1	-42.9	173.5	73.4	0	0	0	0	112.4	P727 Q728 A729 R734	P727-S731 PolarHBondContact O-N 3.32Å; Q728-S731 WeakPolarHBondContact O-CB 3.49Å; Q728-S731 PolarHBondContact O-N 2.96Å; Q728-S731 PolarHBondContact O-OG 2.82Å; A729-S731 PolarHBondContact O-N 2.84Å; S731-R734 PolarHBondContact O-N 3.41Å
732	L	69.6	Low	72.8	Confident	136 Å²	136	91.3 Å²	91.3	71%	0.712	46%	0.456	S	S	*	.	H	α-helix	trans	-69.1	-41.8	177.9	-63.8	173	0	0	0	111	A729 R734 A735 A736	A729-L732 PolarHBondContact O-N 3.43Å; A729-L732 VanDerWaalsContact O-N 3.1Å; L732-R734 VanDerWaalsContact C-N 3.3Å; L732-R734 PolarHBondContact O-N 3.18Å; L732-A735 PolarHBondContact O-N 3.34Å; L732-A736 PolarHBondContact O-N 3.3Å
733	Y	73.7	Confident	74.3	Confident	42 Å²	42	92.1 Å²	92.1	17%	0.165	46%	0.458	C	S	.	.	H	α-helix	trans	-61.6	-32.1	175.8	-77.1	-71.8	0	0	0	113.3	F725 A729 A735 A736 F737	F725-Y733 HydrophobicContact CD2-CE2 4.29Å; A729-Y733 WeakPolarHBondContact O-CD2 3.25Å; A729-Y733 PolarHBondContact O-N 3.16Å; Y733-A735 VanDerWaalsContact C-N 3.34Å; Y733-A735 PolarHBondContact O-N 2.98Å; Y733-A736 PolarHBondContact O-N 3.23Å; Y733-F737 HydrophobicContact CD1-CE1 4.13Å; Y733-F737 HydrophobicContact CD1-CZ 4.21Å; Y733-F737 HydrophobicContact CG-CZ 4.29Å; Y733-F737 WeakPolarHBondContact O-CB 3.38Å; Y733-F737 WeakPolarHBondContact O-CD1 3.31Å; Y733-F737 WeakPolarHBondContact O-CD2 3.4Å; Y733-F737 WeakPolarHBondContact O-CG 3.41Å; Y733-F737 PolarHBondContact O-N 3.14Å
734	R	75.1	Confident	75.7	Confident	158 Å²	158	84 Å²	84	60%	0.596	43%	0.428	S	S	*	.	H	α-helix	trans	-60.2	-40.2	175.4	-80.8	179	-176.6	92.2	-10.2	113.1	A730 S731 L732 F737 T738	A730-R734 WeakPolarHBondContact O-CG 3.46Å; A730-R734 PolarHBondContact O-N 2.94Å; A730-R734 PolarHBondContact O-NH1 2.92Å; A730-R734 VanDerWaalsContact O-NH1 3.09Å; S731-R734 PolarHBondContact O-N 3.41Å; L732-R734 VanDerWaalsContact C-N 3.3Å; L732-R734 PolarHBondContact O-N 3.18Å; R734-F737 PolarHBondContact O-N 3.38Å; R734-T738 PolarHBondContact O-N 3.43Å; R734-T738 PolarHBondContact O-OG1 3.2Å
735	A	80.4	Confident	77.1	Confident	67 Å²	67	80 Å²	80	55%	0.554	41%	0.412	S	S	*	.	H	α-helix	trans	-65.4	-44.1	177.7	0	0	0	0	0	111	L732 Y733 T738 L739	L732-A735 PolarHBondContact O-N 3.34Å; Y733-A735 VanDerWaalsContact C-N 3.34Å; Y733-A735 PolarHBondContact O-N 2.98Å; A735-T738 PolarHBondContact O-N 3.1Å; A735-L739 PolarHBondContact O-N 3.42Å
736	A	81.1	Confident	78.5	Confident	21 Å²	21	77.8 Å²	77.8	17%	0.174	41%	0.411	C	S	.	.	H	α-helix	trans	-61.1	-45.1	174.1	0	0	0	0	0	112.2	L732 Y733 T738 L739 R740 Y816 I820	L732-A736 PolarHBondContact O-N 3.3Å; Y733-A736 PolarHBondContact O-N 3.23Å; A736-T738 VanDerWaalsContact C-N 3.31Å; A736-T738 PolarHBondContact O-N 2.89Å; A736-L739 PolarHBondContact O-N 3.13Å; A736-L739 VanDerWaalsContact O-N 3.16Å; A736-R740 PolarHBondContact O-N 3.31Å; A736-Y816 PolarHBondContact O-OH 2.83Å; A736-Y816 VanDerWaalsContact O-OH 3.04Å; A736-I820 HydrophobicContact CB-CD1 4.28Å
737	F	82.3	Confident	80.1	Confident	51 Å²	51	70.6 Å²	70.6	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-62.4	-37.3	177.7	-61.4	-16.7	0	0	0	112.7	N719 A722 Y733 R734 Q741	N719-F737 HydrophobicContact CB-CD1 4.39Å; N719-F737 HydrophobicContact CB-CE1 3.61Å; N719-F737 HydrophobicContact CB-CZ 4.15Å; A722-F737 HydrophobicContact CB-CZ 4.4Å; Y733-F737 HydrophobicContact CD1-CE1 4.13Å; Y733-F737 HydrophobicContact CD1-CZ 4.21Å; Y733-F737 HydrophobicContact CG-CZ 4.29Å; Y733-F737 WeakPolarHBondContact O-CB 3.38Å; Y733-F737 WeakPolarHBondContact O-CD1 3.31Å; Y733-F737 WeakPolarHBondContact O-CD2 3.4Å; Y733-F737 WeakPolarHBondContact O-CG 3.41Å; Y733-F737 PolarHBondContact O-N 3.14Å; R734-F737 PolarHBondContact O-N 3.38Å; F737-Q741 WeakPolarHBondContact O-CB 3.3Å; F737-Q741 PolarHBondContact O-N 3.03Å
738	T	85.4	Confident	81.5	Confident	75 Å²	75	68.9 Å²	68.9	46%	0.46	36%	0.36	S	S	.	.	H	α-helix	trans	-65.8	-42.6	174.3	-54.1	0	0	0	0	111.2	R734 A735 A736 Q741 R742	R734-T738 PolarHBondContact O-N 3.43Å; R734-T738 PolarHBondContact O-OG1 3.2Å; A735-T738 PolarHBondContact O-N 3.1Å; A736-T738 VanDerWaalsContact C-N 3.31Å; A736-T738 PolarHBondContact O-N 2.89Å; T738-Q741 PolarHBondContact O-N 3.03Å; T738-R742 WeakPolarHBondContact O-CG 3.29Å; T738-R742 PolarHBondContact O-N 2.82Å; T738-R742 VanDerWaalsContact O-N 3.12Å
739	L	88.9	Confident	82.9	Confident	80 Å²	80	65.1 Å²	65.1	42%	0.419	35%	0.345	S	S	.	.	H	α-helix	trans	-64.2	-48.3	176.2	-176.9	60.7	0	0	0	111.7	A735 A736 Q741 R742 M743 Y816	A735-L739 PolarHBondContact O-N 3.42Å; A736-L739 PolarHBondContact O-N 3.13Å; A736-L739 VanDerWaalsContact O-N 3.16Å; L739-Q741 VanDerWaalsContact C-N 3.29Å; L739-Q741 PolarHBondContact O-N 2.75Å; L739-R742 WeakPolarHBondContact O-CB 3.45Å; L739-R742 PolarHBondContact O-N 2.68Å; L739-R742 VanDerWaalsContact O-N 3.11Å; L739-M743 HydrophobicContact CD1-CE 4.07Å; L739-M743 HydrophobicContact CD2-CE 4.12Å; L739-M743 HydrophobicContact CG-CE 3.95Å; L739-M743 HydrophobicContact CG-SD 4.21Å; L739-M743 WeakPolarHBondContact O-CG 3.43Å; L739-M743 PolarHBondContact O-N 3.3Å; L739-Y816 HydrophobicContact CD2-CD2 4.01Å; L739-Y816 HydrophobicContact CD2-CE2 4.02Å; L739-Y816 HydrophobicContact CG-CE2 4.48Å
740	R	87.2	Confident	84.2	Confident	13 Å²	13	64.6 Å²	64.6	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-55.7	-43	174.8	-172.2	-156	58.5	68.8	17.6	111.7	L712 A736 R742 M743 M744 Y816	L712-R740 HydrophobicContact CD2-CG 4.14Å; A736-R740 PolarHBondContact O-N 3.31Å; R740-R742 VanDerWaalsContact C-N 3.33Å; R740-R742 PolarHBondContact O-N 3.31Å; R740-M743 PolarHBondContact O-N 3.48Å; R740-M744 VanDerWaalsContact O-CB 3.26Å; R740-M744 WeakPolarHBondContact O-CB 3.37Å; R740-M744 PolarHBondContact O-N 3.12Å; R740-Y816 HydrophobicContact CB-CE1 3.85Å; R740-Y816 HydrophobicContact CG-CE1 4.05Å
741	Q	88.3	Confident	85.5	Confident	95 Å²	95	63.7 Å²	63.7	44%	0.444	33%	0.328	S	S	.	.	H	α-helix	trans	-65.7	-36.4	179	-169.4	60.5	28.8	0	0	112.2	F737 T738 L739 N745	F737-Q741 WeakPolarHBondContact O-CB 3.3Å; F737-Q741 PolarHBondContact O-N 3.03Å; T738-Q741 PolarHBondContact O-N 3.03Å; L739-Q741 VanDerWaalsContact C-N 3.29Å; L739-Q741 PolarHBondContact O-N 2.75Å; Q741-N745 VanDerWaalsContact O-CB 3.27Å; Q741-N745 WeakPolarHBondContact O-CB 3.43Å; Q741-N745 PolarHBondContact O-N 3.15Å
742	R	90.9	Very high	86.6	Confident	180 Å²	180	66.1 Å²	66.1	68%	0.679	33%	0.328	S	S	*	.	H	α-helix	trans	-66.7	-44.9	173.4	-70.4	175.6	179.1	-169.1	-0.4	112	T738 L739 R740 N745 A746	T738-R742 WeakPolarHBondContact O-CG 3.29Å; T738-R742 PolarHBondContact O-N 2.82Å; T738-R742 VanDerWaalsContact O-N 3.12Å; L739-R742 WeakPolarHBondContact O-CB 3.45Å; L739-R742 PolarHBondContact O-N 2.68Å; L739-R742 VanDerWaalsContact O-N 3.11Å; R740-R742 VanDerWaalsContact C-N 3.33Å; R740-R742 PolarHBondContact O-N 3.31Å; R742-N745 PolarHBondContact O-N 3.03Å; R742-A746 WeakPolarHBondContact O-CB 3.37Å; R742-A746 PolarHBondContact O-N 3.23Å
743	M	92.3	Very high	87.7	Confident	26 Å²	26	63.9 Å²	63.9	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-60.9	-47.6	176	-72.3	175	166.9	0	0	111.8	L712 L739 R740 A746 I747 I812 Y816	L712-M743 HydrophobicContact CD1-CB 4.17Å; L712-M743 HydrophobicContact CD2-CB 4.42Å; L739-M743 HydrophobicContact CD1-CE 4.07Å; L739-M743 HydrophobicContact CD2-CE 4.12Å; L739-M743 HydrophobicContact CG-CE 3.95Å; L739-M743 HydrophobicContact CG-SD 4.21Å; L739-M743 WeakPolarHBondContact O-CG 3.43Å; L739-M743 PolarHBondContact O-N 3.3Å; R740-M743 PolarHBondContact O-N 3.48Å; M743-A746 PolarHBondContact O-N 3.09Å; M743-I747 PolarHBondContact O-N 3.14Å; M743-I747 VanDerWaalsContact O-N 3.1Å; M743-I812 HydrophobicContact CE-CG2 4.15Å; M743-Y816 HydrophobicContact CE-CD2 4.49Å; M743-Y816 HydrophobicContact CE-CG 4.18Å; M743-Y816 HydrophobicContact SD-CD1 3.84Å; M743-Y816 HydrophobicContact SD-CD2 4.38Å; M743-Y816 HydrophobicContact SD-CG 3.78Å
744	M	90.2	Very high	88.5	Confident	7 Å²	7	61.9 Å²	61.9	3%	0.034	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-54.6	176	-178.6	63.7	83.2	0	0	111.2	E709 L712 C713 R740 A746 I747 Q748	E709-M744 HydrophobicContact CG-SD 4.02Å; L712-M744 VanDerWaalsContact C-CE 3.42Å; L712-M744 HydrophobicContact CB-CE 3.45Å; L712-M744 VanDerWaalsContact CB-CE 3.45Å; L712-M744 HydrophobicContact CB-SD 4.23Å; C713-M744 HydrophobicContact CB-CE 4.18Å; C713-M744 WeakPolarHBondContact SG-CE 3.28Å; R740-M744 VanDerWaalsContact O-CB 3.26Å; R740-M744 WeakPolarHBondContact O-CB 3.37Å; R740-M744 PolarHBondContact O-N 3.12Å; M744-A746 VanDerWaalsContact C-N 3.27Å; M744-A746 PolarHBondContact O-N 3.43Å; M744-I747 PolarHBondContact O-N 3.34Å; M744-Q748 HydrophobicContact CG-CG 4.29Å; M744-Q748 WeakPolarHBondContact O-CB 3.43Å; M744-Q748 WeakPolarHBondContact O-CG 3.44Å; M744-Q748 PolarHBondContact O-N 3.09Å; M744-Q748 HydrophobicContact SD-CG 3.95Å
