A0A087X4Y1_POEFO Loading...

Coatomer subunit gamma

The coatomer is a cytosolic protein complex that binds to dilysine motifs and reversibly associates with Golgi non-clathrin-coated vesicles, which further mediate biosynthetic protein transport from the ER, via the Golgi up to the trans Golgi network. Coatomer complex is required for budding from Golgi membranes, and is essential for the retrograde Golgi-to-ER transport of dilysine-tagged proteins.

AlphaFold DB , UniProt , Accession A0A087X4Y1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 873 aa.

						>A0A087X4Y1_POEFO|A0A087X4Y1
MIKKFDKKDEESGSGSNPFQHLEKSAVLQEARIFNETPINPRRCLHILTKIIYLLNQGEHFGTTEATEAFFAMTRLFQSNDQTLRRMCYLTIKEMANISEDVIIVTSSLTKDMTGKEDVYRGPAIRALCRITDTTMLQAIERYMKQAIVDKVPSVSSSALVSSLHMVKMSYDVVKRWVNEAQEAASSDNIMVQYHALGLLYHLRKNDRLAVTKMLNKFTKSGLKSPFAYCMLIRIASKLLDETEGGHDSPLFDFIESCLRNKNEMVVYEAASAIVHMPNCTARELAPAVSVLQLFCSSPKAALRYAAVRTLNKVAMKHPSAVTACNLDLENLITDSNRSIATLAITTLLKTGSESSVDRLMKQISSFVSEISDEFKVVVVQAISALCQKYPRKHSVMMNFLSNMLRDDGGFEYKRAIVDCIISIIEENPESKETGLAHLCEFIEDCEHTVLATKILHLLGKEGPRTPQPSKYIRFIFNRVVLESEAVRAAAVSALAKFGAQNDDLLPSVLVLMQRCMMDSDDEVRDRATFYMNVLQQKQKALNAAYIFNGLSVSIPGLEKSLHQYTLEPSEKPFDMKSVPLATTPITEQKLEIAPVATSKLPEKLAPSRQDIYQEQLASIPEFQALGPLFKSSEPVQLTEAETEYVVRCIKHTFARHMVFQFDCTNTLNDQLLQKVVVQMEPSEAYEVAHYIPAPSLPYSQPGSSYTLVRLPDDDPTAVSCTFSCTMKYLVRDCDPNTGEPDDDGYDDEYVLEDLEVTVADHIQKVLKPNFGAAWEEVGDENEKEETFALASVRTLDEAVGNIISFLGMQPCERSDKVPENKNSHVLFLAGVFRGGHDVLVRARLALADGVTMQVTVRSTEETVVDVILASVG
					

Structure Viewer

Loading PAE data...

(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	30.1	Very low	35.7	Very low	248 Å²	248	187.7 Å²	187.7	100%	1.222	88%	0.882	S	S	*	*				0	99.8	0	-89.2	-177	179.5	0	0	109.1
2	I	31.6	Very low	35.9	Very low	174 Å²	174	181.3 Å²	181.3	89%	0.892	87%	0.873	S	S	*	*	P	Polyproline II helix	trans	-93.7	116.2	171	-66.7	169.4	0	0	0	105.4	K4	I2-K4 PolarHBondContact O-N 2.59Å
3	K	32.4	Very low	36.1	Very low	196 Å²	196	172.3 Å²	172.3	85%	0.852	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-71.5	125.7	172.8	-94.6	-175	173.4	-177.3	0	108.4	F5	K3-F5 PolarHBondContact O-N 3.11Å
4	K	36.7	Very low	36.9	Very low	199 Å²	199	169.9 Å²	169.9	87%	0.865	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-48.9	126	167	-80.6	175.7	169.4	178.1	0	109.6	I2	I2-K4 PolarHBondContact O-N 2.59Å
5	F	35.8	Very low	37.6	Very low	209 Å²	209	163.9 Å²	163.9	92%	0.917	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-80	135.3	153.5	-99	-91.2	0	0	0	107.7	K3	K3-F5 PolarHBondContact O-N 3.11Å
6	D	35.3	Very low	39	Very low	159 Å²	159	158.9 Å²	158.9	85%	0.85	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-63.5	138.8	-174.2	-85.1	-46	0	0	0	112.6	K8	D6-K8 PolarHBondContact O-N 3.1Å
7	K	39.5	Very low	40.7	Very low	175 Å²	175	153.1 Å²	153.1	76%	0.761	81%	0.813	S	S	*	*			trans	-69	105.1	170.4	-83.4	-175.1	161.6	-157.5	0	110	E10	K7-E10 IonicContact NZ-OE1 2.85Å
8	K	36.8	Very low	42.4	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.835	81%	0.809	S	S	*	*			trans	-160.1	116.9	145.7	-108.8	177.5	179.1	-176	0	106.5	D6	D6-K8 PolarHBondContact O-N 3.1Å
9	D	35.3	Very low	44.2	Very low	157 Å²	157	144.7 Å²	144.7	84%	0.84	78%	0.775	S	S	*	*			trans	123.5	67.8	175.6	-60.4	-13.6	0	0	0	111.7
10	E	39.5	Very low	45.6	Very low	164 Å²	164	142.9 Å²	142.9	77%	0.766	76%	0.761	S	S	*	*			trans	-98.9	35.8	172.1	-92.3	-178.3	-175	0	0	111.7	K7	K7-E10 IonicContact NZ-OE1 2.85Å
11	E	40.1	Very low	47.1	Very low	192 Å²	192	144.2 Å²	144.2	90%	0.897	76%	0.763	S	S	*	*			trans	-139.3	63	172.7	-78.8	-169	158.9	0	0	113.1
12	S	37.3	Very low	49.7	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	71%	0.714	S	S	*	*	S	Bend	trans	-165.7	108.9	153.4	44.2	0	0	0	0	110.3
13	G	38.8	Very low	52.3	Low	64 Å²	64	132.4 Å²	132.4	66%	0.66	70%	0.701	S	S	*	*			trans	35.2	95.2	160.8	0	0	0	0	0	118.6	G15	G13-G15 PolarHBondContact O-N 3.4Å
14	S	46.9	Very low	55	Low	139 Å²	139	125.2 Å²	125.2	97%	0.972	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.1	93.4	163	73.3	0	0	0	0	109.9
15	G	47.7	Very low	57.4	Low	79 Å²	79	119 Å²	119	81%	0.814	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	155.3	-3.6	175.5	0	0	0	0	0	116.6	G13 N17	G13-G15 PolarHBondContact O-N 3.4Å; G15-N17 PolarHBondContact O-N 2.91Å
16	S	60	Low	59.9	Low	84 Å²	84	110.8 Å²	110.8	59%	0.587	62%	0.623	S	S	*	*			trans	-69.8	131.8	175.4	60.3	0	0	0	0	110.7
17	N	67.4	Low	62.5	Low	60 Å²	60	103.3 Å²	103.3	32%	0.321	58%	0.583	S	S	.	*			trans	-59.1	126.1	175.6	173.6	-0.9	0	0	0	108.8	G15 F19 Q20 Y53	G15-N17 PolarHBondContact O-N 2.91Å; N17-F19 PolarHBondContact O-N 3.41Å; N17-F19 PolarHBondContact OD1-N 3.48Å; N17-Q20 HydrophobicContact CB-CB 4.22Å; N17-Q20 VanDerWaalsContact O-CB 3.22Å; N17-Q20 WeakPolarHBondContact O-CB 3.33Å; N17-Q20 PolarHBondContact O-N 2.86Å; N17-Y53 VanDerWaalsContact ND2-CE2 3.28Å; N17-Y53 WeakPolarHBondContact ND2-CE2 3.45Å; N17-Y53 PolarHBondContact ND2-OH 3.26Å; N17-Y53 VanDerWaalsContact ND2-OH 3.16Å
18	P	71.1	Confident	64.8	Low	114 Å²	114	96.5 Å²	96.5	74%	0.74	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-7.2	-178.9	23.5	-33.9	0	0	0	114.3
19	F	77.9	Confident	67.2	Low	34 Å²	34	93.4 Å²	93.4	15%	0.149	54%	0.543	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	9.3	177.6	-55.2	-64.1	0	0	0	114.2	N17 H21 L22 H46 T49 K50 Y53	N17-F19 PolarHBondContact O-N 3.41Å; N17-F19 PolarHBondContact OD1-N 3.48Å; F19-H21 VanDerWaalsContact C-N 3.25Å; F19-H21 PolarHBondContact O-N 2.75Å; F19-H21 VanDerWaalsContact O-N 3.17Å; F19-L22 HydrophobicContact CB-CD1 3.75Å; F19-L22 HydrophobicContact CB-CG 4.21Å; F19-L22 HydrophobicContact CD1-CD1 3.81Å; F19-L22 HydrophobicContact CD1-CG 4.44Å; F19-L22 HydrophobicContact CG-CD1 4.19Å; F19-L22 WeakPolarHBondContact O-CG 3.15Å; F19-H46 AromaticContact CE1-CE1 3.55Å; F19-H46 AromaticContact CZ-CE1 3.99Å; F19-T49 HydrophobicContact CE1-CG2 4.48Å; F19-T49 HydrophobicContact CE2-CG2 3.96Å; F19-T49 HydrophobicContact CZ-CG2 3.7Å; F19-K50 HydrophobicContact CD1-CG 3.91Å; F19-K50 HydrophobicContact CE1-CG 3.76Å; F19-Y53 HydrophobicContact CB-CD1 3.66Å; F19-Y53 HydrophobicContact CB-CD2 4.17Å; F19-Y53 HydrophobicContact CB-CE1 3.66Å; F19-Y53 HydrophobicContact CB-CE2 4.21Å; F19-Y53 HydrophobicContact CB-CG 3.9Å; F19-Y53 HydrophobicContact CG-CG 4.41Å; F19-Y53 WeakPolarHBondContact O-CE1 3.38Å
20	Q	71.6	Confident	69.8	Low	107 Å²	107	89 Å²	89	50%	0.5	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-14.8	-170.5	-167.5	164.5	-4.3	0	0	115.5	N17	N17-Q20 HydrophobicContact CB-CB 4.22Å; N17-Q20 VanDerWaalsContact O-CB 3.22Å; N17-Q20 WeakPolarHBondContact O-CB 3.33Å; N17-Q20 PolarHBondContact O-N 2.86Å
21	H	77.9	Confident	72.1	Confident	172 Å²	172	81.3 Å²	81.3	80%	0.796	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.1	40.5	-178.6	-60.2	-61.4	0	0	0	112.6	F19	F19-H21 VanDerWaalsContact C-N 3.25Å; F19-H21 PolarHBondContact O-N 2.75Å; F19-H21 VanDerWaalsContact O-N 3.17Å
22	L	85	Confident	74.3	Confident	39 Å²	39	81 Å²	81	20%	0.204	47%	0.472	C	S	.	.			trans	-78.2	132.7	175.8	-69.3	176.9	0	0	0	111.2	F19 V27 K50 Y53 L54	F19-L22 HydrophobicContact CB-CD1 3.75Å; F19-L22 HydrophobicContact CB-CG 4.21Å; F19-L22 HydrophobicContact CD1-CD1 3.81Å; F19-L22 HydrophobicContact CD1-CG 4.44Å; F19-L22 HydrophobicContact CG-CD1 4.19Å; F19-L22 WeakPolarHBondContact O-CG 3.15Å; L22-V27 HydrophobicContact CB-CG2 4.28Å; L22-V27 HydrophobicContact CD1-CG2 4.48Å; L22-V27 HydrophobicContact CD2-CG2 4.16Å; L22-K50 HydrophobicContact CD1-CB 3.79Å; L22-K50 HydrophobicContact CD1-CD 4.37Å; L22-K50 HydrophobicContact CD1-CG 3.76Å; L22-K50 HydrophobicContact CD2-CD 3.76Å; L22-K50 HydrophobicContact CD2-CG 4.03Å; L22-Y53 HydrophobicContact CD1-CD1 3.87Å; L22-Y53 HydrophobicContact CD1-CE1 4.49Å; L22-L54 HydrophobicContact CB-CD2 3.7Å; L22-L54 HydrophobicContact CB-CG 4.48Å; L22-L54 HydrophobicContact CD1-CD2 4.22Å; L22-L54 HydrophobicContact CD1-CG 4.47Å
23	E	85.3	Confident	76.7	Confident	134 Å²	134	77.4 Å²	77.4	63%	0.626	44%	0.444	S	S	*	.			trans	-97.4	127.2	168.8	-65.5	-176.8	174.4	0	0	110.2	S25 A26 V27	E23-S25 VanDerWaalsContact C-N 3.29Å; E23-S25 PolarHBondContact O-N 3.34Å; E23-A26 HydrophobicContact CB-CB 4.18Å; E23-A26 WeakPolarHBondContact O-CB 3.35Å; E23-A26 PolarHBondContact O-N 3.39Å; E23-A26 VanDerWaalsContact O-N 3.1Å; E23-V27 WeakPolarHBondContact O-CG2 3.35Å; E23-V27 PolarHBondContact O-N 3.34Å
24	K	88.1	Confident	79.2	Confident	45 Å²	45	74.4 Å²	74.4	20%	0.196	41%	0.413	C	S	.	.	H	α-helix	trans	-51.7	-44.6	178.9	174.9	-177.8	71.8	153.5	0	113.6	A26 V27 L28 L54 E59 H60 F61 E65	K24-A26 VanDerWaalsContact C-N 3.33Å; K24-A26 PolarHBondContact O-N 3.04Å; K24-V27 PolarHBondContact O-N 3.49Å; K24-L28 HydrophobicContact CD-CD1 4.37Å; K24-L28 HydrophobicContact CG-CD1 3.82Å; K24-L28 HydrophobicContact CG-CG 4.31Å; K24-L28 WeakPolarHBondContact O-CB 3.13Å; K24-L28 WeakPolarHBondContact O-CG 3.21Å; K24-L28 PolarHBondContact O-N 3.28Å; K24-L54 HydrophobicContact CB-CD1 4.12Å; K24-E59 WeakPolarHBondContact CB-OE1 3.42Å; K24-E59 HydrophobicContact CD-CG 4.36Å; K24-H60 PolarHBondContact NZ-O 3.44Å; K24-F61 HydrophobicContact CD-CD1 4.4Å; K24-F61 HydrophobicContact CD-CE1 4.47Å; K24-F61 HydrophobicContact CD-CG 4.45Å; K24-F61 HydrophobicContact CG-CE1 4.22Å; K24-F61 HydrophobicContact CG-CZ 4.32Å; K24-E65 IonicContact NZ-OE1 3.89Å; K24-E65 IonicContact NZ-OE2 3.97Å; K24-E65 PolarHBondContact NZ-OE2 3.21Å
25	S	87.3	Confident	81	Confident	68 Å²	68	71 Å²	71	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-59.9	-42.5	179.7	54.4	0	0	0	0	111.9	E23 Q29	E23-S25 VanDerWaalsContact C-N 3.29Å; E23-S25 PolarHBondContact O-N 3.34Å; S25-Q29 VanDerWaalsContact O-CG 3.31Å; S25-Q29 WeakPolarHBondContact O-CG 3.23Å; S25-Q29 PolarHBondContact O-N 3.16Å
26	A	89	Confident	82.9	Confident	38 Å²	38	71.6 Å²	71.6	31%	0.314	37%	0.366	S	S	.	.	H	α-helix	trans	-66.4	-43.6	177.3	0	0	0	0	0	111.6	E23 K24 Q29 E30	E23-A26 HydrophobicContact CB-CB 4.18Å; E23-A26 WeakPolarHBondContact O-CB 3.35Å; E23-A26 PolarHBondContact O-N 3.39Å; E23-A26 VanDerWaalsContact O-N 3.1Å; K24-A26 VanDerWaalsContact C-N 3.33Å; K24-A26 PolarHBondContact O-N 3.04Å; A26-Q29 PolarHBondContact O-N 2.95Å; A26-E30 WeakPolarHBondContact O-CG 3.19Å; A26-E30 PolarHBondContact O-N 2.88Å
27	V	89.5	Confident	84	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.006	37%	0.374	C	S	.	.	H	α-helix	trans	-64.8	-41.2	178.5	178.6	0	0	0	0	111.8	L22 E23 K24 Q29 E30 A31 K50 I51 L54	L22-V27 HydrophobicContact CB-CG2 4.28Å; L22-V27 HydrophobicContact CD1-CG2 4.48Å; L22-V27 HydrophobicContact CD2-CG2 4.16Å; E23-V27 WeakPolarHBondContact O-CG2 3.35Å; E23-V27 PolarHBondContact O-N 3.34Å; K24-V27 PolarHBondContact O-N 3.49Å; V27-Q29 VanDerWaalsContact C-N 3.34Å; V27-E30 WeakPolarHBondContact O-CB 3.02Å; V27-E30 PolarHBondContact O-N 3.15Å; V27-A31 PolarHBondContact O-N 2.86Å; V27-K50 HydrophobicContact CG1-CB 3.7Å; V27-K50 HydrophobicContact CG2-CB 4.04Å; V27-K50 HydrophobicContact CG2-CD 4.04Å; V27-I51 HydrophobicContact CG1-CG1 3.61Å; V27-L54 HydrophobicContact CB-CD1 4.02Å; V27-L54 HydrophobicContact CG1-CD1 4.31Å; V27-L54 HydrophobicContact CG2-CD1 3.9Å
28	L	88.2	Confident	84.7	Confident	32 Å²	32	76 Å²	76	17%	0.168	39%	0.393	C	S	.	.	H	α-helix	trans	-66.3	-34.6	175.3	-73	174.2	0	0	0	112.3	K24 A31 F61 E65 A69	K24-L28 HydrophobicContact CD-CD1 4.37Å; K24-L28 HydrophobicContact CG-CD1 3.82Å; K24-L28 HydrophobicContact CG-CG 4.31Å; K24-L28 WeakPolarHBondContact O-CB 3.13Å; K24-L28 WeakPolarHBondContact O-CG 3.21Å; K24-L28 PolarHBondContact O-N 3.28Å; L28-A31 WeakPolarHBondContact O-CB 3.44Å; L28-A31 PolarHBondContact O-N 2.76Å; L28-F61 HydrophobicContact CD1-CD1 4.41Å; L28-F61 HydrophobicContact CD1-CE1 4.42Å; L28-F61 HydrophobicContact CD2-CD1 4.08Å; L28-F61 HydrophobicContact CD2-CE1 3.81Å; L28-F61 HydrophobicContact CG-CE1 4.17Å; L28-E65 HydrophobicContact CD1-CB 3.91Å; L28-E65 HydrophobicContact CD1-CG 4.22Å; L28-A69 HydrophobicContact CD2-CB 3.85Å
29	Q	87.9	Confident	85.5	Confident	127 Å²	127	72.2 Å²	72.2	59%	0.593	37%	0.366	S	S	*	.	H	α-helix	trans	-66.5	-41.8	171.9	-75.1	-179.8	13.5	0	0	112	S25 A26 V27 A31 R32	S25-Q29 VanDerWaalsContact O-CG 3.31Å; S25-Q29 WeakPolarHBondContact O-CG 3.23Å; S25-Q29 PolarHBondContact O-N 3.16Å; A26-Q29 PolarHBondContact O-N 2.95Å; V27-Q29 VanDerWaalsContact C-N 3.34Å; Q29-A31 PolarHBondContact O-N 3.36Å; Q29-R32 WeakPolarHBondContact O-CB 3.37Å; Q29-R32 WeakPolarHBondContact O-CG 3.45Å; Q29-R32 PolarHBondContact O-N 3.23Å
30	E	89.5	Confident	86.1	Confident	64 Å²	64	74 Å²	74	30%	0.299	38%	0.377	S	S	.	.	H	α-helix	trans	-60.3	-32.8	174.5	-72.9	-179.3	-164.5	0	0	112	A26 V27 R32 I33 I47 K50	A26-E30 WeakPolarHBondContact O-CG 3.19Å; A26-E30 PolarHBondContact O-N 2.88Å; V27-E30 WeakPolarHBondContact O-CB 3.02Å; V27-E30 PolarHBondContact O-N 3.15Å; E30-R32 PolarHBondContact O-N 3.04Å; E30-I33 VanDerWaalsContact O-CB 3.25Å; E30-I33 WeakPolarHBondContact O-CB 3.37Å; E30-I33 VanDerWaalsContact O-CG1 3.28Å; E30-I33 WeakPolarHBondContact O-CG1 3.5Å; E30-I33 PolarHBondContact O-N 3.37Å; E30-I47 HydrophobicContact CB-CD1 4.19Å; E30-I47 HydrophobicContact CB-CG1 4.14Å; E30-I47 HydrophobicContact CB-CG2 4.25Å; E30-K50 IonicContact OE1-NZ 3.74Å; E30-K50 PolarHBondContact OE1-NZ 2.86Å; E30-K50 IonicContact OE2-NZ 3.33Å; E30-K50 PolarHBondContact OE2-NZ 3.46Å
31	A	87.9	Confident	87	Confident	3 Å²	3	70.4 Å²	70.4	3%	0.025	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-58.8	-17.5	178.3	0	0	0	0	0	113.9	V27 L28 Q29 I33 F34 I47 I51	V27-A31 PolarHBondContact O-N 2.86Å; L28-A31 WeakPolarHBondContact O-CB 3.44Å; L28-A31 PolarHBondContact O-N 2.76Å; Q29-A31 PolarHBondContact O-N 3.36Å; A31-I33 PolarHBondContact O-N 2.97Å; A31-F34 HydrophobicContact CB-CD2 4.14Å; A31-F34 HydrophobicContact CB-CE2 3.8Å; A31-F34 HydrophobicContact CB-CZ 4.33Å; A31-F34 WeakPolarHBondContact O-CB 3.34Å; A31-F34 WeakPolarHBondContact O-CD2 3.3Å; A31-F34 WeakPolarHBondContact O-CG 3.43Å; A31-F34 PolarHBondContact O-N 2.69Å; A31-F34 VanDerWaalsContact O-N 3.08Å; A31-I47 HydrophobicContact CB-CG2 4.33Å; A31-I51 HydrophobicContact CB-CD1 4.37Å
32	R	85.5	Confident	87.5	Confident	185 Å²	185	72.5 Å²	72.5	70%	0.698	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-60.2	-24.2	171.5	-64.8	179.2	178.2	-177	-0	113.1	Q29 E30 F34 N35	Q29-R32 WeakPolarHBondContact O-CB 3.37Å; Q29-R32 WeakPolarHBondContact O-CG 3.45Å; Q29-R32 PolarHBondContact O-N 3.23Å; E30-R32 PolarHBondContact O-N 3.04Å; R32-F34 PolarHBondContact O-N 2.98Å; R32-F34 VanDerWaalsContact O-N 3.16Å; R32-N35 WeakPolarHBondContact O-CB 3.18Å; R32-N35 PolarHBondContact O-N 2.71Å
33	I	88.4	Confident	87.8	Confident	36 Å²	36	77.6 Å²	77.6	19%	0.185	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-59.2	-23.7	175.2	-67.4	169.1	0	0	0	111.6	E30 A31 N35 E36 I47	E30-I33 VanDerWaalsContact O-CB 3.25Å; E30-I33 WeakPolarHBondContact O-CB 3.37Å; E30-I33 VanDerWaalsContact O-CG1 3.28Å; E30-I33 WeakPolarHBondContact O-CG1 3.5Å; E30-I33 PolarHBondContact O-N 3.37Å; A31-I33 PolarHBondContact O-N 2.97Å; I33-N35 PolarHBondContact O-N 2.94Å; I33-N35 VanDerWaalsContact O-N 3.08Å; I33-E36 WeakPolarHBondContact O-CB 3.22Å; I33-E36 PolarHBondContact O-N 3.2Å; I33-I47 HydrophobicContact CB-CD1 3.96Å; I33-I47 HydrophobicContact CD1-CD1 3.87Å; I33-I47 HydrophobicContact CG1-CD1 4.44Å; I33-I47 HydrophobicContact CG2-CD1 4.24Å