745	N	92.1	Very high	89.3	Confident	86 Å²	86	56.5 Å²	56.5	46%	0.46	29%	0.285	S	S	.	.	H	α-helix	trans	-61.2	-35.2	-179.7	-174.4	72.1	0	0	0	112.1	Q741 R742 N749	Q741-N745 VanDerWaalsContact O-CB 3.27Å; Q741-N745 WeakPolarHBondContact O-CB 3.43Å; Q741-N745 PolarHBondContact O-N 3.15Å; R742-N745 PolarHBondContact O-N 3.03Å; N745-N749 VanDerWaalsContact CG-ND2 3.25Å; N745-N749 PolarHBondContact ND2-ND2 2.84Å; N745-N749 VanDerWaalsContact ND2-ND2 3.17Å; N745-N749 WeakPolarHBondContact O-CB 3.5Å; N745-N749 PolarHBondContact O-N 3.05Å; N745-N749 VanDerWaalsContact O-N 3.11Å; N745-N749 PolarHBondContact O-ND2 3.33Å; N745-N749 PolarHBondContact OD1-ND2 2.65Å
746	A	92.1	Very high	89.8	Confident	46 Å²	46	57.3 Å²	57.3	38%	0.38	28%	0.279	S	S	.	.	H	α-helix	trans	-65.1	-44.6	176.6	0	0	0	0	0	112.4	R742 M743 M744 L750	R742-A746 WeakPolarHBondContact O-CB 3.37Å; R742-A746 PolarHBondContact O-N 3.23Å; M743-A746 PolarHBondContact O-N 3.09Å; M744-A746 VanDerWaalsContact C-N 3.27Å; M744-A746 PolarHBondContact O-N 3.43Å; A746-L750 WeakPolarHBondContact O-CB 3.23Å; A746-L750 PolarHBondContact O-N 2.99Å
747	I	92.6	Very high	90.3	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-70.8	-45.1	179.3	-69.8	159.7	0	0	0	111	V708 E709 L712 M743 M744 N749 L750 E751 C813	V708-I747 HydrophobicContact CB-CD1 4.09Å; V708-I747 HydrophobicContact CG1-CD1 3.48Å; V708-I747 VanDerWaalsContact CG1-CD1 3.48Å; E709-I747 HydrophobicContact CB-CG2 4.13Å; L712-I747 HydrophobicContact CD1-CD1 3.57Å; M743-I747 PolarHBondContact O-N 3.14Å; M743-I747 VanDerWaalsContact O-N 3.1Å; M744-I747 PolarHBondContact O-N 3.34Å; I747-N749 PolarHBondContact O-N 2.73Å; I747-L750 WeakPolarHBondContact O-CB 3.46Å; I747-L750 PolarHBondContact O-N 3.41Å; I747-L750 VanDerWaalsContact O-N 3.1Å; I747-E751 HydrophobicContact CG2-CG 4.36Å; I747-E751 WeakPolarHBondContact O-CG 3.46Å; I747-E751 PolarHBondContact O-N 3.29Å; I747-C813 HydrophobicContact CD1-CB 4.1Å
748	Q	91.6	Very high	90.7	Very high	71 Å²	71	59.5 Å²	59.5	33%	0.332	29%	0.287	S	S	.	.	H	α-helix	trans	-61.4	-40.5	179.6	-71.6	-174.1	-44.2	0	0	112.7	E709 M744 E751 Y752	E709-Q748 HydrophobicContact CG-CG 4Å; E709-Q748 WeakPolarHBondContact OE1-CG 3.01Å; E709-Q748 PolarHBondContact OE1-NE2 3.49Å; M744-Q748 HydrophobicContact CG-CG 4.29Å; M744-Q748 WeakPolarHBondContact O-CB 3.43Å; M744-Q748 WeakPolarHBondContact O-CG 3.44Å; M744-Q748 PolarHBondContact O-N 3.09Å; M744-Q748 HydrophobicContact SD-CG 3.95Å; Q748-E751 PolarHBondContact O-N 3.17Å; Q748-Y752 VanDerWaalsContact O-CB 3.31Å; Q748-Y752 WeakPolarHBondContact O-CB 3.32Å; Q748-Y752 PolarHBondContact O-N 3.02Å
749	N	92.3	Very high	91.1	Very high	85 Å²	85	56.1 Å²	56.1	46%	0.455	27%	0.266	S	S	.	.	H	α-helix	trans	-70	-33.1	175.1	-73.3	-58.5	0	0	0	112.5	N745 I747 Y753	N745-N749 VanDerWaalsContact CG-ND2 3.25Å; N745-N749 PolarHBondContact ND2-ND2 2.84Å; N745-N749 VanDerWaalsContact ND2-ND2 3.17Å; N745-N749 WeakPolarHBondContact O-CB 3.5Å; N745-N749 PolarHBondContact O-N 3.05Å; N745-N749 VanDerWaalsContact O-N 3.11Å; N745-N749 PolarHBondContact O-ND2 3.33Å; N745-N749 PolarHBondContact OD1-ND2 2.65Å; I747-N749 PolarHBondContact O-N 2.73Å; N749-Y753 WeakPolarHBondContact O-CB 3.35Å; N749-Y753 PolarHBondContact O-N 3.22Å
750	L	90.6	Very high	91.3	Very high	29 Å²	29	56.1 Å²	56.1	15%	0.152	26%	0.264	C	S	.	.	H	α-helix	trans	-66.9	-42	174.8	-179.4	62.6	0	0	0	111.6	A746 I747 Y753 M754 I806	A746-L750 WeakPolarHBondContact O-CB 3.23Å; A746-L750 PolarHBondContact O-N 2.99Å; I747-L750 WeakPolarHBondContact O-CB 3.46Å; I747-L750 PolarHBondContact O-N 3.41Å; I747-L750 VanDerWaalsContact O-N 3.1Å; L750-Y753 PolarHBondContact O-N 3.13Å; L750-M754 HydrophobicContact CG-CE 4.14Å; L750-M754 WeakPolarHBondContact O-CG 3.38Å; L750-M754 PolarHBondContact O-N 3.48Å; L750-I806 HydrophobicContact CD1-CD1 4.42Å; L750-I806 HydrophobicContact CD2-CD1 4.35Å; L750-I806 HydrophobicContact CD2-CG1 4.28Å; L750-I806 HydrophobicContact CD2-CG2 3.76Å
751	E	90.3	Very high	91.6	Very high	4 Å²	4	58 Å²	58	2%	0.019	28%	0.277	C	S	.	.	H	α-helix	trans	-66.9	-43.9	174.9	-69.9	172.1	170.8	0	0	112.5	C705 K706 I747 Q748 Y753 M754 M755	C705-E751 HydrophobicContact CB-CG 3.8Å; C705-E751 WeakPolarHBondContact CB-OE1 3.45Å; C705-E751 VanDerWaalsContact O-OE1 3.08Å; K706-E751 VanDerWaalsContact CA-OE1 3.28Å; K706-E751 WeakPolarHBondContact CA-OE1 3.49Å; K706-E751 WeakPolarHBondContact CE-OE2 3.45Å; K706-E751 PolarHBondContact N-OE1 3.24Å; K706-E751 IonicContact NZ-OE2 2.65Å; K706-E751 PolarHBondContact NZ-OE2 2.79Å; I747-E751 HydrophobicContact CG2-CG 4.36Å; I747-E751 WeakPolarHBondContact O-CG 3.46Å; I747-E751 PolarHBondContact O-N 3.29Å; Q748-E751 PolarHBondContact O-N 3.17Å; E751-Y753 VanDerWaalsContact C-N 3.3Å; E751-Y753 PolarHBondContact O-N 3.48Å; E751-M754 HydrophobicContact CG-CE 4.33Å; E751-M754 PolarHBondContact O-N 3.32Å; E751-M755 WeakPolarHBondContact O-CB 3.32Å; E751-M755 WeakPolarHBondContact O-CG 3.33Å; E751-M755 PolarHBondContact O-N 3.44Å
752	Y	92.1	Very high	91.8	Very high	116 Å²	116	55 Å²	55	46%	0.455	26%	0.264	S	S	.	.	H	α-helix	trans	-55.2	-47.7	174	-179.5	-81.2	0	0	0	110.8	Q748 M755 I756 E757	Q748-Y752 VanDerWaalsContact O-CB 3.31Å; Q748-Y752 WeakPolarHBondContact O-CB 3.32Å; Q748-Y752 PolarHBondContact O-N 3.02Å; Y752-M755 PolarHBondContact O-N 3.45Å; Y752-I756 HydrophobicContact CD2-CD1 3.61Å; Y752-I756 HydrophobicContact CE1-CB 4.31Å; Y752-I756 HydrophobicContact CE1-CG2 4.19Å; Y752-I756 HydrophobicContact CE2-CB 4.35Å; Y752-I756 HydrophobicContact CE2-CD1 3.44Å; Y752-I756 VanDerWaalsContact CE2-CD1 3.44Å; Y752-I756 HydrophobicContact CE2-CG1 4.48Å; Y752-I756 HydrophobicContact CE2-CG2 4.29Å; Y752-I756 HydrophobicContact CG-CD1 4.39Å; Y752-I756 WeakPolarHBondContact O-CB 3.35Å; Y752-I756 PolarHBondContact O-N 2.97Å; Y752-E757 HydrophobicContact CE1-CG 4.24Å
753	Y	92.4	Very high	92	Very high	89 Å²	89	47.3 Å²	47.3	35%	0.349	24%	0.236	S	C	.	.	I	π-helix	trans	-58.6	-48.9	176	172.5	-107.4	0	0	0	112.4	N749 L750 E751 M755 E757 I758 M795	N749-Y753 WeakPolarHBondContact O-CB 3.35Å; N749-Y753 PolarHBondContact O-N 3.22Å; L750-Y753 PolarHBondContact O-N 3.13Å; E751-Y753 VanDerWaalsContact C-N 3.3Å; E751-Y753 PolarHBondContact O-N 3.48Å; Y753-M755 PolarHBondContact O-N 2.78Å; Y753-E757 HydrophobicContact CD2-CB 3.87Å; Y753-E757 HydrophobicContact CD2-CG 4.15Å; Y753-E757 HydrophobicContact CE2-CB 4.33Å; Y753-E757 WeakPolarHBondContact O-CB 3.31Å; Y753-E757 PolarHBondContact O-N 3.12Å; Y753-I758 HydrophobicContact CD1-CD1 3.78Å; Y753-I758 HydrophobicContact CE1-CD1 3.28Å; Y753-I758 HydrophobicContact CE1-CG1 4.32Å; Y753-I758 HydrophobicContact CE2-CD1 4.12Å; Y753-I758 HydrophobicContact CE2-CG1 4.32Å; Y753-I758 HydrophobicContact CG-CD1 4.39Å; Y753-I758 VanDerWaalsContact CZ-CD1 3.47Å; Y753-I758 PolarHBondContact O-N 3.47Å; Y753-M795 HydrophobicContact CD1-CE 4.49Å; Y753-M795 HydrophobicContact CE1-CE 3.68Å
754	M	90.8	Very high	92	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	26%	0.256	C	S	.	.	I	π-helix	trans	-64.4	-42.7	179.5	-67.6	-177.3	-61.2	0	0	112.8	Q701 L702 C705 L750 E751 I759	Q701-M754 HydrophobicContact CG-SD 4.22Å; L702-M754 HydrophobicContact CD2-CB 3.8Å; L702-M754 HydrophobicContact CD2-CE 3.91Å; L702-M754 HydrophobicContact CD2-SD 4.14Å; C705-M754 HydrophobicContact CB-CE 4.36Å; L750-M754 HydrophobicContact CG-CE 4.14Å; L750-M754 WeakPolarHBondContact O-CG 3.38Å; L750-M754 PolarHBondContact O-N 3.48Å; E751-M754 HydrophobicContact CG-CE 4.33Å; E751-M754 PolarHBondContact O-N 3.32Å; M754-I759 WeakPolarHBondContact O-CD1 3.45Å; M754-I759 VanDerWaalsContact O-CG1 3.25Å; M754-I759 WeakPolarHBondContact O-CG1 3.28Å; M754-I759 PolarHBondContact O-N 3.35Å; M754-I759 VanDerWaalsContact O-N 3.13Å