34	F	90.6	Very high	88.1	Confident	1 Å²	1	71.2 Å²	71.2	0%	0.004	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-61.1	-18.9	175.7	-56.7	-23.8	0	0	0	113.4	A31 R32 C44 I47 L48 I51 A72 M73 L76	A31-F34 HydrophobicContact CB-CD2 4.14Å; A31-F34 HydrophobicContact CB-CE2 3.8Å; A31-F34 HydrophobicContact CB-CZ 4.33Å; A31-F34 WeakPolarHBondContact O-CB 3.34Å; A31-F34 WeakPolarHBondContact O-CD2 3.3Å; A31-F34 WeakPolarHBondContact O-CG 3.43Å; A31-F34 PolarHBondContact O-N 2.69Å; A31-F34 VanDerWaalsContact O-N 3.08Å; R32-F34 PolarHBondContact O-N 2.98Å; R32-F34 VanDerWaalsContact O-N 3.16Å; F34-C44 HydrophobicContact CD1-CB 4.02Å; F34-C44 HydrophobicContact CE1-CB 3.98Å; F34-I47 HydrophobicContact CE1-CB 3.91Å; F34-I47 HydrophobicContact CE1-CD1 4.26Å; F34-I47 HydrophobicContact CE1-CG2 3.94Å; F34-I47 HydrophobicContact CZ-CB 4.02Å; F34-I47 HydrophobicContact CZ-CG2 3.64Å; F34-L48 HydrophobicContact CE1-CD2 4.4Å; F34-L48 HydrophobicContact CE1-CG 4.26Å; F34-L48 HydrophobicContact CE2-CD2 3.93Å; F34-L48 HydrophobicContact CZ-CD2 3.56Å; F34-L48 HydrophobicContact CZ-CG 3.82Å; F34-I51 HydrophobicContact CE2-CD1 4.28Å; F34-I51 HydrophobicContact CZ-CD1 4.3Å; F34-A72 HydrophobicContact CB-CB 4.21Å; F34-A72 WeakPolarHBondContact CB-O 3.46Å; F34-A72 HydrophobicContact CD2-CB 3.95Å; F34-M73 HydrophobicContact CD2-CB 4.31Å; F34-M73 HydrophobicContact CE2-CB 4.41Å; F34-L76 HydrophobicContact CB-CD1 4.5Å; F34-L76 HydrophobicContact CB-CD2 3.96Å; F34-L76 HydrophobicContact CB-CG 4.25Å; F34-L76 HydrophobicContact CD1-CD1 3.79Å; F34-L76 HydrophobicContact CD1-CD2 3.93Å; F34-L76 HydrophobicContact CD1-CG 4.3Å; F34-L76 HydrophobicContact CD2-CD1 4.29Å; F34-L76 HydrophobicContact CE1-CD1 3.99Å; F34-L76 HydrophobicContact CE2-CD1 4.48Å; F34-L76 HydrophobicContact CG-CD1 3.95Å; F34-L76 HydrophobicContact CG-CD2 4.13Å; F34-L76 HydrophobicContact CG-CG 4.23Å; F34-L76 HydrophobicContact CZ-CD1 4.34Å
35	N	85.9	Confident	88.3	Confident	67 Å²	67	70.5 Å²	70.5	36%	0.358	35%	0.349	S	S	.	.	G	3₁₀ helix	trans	-89.8	-6.2	177.8	-63	-49.9	0	0	0	114.2	R32 I33 R75	R32-N35 WeakPolarHBondContact O-CB 3.18Å; R32-N35 PolarHBondContact O-N 2.71Å; I33-N35 PolarHBondContact O-N 2.94Å; I33-N35 VanDerWaalsContact O-N 3.08Å; N35-R75 WeakPolarHBondContact OD1-CD 3.28Å; N35-R75 PolarHBondContact OD1-NE 3.28Å
36	E	86.6	Confident	88.5	Confident	93 Å²	93	71.6 Å²	71.6	44%	0.435	35%	0.347	S	S	.	.			trans	-67.7	141.7	179.3	-69.9	-178.6	178.2	0	0	112.1	I33 P38	I33-E36 WeakPolarHBondContact O-CB 3.22Å; I33-E36 PolarHBondContact O-N 3.2Å; E36-P38 CarbonylContact O-C 3.58Å
37	T	82.6	Confident	88.6	Confident	123 Å²	123	70 Å²	70	76%	0.755	33%	0.333	S	S	*	.	S	Bend	trans	-122.5	118.4	173.7	-52.6	0	0	0	0	108.6
38	P	83.3	Confident	88.8	Confident	113 Å²	113	70 Å²	70	73%	0.734	33%	0.333	S	S	*	.	S	Bend	cis	-79.2	147.4	5	32.7	-35.2	0	0	0	113.9	E36 N40	E36-P38 CarbonylContact O-C 3.58Å; P38-N40 PolarHBondContact O-N 3.18Å
39	I	88.6	Confident	89	Confident	34 Å²	34	70.8 Å²	70.8	17%	0.174	34%	0.339	C	S	.	.			trans	-64.8	130.2	177.6	-61.7	170.9	0	0	0	110	P41 R75 L76 Q78 L84	I39-P41 WeakPolarHBondContact O-CD 3.42Å; I39-R75 WeakPolarHBondContact CD1-O 3.22Å; I39-L76 HydrophobicContact CG2-CD2 3.97Å; I39-Q78 HydrophobicContact CD1-CB 4Å; I39-L84 HydrophobicContact CG2-CD2 4.31Å
40	N	89.6	Confident	89.2	Confident	71 Å²	71	65.8 Å²	65.8	38%	0.38	32%	0.316	S	S	.	.			trans	-98.2	104.8	172.8	-173.8	-33.2	0	0	0	110.9	P38 R42 R43 C44	P38-N40 PolarHBondContact O-N 3.18Å; N40-R42 VanDerWaalsContact C-N 3.33Å; N40-R42 PolarHBondContact O-N 3.19Å; N40-R42 PolarHBondContact OD1-N 2.96Å; N40-R43 HydrophobicContact CB-CB 4.31Å; N40-R43 PolarHBondContact O-N 3.45Å; N40-R43 PolarHBondContact OD1-N 3.4Å; N40-C44 PolarHBondContact O-N 3.32Å; N40-C44 VanDerWaalsContact O-N 3.11Å; N40-C44 PolarHBondContact O-SG 2.98Å
41	P	89.4	Confident	89.3	Confident	33 Å²	33	62.8 Å²	62.8	21%	0.214	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-36.6	-171.7	-24.5	35.3	0	0	0	114	I39 C44 L45 D81 L84	I39-P41 WeakPolarHBondContact O-CD 3.42Å; P41-C44 PolarHBondContact O-N 3.36Å; P41-L45 VanDerWaalsContact O-CB 3.25Å; P41-L45 WeakPolarHBondContact O-CB 3.25Å; P41-L45 WeakPolarHBondContact O-CD1 3.49Å; P41-L45 WeakPolarHBondContact O-CG 3.3Å; P41-L45 PolarHBondContact O-N 2.92Å; P41-D81 HydrophobicContact CB-CB 3.85Å; P41-D81 HydrophobicContact CG-CB 4Å; P41-L84 HydrophobicContact CB-CB 4.41Å; P41-L84 HydrophobicContact CB-CD2 4.09Å
42	R	89.9	Confident	89.4	Confident	216 Å²	216	63.4 Å²	63.4	82%	0.815	30%	0.304	S	S	*	.	H	α-helix	trans	-66.9	-42.2	-178.1	-69.3	-175.6	-179.2	174.8	1.2	112.2	N40 H46	N40-R42 VanDerWaalsContact C-N 3.33Å; N40-R42 PolarHBondContact O-N 3.19Å; N40-R42 PolarHBondContact OD1-N 2.96Å; R42-H46 PolarHBondContact O-N 3.03Å
43	R	90	Very high	89.7	Confident	145 Å²	145	56.9 Å²	56.9	55%	0.547	28%	0.28	S	S	.	.	H	α-helix	trans	-67	-46.3	176.7	-80.1	-175.5	148.4	-166.6	-7	111	N40 L45 H46 I47	N40-R43 HydrophobicContact CB-CB 4.31Å; N40-R43 PolarHBondContact O-N 3.45Å; N40-R43 PolarHBondContact OD1-N 3.4Å; R43-L45 VanDerWaalsContact C-N 3.32Å; R43-L45 PolarHBondContact O-N 3.48Å; R43-H46 PolarHBondContact O-N 3.29Å; R43-H46 VanDerWaalsContact O-N 3.16Å; R43-I47 WeakPolarHBondContact O-CG1 2.96Å; R43-I47 PolarHBondContact O-N 3.37Å; R43-I47 VanDerWaalsContact O-N 3.12Å
44	C	92.2	Very high	89.7	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.9	-41.3	179.4	-59.7	0	0	0	0	111.8	F34 N40 P41 H46 I47 L48 L76 L84	F34-C44 HydrophobicContact CD1-CB 4.02Å; F34-C44 HydrophobicContact CE1-CB 3.98Å; N40-C44 PolarHBondContact O-N 3.32Å; N40-C44 VanDerWaalsContact O-N 3.11Å; N40-C44 PolarHBondContact O-SG 2.98Å; P41-C44 PolarHBondContact O-N 3.36Å; C44-H46 VanDerWaalsContact C-N 3.34Å; C44-H46 PolarHBondContact O-N 3.48Å; C44-I47 PolarHBondContact O-N 3.32Å; C44-L48 WeakPolarHBondContact O-CG 3.25Å; C44-L48 PolarHBondContact O-N 3.19Å; C44-L76 HydrophobicContact CB-CD1 4.29Å; C44-L76 HydrophobicContact CB-CD2 3.93Å; C44-L84 HydrophobicContact CB-CD1 3.67Å
45	L	92.3	Very high	89.6	Confident	30 Å²	30	56.9 Å²	56.9	16%	0.157	28%	0.28	C	S	.	.	H	α-helix	trans	-56.8	-44.9	173.7	-83.2	170.4	0	0	0	112.7	P41 R43 I47 L48 T49 T83 L84 M87	P41-L45 VanDerWaalsContact O-CB 3.25Å; P41-L45 WeakPolarHBondContact O-CB 3.25Å; P41-L45 WeakPolarHBondContact O-CD1 3.49Å; P41-L45 WeakPolarHBondContact O-CG 3.3Å; P41-L45 PolarHBondContact O-N 2.92Å; R43-L45 VanDerWaalsContact C-N 3.32Å; R43-L45 PolarHBondContact O-N 3.48Å; L45-I47 VanDerWaalsContact C-N 3.34Å; L45-I47 PolarHBondContact O-N 3.1Å; L45-L48 PolarHBondContact O-N 2.89Å; L45-T49 WeakPolarHBondContact O-CB 2.94Å; L45-T49 PolarHBondContact O-N 3.45Å; L45-T49 PolarHBondContact O-OG1 3.19Å; L45-T83 HydrophobicContact CD1-CG2 3.88Å; L45-T83 HydrophobicContact CD2-CG2 3.95Å; L45-L84 HydrophobicContact CD2-CB 4.3Å; L45-L84 HydrophobicContact CD2-CD1 4.2Å; L45-L84 HydrophobicContact CG-CB 4.2Å; L45-L84 HydrophobicContact CG-CD1 3.96Å; L45-M87 HydrophobicContact CD2-CB 3.76Å; L45-M87 HydrophobicContact CD2-CG 3.34Å
46	H	91.9	Very high	89.7	Confident	92 Å²	92	59 Å²	59	43%	0.426	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-42.8	179.9	-171.9	63.7	0	0	0	111	F19 R42 R43 C44 T49 K50	F19-H46 AromaticContact CE1-CE1 3.55Å; F19-H46 AromaticContact CZ-CE1 3.99Å; R42-H46 PolarHBondContact O-N 3.03Å; R43-H46 PolarHBondContact O-N 3.29Å; R43-H46 VanDerWaalsContact O-N 3.16Å; C44-H46 VanDerWaalsContact C-N 3.34Å; C44-H46 PolarHBondContact O-N 3.48Å; H46-T49 WeakPolarHBondContact O-CB 3.44Å; H46-T49 PolarHBondContact O-N 3.39Å; H46-K50 WeakPolarHBondContact NE2-CE 3.39Å; H46-K50 WeakPolarHBondContact O-CG 3.38Å; H46-K50 PolarHBondContact O-N 3.22Å
47	I	91.5	Very high	89.8	Confident	4 Å²	4	60.6 Å²	60.6	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-67.8	-45.3	179	-59.4	160.1	0	0	0	111.2	E30 A31 I33 F34 R43 C44 L45 T49 K50 I51	E30-I47 HydrophobicContact CB-CD1 4.19Å; E30-I47 HydrophobicContact CB-CG1 4.14Å; E30-I47 HydrophobicContact CB-CG2 4.25Å; A31-I47 HydrophobicContact CB-CG2 4.33Å; I33-I47 HydrophobicContact CB-CD1 3.96Å; I33-I47 HydrophobicContact CD1-CD1 3.87Å; I33-I47 HydrophobicContact CG1-CD1 4.44Å; I33-I47 HydrophobicContact CG2-CD1 4.24Å; F34-I47 HydrophobicContact CE1-CB 3.91Å; F34-I47 HydrophobicContact CE1-CD1 4.26Å; F34-I47 HydrophobicContact CE1-CG2 3.94Å; F34-I47 HydrophobicContact CZ-CB 4.02Å; F34-I47 HydrophobicContact CZ-CG2 3.64Å; R43-I47 WeakPolarHBondContact O-CG1 2.96Å; R43-I47 PolarHBondContact O-N 3.37Å; R43-I47 VanDerWaalsContact O-N 3.12Å; C44-I47 PolarHBondContact O-N 3.32Å; L45-I47 VanDerWaalsContact C-N 3.34Å; L45-I47 PolarHBondContact O-N 3.1Å; I47-T49 PolarHBondContact O-N 3.08Å; I47-K50 WeakPolarHBondContact O-CB 3.43Å; I47-K50 PolarHBondContact O-N 2.93Å; I47-K50 VanDerWaalsContact O-N 3.08Å; I47-I51 HydrophobicContact CG2-CD1 4.26Å; I47-I51 WeakPolarHBondContact O-CG1 3.42Å; I47-I51 PolarHBondContact O-N 2.93Å
48	L	92.8	Very high	89.9	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-59.3	-37.3	174.3	-69.2	175.6	0	0	0	111.8	F34 C44 L45 I51 I52 M73 L76 L84 M87 T91	F34-L48 HydrophobicContact CE1-CD2 4.4Å; F34-L48 HydrophobicContact CE1-CG 4.26Å; F34-L48 HydrophobicContact CE2-CD2 3.93Å; F34-L48 HydrophobicContact CZ-CD2 3.56Å; F34-L48 HydrophobicContact CZ-CG 3.82Å; C44-L48 WeakPolarHBondContact O-CG 3.25Å; C44-L48 PolarHBondContact O-N 3.19Å; L45-L48 PolarHBondContact O-N 2.89Å; L48-I51 PolarHBondContact O-N 3.12Å; L48-I52 WeakPolarHBondContact O-CG1 3.21Å; L48-I52 PolarHBondContact O-N 3.43Å; L48-M73 HydrophobicContact CD2-CG 4.15Å; L48-M73 HydrophobicContact CD2-SD 4.16Å; L48-L76 HydrophobicContact CD1-CD1 3.84Å; L48-L76 HydrophobicContact CD2-CD1 4.36Å; L48-L76 HydrophobicContact CG-CD1 4.31Å; L48-L84 HydrophobicContact CD1-CD1 3.97Å; L48-M87 HydrophobicContact CB-CE 4.33Å; L48-M87 HydrophobicContact CD1-CB 3.96Å; L48-T91 HydrophobicContact CD2-CG2 4.03Å
49	T	92.7	Very high	90	Very high	49 Å²	49	55 Å²	55	30%	0.301	27%	0.268	S	S	.	.	H	α-helix	trans	-62.5	-43.3	174.2	-56	0	0	0	0	111.6	F19 L45 H46 I47 I52 Y53	F19-T49 HydrophobicContact CE1-CG2 4.48Å; F19-T49 HydrophobicContact CE2-CG2 3.96Å; F19-T49 HydrophobicContact CZ-CG2 3.7Å; L45-T49 WeakPolarHBondContact O-CB 2.94Å; L45-T49 PolarHBondContact O-N 3.45Å; L45-T49 PolarHBondContact O-OG1 3.19Å; H46-T49 WeakPolarHBondContact O-CB 3.44Å; H46-T49 PolarHBondContact O-N 3.39Å; I47-T49 PolarHBondContact O-N 3.08Å; T49-I52 PolarHBondContact O-N 3.31Å; T49-Y53 VanDerWaalsContact O-CB 3.3Å; T49-Y53 WeakPolarHBondContact O-CB 3.34Å; T49-Y53 PolarHBondContact O-N 3.4Å
50	K	92.1	Very high	89.9	Confident	22 Å²	22	61.4 Å²	61.4	10%	0.096	30%	0.296	C	S	.	.	H	α-helix	trans	-60.1	-46.3	174.9	-68.7	-179.7	178.9	180	0	111.4	F19 L22 V27 E30 H46 I47 I52 Y53 L54	F19-K50 HydrophobicContact CD1-CG 3.91Å; F19-K50 HydrophobicContact CE1-CG 3.76Å; L22-K50 HydrophobicContact CD1-CB 3.79Å; L22-K50 HydrophobicContact CD1-CD 4.37Å; L22-K50 HydrophobicContact CD1-CG 3.76Å; L22-K50 HydrophobicContact CD2-CD 3.76Å; L22-K50 HydrophobicContact CD2-CG 4.03Å; V27-K50 HydrophobicContact CG1-CB 3.7Å; V27-K50 HydrophobicContact CG2-CB 4.04Å; V27-K50 HydrophobicContact CG2-CD 4.04Å; E30-K50 IonicContact OE1-NZ 3.74Å; E30-K50 PolarHBondContact OE1-NZ 2.86Å; E30-K50 IonicContact OE2-NZ 3.33Å; E30-K50 PolarHBondContact OE2-NZ 3.46Å; H46-K50 WeakPolarHBondContact NE2-CE 3.39Å; H46-K50 WeakPolarHBondContact O-CG 3.38Å; H46-K50 PolarHBondContact O-N 3.22Å; I47-K50 WeakPolarHBondContact O-CB 3.43Å; I47-K50 PolarHBondContact O-N 2.93Å; I47-K50 VanDerWaalsContact O-N 3.08Å; K50-I52 PolarHBondContact O-N 2.9Å; K50-Y53 WeakPolarHBondContact O-CB 3.5Å; K50-Y53 PolarHBondContact O-N 3.19Å; K50-L54 WeakPolarHBondContact O-CG 3.45Å; K50-L54 PolarHBondContact O-N 3.01Å
51	I	90.7	Very high	89.8	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-50.1	178.7	-66.5	169.9	0	0	0	111	V27 A31 F34 I47 L48 Y53 L54 L55 F61 M95	V27-I51 HydrophobicContact CG1-CG1 3.61Å; A31-I51 HydrophobicContact CB-CD1 4.37Å; F34-I51 HydrophobicContact CE2-CD1 4.28Å; F34-I51 HydrophobicContact CZ-CD1 4.3Å; I47-I51 HydrophobicContact CG2-CD1 4.26Å; I47-I51 WeakPolarHBondContact O-CG1 3.42Å; I47-I51 PolarHBondContact O-N 2.93Å; L48-I51 PolarHBondContact O-N 3.12Å; I51-Y53 VanDerWaalsContact C-N 3.3Å; I51-Y53 PolarHBondContact O-N 3.24Å; I51-L54 PolarHBondContact O-N 3.18Å; I51-L55 HydrophobicContact CG2-CD1 4.2Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 3.1Å; I51-L55 VanDerWaalsContact O-N 3.07Å; I51-F61 HydrophobicContact CG2-CE1 4.43Å; I51-F61 HydrophobicContact CG2-CZ 4.34Å; I51-M95 HydrophobicContact CG2-SD 4.22Å
52	I	90.8	Very high	89.8	Confident	16 Å²	16	58.8 Å²	58.8	8%	0.082	29%	0.288	C	S	.	.	H	α-helix	trans	-63.6	-37.5	178.2	-67.9	172	0	0	0	111.3	L48 T49 K50 L55 N56 M87 L90	L48-I52 WeakPolarHBondContact O-CG1 3.21Å; L48-I52 PolarHBondContact O-N 3.43Å; T49-I52 PolarHBondContact O-N 3.31Å; K50-I52 PolarHBondContact O-N 2.9Å; I52-L55 PolarHBondContact O-N 3.27Å; I52-N56 WeakPolarHBondContact CG2-ND2 3.39Å; I52-N56 WeakPolarHBondContact O-CB 3.37Å; I52-N56 PolarHBondContact O-N 3.32Å; I52-N56 PolarHBondContact O-ND2 3.2Å; I52-M87 HydrophobicContact CD1-CE 3.68Å; I52-L90 HydrophobicContact CD1-CB 4.29Å; I52-L90 HydrophobicContact CD1-CD2 3.75Å; I52-L90 HydrophobicContact CD1-CG 3.83Å
53	Y	91.1	Very high	89.8	Confident	48 Å²	48	51.6 Å²	51.6	19%	0.188	27%	0.268	C	S	.	.	H	α-helix	trans	-60.9	-47.3	176.5	177.5	-95.5	0	0	0	111.4	N17 F19 L22 T49 K50 I51 L55 N56 Q57	N17-Y53 VanDerWaalsContact ND2-CE2 3.28Å; N17-Y53 WeakPolarHBondContact ND2-CE2 3.45Å; N17-Y53 PolarHBondContact ND2-OH 3.26Å; N17-Y53 VanDerWaalsContact ND2-OH 3.16Å; F19-Y53 HydrophobicContact CB-CD1 3.66Å; F19-Y53 HydrophobicContact CB-CD2 4.17Å; F19-Y53 HydrophobicContact CB-CE1 3.66Å; F19-Y53 HydrophobicContact CB-CE2 4.21Å; F19-Y53 HydrophobicContact CB-CG 3.9Å; F19-Y53 HydrophobicContact CG-CG 4.41Å; F19-Y53 WeakPolarHBondContact O-CE1 3.38Å; L22-Y53 HydrophobicContact CD1-CD1 3.87Å; L22-Y53 HydrophobicContact CD1-CE1 4.49Å; T49-Y53 VanDerWaalsContact O-CB 3.3Å; T49-Y53 WeakPolarHBondContact O-CB 3.34Å; T49-Y53 PolarHBondContact O-N 3.4Å; K50-Y53 WeakPolarHBondContact O-CB 3.5Å; K50-Y53 PolarHBondContact O-N 3.19Å; I51-Y53 VanDerWaalsContact C-N 3.3Å; I51-Y53 PolarHBondContact O-N 3.24Å; Y53-L55 PolarHBondContact O-N 3.48Å; Y53-N56 PolarHBondContact O-N 3.39Å; Y53-Q57 HydrophobicContact CD1-CG 4.22Å; Y53-Q57 HydrophobicContact CE1-CG 3.76Å; Y53-Q57 HydrophobicContact CE2-CG 4.18Å; Y53-Q57 WeakPolarHBondContact O-CG 3.41Å; Y53-Q57 PolarHBondContact O-N 3.45Å