755	M	90.5	Very high	92.1	Very high	44 Å²	44	55.1 Å²	55.1	22%	0.217	27%	0.273	C	S	.	.	I	π-helix	trans	-79.5	-49.1	-175.2	-67.1	179.6	172.9	0	0	112.7	L585 L702 K706 E751 Y752 Y753 E760	L585-M755 HydrophobicContact CB-CE 4.07Å; L585-M755 HydrophobicContact CD1-CE 4Å; L702-M755 HydrophobicContact CD2-CE 4.25Å; L702-M755 HydrophobicContact CD2-CG 4.36Å; K706-M755 HydrophobicContact CG-CE 4.27Å; E751-M755 WeakPolarHBondContact O-CB 3.32Å; E751-M755 WeakPolarHBondContact O-CG 3.33Å; E751-M755 PolarHBondContact O-N 3.44Å; Y752-M755 PolarHBondContact O-N 3.45Å; Y753-M755 PolarHBondContact O-N 2.78Å; M755-E760 PolarHBondContact O-N 3.03Å
756	I	91.3	Very high	92.2	Very high	84 Å²	84	51.3 Å²	51.3	43%	0.431	25%	0.252	S	S	.	.	I	π-helix	trans	-98.8	-33.7	-166.9	-68	165.8	0	0	0	112.9	Y752 P761	Y752-I756 HydrophobicContact CD2-CD1 3.61Å; Y752-I756 HydrophobicContact CE1-CB 4.31Å; Y752-I756 HydrophobicContact CE1-CG2 4.19Å; Y752-I756 HydrophobicContact CE2-CB 4.35Å; Y752-I756 HydrophobicContact CE2-CD1 3.44Å; Y752-I756 VanDerWaalsContact CE2-CD1 3.44Å; Y752-I756 HydrophobicContact CE2-CG1 4.48Å; Y752-I756 HydrophobicContact CE2-CG2 4.29Å; Y752-I756 HydrophobicContact CG-CD1 4.39Å; Y752-I756 WeakPolarHBondContact O-CB 3.35Å; Y752-I756 PolarHBondContact O-N 2.97Å; I756-P761 WeakPolarHBondContact O-CD 3.39Å; I756-P761 WeakPolarHBondContact O-CG 3.38Å
757	E	91.4	Very high	92.2	Very high	114 Å²	114	50.7 Å²	50.7	53%	0.533	24%	0.243	S	C	.	.	I	π-helix	trans	-88.5	-25.8	178.5	-59.5	-68.4	153.3	0	0	112.7	Y752 Y753	Y752-E757 HydrophobicContact CE1-CG 4.24Å; Y753-E757 HydrophobicContact CD2-CB 3.87Å; Y753-E757 HydrophobicContact CD2-CG 4.15Å; Y753-E757 HydrophobicContact CE2-CB 4.33Å; Y753-E757 WeakPolarHBondContact O-CB 3.31Å; Y753-E757 PolarHBondContact O-N 3.12Å
758	I	92.4	Very high	92.2	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.026	27%	0.268	C	S	.	.	I	π-helix	trans	-108.9	-61.5	-176.6	-62	163.7	0	0	0	112.6	Y753 N762 N793	Y753-I758 HydrophobicContact CD1-CD1 3.78Å; Y753-I758 HydrophobicContact CE1-CD1 3.28Å; Y753-I758 HydrophobicContact CE1-CG1 4.32Å; Y753-I758 HydrophobicContact CE2-CD1 4.12Å; Y753-I758 HydrophobicContact CE2-CG1 4.32Å; Y753-I758 HydrophobicContact CG-CD1 4.39Å; Y753-I758 VanDerWaalsContact CZ-CD1 3.47Å; Y753-I758 PolarHBondContact O-N 3.47Å; I758-N762 VanDerWaalsContact O-CB 3.3Å; I758-N762 WeakPolarHBondContact O-CB 3.4Å; I758-N762 VanDerWaalsContact O-CG 3.3Å; I758-N762 PolarHBondContact O-N 3.46Å; I758-N762 PolarHBondContact O-ND2 3.29Å; I758-N793 HydrophobicContact CB-CB 4.41Å; I758-N793 VanDerWaalsContact CD1-C 3.46Å; I758-N793 HydrophobicContact CD1-CB 3.96Å; I758-N793 VanDerWaalsContact CD1-O 3.22Å; I758-N793 WeakPolarHBondContact CD1-O 3.21Å; I758-N793 HydrophobicContact CG1-CB 3.91Å; I758-N793 HydrophobicContact CG2-CB 3.61Å
759	I	92.2	Very high	92.1	Very high	4 Å²	4	57.8 Å²	57.8	2%	0.021	27%	0.274	C	S	.	.	I	π-helix	trans	-71.1	-48.7	-169.2	-70.6	165.6	0	0	0	111.3	L584 L702 M754 W763	L584-I759 HydrophobicContact CB-CG2 4.35Å; L584-I759 HydrophobicContact CD1-CG2 3.97Å; L584-I759 HydrophobicContact CD2-CD1 4.38Å; L702-I759 HydrophobicContact CD1-CD1 3.76Å; L702-I759 HydrophobicContact CD2-CD1 4.3Å; M754-I759 WeakPolarHBondContact O-CD1 3.45Å; M754-I759 VanDerWaalsContact O-CG1 3.25Å; M754-I759 WeakPolarHBondContact O-CG1 3.28Å; M754-I759 PolarHBondContact O-N 3.35Å; M754-I759 VanDerWaalsContact O-N 3.13Å; I759-W763 VanDerWaalsContact O-CB 3.25Å; I759-W763 WeakPolarHBondContact O-CB 3.47Å; I759-W763 PolarHBondContact O-N 3.41Å
760	E	93	Very high	91.9	Very high	79 Å²	79	54.1 Å²	54.1	37%	0.369	25%	0.254	S	S	.	.	H	α-helix	trans	-64.5	-44.8	-176.5	-160.5	59	-139.1	0	0	114.1	K580 M755 W763 H764	K580-E760 WeakPolarHBondContact CE-OE2 3.25Å; K580-E760 IonicContact NZ-OE1 3.64Å; K580-E760 PolarHBondContact NZ-OE1 3.22Å; K580-E760 IonicContact NZ-OE2 3.71Å; K580-E760 PolarHBondContact NZ-OE2 2.94Å; M755-E760 PolarHBondContact O-N 3.03Å; E760-W763 PolarHBondContact O-N 3.47Å; E760-H764 PolarHBondContact O-N 2.89Å
761	P	93.9	Very high	91.8	Very high	52 Å²	52	61 Å²	61	34%	0.338	28%	0.283	S	S	.	.	H	α-helix	trans	-68.8	-41.8	-179.7	-22.3	36.9	0	0	0	112.1	I756 W763 H764 I765	I756-P761 WeakPolarHBondContact O-CD 3.39Å; I756-P761 WeakPolarHBondContact O-CG 3.38Å; P761-W763 VanDerWaalsContact C-N 3.28Å; P761-W763 PolarHBondContact O-N 2.69Å; P761-H764 PolarHBondContact O-N 2.76Å; P761-I765 VanDerWaalsContact O-CG1 3.31Å; P761-I765 WeakPolarHBondContact O-CG1 3.37Å; P761-I765 PolarHBondContact O-N 2.89Å
762	N	93.1	Very high	91.7	Very high	32 Å²	32	66.2 Å²	66.2	17%	0.171	32%	0.315	C	S	.	.	H	α-helix	trans	-61.5	-38.9	174.3	-76.3	-17.7	0	0	0	111.3	I758 F766 F786	I758-N762 VanDerWaalsContact O-CB 3.3Å; I758-N762 WeakPolarHBondContact O-CB 3.4Å; I758-N762 VanDerWaalsContact O-CG 3.3Å; I758-N762 PolarHBondContact O-N 3.46Å; I758-N762 PolarHBondContact O-ND2 3.29Å; N762-F766 WeakPolarHBondContact O-CB 3.4Å; N762-F766 PolarHBondContact O-N 3.17Å; N762-F786 HydrophobicContact CB-CD2 3.91Å; N762-F786 HydrophobicContact CB-CE2 3.93Å
763	W	93.9	Very high	91.4	Very high	20 Å²	20	61.6 Å²	61.6	8%	0.076	30%	0.299	C	S	.	.	H	α-helix	trans	-65.6	-42.5	175.5	-177.7	-94.9	0	0	0	112.4	L576 K580 I759 E760 P761 F766 I767 F786	L576-W763 HydrophobicContact CB-CH2 4.15Å; L576-W763 WeakPolarHBondContact O-CH2 3.3Å; K580-W763 HydrophobicContact CB-CH2 3.89Å; K580-W763 HydrophobicContact CB-CZ2 4.03Å; K580-W763 HydrophobicContact CB-CZ3 4.17Å; K580-W763 HydrophobicContact CD-CD2 3.49Å; K580-W763 VanDerWaalsContact CD-CD2 3.49Å; K580-W763 HydrophobicContact CD-CE3 4.07Å; K580-W763 HydrophobicContact CD-CG 3.74Å; K580-W763 HydrophobicContact CD-CH2 4.35Å; K580-W763 HydrophobicContact CD-CZ2 3.83Å; K580-W763 HydrophobicContact CD-CZ3 4.46Å; I759-W763 VanDerWaalsContact O-CB 3.25Å; I759-W763 WeakPolarHBondContact O-CB 3.47Å; I759-W763 PolarHBondContact O-N 3.41Å; E760-W763 PolarHBondContact O-N 3.47Å; P761-W763 VanDerWaalsContact C-N 3.28Å; P761-W763 PolarHBondContact O-N 2.69Å; W763-F766 HydrophobicContact CE3-CD1 4.1Å; W763-F766 HydrophobicContact CH2-CE1 4.45Å; W763-F766 HydrophobicContact CZ3-CD1 4.11Å; W763-F766 HydrophobicContact CZ3-CE1 4.2Å; W763-F766 PolarHBondContact O-N 2.68Å; W763-I767 HydrophobicContact CD2-CG1 4.24Å; W763-I767 HydrophobicContact CG-CG1 4.38Å; W763-I767 HydrophobicContact CH2-CD1 4.48Å; W763-I767 HydrophobicContact CZ2-CD1 3.79Å; W763-I767 HydrophobicContact CZ2-CG1 4.13Å; W763-I767 WeakPolarHBondContact O-CG1 3.45Å; W763-I767 PolarHBondContact O-N 2.67Å; W763-F786 HydrophobicContact CB-CE2 4.14Å; W763-F786 HydrophobicContact CE3-CE1 4.15Å; W763-F786 HydrophobicContact CE3-CE2 4.03Å; W763-F786 AromaticContact CE3-CZ 3.69Å; W763-F786 HydrophobicContact CE3-CZ 3.69Å; W763-F786 HydrophobicContact CZ3-CE1 4.35Å; W763-F786 HydrophobicContact CZ3-CZ 4.32Å
764	H	93.4	Very high	90.9	Very high	118 Å²	118	64.2 Å²	64.2	55%	0.546	32%	0.315	S	S	.	.	H	α-helix	trans	-60.2	-47.8	176.3	-172.3	-75.9	0	0	0	111.2	E760 P761 F766 I767 E768	E760-H764 PolarHBondContact O-N 2.89Å; P761-H764 PolarHBondContact O-N 2.76Å; H764-F766 VanDerWaalsContact C-N 3.3Å; H764-F766 PolarHBondContact O-N 3.48Å; H764-I767 PolarHBondContact O-N 3.29Å; H764-E768 IonicContact CE1-OE2 2.68Å; H764-E768 IonicContact ND1-OE2 2.66Å; H764-E768 WeakPolarHBondContact O-CB 3.26Å; H764-E768 PolarHBondContact O-N 2.92Å
765	I	92.9	Very high	90.6	Very high	78 Å²	78	65.1 Å²	65.1	40%	0.4	32%	0.319	S	S	.	.	H	α-helix	trans	-60.1	-41.2	176.8	-66.1	164.9	0	0	0	111	P761 K769	P761-I765 VanDerWaalsContact O-CG1 3.31Å; P761-I765 WeakPolarHBondContact O-CG1 3.37Å; P761-I765 PolarHBondContact O-N 2.89Å; I765-K769 HydrophobicContact CG2-CD 4.04Å; I765-K769 WeakPolarHBondContact O-CB 3.49Å; I765-K769 VanDerWaalsContact O-CG 3.29Å; I765-K769 WeakPolarHBondContact O-CG 3.49Å; I765-K769 PolarHBondContact O-N 3.23Å