54	L	90.3	Very high	89.9	Confident	6 Å²	6	49.5 Å²	49.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-60.7	-44.3	177.1	-66.7	-176.9	0	0	0	111.9	L22 K24 V27 K50 I51 N56 Q57 G58 E59 F61	L22-L54 HydrophobicContact CB-CD2 3.7Å; L22-L54 HydrophobicContact CB-CG 4.48Å; L22-L54 HydrophobicContact CD1-CD2 4.22Å; L22-L54 HydrophobicContact CD1-CG 4.47Å; K24-L54 HydrophobicContact CB-CD1 4.12Å; V27-L54 HydrophobicContact CB-CD1 4.02Å; V27-L54 HydrophobicContact CG1-CD1 4.31Å; V27-L54 HydrophobicContact CG2-CD1 3.9Å; K50-L54 WeakPolarHBondContact O-CG 3.45Å; K50-L54 PolarHBondContact O-N 3.01Å; I51-L54 PolarHBondContact O-N 3.18Å; L54-N56 VanDerWaalsContact C-N 3.33Å; L54-N56 PolarHBondContact O-N 2.97Å; L54-Q57 PolarHBondContact O-N 3.05Å; L54-G58 PolarHBondContact O-N 3.06Å; L54-E59 HydrophobicContact CB-CB 4.37Å; L54-E59 WeakPolarHBondContact CD2-OE2 3.44Å; L54-E59 WeakPolarHBondContact O-CB 3.36Å; L54-E59 PolarHBondContact O-N 2.71Å; L54-E59 VanDerWaalsContact O-N 3.1Å; L54-F61 HydrophobicContact CB-CE2 3.95Å; L54-F61 HydrophobicContact CB-CZ 3.98Å; L54-F61 HydrophobicContact CD1-CZ 4.17Å
55	L	88.3	Confident	89.7	Confident	31 Å²	31	52.8 Å²	52.8	16%	0.162	29%	0.287	C	S	.	.	H	α-helix	trans	-58.6	-43.1	175	-72.4	169.4	0	0	0	112.1	I51 I52 Y53 Q57 G58 F61 E94 M95 I98	I51-L55 HydrophobicContact CG2-CD1 4.2Å; I51-L55 WeakPolarHBondContact O-CG 3.46Å; I51-L55 PolarHBondContact O-N 3.1Å; I51-L55 VanDerWaalsContact O-N 3.07Å; I52-L55 PolarHBondContact O-N 3.27Å; Y53-L55 PolarHBondContact O-N 3.48Å; L55-Q57 VanDerWaalsContact C-N 3.34Å; L55-Q57 PolarHBondContact O-N 3.15Å; L55-G58 PolarHBondContact O-N 2.92Å; L55-G58 VanDerWaalsContact O-N 3.09Å; L55-F61 HydrophobicContact CD2-CD2 3.37Å; L55-F61 HydrophobicContact CD2-CE2 3.63Å; L55-F61 HydrophobicContact CD2-CG 4.19Å; L55-F61 HydrophobicContact CG-CD2 4.04Å; L55-F61 HydrophobicContact CG-CE2 3.76Å; L55-F61 HydrophobicContact CG-CZ 4.44Å; L55-E94 HydrophobicContact CD1-CB 4.11Å; L55-M95 HydrophobicContact CD1-CG 4.05Å; L55-I98 HydrophobicContact CD2-CD1 3.98Å
56	N	88.2	Confident	89.6	Confident	112 Å²	112	51.4 Å²	51.4	60%	0.599	28%	0.28	S	S	*	.	H	α-helix	trans	-72.3	-22.6	179.5	-75.7	-29.2	0	0	0	114.1	I52 Y53 L54 G58	I52-N56 WeakPolarHBondContact CG2-ND2 3.39Å; I52-N56 WeakPolarHBondContact O-CB 3.37Å; I52-N56 PolarHBondContact O-N 3.32Å; I52-N56 PolarHBondContact O-ND2 3.2Å; Y53-N56 PolarHBondContact O-N 3.39Å; L54-N56 VanDerWaalsContact C-N 3.33Å; L54-N56 PolarHBondContact O-N 2.97Å; N56-G58 PolarHBondContact O-N 3.31Å
57	Q	87.8	Confident	89.5	Confident	126 Å²	126	47.8 Å²	47.8	59%	0.589	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-3.7	170.2	-66.8	-57.8	-49.4	0	0	112.5	Y53 L54 L55	Y53-Q57 HydrophobicContact CD1-CG 4.22Å; Y53-Q57 HydrophobicContact CE1-CG 3.76Å; Y53-Q57 HydrophobicContact CE2-CG 4.18Å; Y53-Q57 WeakPolarHBondContact O-CG 3.41Å; Y53-Q57 PolarHBondContact O-N 3.45Å; L54-Q57 PolarHBondContact O-N 3.05Å; L55-Q57 VanDerWaalsContact C-N 3.34Å; L55-Q57 PolarHBondContact O-N 3.15Å
58	G	83.9	Confident	89.4	Confident	49 Å²	49	54 Å²	54	51%	0.505	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	85	18	-178.9	0	0	0	0	0	113.9	L54 L55 N56	L54-G58 PolarHBondContact O-N 3.06Å; L55-G58 PolarHBondContact O-N 2.92Å; L55-G58 VanDerWaalsContact O-N 3.09Å; N56-G58 PolarHBondContact O-N 3.31Å
59	E	87.1	Confident	89.2	Confident	69 Å²	69	54.2 Å²	54.2	32%	0.322	30%	0.295	S	S	.	.	P	Polyproline II helix	trans	-73.1	132.5	176.8	-165	167.5	-168.9	0	0	111.5	K24 L54	K24-E59 WeakPolarHBondContact CB-OE1 3.42Å; K24-E59 HydrophobicContact CD-CG 4.36Å; L54-E59 HydrophobicContact CB-CB 4.37Å; L54-E59 WeakPolarHBondContact CD2-OE2 3.44Å; L54-E59 WeakPolarHBondContact O-CB 3.36Å; L54-E59 PolarHBondContact O-N 2.71Å; L54-E59 VanDerWaalsContact O-N 3.1Å
60	H	84.5	Confident	89.1	Confident	168 Å²	168	51.9 Å²	51.9	78%	0.778	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-86.2	117.1	-177	-70.1	-69.3	0	0	0	112.1	K24	K24-H60 PolarHBondContact NZ-O 3.44Å
61	F	88.8	Confident	88.9	Confident	15 Å²	15	54.5 Å²	54.5	7%	0.066	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-87.8	129.2	168.6	-71.7	-109.8	0	0	0	108.8	K24 L28 I51 L54 L55 A66	K24-F61 HydrophobicContact CD-CD1 4.4Å; K24-F61 HydrophobicContact CD-CE1 4.47Å; K24-F61 HydrophobicContact CD-CG 4.45Å; K24-F61 HydrophobicContact CG-CE1 4.22Å; K24-F61 HydrophobicContact CG-CZ 4.32Å; L28-F61 HydrophobicContact CD1-CD1 4.41Å; L28-F61 HydrophobicContact CD1-CE1 4.42Å; L28-F61 HydrophobicContact CD2-CD1 4.08Å; L28-F61 HydrophobicContact CD2-CE1 3.81Å; L28-F61 HydrophobicContact CG-CE1 4.17Å; I51-F61 HydrophobicContact CG2-CE1 4.43Å; I51-F61 HydrophobicContact CG2-CZ 4.34Å; L54-F61 HydrophobicContact CB-CE2 3.95Å; L54-F61 HydrophobicContact CB-CZ 3.98Å; L54-F61 HydrophobicContact CD1-CZ 4.17Å; L55-F61 HydrophobicContact CD2-CD2 3.37Å; L55-F61 HydrophobicContact CD2-CE2 3.63Å; L55-F61 HydrophobicContact CD2-CG 4.19Å; L55-F61 HydrophobicContact CG-CD2 4.04Å; L55-F61 HydrophobicContact CG-CE2 3.76Å; L55-F61 HydrophobicContact CG-CZ 4.44Å; F61-A66 HydrophobicContact CB-CB 4.24Å
62	G	89.6	Confident	88.9	Confident	34 Å²	34	55 Å²	55	35%	0.351	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-66.7	150.7	170.9	0	0	0	0	0	110.8	T64 E65 A66	G62-T64 VanDerWaalsContact C-N 3.27Å; G62-T64 PolarHBondContact O-N 3.48Å; G62-E65 PolarHBondContact N-OE2 3.23Å; G62-E65 WeakPolarHBondContact O-CB 3.49Å; G62-E65 PolarHBondContact O-N 3.49Å; G62-E65 VanDerWaalsContact O-N 3.08Å; G62-A66 WeakPolarHBondContact O-CB 3.39Å; G62-A66 PolarHBondContact O-N 3.47Å
63	T	90.5	Very high	88.8	Confident	66 Å²	66	54.3 Å²	54.3	41%	0.405	29%	0.293	S	S	.	.	H	α-helix	trans	-53.1	-43.2	-178.8	-55.4	0	0	0	0	112.6	T67 I98 E100	T63-T67 WeakPolarHBondContact O-CB 3.45Å; T63-T67 PolarHBondContact O-N 2.96Å; T63-T67 PolarHBondContact O-OG1 3.44Å; T63-I98 WeakPolarHBondContact CA-O 3.41Å; T63-I98 WeakPolarHBondContact CG2-O 3.41Å; T63-E100 HydrophobicContact CG2-CG 3.74Å
64	T	90.4	Very high	88.7	Confident	100 Å²	100	53.6 Å²	53.6	61%	0.613	29%	0.294	S	S	*	.	H	α-helix	trans	-65.2	-46.3	177.1	-45.4	0	0	0	0	112	G62 A66 T67 E68	G62-T64 VanDerWaalsContact C-N 3.27Å; G62-T64 PolarHBondContact O-N 3.48Å; T64-A66 VanDerWaalsContact C-N 3.34Å; T64-A66 PolarHBondContact O-N 2.94Å; T64-T67 PolarHBondContact O-N 3.32Å; T64-E68 WeakPolarHBondContact O-CG 3.48Å; T64-E68 PolarHBondContact O-N 3.44Å
65	E	89.6	Confident	88.6	Confident	70 Å²	70	58.9 Å²	58.9	33%	0.327	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-44.5	178.8	-60.7	176.6	151.1	0	0	111.3	K24 L28 G62 A69	K24-E65 IonicContact NZ-OE1 3.89Å; K24-E65 IonicContact NZ-OE2 3.97Å; K24-E65 PolarHBondContact NZ-OE2 3.21Å; L28-E65 HydrophobicContact CD1-CB 3.91Å; L28-E65 HydrophobicContact CD1-CG 4.22Å; G62-E65 PolarHBondContact N-OE2 3.23Å; G62-E65 WeakPolarHBondContact O-CB 3.49Å; G62-E65 PolarHBondContact O-N 3.49Å; G62-E65 VanDerWaalsContact O-N 3.08Å; E65-A69 WeakPolarHBondContact O-CB 3.49Å; E65-A69 PolarHBondContact O-N 2.97Å; E65-A69 VanDerWaalsContact O-N 3.09Å
66	A	88.6	Confident	88.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.008	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-44.4	177.5	0	0	0	0	0	111	F61 G62 T64 A69 F70 M95 I98 S99	F61-A66 HydrophobicContact CB-CB 4.24Å; G62-A66 WeakPolarHBondContact O-CB 3.39Å; G62-A66 PolarHBondContact O-N 3.47Å; T64-A66 VanDerWaalsContact C-N 3.34Å; T64-A66 PolarHBondContact O-N 2.94Å; A66-A69 PolarHBondContact O-N 3.38Å; A66-F70 WeakPolarHBondContact O-CB 3.42Å; A66-F70 PolarHBondContact O-N 3.2Å; A66-M95 HydrophobicContact CB-CE 3.96Å; A66-M95 WeakPolarHBondContact O-CE 3.45Å; A66-I98 HydrophobicContact CB-CB 4.15Å; A66-I98 HydrophobicContact CB-CG2 3.71Å; A66-S99 PolarHBondContact O-OG 3.45Å
67	T	90.6	Very high	88.8	Confident	15 Å²	15	53 Å²	53	9%	0.092	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-43.2	179.5	-55.5	0	0	0	0	112	T63 T64 F70 F71 S99 E100	T63-T67 WeakPolarHBondContact O-CB 3.45Å; T63-T67 PolarHBondContact O-N 2.96Å; T63-T67 PolarHBondContact O-OG1 3.44Å; T64-T67 PolarHBondContact O-N 3.32Å; T67-F70 PolarHBondContact O-N 2.66Å; T67-F71 HydrophobicContact CG2-CD2 4.1Å; T67-F71 HydrophobicContact CG2-CE2 3.73Å; T67-F71 HydrophobicContact CG2-CZ 3.98Å; T67-F71 WeakPolarHBondContact O-CG 3.36Å; T67-F71 PolarHBondContact O-N 3.14Å; T67-S99 WeakPolarHBondContact OG1-CA 3.23Å; T67-E100 HydrophobicContact CG2-CB 4.42Å; T67-E100 PolarHBondContact OG1-N 2.71Å
68	E	89.1	Confident	88.7	Confident	134 Å²	134	53.6 Å²	53.6	63%	0.626	28%	0.284	S	S	*	.	H	α-helix	trans	-62.5	-47	176.2	-74.4	-177.2	-174.6	0	0	112.2	T64 F70 F71 A72	T64-E68 WeakPolarHBondContact O-CG 3.48Å; T64-E68 PolarHBondContact O-N 3.44Å; E68-F70 VanDerWaalsContact C-N 3.32Å; E68-F70 PolarHBondContact O-N 3.39Å; E68-F71 PolarHBondContact O-N 2.96Å; E68-A72 PolarHBondContact O-N 3.24Å
69	A	88.7	Confident	88.9	Confident	7 Å²	7	52.1 Å²	52.1	6%	0.058	27%	0.266	C	S	.	.	H	α-helix	trans	-64.6	-37.9	176.8	0	0	0	0	0	111.9	L28 E65 A66 A72 M73 M95	L28-A69 HydrophobicContact CD2-CB 3.85Å; E65-A69 WeakPolarHBondContact O-CB 3.49Å; E65-A69 PolarHBondContact O-N 2.97Å; E65-A69 VanDerWaalsContact O-N 3.09Å; A66-A69 PolarHBondContact O-N 3.38Å; A69-A72 PolarHBondContact O-N 3.21Å; A69-M73 WeakPolarHBondContact O-CB 3.1Å; A69-M73 PolarHBondContact O-N 3.2Å; A69-M95 HydrophobicContact CB-CE 4Å
70	F	89.8	Confident	88.9	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-63.1	-46.6	175.4	-175.5	-89.1	0	0	0	111.5	A66 T67 E68 M73 T74 I92 M95 V102 I104 V105	A66-F70 WeakPolarHBondContact O-CB 3.42Å; A66-F70 PolarHBondContact O-N 3.2Å; T67-F70 PolarHBondContact O-N 2.66Å; E68-F70 VanDerWaalsContact C-N 3.32Å; E68-F70 PolarHBondContact O-N 3.39Å; F70-M73 HydrophobicContact CD2-CE 3.59Å; F70-M73 HydrophobicContact CE2-CE 3.68Å; F70-M73 HydrophobicContact CG-CE 4.24Å; F70-M73 HydrophobicContact CZ-CE 4.37Å; F70-M73 WeakPolarHBondContact O-CB 3.27Å; F70-M73 PolarHBondContact O-N 3.27Å; F70-T74 HydrophobicContact CE1-CG2 4.43Å; F70-T74 WeakPolarHBondContact O-CG2 3.47Å; F70-T74 PolarHBondContact O-N 3.46Å; F70-I92 HydrophobicContact CE2-CB 4.23Å; F70-I92 HydrophobicContact CE2-CG1 3.85Å; F70-I92 HydrophobicContact CE2-CG2 4.16Å; F70-I92 HydrophobicContact CZ-CG1 4.26Å; F70-I92 HydrophobicContact CZ-CG2 4.47Å; F70-M95 HydrophobicContact CB-CE 4.27Å; F70-M95 HydrophobicContact CD2-CB 4.17Å; F70-V102 HydrophobicContact CE1-CB 4.41Å; F70-V102 HydrophobicContact CE1-CG1 4.07Å; F70-V102 HydrophobicContact CE2-CG1 3.86Å; F70-V102 HydrophobicContact CZ-CB 4.25Å; F70-V102 HydrophobicContact CZ-CG1 3.45Å; F70-V102 VanDerWaalsContact CZ-CG1 3.45Å; F70-I104 HydrophobicContact CE1-CG2 3.88Å; F70-V105 HydrophobicContact CE1-CG1 3.98Å; F70-V105 HydrophobicContact CZ-CG1 3.91Å; F70-V105 HydrophobicContact CZ-CG2 3.98Å
71	F	89.5	Confident	89.1	Confident	76 Å²	76	49.9 Å²	49.9	33%	0.333	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-41.8	176	-74.9	-20.6	0	0	0	112.8	T67 E68 M73 T74 D101 I104	T67-F71 HydrophobicContact CG2-CD2 4.1Å; T67-F71 HydrophobicContact CG2-CE2 3.73Å; T67-F71 HydrophobicContact CG2-CZ 3.98Å; T67-F71 WeakPolarHBondContact O-CG 3.36Å; T67-F71 PolarHBondContact O-N 3.14Å; E68-F71 PolarHBondContact O-N 2.96Å; F71-M73 VanDerWaalsContact C-N 3.29Å; F71-M73 PolarHBondContact O-N 3.33Å; F71-T74 WeakPolarHBondContact O-CB 3.49Å; F71-T74 PolarHBondContact O-N 3.23Å; F71-T74 VanDerWaalsContact O-N 3.15Å; F71-T74 PolarHBondContact O-OG1 3.31Å; F71-D101 HydrophobicContact CE1-CB 4.16Å; F71-D101 HydrophobicContact CZ-CB 3.78Å; F71-I104 HydrophobicContact CD1-CD1 4.19Å; F71-I104 HydrophobicContact CD1-CG2 3.95Å; F71-I104 HydrophobicContact CE1-CB 4.35Å; F71-I104 HydrophobicContact CE1-CD1 4.05Å; F71-I104 HydrophobicContact CE1-CG2 3.79Å
72	A	88.9	Confident	89.2	Confident	12 Å²	12	53.6 Å²	53.6	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-59.6	-41.3	174.9	0	0	0	0	0	111.6	F34 E68 A69 T74 R75	F34-A72 HydrophobicContact CB-CB 4.21Å; F34-A72 WeakPolarHBondContact CB-O 3.46Å; F34-A72 HydrophobicContact CD2-CB 3.95Å; E68-A72 PolarHBondContact O-N 3.24Å; A69-A72 PolarHBondContact O-N 3.21Å; A72-T74 VanDerWaalsContact C-N 3.26Å; A72-T74 PolarHBondContact O-N 3.45Å; A72-R75 PolarHBondContact O-N 3.42Å
73	M	90.6	Very high	89.3	Confident	1 Å²	1	56 Å²	56	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-61.9	-28.8	177.3	176.1	-169.4	61.9	0	0	113	F34 L48 A69 F70 F71 R75 L76 C88 T91 I92	F34-M73 HydrophobicContact CD2-CB 4.31Å; F34-M73 HydrophobicContact CE2-CB 4.41Å; L48-M73 HydrophobicContact CD2-CG 4.15Å; L48-M73 HydrophobicContact CD2-SD 4.16Å; A69-M73 WeakPolarHBondContact O-CB 3.1Å; A69-M73 PolarHBondContact O-N 3.2Å; F70-M73 HydrophobicContact CD2-CE 3.59Å; F70-M73 HydrophobicContact CE2-CE 3.68Å; F70-M73 HydrophobicContact CG-CE 4.24Å; F70-M73 HydrophobicContact CZ-CE 4.37Å; F70-M73 WeakPolarHBondContact O-CB 3.27Å; F70-M73 PolarHBondContact O-N 3.27Å; F71-M73 VanDerWaalsContact C-N 3.29Å; F71-M73 PolarHBondContact O-N 3.33Å; M73-R75 PolarHBondContact O-N 3.35Å; M73-R75 VanDerWaalsContact O-N 3.09Å; M73-L76 HydrophobicContact CB-CD1 4.43Å; M73-L76 HydrophobicContact CG-CD1 4.03Å; M73-L76 WeakPolarHBondContact O-CB 3.48Å; M73-L76 VanDerWaalsContact O-CG 3.32Å; M73-L76 WeakPolarHBondContact O-CG 3.44Å; M73-L76 PolarHBondContact O-N 2.85Å; M73-C88 HydrophobicContact SD-CB 4.48Å; M73-T91 HydrophobicContact CE-CG2 4.42Å; M73-T91 WeakPolarHBondContact SD-CB 3.46Å; M73-T91 HydrophobicContact SD-CG2 3.51Å; M73-T91 VanDerWaalsContact SD-CG2 3.51Å; M73-I92 HydrophobicContact CE-CB 4.45Å; M73-I92 HydrophobicContact CE-CD1 4.28Å; M73-I92 HydrophobicContact CE-CG1 3.35Å; M73-I92 HydrophobicContact SD-CG1 4.31Å
74	T	88.1	Confident	89.4	Confident	34 Å²	34	52.8 Å²	52.8	21%	0.209	27%	0.268	C	S	.	.	H	α-helix	trans	-58.1	-28.4	-178.4	68.2	0	0	0	0	113.4	F70 F71 A72 L76 F77 I104 V105	F70-T74 HydrophobicContact CE1-CG2 4.43Å; F70-T74 WeakPolarHBondContact O-CG2 3.47Å; F70-T74 PolarHBondContact O-N 3.46Å; F71-T74 WeakPolarHBondContact O-CB 3.49Å; F71-T74 PolarHBondContact O-N 3.23Å; F71-T74 VanDerWaalsContact O-N 3.15Å; F71-T74 PolarHBondContact O-OG1 3.31Å; A72-T74 VanDerWaalsContact C-N 3.26Å; A72-T74 PolarHBondContact O-N 3.45Å; T74-L76 PolarHBondContact O-N 3.23Å; T74-F77 WeakPolarHBondContact O-CB 3.5Å; T74-F77 WeakPolarHBondContact O-CD2 3.39Å; T74-F77 PolarHBondContact O-N 3.46Å; T74-I104 HydrophobicContact CG2-CG2 3.95Å; T74-V105 HydrophobicContact CG2-CG1 3.58Å
75	R	88.3	Confident	89.4	Confident	117 Å²	117	48.6 Å²	48.6	44%	0.442	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-66.6	-24.7	176.1	-66.3	-167.2	-177.5	-143	-1.8	113.3	N35 I39 A72 M73 F77 Q78	N35-R75 WeakPolarHBondContact OD1-CD 3.28Å; N35-R75 PolarHBondContact OD1-NE 3.28Å; I39-R75 WeakPolarHBondContact CD1-O 3.22Å; A72-R75 PolarHBondContact O-N 3.42Å; M73-R75 PolarHBondContact O-N 3.35Å; M73-R75 VanDerWaalsContact O-N 3.09Å; R75-F77 PolarHBondContact O-N 3.42Å; R75-F77 VanDerWaalsContact O-N 3.15Å; R75-Q78 WeakPolarHBondContact O-CB 3.35Å; R75-Q78 WeakPolarHBondContact O-CG 3.29Å; R75-Q78 PolarHBondContact O-N 3.13Å