766	F	93.1	Very high	90.3	Very high	6 Å²	6	63.4 Å²	63.4	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-61.8	-51.9	175.8	171.6	-110	0	0	0	111.7	L576 N762 W763 H764 E768 K769 M770 L782 H783 F786	L576-F766 HydrophobicContact CD1-CE1 4.2Å; L576-F766 HydrophobicContact CD1-CZ 4.09Å; N762-F766 WeakPolarHBondContact O-CB 3.4Å; N762-F766 PolarHBondContact O-N 3.17Å; W763-F766 HydrophobicContact CE3-CD1 4.1Å; W763-F766 HydrophobicContact CH2-CE1 4.45Å; W763-F766 HydrophobicContact CZ3-CD1 4.11Å; W763-F766 HydrophobicContact CZ3-CE1 4.2Å; W763-F766 PolarHBondContact O-N 2.68Å; H764-F766 VanDerWaalsContact C-N 3.3Å; H764-F766 PolarHBondContact O-N 3.48Å; F766-E768 VanDerWaalsContact C-N 3.33Å; F766-E768 PolarHBondContact O-N 3.42Å; F766-K769 PolarHBondContact O-N 2.85Å; F766-M770 HydrophobicContact CZ-SD 4.4Å; F766-M770 VanDerWaalsContact O-CB 3.26Å; F766-M770 WeakPolarHBondContact O-CB 3.08Å; F766-M770 PolarHBondContact O-N 3.06Å; F766-L782 HydrophobicContact CD2-CB 4.18Å; F766-L782 WeakPolarHBondContact CD2-O 3.31Å; F766-L782 HydrophobicContact CE2-CB 4.13Å; F766-H783 HydrophobicContact CE2-CB 4.07Å; F766-H783 HydrophobicContact CZ-CB 4.38Å; F766-F786 HydrophobicContact CB-CB 4.22Å; F766-F786 HydrophobicContact CB-CD2 4.01Å; F766-F786 HydrophobicContact CB-CG 4.22Å; F766-F786 HydrophobicContact CD2-CB 4.04Å; F766-F786 HydrophobicContact CG-CB 4.19Å; F766-F786 HydrophobicContact CG-CD2 4.46Å; F766-F786 HydrophobicContact CG-CG 4.23Å
767	I	92	Very high	89.9	Confident	34 Å²	34	60.2 Å²	60.2	17%	0.174	30%	0.295	C	S	.	.	H	α-helix	trans	-63.8	-36.2	179.7	-67.4	-63.4	0	0	0	112.5	M573 W763 H764 K771	M573-I767 HydrophobicContact CE-CD1 3.51Å; W763-I767 HydrophobicContact CD2-CG1 4.24Å; W763-I767 HydrophobicContact CG-CG1 4.38Å; W763-I767 HydrophobicContact CH2-CD1 4.48Å; W763-I767 HydrophobicContact CZ2-CD1 3.79Å; W763-I767 HydrophobicContact CZ2-CG1 4.13Å; W763-I767 WeakPolarHBondContact O-CG1 3.45Å; W763-I767 PolarHBondContact O-N 2.67Å; H764-I767 PolarHBondContact O-N 3.29Å; I767-K771 WeakPolarHBondContact O-CG 3.45Å; I767-K771 PolarHBondContact O-N 3.02Å
768	E	92.3	Very high	89.7	Confident	115 Å²	115	57.7 Å²	57.7	54%	0.537	29%	0.285	S	S	.	.	H	α-helix	trans	-66.4	-48.7	176.4	-173.4	171.1	-169	0	0	111.4	H764 F766 M770 K771	H764-E768 IonicContact CE1-OE2 2.68Å; H764-E768 IonicContact ND1-OE2 2.66Å; H764-E768 WeakPolarHBondContact O-CB 3.26Å; H764-E768 PolarHBondContact O-N 2.92Å; F766-E768 VanDerWaalsContact C-N 3.33Å; F766-E768 PolarHBondContact O-N 3.42Å; E768-M770 VanDerWaalsContact C-N 3.31Å; E768-M770 PolarHBondContact O-N 2.93Å; E768-K771 PolarHBondContact O-N 2.86Å
769	K	90.6	Very high	89.6	Confident	105 Å²	105	57.6 Å²	57.6	46%	0.457	29%	0.285	S	S	.	.	H	α-helix	trans	-63	-36.3	175	-70.3	176.5	-179	177.1	0	112.4	I765 F766 K771 T772 V773 L782	I765-K769 HydrophobicContact CG2-CD 4.04Å; I765-K769 WeakPolarHBondContact O-CB 3.49Å; I765-K769 VanDerWaalsContact O-CG 3.29Å; I765-K769 WeakPolarHBondContact O-CG 3.49Å; I765-K769 PolarHBondContact O-N 3.23Å; F766-K769 PolarHBondContact O-N 2.85Å; K769-K771 PolarHBondContact O-N 2.85Å; K769-T772 PolarHBondContact O-N 3.21Å; K769-T772 VanDerWaalsContact O-N 3.07Å; K769-T772 PolarHBondContact O-OG1 3.1Å; K769-V773 WeakPolarHBondContact O-CG2 3.46Å; K769-L782 HydrophobicContact CB-CD1 3.91Å; K769-L782 HydrophobicContact CB-CD2 4.05Å; K769-L782 HydrophobicContact CD-CD2 3.61Å; K769-L782 HydrophobicContact CG-CD2 4.45Å
770	M	88.6	Confident	89.3	Confident	8 Å²	8	59.5 Å²	59.5	4%	0.039	30%	0.295	C	S	.	.	H	α-helix	trans	-59.5	-30.9	179.5	-167.6	67.4	-176.4	0	0	112.7	L567 L572 M573 F766 E768 T772 V773 V779	L567-M770 HydrophobicContact CD2-CE 3.75Å; L572-M770 HydrophobicContact CD2-CE 4.41Å; M573-M770 HydrophobicContact CE-CG 4.01Å; M573-M770 HydrophobicContact SD-CE 3.78Å; M573-M770 HydrophobicContact SD-CG 3.64Å; F766-M770 HydrophobicContact CZ-SD 4.4Å; F766-M770 VanDerWaalsContact O-CB 3.26Å; F766-M770 WeakPolarHBondContact O-CB 3.08Å; F766-M770 PolarHBondContact O-N 3.06Å; E768-M770 VanDerWaalsContact C-N 3.31Å; E768-M770 PolarHBondContact O-N 2.93Å; M770-T772 VanDerWaalsContact C-N 3.29Å; M770-T772 PolarHBondContact O-N 3.26Å; M770-V773 PolarHBondContact O-N 3.04Å; M770-V773 HydrophobicContact SD-CG2 4.47Å; M770-V779 HydrophobicContact CE-CB 4.25Å; M770-V779 HydrophobicContact CE-CG1 3.59Å; M770-V779 HydrophobicContact CE-CG2 3.71Å; M770-V779 HydrophobicContact SD-CB 4.39Å; M770-V779 HydrophobicContact SD-CG1 3.98Å; M770-V779 HydrophobicContact SD-CG2 4.02Å
771	K	87.7	Confident	89.1	Confident	172 Å²	172	62.4 Å²	62.4	75%	0.748	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-21.4	177.2	-68	168.8	-174.8	173.5	0	113.9	I767 E768 K769	I767-K771 WeakPolarHBondContact O-CG 3.45Å; I767-K771 PolarHBondContact O-N 3.02Å; E768-K771 PolarHBondContact O-N 2.86Å; K769-K771 PolarHBondContact O-N 2.85Å
772	T	87.8	Confident	89	Confident	114 Å²	114	61.4 Å²	61.4	70%	0.699	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	11.2	-178.3	62.5	0	0	0	0	112.9	K769 M770	K769-T772 PolarHBondContact O-N 3.21Å; K769-T772 VanDerWaalsContact O-N 3.07Å; K769-T772 PolarHBondContact O-OG1 3.1Å; M770-T772 VanDerWaalsContact C-N 3.29Å; M770-T772 PolarHBondContact O-N 3.26Å
773	V	86.3	Confident	89	Confident	20 Å²	20	60 Å²	60	12%	0.121	29%	0.287	C	S	.	.			trans	-81.6	128.7	-176	178.1	0	0	0	0	111.5	L563 K769 M770 N775 N778 V779 L782	L563-V773 HydrophobicContact CD2-CG1 4.37Å; L563-V773 VanDerWaalsContact CD2-O 3.29Å; L563-V773 WeakPolarHBondContact CD2-O 3.24Å; K769-V773 WeakPolarHBondContact O-CG2 3.46Å; M770-V773 PolarHBondContact O-N 3.04Å; M770-V773 HydrophobicContact SD-CG2 4.47Å; V773-N775 WeakPolarHBondContact CG1-O 3.36Å; V773-N778 HydrophobicContact CG1-CB 3.89Å; V773-V779 HydrophobicContact CB-CG2 4.43Å; V773-V779 HydrophobicContact CG1-CG2 3.68Å; V773-L782 HydrophobicContact CG2-CD1 3.58Å
774	E	82	Confident	88.8	Confident	144 Å²	144	63.3 Å²	63.3	67%	0.673	30%	0.303	S	S	*	.			trans	-103.5	-16.2	173.2	-59	-176.3	150.9	0	0	113.6
775	N	83.6	Confident	88.7	Confident	20 Å²	20	62.5 Å²	62.5	11%	0.107	30%	0.302	C	S	.	.	S	Bend	trans	-131.3	138.3	-171.6	-64.6	-70.4	0	0	0	112	V773 D777 N778 V779	V773-N775 WeakPolarHBondContact CG1-O 3.36Å; N775-D777 VanDerWaalsContact C-N 3.31Å; N775-D777 PolarHBondContact O-N 2.74Å; N775-N778 WeakPolarHBondContact O-CB 3.36Å; N775-N778 PolarHBondContact O-N 2.91Å; N775-V779 PolarHBondContact O-N 2.91Å
776	V	85.4	Confident	88.7	Confident	7 Å²	7	59.2 Å²	59.2	4%	0.042	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-36.2	178.7	-178.1	0	0	0	0	112.6	L562 L563 L566 N778 V779 L780	L562-V776 HydrophobicContact CB-CG2 4.01Å; L562-V776 HydrophobicContact CD2-CB 4.39Å; L562-V776 HydrophobicContact CD2-CG1 4.22Å; L562-V776 HydrophobicContact CD2-CG2 4Å; L562-V776 HydrophobicContact CG-CG2 3.87Å; L563-V776 HydrophobicContact CB-CG2 3.85Å; L563-V776 HydrophobicContact CD1-CG2 4.26Å; L566-V776 HydrophobicContact CD1-CG1 3.88Å; L566-V776 HydrophobicContact CD1-CG2 4.21Å; V776-N778 PolarHBondContact O-N 3.29Å; V776-V779 WeakPolarHBondContact O-CA 3.3Å; V776-V779 VanDerWaalsContact O-CB 3.3Å; V776-V779 WeakPolarHBondContact O-CB 3.39Å; V776-V779 PolarHBondContact O-N 3.27Å; V776-L780 PolarHBondContact O-N 2.96Å; V776-L780 VanDerWaalsContact O-N 3.09Å
777	D	82.4	Confident	88.7	Confident	18 Å²	18	59 Å²	59	10%	0.096	28%	0.284	C	S	.	.	H	α-helix	trans	-54.8	-35.7	172	-83.5	-43.2	0	0	0	113.5	R515 Y519 Y555 N775 L780 R781	R515-D777 WeakPolarHBondContact CD-OD2 3.49Å; R515-D777 IonicContact CZ-OD2 2.77Å; R515-D777 IonicContact NE-OD2 3.57Å; R515-D777 IonicContact NH1-OD1 2.94Å; R515-D777 PolarHBondContact NH1-OD1 2.65Å; R515-D777 IonicContact NH1-OD2 3.1Å; R515-D777 PolarHBondContact NH1-OD2 2.65Å; Y519-D777 PolarHBondContact OH-OD1 2.74Å; Y519-D777 PolarHBondContact OH-OD2 2.87Å; Y555-D777 PolarHBondContact OH-OD2 3.11Å; N775-D777 VanDerWaalsContact C-N 3.31Å; N775-D777 PolarHBondContact O-N 2.74Å; D777-L780 PolarHBondContact O-N 3.18Å; D777-R781 WeakPolarHBondContact O-CG 3.32Å; D777-R781 PolarHBondContact O-N 3.38Å
778	N	87.5	Confident	88.6	Confident	61 Å²	61	60.8 Å²	60.8	33%	0.326	29%	0.294	S	S	.	.	H	α-helix	trans	-74.2	-32.1	178.4	-68.1	-10.7	0	0	0	110.8	V773 N775 V776 L782	V773-N778 HydrophobicContact CG1-CB 3.89Å; N775-N778 WeakPolarHBondContact O-CB 3.36Å; N775-N778 PolarHBondContact O-N 2.91Å; V776-N778 PolarHBondContact O-N 3.29Å; N778-L782 VanDerWaalsContact O-CB 3.26Å; N778-L782 WeakPolarHBondContact O-CB 3.38Å; N778-L782 WeakPolarHBondContact O-CD1 3.13Å; N778-L782 WeakPolarHBondContact O-CG 3.4Å; N778-L782 PolarHBondContact O-N 3.49Å
779	V	89.3	Confident	88.5	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	29%	0.285	C	S	.	.	H	α-helix	trans	-59.5	-50.9	170.4	177.3	0	0	0	0	110.2	L563 L572 V686 M770 V773 N775 V776 R781 L782 H783	L563-V779 HydrophobicContact CD1-CG2 3.73Å; L572-V779 HydrophobicContact CD2-CG1 4.21Å; V686-V779 HydrophobicContact CG1-CG1 3.98Å; V686-V779 HydrophobicContact CG2-CG1 4.4Å; M770-V779 HydrophobicContact CE-CB 4.25Å; M770-V779 HydrophobicContact CE-CG1 3.59Å; M770-V779 HydrophobicContact CE-CG2 3.71Å; M770-V779 HydrophobicContact SD-CB 4.39Å; M770-V779 HydrophobicContact SD-CG1 3.98Å; M770-V779 HydrophobicContact SD-CG2 4.02Å; V773-V779 HydrophobicContact CB-CG2 4.43Å; V773-V779 HydrophobicContact CG1-CG2 3.68Å; N775-V779 PolarHBondContact O-N 2.91Å; V776-V779 WeakPolarHBondContact O-CA 3.3Å; V776-V779 VanDerWaalsContact O-CB 3.3Å; V776-V779 WeakPolarHBondContact O-CB 3.39Å; V776-V779 PolarHBondContact O-N 3.27Å; V779-R781 PolarHBondContact O-N 3.01Å; V779-L782 PolarHBondContact O-N 3.1Å; V779-H783 VanDerWaalsContact O-CB 3.31Å; V779-H783 WeakPolarHBondContact O-CB 3.43Å; V779-H783 PolarHBondContact O-N 3.22Å
780	L	86.9	Confident	88.5	Confident	44 Å²	44	52.6 Å²	52.6	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-59	-47.8	-179.1	-65.6	174.5	0	0	0	111.7	L685 V686 V776 D777 H783 Q784	L685-L780 VanDerWaalsContact O-CD2 3.26Å; L685-L780 WeakPolarHBondContact O-CD2 3.44Å; V686-L780 HydrophobicContact CB-CD2 4.11Å; V686-L780 HydrophobicContact CG1-CD2 4.22Å; V686-L780 HydrophobicContact CG2-CD2 3.85Å; V776-L780 PolarHBondContact O-N 2.96Å; V776-L780 VanDerWaalsContact O-N 3.09Å; D777-L780 PolarHBondContact O-N 3.18Å; L780-H783 PolarHBondContact O-N 2.92Å; L780-Q784 WeakPolarHBondContact O-CB 3.44Å; L780-Q784 VanDerWaalsContact O-CG 3.31Å; L780-Q784 WeakPolarHBondContact O-CG 3.39Å; L780-Q784 PolarHBondContact O-N 3.22Å
781	R	89.2	Confident	88.5	Confident	140 Å²	140	52.7 Å²	52.7	53%	0.528	26%	0.264	S	S	.	.	H	α-helix	trans	-61.6	-50	177.1	-72.4	172.4	179.4	164.7	0.2	112.2	D777 V779 H783 Q784 D785	D777-R781 WeakPolarHBondContact O-CG 3.32Å; D777-R781 PolarHBondContact O-N 3.38Å; V779-R781 PolarHBondContact O-N 3.01Å; R781-H783 VanDerWaalsContact C-N 3.25Å; R781-H783 PolarHBondContact O-N 3.11Å; R781-Q784 PolarHBondContact O-N 3.04Å; R781-D785 WeakPolarHBondContact O-CB 3.44Å; R781-D785 PolarHBondContact O-N 3.47Å
782	L	91.8	Very high	88.5	Confident	31 Å²	31	50.3 Å²	50.3	16%	0.162	25%	0.253	C	S	.	.	H	α-helix	trans	-61.4	-34.9	-179.8	-72.3	171.9	0	0	0	112.6	F766 K769 V773 N778 V779 F786	F766-L782 HydrophobicContact CD2-CB 4.18Å; F766-L782 WeakPolarHBondContact CD2-O 3.31Å; F766-L782 HydrophobicContact CE2-CB 4.13Å; K769-L782 HydrophobicContact CB-CD1 3.91Å; K769-L782 HydrophobicContact CB-CD2 4.05Å; K769-L782 HydrophobicContact CD-CD2 3.61Å; K769-L782 HydrophobicContact CG-CD2 4.45Å; V773-L782 HydrophobicContact CG2-CD1 3.58Å; N778-L782 VanDerWaalsContact O-CB 3.26Å; N778-L782 WeakPolarHBondContact O-CB 3.38Å; N778-L782 WeakPolarHBondContact O-CD1 3.13Å; N778-L782 WeakPolarHBondContact O-CG 3.4Å; N778-L782 PolarHBondContact O-N 3.49Å; V779-L782 PolarHBondContact O-N 3.1Å; L782-F786 VanDerWaalsContact O-CB 3.29Å; L782-F786 WeakPolarHBondContact O-CB 3.36Å; L782-F786 PolarHBondContact O-N 3.41Å
783	H	91.9	Very high	88.4	Confident	2 Å²	2	48 Å²	48	1%	0.009	24%	0.237	C	C	.	.	H	α-helix	trans	-71.2	-42.5	176.6	-178.4	-122.5	0	0	0	112.4	V686 L687 S691 Y695 F766 V779 L780 R781 F786 L787	V686-H783 PolarHBondContact O-CE1 2.95Å; V686-H783 VanDerWaalsContact O-CE1 3.23Å; V686-H783 PolarHBondContact O-ND1 2.87Å; L687-H783 WeakPolarHBondContact CD2-CE1 3.21Å; S691-H783 WeakPolarHBondContact CB-CE1 3.37Å; S691-H783 PolarHBondContact OG-CE1 3.44Å; Y695-H783 AromaticContact CE2-CE1 3.75Å; Y695-H783 AromaticContact CE2-NE2 2.7Å; Y695-H783 WeakPolarHBondContact CE2-NE2 3.33Å; Y695-H783 AromaticContact CZ-NE2 2.71Å; Y695-H783 PolarHBondContact OH-CD2 3.38Å; Y695-H783 PolarHBondContact OH-NE2 3.11Å; F766-H783 HydrophobicContact CE2-CB 4.07Å; F766-H783 HydrophobicContact CZ-CB 4.38Å; V779-H783 VanDerWaalsContact O-CB 3.31Å; V779-H783 WeakPolarHBondContact O-CB 3.43Å; V779-H783 PolarHBondContact O-N 3.22Å; L780-H783 PolarHBondContact O-N 2.92Å; R781-H783 VanDerWaalsContact C-N 3.25Å; R781-H783 PolarHBondContact O-N 3.11Å; H783-F786 PolarHBondContact O-N 3.1Å; H783-L787 PolarHBondContact O-N 3.27Å
784	Q	90.4	Very high	88.3	Confident	90 Å²	90	47.1 Å²	47.1	42%	0.421	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-47	173.3	-72	176	-2.7	0	0	111.6	L780 R781 F786 L787 D788	L780-Q784 WeakPolarHBondContact O-CB 3.44Å; L780-Q784 VanDerWaalsContact O-CG 3.31Å; L780-Q784 WeakPolarHBondContact O-CG 3.39Å; L780-Q784 PolarHBondContact O-N 3.22Å; R781-Q784 PolarHBondContact O-N 3.04Å; Q784-F786 VanDerWaalsContact C-N 3.32Å; Q784-F786 PolarHBondContact O-N 3.22Å; Q784-L787 PolarHBondContact O-N 3.09Å; Q784-D788 WeakPolarHBondContact O-CB 3.49Å; Q784-D788 PolarHBondContact O-N 3.24Å
785	D	91.8	Very high	88.3	Confident	100 Å²	100	43 Å²	43	54%	0.535	21%	0.213	S	C	.	.	H	α-helix	trans	-58.4	-42.4	176.7	-72.3	-21.4	0	0	0	111.6	R781 S789	R781-D785 WeakPolarHBondContact O-CB 3.44Å; R781-D785 PolarHBondContact O-N 3.47Å; D785-S789 WeakPolarHBondContact O-CB 3.31Å; D785-S789 PolarHBondContact O-N 2.84Å; D785-S789 PolarHBondContact O-OG 3.21Å
786	F	93.1	Very high	87.9	Confident	10 Å²	10	42.5 Å²	42.5	4%	0.044	21%	0.21	C	C	.	.	H	α-helix	trans	-60.5	-51.7	174.3	162.9	-98.9	0	0	0	111.3	L584 Y695 N762 W763 F766 L782 H783 Q784 S789 C790	L584-F786 HydrophobicContact CD1-CZ 4.15Å; Y695-F786 AromaticContact CE1-CE1 3.99Å; Y695-F786 HydrophobicContact CE1-CE1 3.99Å; N762-F786 HydrophobicContact CB-CD2 3.91Å; N762-F786 HydrophobicContact CB-CE2 3.93Å; W763-F786 HydrophobicContact CB-CE2 4.14Å; W763-F786 HydrophobicContact CE3-CE1 4.15Å; W763-F786 HydrophobicContact CE3-CE2 4.03Å; W763-F786 AromaticContact CE3-CZ 3.69Å; W763-F786 HydrophobicContact CE3-CZ 3.69Å; W763-F786 HydrophobicContact CZ3-CE1 4.35Å; W763-F786 HydrophobicContact CZ3-CZ 4.32Å; F766-F786 HydrophobicContact CB-CB 4.22Å; F766-F786 HydrophobicContact CB-CD2 4.01Å; F766-F786 HydrophobicContact CB-CG 4.22Å; F766-F786 HydrophobicContact CD2-CB 4.04Å; F766-F786 HydrophobicContact CG-CB 4.19Å; F766-F786 HydrophobicContact CG-CD2 4.46Å; F766-F786 HydrophobicContact CG-CG 4.23Å; L782-F786 VanDerWaalsContact O-CB 3.29Å; L782-F786 WeakPolarHBondContact O-CB 3.36Å; L782-F786 PolarHBondContact O-N 3.41Å; H783-F786 PolarHBondContact O-N 3.1Å; Q784-F786 VanDerWaalsContact C-N 3.32Å; Q784-F786 PolarHBondContact O-N 3.22Å; F786-S789 PolarHBondContact O-N 3.01Å; F786-C790 VanDerWaalsContact CE2-SG 3.53Å; F786-C790 WeakPolarHBondContact O-CB 3.35Å; F786-C790 PolarHBondContact O-N 3.05Å; F786-C790 PolarHBondContact O-SG 3.25Å
787	L	91.7	Very high	87.1	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-47.1	-179.5	-86.7	173.3	0	0	0	112.2	K694 Y695 L698 H783 Q784 C790 L791	K694-L787 HydrophobicContact CB-CD1 4.31Å; K694-L787 HydrophobicContact CB-CD2 4.13Å; K694-L787 HydrophobicContact CD-CB 4.21Å; K694-L787 HydrophobicContact CD-CD1 4.28Å; Y695-L787 HydrophobicContact CD1-CD2 3.71Å; Y695-L787 HydrophobicContact CD2-CD1 4.35Å; Y695-L787 HydrophobicContact CD2-CD2 4Å; Y695-L787 HydrophobicContact CE1-CD2 3.53Å; Y695-L787 HydrophobicContact CE1-CG 4.42Å; Y695-L787 HydrophobicContact CE2-CD1 3.89Å; Y695-L787 HydrophobicContact CE2-CD2 3.82Å; Y695-L787 HydrophobicContact CE2-CG 4.2Å; Y695-L787 HydrophobicContact CG-CD2 3.94Å; L698-L787 HydrophobicContact CD1-CD2 4.4Å; H783-L787 PolarHBondContact O-N 3.27Å; Q784-L787 PolarHBondContact O-N 3.09Å; L787-C790 PolarHBondContact O-N 3.29Å; L787-L791 WeakPolarHBondContact O-CB 3.48Å; L787-L791 WeakPolarHBondContact O-CG 3.38Å; L787-L791 PolarHBondContact O-N 3.05Å
788	D	89.9	Confident	85.8	Confident	72 Å²	72	50.9 Å²	50.9	39%	0.385	25%	0.252	S	S	.	.	H	α-helix	trans	-71.9	-31.5	-177.6	-71.4	-29.2	0	0	0	112.2	K694 Q784 K792	K694-D788 WeakPolarHBondContact CE-OD1 3.38Å; K694-D788 IonicContact NZ-OD1 3.86Å; K694-D788 PolarHBondContact NZ-OD1 3.29Å; K694-D788 IonicContact NZ-OD2 3.2Å; K694-D788 PolarHBondContact NZ-OD2 3.17Å; Q784-D788 WeakPolarHBondContact O-CB 3.49Å; Q784-D788 PolarHBondContact O-N 3.24Å; D788-K792 VanDerWaalsContact O-CB 3.23Å; D788-K792 WeakPolarHBondContact O-CB 3.4Å; D788-K792 PolarHBondContact O-N 2.94Å
789	S	90.8	Very high	84.3	Confident	49 Å²	49	51.6 Å²	51.6	34%	0.343	26%	0.262	S	S	.	.	H	α-helix	trans	-65.3	-43.7	169.4	-60.9	0	0	0	0	111.9	D785 F786 N793	D785-S789 WeakPolarHBondContact O-CB 3.31Å; D785-S789 PolarHBondContact O-N 2.84Å; D785-S789 PolarHBondContact O-OG 3.21Å; F786-S789 PolarHBondContact O-N 3.01Å; S789-N793 VanDerWaalsContact O-CB 3.3Å; S789-N793 WeakPolarHBondContact O-CB 3.38Å; S789-N793 PolarHBondContact O-N 2.99Å