76	L	90.9	Very high	89.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-64.9	-18.8	179.9	-55.2	179.6	0	0	0	112.5	F34 I39 C44 L48 M73 T74 Q78 S79 L84	F34-L76 HydrophobicContact CB-CD1 4.5Å; F34-L76 HydrophobicContact CB-CD2 3.96Å; F34-L76 HydrophobicContact CB-CG 4.25Å; F34-L76 HydrophobicContact CD1-CD1 3.79Å; F34-L76 HydrophobicContact CD1-CD2 3.93Å; F34-L76 HydrophobicContact CD1-CG 4.3Å; F34-L76 HydrophobicContact CD2-CD1 4.29Å; F34-L76 HydrophobicContact CE1-CD1 3.99Å; F34-L76 HydrophobicContact CE2-CD1 4.48Å; F34-L76 HydrophobicContact CG-CD1 3.95Å; F34-L76 HydrophobicContact CG-CD2 4.13Å; F34-L76 HydrophobicContact CG-CG 4.23Å; F34-L76 HydrophobicContact CZ-CD1 4.34Å; I39-L76 HydrophobicContact CG2-CD2 3.97Å; C44-L76 HydrophobicContact CB-CD1 4.29Å; C44-L76 HydrophobicContact CB-CD2 3.93Å; L48-L76 HydrophobicContact CD1-CD1 3.84Å; L48-L76 HydrophobicContact CD2-CD1 4.36Å; L48-L76 HydrophobicContact CG-CD1 4.31Å; M73-L76 HydrophobicContact CB-CD1 4.43Å; M73-L76 HydrophobicContact CG-CD1 4.03Å; M73-L76 WeakPolarHBondContact O-CB 3.48Å; M73-L76 VanDerWaalsContact O-CG 3.32Å; M73-L76 WeakPolarHBondContact O-CG 3.44Å; M73-L76 PolarHBondContact O-N 2.85Å; T74-L76 PolarHBondContact O-N 3.23Å; L76-Q78 PolarHBondContact O-N 3.36Å; L76-Q78 VanDerWaalsContact O-N 3.14Å; L76-S79 PolarHBondContact O-N 3.46Å; L76-S79 VanDerWaalsContact O-N 3.08Å; L76-L84 HydrophobicContact CB-CD2 4.35Å; L76-L84 HydrophobicContact CD1-CD1 4.25Å
77	F	88.9	Confident	89.7	Confident	19 Å²	19	53.3 Å²	53.3	8%	0.083	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-65	-8.3	170.6	-77.9	-96	0	0	0	114.2	T74 R75 S79 R85 C88 Y89 I92 V105 L109	T74-F77 WeakPolarHBondContact O-CB 3.5Å; T74-F77 WeakPolarHBondContact O-CD2 3.39Å; T74-F77 PolarHBondContact O-N 3.46Å; R75-F77 PolarHBondContact O-N 3.42Å; R75-F77 VanDerWaalsContact O-N 3.15Å; F77-S79 VanDerWaalsContact C-N 3.34Å; F77-R85 VanDerWaalsContact CD1-NH1 3.28Å; F77-R85 VanDerWaalsContact O-CZ 3.24Å; F77-R85 PolarHBondContact O-NH1 3.33Å; F77-R85 PolarHBondContact O-NH2 2.97Å; F77-C88 HydrophobicContact CE2-CB 4.23Å; F77-C88 HydrophobicContact CZ-CB 4.42Å; F77-Y89 HydrophobicContact CE1-CD1 4.49Å; F77-Y89 AromaticContact CE1-CE1 3.87Å; F77-Y89 HydrophobicContact CE1-CE1 3.87Å; F77-Y89 HydrophobicContact CZ-CD1 4.39Å; F77-Y89 HydrophobicContact CZ-CE1 4.21Å; F77-I92 HydrophobicContact CE2-CD1 3.8Å; F77-I92 HydrophobicContact CZ-CD1 3.55Å; F77-V105 HydrophobicContact CE2-CG1 4.34Å; F77-L109 HydrophobicContact CE1-CD2 3.98Å; F77-L109 HydrophobicContact CZ-CD2 3.96Å
78	Q	86.9	Confident	89.8	Confident	139 Å²	139	52.6 Å²	52.6	65%	0.65	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-78.7	-18.6	171.6	-62.3	177.9	6.8	0	0	112.8	I39 R75 L76	I39-Q78 HydrophobicContact CD1-CB 4Å; R75-Q78 WeakPolarHBondContact O-CB 3.35Å; R75-Q78 WeakPolarHBondContact O-CG 3.29Å; R75-Q78 PolarHBondContact O-N 3.13Å; L76-Q78 PolarHBondContact O-N 3.36Å; L76-Q78 VanDerWaalsContact O-N 3.14Å
79	S	88.1	Confident	90	Very high	18 Å²	18	46.6 Å²	46.6	13%	0.126	23%	0.225	C	C	.	.			trans	-87.6	131	-178.2	-177.8	0	0	0	0	112.2	L76 F77 D81 R85	L76-S79 PolarHBondContact O-N 3.46Å; L76-S79 VanDerWaalsContact O-N 3.08Å; F77-S79 VanDerWaalsContact C-N 3.34Å; S79-D81 PolarHBondContact O-N 3.27Å; S79-D81 PolarHBondContact OG-N 2.87Å; S79-R85 PolarHBondContact O-NH2 2.99Å
80	N	85.6	Confident	90.1	Very high	132 Å²	132	49.5 Å²	49.5	71%	0.706	24%	0.239	S	C	*	.			trans	-80.8	10.2	176.8	-64	-24.2	0	0	0	113.5	Q82 Y120	N80-Q82 PolarHBondContact O-N 3.48Å; N80-Y120 PolarHBondContact O-OH 2.94Å
81	D	90.6	Very high	90.2	Very high	57 Å²	57	49.5 Å²	49.5	31%	0.305	24%	0.239	S	C	.	.			trans	-72.7	118.3	176.9	-175.4	-88	0	0	0	111.3	P41 S79 T83 L84 R85	P41-D81 HydrophobicContact CB-CB 3.85Å; P41-D81 HydrophobicContact CG-CB 4Å; S79-D81 PolarHBondContact O-N 3.27Å; S79-D81 PolarHBondContact OG-N 2.87Å; D81-T83 VanDerWaalsContact C-N 3.33Å; D81-T83 PolarHBondContact O-N 3.33Å; D81-T83 WeakPolarHBondContact OD1-CB 3.46Å; D81-T83 PolarHBondContact OD1-N 2.99Å; D81-T83 VanDerWaalsContact OD1-N 3.11Å; D81-L84 HydrophobicContact CB-CB 3.99Å; D81-L84 PolarHBondContact O-N 2.89Å; D81-L84 WeakPolarHBondContact OD1-CB 3.29Å; D81-L84 PolarHBondContact OD1-N 3.14Å; D81-R85 WeakPolarHBondContact O-CB 3.34Å; D81-R85 PolarHBondContact O-N 3.26Å
82	Q	90	Very high	90.3	Very high	93 Å²	93	45.9 Å²	45.9	44%	0.435	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-37.2	-175.3	-70.3	-179	8.8	0	0	113.3	N80 R86 Y120	N80-Q82 PolarHBondContact O-N 3.48Å; Q82-R86 WeakPolarHBondContact O-CG 3.44Å; Q82-R86 PolarHBondContact O-N 3.03Å; Q82-Y120 HydrophobicContact CB-CE1 4.17Å; Q82-Y120 HydrophobicContact CG-CE1 3.85Å; Q82-Y120 WeakPolarHBondContact CG-OH 3.15Å
83	T	91.3	Very high	90.3	Very high	84 Å²	84	49 Å²	49	52%	0.515	24%	0.235	S	C	.	.	H	α-helix	trans	-71.3	-45.1	-177.2	-51.7	0	0	0	0	109.9	L45 D81 R85 R86 M87	L45-T83 HydrophobicContact CD1-CG2 3.88Å; L45-T83 HydrophobicContact CD2-CG2 3.95Å; D81-T83 VanDerWaalsContact C-N 3.33Å; D81-T83 PolarHBondContact O-N 3.33Å; D81-T83 WeakPolarHBondContact OD1-CB 3.46Å; D81-T83 PolarHBondContact OD1-N 2.99Å; D81-T83 VanDerWaalsContact OD1-N 3.11Å; T83-R85 VanDerWaalsContact C-N 3.32Å; T83-R85 PolarHBondContact O-N 3.17Å; T83-R86 PolarHBondContact O-N 2.9Å; T83-M87 PolarHBondContact O-N 2.95Å
84	L	92.1	Very high	90.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.3	-44.7	174.5	-177.4	65.5	0	0	0	111.1	I39 P41 C44 L45 L48 L76 D81 R86 M87 C88	I39-L84 HydrophobicContact CG2-CD2 4.31Å; P41-L84 HydrophobicContact CB-CB 4.41Å; P41-L84 HydrophobicContact CB-CD2 4.09Å; C44-L84 HydrophobicContact CB-CD1 3.67Å; L45-L84 HydrophobicContact CD2-CB 4.3Å; L45-L84 HydrophobicContact CD2-CD1 4.2Å; L45-L84 HydrophobicContact CG-CB 4.2Å; L45-L84 HydrophobicContact CG-CD1 3.96Å; L48-L84 HydrophobicContact CD1-CD1 3.97Å; L76-L84 HydrophobicContact CB-CD2 4.35Å; L76-L84 HydrophobicContact CD1-CD1 4.25Å; D81-L84 HydrophobicContact CB-CB 3.99Å; D81-L84 PolarHBondContact O-N 2.89Å; D81-L84 WeakPolarHBondContact OD1-CB 3.29Å; D81-L84 PolarHBondContact OD1-N 3.14Å; L84-R86 PolarHBondContact O-N 3.02Å; L84-M87 PolarHBondContact O-N 3.11Å; L84-C88 PolarHBondContact O-N 3.36Å; L84-C88 PolarHBondContact O-SG 3.46Å
85	R	91.8	Very high	90.3	Very high	11 Å²	11	51.4 Å²	51.4	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-58.6	-45.6	177.4	-166.8	66.9	60.4	135.6	-1.8	112.1	F77 S79 D81 T83 M87 C88 Y89 D112 Y120	F77-R85 VanDerWaalsContact CD1-NH1 3.28Å; F77-R85 VanDerWaalsContact O-CZ 3.24Å; F77-R85 PolarHBondContact O-NH1 3.33Å; F77-R85 PolarHBondContact O-NH2 2.97Å; S79-R85 PolarHBondContact O-NH2 2.99Å; D81-R85 WeakPolarHBondContact O-CB 3.34Å; D81-R85 PolarHBondContact O-N 3.26Å; T83-R85 VanDerWaalsContact C-N 3.32Å; T83-R85 PolarHBondContact O-N 3.17Å; R85-M87 PolarHBondContact O-N 3.07Å; R85-C88 WeakPolarHBondContact O-CB 3.41Å; R85-C88 PolarHBondContact O-N 3.21Å; R85-Y89 HydrophobicContact CG-CE1 4.36Å; R85-Y89 HydrophobicContact CG-CE2 3.7Å; R85-Y89 WeakPolarHBondContact CG-OH 3.29Å; R85-Y89 VanDerWaalsContact O-CD2 3.32Å; R85-Y89 WeakPolarHBondContact O-CD2 3.36Å; R85-Y89 PolarHBondContact O-N 2.84Å; R85-Y89 VanDerWaalsContact O-N 3.12Å; R85-D112 IonicContact CZ-OD2 2.86Å; R85-D112 IonicContact NH1-OD1 3.17Å; R85-D112 PolarHBondContact NH1-OD1 3.44Å; R85-D112 IonicContact NH1-OD2 3.26Å; R85-D112 PolarHBondContact NH1-OD2 3.12Å; R85-Y120 HydrophobicContact CB-CD1 4.41Å; R85-Y120 HydrophobicContact CB-CE1 3.95Å; R85-Y120 HydrophobicContact CG-CD1 3.93Å; R85-Y120 HydrophobicContact CG-CE1 3.89Å; R85-Y120 HydrophobicContact CG-CG 4.4Å
86	R	90.6	Very high	90.3	Very high	134 Å²	134	46.5 Å²	46.5	51%	0.506	23%	0.228	S	C	.	.	H	α-helix	trans	-61.5	-41.4	176.3	-73.2	176.2	-177	-169.8	5.5	112.5	Q82 T83 L84 C88 Y89 L90	Q82-R86 WeakPolarHBondContact O-CG 3.44Å; Q82-R86 PolarHBondContact O-N 3.03Å; T83-R86 PolarHBondContact O-N 2.9Å; L84-R86 PolarHBondContact O-N 3.02Å; R86-C88 VanDerWaalsContact C-N 3.33Å; R86-Y89 PolarHBondContact O-N 3.43Å; R86-L90 PolarHBondContact O-N 3.35Å; R86-L90 VanDerWaalsContact O-N 3.13Å