790	C	90.8	Very high	82.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64.1	-48.5	175.2	-76.8	0	0	0	0	111.8	L698 F786 L787 K792 N793 C794	L698-C790 HydrophobicContact CD1-CB 4.04Å; F786-C790 VanDerWaalsContact CE2-SG 3.53Å; F786-C790 WeakPolarHBondContact O-CB 3.35Å; F786-C790 PolarHBondContact O-N 3.05Å; F786-C790 PolarHBondContact O-SG 3.25Å; L787-C790 PolarHBondContact O-N 3.29Å; C790-K792 VanDerWaalsContact C-N 3.35Å; C790-K792 PolarHBondContact O-N 3.32Å; C790-N793 PolarHBondContact O-N 3.35Å; C790-C794 WeakPolarHBondContact O-CB 3.5Å; C790-C794 PolarHBondContact O-N 3.23Å; C790-C794 PolarHBondContact O-SG 2.98Å
791	L	87.9	Confident	81.9	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.052	31%	0.305	C	S	.	.	H	α-helix	trans	-57.8	-45.4	176.7	-73.4	175.8	0	0	0	112.4	K694 M697 L698 L787 L796 T797	K694-L791 HydrophobicContact CB-CD1 3.94Å; K694-L791 HydrophobicContact CD-CD1 3.83Å; K694-L791 HydrophobicContact CG-CD1 3.74Å; M697-L791 HydrophobicContact CB-CD2 4.34Å; M697-L791 HydrophobicContact CE-CD2 4.01Å; L698-L791 HydrophobicContact CD1-CD2 4.38Å; L698-L791 HydrophobicContact CD2-CD2 3.96Å; L698-L791 HydrophobicContact CG-CD2 3.81Å; L787-L791 WeakPolarHBondContact O-CB 3.48Å; L787-L791 WeakPolarHBondContact O-CG 3.38Å; L787-L791 PolarHBondContact O-N 3.05Å; L791-L796 HydrophobicContact CD2-CB 4.27Å; L791-L796 HydrophobicContact CD2-CD1 3.8Å; L791-L796 WeakPolarHBondContact O-CB 3.48Å; L791-L796 PolarHBondContact O-N 2.87Å; L791-T797 PolarHBondContact O-OG1 3.46Å
792	K	87.1	Confident	81.2	Confident	121 Å²	121	56.6 Å²	56.6	53%	0.526	30%	0.301	S	S	.	.	H	α-helix	trans	-63.4	-49.9	179.6	-173.4	178.8	179.5	-178.4	0	111.3	D788 C790 M795 T797	D788-K792 VanDerWaalsContact O-CB 3.23Å; D788-K792 WeakPolarHBondContact O-CB 3.4Å; D788-K792 PolarHBondContact O-N 2.94Å; C790-K792 VanDerWaalsContact C-N 3.35Å; C790-K792 PolarHBondContact O-N 3.32Å; K792-M795 PolarHBondContact O-N 3.21Å; K792-T797 VanDerWaalsContact CA-OG1 3.29Å; K792-T797 WeakPolarHBondContact CA-OG1 3.32Å; K792-T797 PolarHBondContact N-OG1 3.4Å
793	N	86.1	Confident	80.4	Confident	67 Å²	67	55.4 Å²	55.4	36%	0.358	29%	0.294	S	S	.	.	H	α-helix	trans	-73.6	-32.9	-175.1	-64.2	-4.9	0	0	0	112.2	I758 S789 C790 M795	I758-N793 HydrophobicContact CB-CB 4.41Å; I758-N793 VanDerWaalsContact CD1-C 3.46Å; I758-N793 HydrophobicContact CD1-CB 3.96Å; I758-N793 VanDerWaalsContact CD1-O 3.22Å; I758-N793 WeakPolarHBondContact CD1-O 3.21Å; I758-N793 HydrophobicContact CG1-CB 3.91Å; I758-N793 HydrophobicContact CG2-CB 3.61Å; S789-N793 VanDerWaalsContact O-CB 3.3Å; S789-N793 WeakPolarHBondContact O-CB 3.38Å; S789-N793 PolarHBondContact O-N 2.99Å; C790-N793 PolarHBondContact O-N 3.35Å; N793-M795 PolarHBondContact O-N 2.64Å
794	C	84.3	Confident	79.7	Confident	1 Å²	1	62.5 Å²	62.5	1%	0.007	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	10.1	170.9	-68.8	0	0	0	0	113.8	L698 Q701 C790 L796	L698-C794 HydrophobicContact CD2-CB 3.89Å; Q701-C794 PolarHBondContact NE2-O 3.36Å; Q701-C794 PolarHBondContact OE1-O 3.35Å; C790-C794 WeakPolarHBondContact O-CB 3.5Å; C790-C794 PolarHBondContact O-N 3.23Å; C790-C794 PolarHBondContact O-SG 2.98Å; C794-L796 VanDerWaalsContact C-N 3.35Å; C794-L796 HydrophobicContact CB-CG 4.37Å; C794-L796 PolarHBondContact O-N 3.34Å
795	M	82	Confident	79.3	Confident	56 Å²	56	61.3 Å²	61.3	28%	0.276	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	30.8	174.4	-53.9	158.7	171.5	0	0	113.8	Y753 K792 N793 L802 I806	Y753-M795 HydrophobicContact CD1-CE 4.49Å; Y753-M795 HydrophobicContact CE1-CE 3.68Å; K792-M795 PolarHBondContact O-N 3.21Å; N793-M795 PolarHBondContact O-N 2.64Å; M795-L802 HydrophobicContact CB-CD2 3.73Å; M795-L802 HydrophobicContact CE-CD2 4.44Å; M795-L802 HydrophobicContact CG-CD2 3.79Å; M795-L802 HydrophobicContact SD-CD2 3.39Å; M795-L802 WeakPolarHBondContact SD-CD2 3.34Å; M795-I806 HydrophobicContact SD-CD1 3.98Å
796	L	75.8	Confident	79	Confident	10 Å²	10	57.4 Å²	57.4	5%	0.052	30%	0.302	C	S	.	.	S	Bend	trans	-98.2	-20.2	-179.6	-59.6	-167.9	0	0	0	114.3	M649 M697 L698 Q701 L791 C794 N803	M649-L796 HydrophobicContact CE-CB 3.92Å; M649-L796 HydrophobicContact CE-CD1 3.82Å; M649-L796 HydrophobicContact CE-CD2 3.33Å; M649-L796 HydrophobicContact CE-CG 3.87Å; M697-L796 HydrophobicContact CB-CD1 4.38Å; L698-L796 HydrophobicContact CD2-CD1 3.98Å; Q701-L796 VanDerWaalsContact CD-CD2 3.49Å; Q701-L796 HydrophobicContact CG-CD2 4.43Å; Q701-L796 VanDerWaalsContact OE1-CG 3.31Å; L791-L796 HydrophobicContact CD2-CB 4.27Å; L791-L796 HydrophobicContact CD2-CD1 3.8Å; L791-L796 WeakPolarHBondContact O-CB 3.48Å; L791-L796 PolarHBondContact O-N 2.87Å; C794-L796 VanDerWaalsContact C-N 3.35Å; C794-L796 HydrophobicContact CB-CG 4.37Å; C794-L796 PolarHBondContact O-N 3.34Å; L796-N803 WeakPolarHBondContact CD2-ND2 3.18Å
797	T	68.7	Low	78.4	Confident	60 Å²	60	58.5 Å²	58.5	37%	0.368	31%	0.306	S	S	.	.	S	Bend	trans	-98.9	-26.9	-175.4	-39.8	0	0	0	0	113.5	M653 L791 K792	M653-T797 HydrophobicContact CE-CG2 3.76Å; M653-T797 WeakPolarHBondContact CE-O 3.47Å; L791-T797 PolarHBondContact O-OG1 3.46Å; K792-T797 VanDerWaalsContact CA-OG1 3.29Å; K792-T797 WeakPolarHBondContact CA-OG1 3.32Å; K792-T797 PolarHBondContact N-OG1 3.4Å
798	E	55.8	Low	78.1	Confident	141 Å²	141	63.9 Å²	63.9	66%	0.659	33%	0.33	S	S	*	.	S	Bend	trans	-102	94.1	-168	-165.5	164	-114.2	0	0	112.6
799	S	54.6	Low	78.1	Confident	77 Å²	77	63.9 Å²	63.9	54%	0.538	33%	0.329	S	S	.	.			trans	53.4	111.5	173.1	72.5	0	0	0	0	115.5	H801 L802	S799-H801 PolarHBondContact O-N 3.13Å; S799-L802 PolarHBondContact O-N 2.96Å
800	S	58.9	Low	77.9	Confident	74 Å²	74	61.5 Å²	61.5	52%	0.517	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-12.5	-171.3	61.6	0	0	0	0	117.2	L802 R804	S800-L802 PolarHBondContact O-N 3.14Å; S800-R804 WeakPolarHBondContact O-CB 3.42Å; S800-R804 PolarHBondContact O-N 3.17Å
801	H	66.4	Low	77.7	Confident	135 Å²	135	65.9 Å²	65.9	63%	0.625	33%	0.332	S	S	*	.	H	α-helix	trans	-55.5	-42.5	172.9	-57.8	-68.8	0	0	0	114.3	S799 S805	S799-H801 PolarHBondContact O-N 3.13Å; H801-S805 WeakPolarHBondContact O-CB 3.34Å; H801-S805 PolarHBondContact O-N 3.17Å; H801-S805 PolarHBondContact O-OG 3.32Å
802	L	74.9	Confident	77.8	Confident	83 Å²	83	70.2 Å²	70.2	44%	0.435	35%	0.354	S	S	.	.	H	α-helix	trans	-77.5	-48.7	-173.1	-160	146.3	0	0	0	111.4	M795 S799 S800 R804 S805 I806	M795-L802 HydrophobicContact CB-CD2 3.73Å; M795-L802 HydrophobicContact CE-CD2 4.44Å; M795-L802 HydrophobicContact CG-CD2 3.79Å; M795-L802 HydrophobicContact SD-CD2 3.39Å; M795-L802 WeakPolarHBondContact SD-CD2 3.34Å; S799-L802 PolarHBondContact O-N 2.96Å; S800-L802 PolarHBondContact O-N 3.14Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 2.88Å; L802-S805 WeakPolarHBondContact O-CA 3.46Å; L802-S805 WeakPolarHBondContact O-CB 3.16Å; L802-S805 PolarHBondContact O-N 2.79Å; L802-I806 HydrophobicContact CD2-CD1 3.85Å; L802-I806 HydrophobicContact CD2-CG1 4.41Å; L802-I806 PolarHBondContact O-N 3.1Å
803	N	75.4	Confident	78	Confident	6 Å²	6	64.5 Å²	64.5	3%	0.032	33%	0.329	C	S	.	.	H	α-helix	trans	-53	-47.9	169	178.9	-83.7	0	0	0	111.8	L796 S805 I806 F807	L796-N803 WeakPolarHBondContact CD2-ND2 3.18Å; N803-S805 PolarHBondContact O-N 3.13Å; N803-I806 WeakPolarHBondContact O-CB 3.13Å; N803-I806 PolarHBondContact O-N 3.35Å; N803-I806 VanDerWaalsContact O-N 3.11Å; N803-F807 WeakPolarHBondContact O-CD2 3.39Å; N803-F807 PolarHBondContact O-N 3.18Å; N803-F807 VanDerWaalsContact OD1-CD2 3.26Å; N803-F807 WeakPolarHBondContact OD1-CD2 3.46Å; N803-F807 WeakPolarHBondContact OD1-CE2 3.46Å
804	R	77.4	Confident	78	Confident	151 Å²	151	62.8 Å²	62.8	57%	0.57	32%	0.32	S	S	*	.	H	α-helix	trans	-61.5	-27.6	175.6	-173.6	175.7	-175.4	-171.6	3.2	113.1	S800 L802 K808	S800-R804 WeakPolarHBondContact O-CB 3.42Å; S800-R804 PolarHBondContact O-N 3.17Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 2.88Å; R804-K808 WeakPolarHBondContact O-CB 3.32Å; R804-K808 WeakPolarHBondContact O-CG 3.36Å; R804-K808 PolarHBondContact O-N 2.85Å
805	S	82	Confident	78.2	Confident	65 Å²	65	69.7 Å²	69.7	46%	0.455	35%	0.35	S	S	.	.	H	α-helix	trans	-76.1	-38	175.5	-59.7	0	0	0	0	111.9	H801 L802 N803 K808 L809	H801-S805 WeakPolarHBondContact O-CB 3.34Å; H801-S805 PolarHBondContact O-N 3.17Å; H801-S805 PolarHBondContact O-OG 3.32Å; L802-S805 WeakPolarHBondContact O-CA 3.46Å; L802-S805 WeakPolarHBondContact O-CB 3.16Å; L802-S805 PolarHBondContact O-N 2.79Å; N803-S805 PolarHBondContact O-N 3.13Å; S805-K808 PolarHBondContact O-N 3.43Å; S805-L809 PolarHBondContact O-N 3.4Å
806	I	84.5	Confident	78.5	Confident	18 Å²	18	68.1 Å²	68.1	9%	0.092	34%	0.341	C	S	.	.	H	α-helix	trans	-61.5	-47.6	170.5	-65.7	169	0	0	0	110.5	L750 M795 L802 N803 K808 L809 C810	L750-I806 HydrophobicContact CD1-CD1 4.42Å; L750-I806 HydrophobicContact CD2-CD1 4.35Å; L750-I806 HydrophobicContact CD2-CG1 4.28Å; L750-I806 HydrophobicContact CD2-CG2 3.76Å; M795-I806 HydrophobicContact SD-CD1 3.98Å; L802-I806 HydrophobicContact CD2-CD1 3.85Å; L802-I806 HydrophobicContact CD2-CG1 4.41Å; L802-I806 PolarHBondContact O-N 3.1Å; N803-I806 WeakPolarHBondContact O-CB 3.13Å; N803-I806 PolarHBondContact O-N 3.35Å; N803-I806 VanDerWaalsContact O-N 3.11Å; I806-K808 VanDerWaalsContact C-N 3.35Å; I806-K808 PolarHBondContact O-N 3.28Å; I806-L809 WeakPolarHBondContact O-CB 3.41Å; I806-L809 PolarHBondContact O-N 3Å; I806-C810 WeakPolarHBondContact O-CB 3.32Å; I806-C810 PolarHBondContact O-N 3.01Å; I806-C810 PolarHBondContact O-SG 3.5Å
807	F	81.9	Confident	79	Confident	32 Å²	32	67.8 Å²	67.8	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-60.8	-40.5	175.5	-85.9	-75.8	0	0	0	112.8	L645 Y704 N803 C810 K811	L645-F807 HydrophobicContact CB-CE2 4.45Å; L645-F807 HydrophobicContact CB-CZ 4.13Å; L645-F807 HydrophobicContact CD2-CE2 3.9Å; L645-F807 HydrophobicContact CD2-CZ 3.7Å; L645-F807 HydrophobicContact CG-CZ 4.46Å; Y704-F807 AromaticContact CD1-CD1 3.63Å; Y704-F807 HydrophobicContact CD1-CD1 3.63Å; Y704-F807 AromaticContact CD1-CE1 3.35Å; Y704-F807 HydrophobicContact CD1-CE1 3.35Å; Y704-F807 HydrophobicContact CD1-CZ 4.3Å; Y704-F807 AromaticContact CE1-CD1 3.36Å; Y704-F807 HydrophobicContact CE1-CD1 3.36Å; Y704-F807 AromaticContact CE1-CE1 3.58Å; Y704-F807 HydrophobicContact CE1-CE1 3.58Å; Y704-F807 HydrophobicContact CE1-CG 4.44Å; Y704-F807 AromaticContact CG-CE1 3.92Å; Y704-F807 HydrophobicContact CG-CE1 3.92Å; N803-F807 WeakPolarHBondContact O-CD2 3.39Å; N803-F807 PolarHBondContact O-N 3.18Å; N803-F807 VanDerWaalsContact OD1-CD2 3.26Å; N803-F807 WeakPolarHBondContact OD1-CD2 3.46Å; N803-F807 WeakPolarHBondContact OD1-CE2 3.46Å; F807-C810 PolarHBondContact O-N 3.34Å; F807-K811 WeakPolarHBondContact O-CB 3.41Å; F807-K811 WeakPolarHBondContact O-CG 3.49Å; F807-K811 PolarHBondContact O-N 3.33Å
808	K	85.3	Confident	79.8	Confident	113 Å²	113	70.3 Å²	70.3	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-61.1	-44.7	173.3	-77.9	168.9	178.6	-179.6	0	112.1	R804 S805 I806 K811 I812	R804-K808 WeakPolarHBondContact O-CB 3.32Å; R804-K808 WeakPolarHBondContact O-CG 3.36Å; R804-K808 PolarHBondContact O-N 2.85Å; S805-K808 PolarHBondContact O-N 3.43Å; I806-K808 VanDerWaalsContact C-N 3.35Å; I806-K808 PolarHBondContact O-N 3.28Å; K808-K811 PolarHBondContact O-N 3.43Å; K808-I812 WeakPolarHBondContact O-CD1 3.39Å; K808-I812 VanDerWaalsContact O-CG1 3.26Å; K808-I812 WeakPolarHBondContact O-CG1 3.22Å; K808-I812 PolarHBondContact O-N 3.33Å
809	L	89.4	Confident	81.2	Confident	72 Å²	72	70.3 Å²	70.3	38%	0.377	35%	0.345	S	S	.	.	H	α-helix	trans	-57.6	-49.4	176.7	-175.5	80.9	0	0	0	110.7	S805 I806 I812 C813	S805-L809 PolarHBondContact O-N 3.4Å; I806-L809 WeakPolarHBondContact O-CB 3.41Å; I806-L809 PolarHBondContact O-N 3Å; L809-I812 PolarHBondContact O-N 2.84Å; L809-C813 PolarHBondContact O-N 3.16Å; L809-C813 PolarHBondContact O-SG 3.36Å
810	C	87.3	Confident	82.5	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.5	-45.3	178.4	-68.8	0	0	0	0	112.2	Y704 V708 I806 F807 I812 C813 L814	Y704-C810 HydrophobicContact CD1-CB 4.07Å; Y704-C810 HydrophobicContact CE1-CB 3.32Å; V708-C810 HydrophobicContact CG2-CB 3.98Å; I806-C810 WeakPolarHBondContact O-CB 3.32Å; I806-C810 PolarHBondContact O-N 3.01Å; I806-C810 PolarHBondContact O-SG 3.5Å; F807-C810 PolarHBondContact O-N 3.34Å; C810-I812 VanDerWaalsContact C-N 3.32Å; C810-I812 PolarHBondContact O-N 3.41Å; C810-C813 WeakPolarHBondContact O-CB 3.33Å; C810-C813 PolarHBondContact O-N 3.47Å; C810-C813 VanDerWaalsContact O-N 3.13Å; C810-L814 PolarHBondContact O-N 3.36Å
811	K	86.9	Confident	83.4	Confident	92 Å²	92	66.2 Å²	66.2	40%	0.4	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-34.1	174.4	-70.6	-168.9	-174.9	-147.1	0	112.8	E671 Y704 F807 K808 K815	E671-K811 VanDerWaalsContact CD-NZ 3.27Å; E671-K811 WeakPolarHBondContact OE1-CE 3.44Å; E671-K811 IonicContact OE1-NZ 3.46Å; E671-K811 PolarHBondContact OE1-NZ 3.24Å; E671-K811 IonicContact OE2-NZ 3.84Å; E671-K811 PolarHBondContact OE2-NZ 3.01Å; Y704-K811 WeakPolarHBondContact OH-CG 3.09Å; F807-K811 WeakPolarHBondContact O-CB 3.41Å; F807-K811 WeakPolarHBondContact O-CG 3.49Å; F807-K811 PolarHBondContact O-N 3.33Å; K808-K811 PolarHBondContact O-N 3.43Å; K811-K815 WeakPolarHBondContact O-CG 3.43Å; K811-K815 PolarHBondContact O-N 3.05Å
812	I	90.1	Very high	83.9	Confident	100 Å²	100	64.2 Å²	64.2	51%	0.513	31%	0.306	S	S	.	.	H	α-helix	trans	-67.7	-40.3	173.1	-69.6	162.7	0	0	0	110.9	M743 K808 L809 C810 K815 Y816	M743-I812 HydrophobicContact CE-CG2 4.15Å; K808-I812 WeakPolarHBondContact O-CD1 3.39Å; K808-I812 VanDerWaalsContact O-CG1 3.26Å; K808-I812 WeakPolarHBondContact O-CG1 3.22Å; K808-I812 PolarHBondContact O-N 3.33Å; L809-I812 PolarHBondContact O-N 2.84Å; C810-I812 VanDerWaalsContact C-N 3.32Å; C810-I812 PolarHBondContact O-N 3.41Å; I812-K815 PolarHBondContact O-N 3.17Å; I812-Y816 PolarHBondContact O-N 3.4Å
813	C	89.4	Confident	83.5	Confident	2 Å²	2	62 Å²	62	1%	0.014	30%	0.298	C	S	.	.	H	α-helix	trans	-64.5	-41	176	-64.3	0	0	0	0	111.8	V708 L712 I747 L809 C810 Y816 C817	V708-C813 HydrophobicContact CG1-CB 3.49Å; V708-C813 VanDerWaalsContact CG1-CB 3.49Å; L712-C813 HydrophobicContact CD1-CB 4.32Å; I747-C813 HydrophobicContact CD1-CB 4.1Å; L809-C813 PolarHBondContact O-N 3.16Å; L809-C813 PolarHBondContact O-SG 3.36Å; C810-C813 WeakPolarHBondContact O-CB 3.33Å; C810-C813 PolarHBondContact O-N 3.47Å; C810-C813 VanDerWaalsContact O-N 3.13Å; C813-Y816 WeakPolarHBondContact O-CB 3.26Å; C813-Y816 PolarHBondContact O-N 3.01Å; C813-C817 PolarHBondContact O-N 3.04Å; C813-C817 PolarHBondContact O-SG 3.15Å
814	L	87.5	Confident	82.9	Confident	30 Å²	30	64 Å²	64	16%	0.157	31%	0.312	C	S	.	.	H	α-helix	trans	-63.9	-43.2	174.2	-69.4	174.5	0	0	0	112.7	Y704 V708 Q711 C810 Y816 C817 E818	Y704-L814 HydrophobicContact CE2-CD1 4.22Å; V708-L814 HydrophobicContact CB-CD2 4.48Å; V708-L814 HydrophobicContact CG1-CD2 4.31Å; V708-L814 HydrophobicContact CG1-CG 4.33Å; V708-L814 HydrophobicContact CG2-CD1 4.07Å; V708-L814 HydrophobicContact CG2-CD2 4Å; V708-L814 HydrophobicContact CG2-CG 3.87Å; Q711-L814 HydrophobicContact CB-CD2 4.32Å; Q711-L814 HydrophobicContact CG-CD2 4.19Å; C810-L814 PolarHBondContact O-N 3.36Å; L814-Y816 VanDerWaalsContact C-N 3.29Å; L814-Y816 PolarHBondContact O-N 3.12Å; L814-C817 WeakPolarHBondContact O-CA 3.46Å; L814-C817 VanDerWaalsContact O-CB 3.24Å; L814-C817 WeakPolarHBondContact O-CB 3.37Å; L814-C817 PolarHBondContact O-N 3.44Å; L814-E818 WeakPolarHBondContact O-CG 3.49Å; L814-E818 PolarHBondContact O-N 2.79Å
815	K	88.6	Confident	82	Confident	146 Å²	146	59.7 Å²	59.7	64%	0.635	31%	0.305	S	S	*	.	H	α-helix	trans	-62.5	-35.5	173.6	-72.4	-174	178.3	-163.9	0	113.2	K811 I812 C817 F819	K811-K815 WeakPolarHBondContact O-CG 3.43Å; K811-K815 PolarHBondContact O-N 3.05Å; I812-K815 PolarHBondContact O-N 3.17Å; K815-C817 VanDerWaalsContact C-N 3.33Å; K815-F819 WeakPolarHBondContact O-CB 3.27Å; K815-F819 PolarHBondContact O-N 3.28Å; K815-F819 VanDerWaalsContact O-N 3.09Å
816	Y	88.6	Confident	80.6	Confident	24 Å²	24	65.1 Å²	65.1	9%	0.094	32%	0.317	C	S	.	.	H	α-helix	trans	-63.7	-40.4	170.6	170.9	-90.2	0	0	0	111.1	L712 A736 L739 R740 M743 I812 C813 L814 F819 I820	L712-Y816 HydrophobicContact CD2-CD1 4.15Å; L712-Y816 HydrophobicContact CD2-CE1 4.45Å; A736-Y816 PolarHBondContact O-OH 2.83Å; A736-Y816 VanDerWaalsContact O-OH 3.04Å; L739-Y816 HydrophobicContact CD2-CD2 4.01Å; L739-Y816 HydrophobicContact CD2-CE2 4.02Å; L739-Y816 HydrophobicContact CG-CE2 4.48Å; R740-Y816 HydrophobicContact CB-CE1 3.85Å; R740-Y816 HydrophobicContact CG-CE1 4.05Å; M743-Y816 HydrophobicContact CE-CD2 4.49Å; M743-Y816 HydrophobicContact CE-CG 4.18Å; M743-Y816 HydrophobicContact SD-CD1 3.84Å; M743-Y816 HydrophobicContact SD-CD2 4.38Å; M743-Y816 HydrophobicContact SD-CG 3.78Å; I812-Y816 PolarHBondContact O-N 3.4Å; C813-Y816 WeakPolarHBondContact O-CB 3.26Å; C813-Y816 PolarHBondContact O-N 3.01Å; L814-Y816 VanDerWaalsContact C-N 3.29Å; L814-Y816 PolarHBondContact O-N 3.12Å; Y816-F819 PolarHBondContact O-N 3.34Å; Y816-I820 HydrophobicContact CD1-CG1 4.45Å; Y816-I820 HydrophobicContact CD2-CG1 4.38Å; Y816-I820 HydrophobicContact CE1-CG1 3.9Å; Y816-I820 HydrophobicContact CE2-CD1 4.07Å; Y816-I820 HydrophobicContact CE2-CG1 3.85Å; Y816-I820 WeakPolarHBondContact O-CG1 3.37Å; Y816-I820 PolarHBondContact O-N 2.94Å; Y816-I820 VanDerWaalsContact O-N 3.15Å
817	C	85.4	Confident	78.9	Confident	3 Å²	3	66.5 Å²	66.5	2%	0.02	33%	0.328	C	S	.	.	H	α-helix	trans	-60.3	-52.7	176	-68.3	0	0	0	0	112.1	L712 I715 C813 L814 K815 F819 I820 Q821	L712-C817 VanDerWaalsContact CD2-SG 3.58Å; I715-C817 HydrophobicContact CD1-CB 3.3Å; I715-C817 WeakPolarHBondContact CD1-O 3.39Å; C813-C817 PolarHBondContact O-N 3.04Å; C813-C817 PolarHBondContact O-SG 3.15Å; L814-C817 WeakPolarHBondContact O-CA 3.46Å; L814-C817 VanDerWaalsContact O-CB 3.24Å; L814-C817 WeakPolarHBondContact O-CB 3.37Å; L814-C817 PolarHBondContact O-N 3.44Å; K815-C817 VanDerWaalsContact C-N 3.33Å; C817-F819 VanDerWaalsContact C-N 3.34Å; C817-F819 PolarHBondContact O-N 3.04Å; C817-I820 PolarHBondContact O-N 3.44Å; C817-Q821 PolarHBondContact O-N 2.68Å
818	E	85.5	Confident	77.3	Confident	112 Å²	112	69 Å²	69	52%	0.523	36%	0.355	S	S	.	.	H	α-helix	trans	-54.5	-47.8	177	-68.7	163.7	-170.9	0	0	111.8	L814 I820 Q821 V822	L814-E818 WeakPolarHBondContact O-CG 3.49Å; L814-E818 PolarHBondContact O-N 2.79Å; E818-I820 VanDerWaalsContact C-N 3.31Å; E818-I820 PolarHBondContact O-N 3.41Å; E818-Q821 PolarHBondContact O-N 3.02Å; E818-V822 WeakPolarHBondContact O-CG2 3.23Å; E818-V822 PolarHBondContact O-N 3.16Å
819	F	85.3	Confident	75.1	Confident	141 Å²	141	73.5 Å²	73.5	62%	0.618	37%	0.369	S	S	*	.	H	α-helix	trans	-59	-39.6	179.2	176	-98	0	0	0	112.9	K815 Y816 C817 S823	K815-F819 WeakPolarHBondContact O-CB 3.27Å; K815-F819 PolarHBondContact O-N 3.28Å; K815-F819 VanDerWaalsContact O-N 3.09Å; Y816-F819 PolarHBondContact O-N 3.34Å; C817-F819 VanDerWaalsContact C-N 3.34Å; C817-F819 PolarHBondContact O-N 3.04Å; F819-S823 WeakPolarHBondContact O-CB 3.49Å; F819-S823 PolarHBondContact O-N 3.06Å; F819-S823 PolarHBondContact O-OG 3.13Å
820	I	81.1	Confident	72.7	Confident	6 Å²	6	75 Å²	75	3%	0.031	38%	0.381	C	S	.	.	H	α-helix	trans	-73.4	-37.2	178.6	-65.2	-66.5	0	0	0	111.8	I715 N719 A736 Y816 C817 E818 S823 S824	I715-I820 HydrophobicContact CG2-CB 4.2Å; I715-I820 HydrophobicContact CG2-CG2 3.57Å; N719-I820 WeakPolarHBondContact ND2-CG2 3.47Å; A736-I820 HydrophobicContact CB-CD1 4.28Å; Y816-I820 HydrophobicContact CD1-CG1 4.45Å; Y816-I820 HydrophobicContact CD2-CG1 4.38Å; Y816-I820 HydrophobicContact CE1-CG1 3.9Å; Y816-I820 HydrophobicContact CE2-CD1 4.07Å; Y816-I820 HydrophobicContact CE2-CG1 3.85Å; Y816-I820 WeakPolarHBondContact O-CG1 3.37Å; Y816-I820 PolarHBondContact O-N 2.94Å; Y816-I820 VanDerWaalsContact O-N 3.15Å; C817-I820 PolarHBondContact O-N 3.44Å; E818-I820 VanDerWaalsContact C-N 3.31Å; E818-I820 PolarHBondContact O-N 3.41Å; I820-S823 WeakPolarHBondContact CA-OG 3.28Å; I820-S823 PolarHBondContact O-N 3.16Å; I820-S823 PolarHBondContact O-OG 3.02Å; I820-S824 VanDerWaalsContact O-CB 3.24Å; I820-S824 WeakPolarHBondContact O-CB 3.47Å; I820-S824 PolarHBondContact O-N 3.05Å
821	Q	77.6	Confident	70.2	Confident	59 Å²	59	80.5 Å²	80.5	28%	0.276	42%	0.416	S	S	.	.	H	α-helix	trans	-65.8	-41.8	175.1	-74.1	170.2	-14.2	0	0	112.1	I715 C817 E818 S825	I715-Q821 HydrophobicContact CD1-CG 3.81Å; I715-Q821 HydrophobicContact CG1-CG 3.95Å; C817-Q821 PolarHBondContact O-N 2.68Å; E818-Q821 PolarHBondContact O-N 3.02Å; Q821-S825 WeakPolarHBondContact O-CB 3.45Å; Q821-S825 PolarHBondContact O-N 3.06Å; Q821-S825 PolarHBondContact O-OG 3.1Å
822	V	77.1	Confident	68	Low	93 Å²	93	80 Å²	80	56%	0.564	44%	0.437	S	S	*	.	H	α-helix	trans	-65.1	-43.7	175.5	173.4	0	0	0	0	111.5	E818 S825 Y826	E818-V822 WeakPolarHBondContact O-CG2 3.23Å; E818-V822 PolarHBondContact O-N 3.16Å; V822-S825 WeakPolarHBondContact CA-OG 3.32Å; V822-S825 PolarHBondContact O-N 3.33Å; V822-S825 PolarHBondContact O-OG 3.29Å; V822-S825 VanDerWaalsContact O-OG 3.05Å; V822-Y826 WeakPolarHBondContact O-CB 3.38Å; V822-Y826 PolarHBondContact O-N 3.19Å
823	S	68.1	Low	65.1	Low	36 Å²	36	82.5 Å²	82.5	25%	0.252	49%	0.488	S	S	.	.	H	α-helix	trans	-70.9	-35	178.7	51.5	0	0	0	0	113.3	F819 I820 Y826 S827	F819-S823 WeakPolarHBondContact O-CB 3.49Å; F819-S823 PolarHBondContact O-N 3.06Å; F819-S823 PolarHBondContact O-OG 3.13Å; I820-S823 WeakPolarHBondContact CA-OG 3.28Å; I820-S823 PolarHBondContact O-N 3.16Å; I820-S823 PolarHBondContact O-OG 3.02Å; S823-Y826 PolarHBondContact O-N 2.67Å; S823-S827 PolarHBondContact O-N 3.39Å
824	S	62.1	Low	63.9	Low	48 Å²	48	86.6 Å²	86.6	34%	0.336	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-47.1	172.3	-177.4	0	0	0	0	111.9	I820 Y826 S827 A828	I820-S824 VanDerWaalsContact O-CB 3.24Å; I820-S824 WeakPolarHBondContact O-CB 3.47Å; I820-S824 PolarHBondContact O-N 3.05Å; S824-Y826 VanDerWaalsContact C-N 3.34Å; S824-Y826 PolarHBondContact O-N 3.27Å; S824-S827 PolarHBondContact O-N 3.09Å; S824-A828 PolarHBondContact O-N 3.5Å
825	S	57.7	Low	62.7	Low	61 Å²	61	89.5 Å²	89.5	43%	0.427	53%	0.531	S	S	.	.	H	α-helix	trans	-69.7	-26.6	178.1	53	0	0	0	0	113.7	Q821 V822 R829	Q821-S825 WeakPolarHBondContact O-CB 3.45Å; Q821-S825 PolarHBondContact O-N 3.06Å; Q821-S825 PolarHBondContact O-OG 3.1Å; V822-S825 WeakPolarHBondContact CA-OG 3.32Å; V822-S825 PolarHBondContact O-N 3.33Å; V822-S825 PolarHBondContact O-OG 3.29Å; V822-S825 VanDerWaalsContact O-OG 3.05Å; S825-R829 WeakPolarHBondContact O-CG 3.23Å; S825-R829 PolarHBondContact O-N 3.3Å
826	Y	52.8	Low	61.2	Low	180 Å²	180	86.4 Å²	86.4	71%	0.706	53%	0.525	S	S	*	.	H	α-helix	trans	-69.4	-43	168.8	-131.8	-89.8	0	0	0	111.9	V822 S823 S824 A828 R829	V822-Y826 WeakPolarHBondContact O-CB 3.38Å; V822-Y826 PolarHBondContact O-N 3.19Å; S823-Y826 PolarHBondContact O-N 2.67Å; S824-Y826 VanDerWaalsContact C-N 3.34Å; S824-Y826 PolarHBondContact O-N 3.27Å; Y826-A828 VanDerWaalsContact C-N 3.34Å; Y826-A828 PolarHBondContact O-N 3.36Å; Y826-R829 PolarHBondContact O-N 3.31Å; Y826-R829 VanDerWaalsContact O-N 3.17Å
827	S	49.5	Very low	59.6	Low	46 Å²	46	90.1 Å²	90.1	32%	0.322	55%	0.55	S	S	.	*	H	α-helix	trans	-65.7	-36.3	177.8	-166.4	0	0	0	0	112.4	S823 S824 R829 V830	S823-S827 PolarHBondContact O-N 3.39Å; S824-S827 PolarHBondContact O-N 3.09Å; S827-R829 PolarHBondContact O-N 3.05Å; S827-V830 PolarHBondContact O-N 3.05Å
828	A	48.2	Very low	58	Low	85 Å²	85	95.5 Å²	95.5	70%	0.702	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	-13.3	175.2	0	0	0	0	0	114.2	S824 Y826	S824-A828 PolarHBondContact O-N 3.5Å; Y826-A828 VanDerWaalsContact C-N 3.34Å; Y826-A828 PolarHBondContact O-N 3.36Å
829	R	39.2	Very low	56.2	Low	208 Å²	208	94.4 Å²	94.4	79%	0.785	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.1	0.1	177.6	-79.2	-178	178.2	177.3	2	114.4	S825 Y826 S827 P831	S825-R829 WeakPolarHBondContact O-CG 3.23Å; S825-R829 PolarHBondContact O-N 3.3Å; Y826-R829 PolarHBondContact O-N 3.31Å; Y826-R829 VanDerWaalsContact O-N 3.17Å; S827-R829 PolarHBondContact O-N 3.05Å; R829-P831 WeakPolarHBondContact O-CD 3.4Å
830	V	39.2	Very low	54.1	Low	104 Å²	104	91.1 Å²	91.1	63%	0.63	59%	0.585	S	S	*	*			trans	-93.6	96.7	169.2	-176.1	0	0	0	0	107.6	S827 G832	S827-V830 PolarHBondContact O-N 3.05Å; V830-G832 PolarHBondContact O-N 3.46Å
831	P	34.6	Very low	52	Low	114 Å²	114	97.6 Å²	97.6	74%	0.74	63%	0.628	S	S	*	*			trans	-60.2	137.6	164.5	28.3	-33.7	0	0	0	108	R829 G833	R829-P831 WeakPolarHBondContact O-CD 3.4Å; P831-G833 PolarHBondContact O-N 3.21Å
832	G	40.1	Very low	49.9	Very low	81 Å²	81	100.8 Å²	100.8	84%	0.835	66%	0.657	S	S	*	*			trans	-55.2	131.1	180	0	0	0	0	0	111.3	V830	V830-G832 PolarHBondContact O-N 3.46Å
833	G	29.8	Very low	47.4	Very low	154 Å²	154	101.5 Å²	101.5	100%	1.588	67%	0.666	S	S	*	*			trans	-82.8	0	166.7	0	0	0	0	0	111.5	P831	P831-G833 PolarHBondContact O-N 3.21Å

Retrieved 833 of 833 residues in 1322.4 ms (Link to these results)

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