87	M	92.4	Very high	90	Very high	37 Å²	37	52 Å²	52	18%	0.182	26%	0.257	C	S	.	.	H	α-helix	trans	-66.3	-34.9	175.9	-74.5	-60.2	-69.9	0	0	112.5	L45 L48 I52 T83 L84 R85 L90 T91	L45-M87 HydrophobicContact CD2-CB 3.76Å; L45-M87 HydrophobicContact CD2-CG 3.34Å; L48-M87 HydrophobicContact CB-CE 4.33Å; L48-M87 HydrophobicContact CD1-CB 3.96Å; I52-M87 HydrophobicContact CD1-CE 3.68Å; T83-M87 PolarHBondContact O-N 2.95Å; L84-M87 PolarHBondContact O-N 3.11Å; R85-M87 PolarHBondContact O-N 3.07Å; M87-L90 PolarHBondContact O-N 3.46Å; M87-L90 HydrophobicContact SD-CD2 4.4Å; M87-T91 WeakPolarHBondContact O-CB 3.21Å; M87-T91 PolarHBondContact O-N 3.49Å; M87-T91 PolarHBondContact O-OG1 3.04Å
88	C	92.8	Very high	90.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.4	-47.2	172.5	-63.4	0	0	0	0	110.9	M73 F77 L84 R85 R86 L90 T91 I92	M73-C88 HydrophobicContact SD-CB 4.48Å; F77-C88 HydrophobicContact CE2-CB 4.23Å; F77-C88 HydrophobicContact CZ-CB 4.42Å; L84-C88 PolarHBondContact O-N 3.36Å; L84-C88 PolarHBondContact O-SG 3.46Å; R85-C88 WeakPolarHBondContact O-CB 3.41Å; R85-C88 PolarHBondContact O-N 3.21Å; R86-C88 VanDerWaalsContact C-N 3.33Å; C88-L90 VanDerWaalsContact C-N 3.31Å; C88-L90 PolarHBondContact O-N 2.99Å; C88-T91 PolarHBondContact O-N 3.1Å; C88-I92 VanDerWaalsContact O-CG1 3.24Å; C88-I92 WeakPolarHBondContact O-CG1 3.27Å; C88-I92 PolarHBondContact O-N 3.02Å
89	Y	93.2	Very high	90.1	Very high	7 Å²	7	47.5 Å²	47.5	3%	0.027	24%	0.239	C	C	.	.	H	α-helix	trans	-59.3	-40.4	177.1	-58	-42.5	0	0	0	113.2	F77 R85 R86 K93 L109 D112 P123 A124 A127	F77-Y89 HydrophobicContact CE1-CD1 4.49Å; F77-Y89 AromaticContact CE1-CE1 3.87Å; F77-Y89 HydrophobicContact CE1-CE1 3.87Å; F77-Y89 HydrophobicContact CZ-CD1 4.39Å; F77-Y89 HydrophobicContact CZ-CE1 4.21Å; R85-Y89 HydrophobicContact CG-CE1 4.36Å; R85-Y89 HydrophobicContact CG-CE2 3.7Å; R85-Y89 WeakPolarHBondContact CG-OH 3.29Å; R85-Y89 VanDerWaalsContact O-CD2 3.32Å; R85-Y89 WeakPolarHBondContact O-CD2 3.36Å; R85-Y89 PolarHBondContact O-N 2.84Å; R85-Y89 VanDerWaalsContact O-N 3.12Å; R86-Y89 PolarHBondContact O-N 3.43Å; Y89-K93 WeakPolarHBondContact O-CG 3.42Å; Y89-K93 PolarHBondContact O-N 3.41Å; Y89-L109 HydrophobicContact CD1-CD2 3.69Å; Y89-L109 HydrophobicContact CE1-CD2 3.55Å; Y89-D112 WeakPolarHBondContact OH-CB 3.36Å; Y89-D112 PolarHBondContact OH-OD2 3.1Å; Y89-P123 HydrophobicContact CD2-CB 3.4Å; Y89-P123 HydrophobicContact CE2-CB 3.75Å; Y89-P123 HydrophobicContact CG-CB 4.18Å; Y89-A124 HydrophobicContact CE1-CB 4.11Å; Y89-A127 HydrophobicContact CD1-CB 4.2Å
90	L	91.8	Very high	90.1	Very high	68 Å²	68	52.4 Å²	52.4	36%	0.356	26%	0.26	S	S	.	.	H	α-helix	trans	-65.6	-48.1	177.4	-176.4	60.8	0	0	0	110.9	I52 R86 M87 C88 I92 K93 E94	I52-L90 HydrophobicContact CD1-CB 4.29Å; I52-L90 HydrophobicContact CD1-CD2 3.75Å; I52-L90 HydrophobicContact CD1-CG 3.83Å; R86-L90 PolarHBondContact O-N 3.35Å; R86-L90 VanDerWaalsContact O-N 3.13Å; M87-L90 PolarHBondContact O-N 3.46Å; M87-L90 HydrophobicContact SD-CD2 4.4Å; C88-L90 VanDerWaalsContact C-N 3.31Å; C88-L90 PolarHBondContact O-N 2.99Å; L90-I92 VanDerWaalsContact C-N 3.31Å; L90-I92 PolarHBondContact O-N 2.64Å; L90-K93 WeakPolarHBondContact O-CB 3.38Å; L90-K93 PolarHBondContact O-N 2.82Å; L90-K93 VanDerWaalsContact O-N 3.1Å; L90-E94 PolarHBondContact O-N 3.48Å
91	T	91.3	Very high	90.1	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-40.9	178.9	-50.6	0	0	0	0	111.4	L48 M73 M87 C88 K93 E94 M95	L48-T91 HydrophobicContact CD2-CG2 4.03Å; M73-T91 HydrophobicContact CE-CG2 4.42Å; M73-T91 WeakPolarHBondContact SD-CB 3.46Å; M73-T91 HydrophobicContact SD-CG2 3.51Å; M73-T91 VanDerWaalsContact SD-CG2 3.51Å; M87-T91 WeakPolarHBondContact O-CB 3.21Å; M87-T91 PolarHBondContact O-N 3.49Å; M87-T91 PolarHBondContact O-OG1 3.04Å; C88-T91 PolarHBondContact O-N 3.1Å; T91-K93 VanDerWaalsContact C-N 3.33Å; T91-K93 PolarHBondContact O-N 3.34Å; T91-E94 PolarHBondContact O-N 2.88Å; T91-M95 HydrophobicContact CG2-CG 4.12Å; T91-M95 HydrophobicContact CG2-SD 3.51Å; T91-M95 VanDerWaalsContact CG2-SD 3.51Å; T91-M95 WeakPolarHBondContact O-CB 3.38Å; T91-M95 WeakPolarHBondContact O-CG 3.47Å; T91-M95 PolarHBondContact O-N 3.28Å
92	I	91.4	Very high	89.8	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.3	-48	173.9	-70.7	164.9	0	0	0	110.7	F70 M73 F77 C88 L90 E94 M95 A96 V105 L109 A127 I131	F70-I92 HydrophobicContact CE2-CB 4.23Å; F70-I92 HydrophobicContact CE2-CG1 3.85Å; F70-I92 HydrophobicContact CE2-CG2 4.16Å; F70-I92 HydrophobicContact CZ-CG1 4.26Å; F70-I92 HydrophobicContact CZ-CG2 4.47Å; M73-I92 HydrophobicContact CE-CB 4.45Å; M73-I92 HydrophobicContact CE-CD1 4.28Å; M73-I92 HydrophobicContact CE-CG1 3.35Å; M73-I92 HydrophobicContact SD-CG1 4.31Å; F77-I92 HydrophobicContact CE2-CD1 3.8Å; F77-I92 HydrophobicContact CZ-CD1 3.55Å; C88-I92 VanDerWaalsContact O-CG1 3.24Å; C88-I92 WeakPolarHBondContact O-CG1 3.27Å; C88-I92 PolarHBondContact O-N 3.02Å; L90-I92 VanDerWaalsContact C-N 3.31Å; L90-I92 PolarHBondContact O-N 2.64Å; I92-E94 VanDerWaalsContact C-N 3.31Å; I92-E94 PolarHBondContact O-N 2.95Å; I92-M95 PolarHBondContact O-N 2.86Å; I92-A96 WeakPolarHBondContact O-CB 3.22Å; I92-A96 PolarHBondContact O-N 3.42Å; I92-V105 HydrophobicContact CD1-CG1 4.48Å; I92-V105 HydrophobicContact CD1-CG2 4.18Å; I92-L109 HydrophobicContact CD1-CD2 4.34Å; I92-A127 HydrophobicContact CG2-CB 4.48Å; I92-I131 HydrophobicContact CG2-CG2 3.77Å
93	K	89.8	Confident	89.5	Confident	78 Å²	78	49.1 Å²	49.1	34%	0.339	25%	0.245	S	C	.	.	H	α-helix	trans	-62.6	-37.3	-177	-75	176.8	68.4	-144.9	0	113.2	Y89 L90 T91 A127 R130	Y89-K93 WeakPolarHBondContact O-CG 3.42Å; Y89-K93 PolarHBondContact O-N 3.41Å; L90-K93 WeakPolarHBondContact O-CB 3.38Å; L90-K93 PolarHBondContact O-N 2.82Å; L90-K93 VanDerWaalsContact O-N 3.1Å; T91-K93 VanDerWaalsContact C-N 3.33Å; T91-K93 PolarHBondContact O-N 3.34Å; K93-A127 HydrophobicContact CG-CB 4.46Å; K93-R130 HydrophobicContact CG-CB 4.41Å; K93-R130 HydrophobicContact CG-CG 4.42Å
94	E	89.8	Confident	89.3	Confident	80 Å²	80	49.5 Å²	49.5	37%	0.374	24%	0.243	S	C	.	.	H	α-helix	trans	-76.6	-41.1	179.3	-60.1	-50.1	135.9	0	0	111.7	L55 L90 T91 I92	L55-E94 HydrophobicContact CD1-CB 4.11Å; L90-E94 PolarHBondContact O-N 3.48Å; T91-E94 PolarHBondContact O-N 2.88Å; I92-E94 VanDerWaalsContact C-N 3.31Å; I92-E94 PolarHBondContact O-N 2.95Å
95	M	89.4	Confident	89.2	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.02	24%	0.243	C	C	.	.	H	α-helix	trans	-84.1	-15.3	-176.1	-65.4	-174.3	72.6	0	0	114.4	I51 L55 A66 A69 F70 T91 I92 N97 I98 S99	I51-M95 HydrophobicContact CG2-SD 4.22Å; L55-M95 HydrophobicContact CD1-CG 4.05Å; A66-M95 HydrophobicContact CB-CE 3.96Å; A66-M95 WeakPolarHBondContact O-CE 3.45Å; A69-M95 HydrophobicContact CB-CE 4Å; F70-M95 HydrophobicContact CB-CE 4.27Å; F70-M95 HydrophobicContact CD2-CB 4.17Å; T91-M95 HydrophobicContact CG2-CG 4.12Å; T91-M95 HydrophobicContact CG2-SD 3.51Å; T91-M95 VanDerWaalsContact CG2-SD 3.51Å; T91-M95 WeakPolarHBondContact O-CB 3.38Å; T91-M95 WeakPolarHBondContact O-CG 3.47Å; T91-M95 PolarHBondContact O-N 3.28Å; I92-M95 PolarHBondContact O-N 2.86Å; M95-N97 PolarHBondContact O-N 3.17Å; M95-N97 VanDerWaalsContact O-N 3.14Å; M95-I98 PolarHBondContact O-N 2.9Å; M95-S99 WeakPolarHBondContact O-CB 3.41Å; M95-S99 PolarHBondContact O-N 3.46Å; M95-S99 PolarHBondContact O-OG 2.64Å
96	A	86.8	Confident	89	Confident	14 Å²	14	50.2 Å²	50.2	12%	0.116	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-30.4	-175.4	0	0	0	0	0	114.5	I92 V102 R130 I131	I92-A96 WeakPolarHBondContact O-CB 3.22Å; I92-A96 PolarHBondContact O-N 3.42Å; A96-V102 HydrophobicContact CB-CG1 4.17Å; A96-R130 HydrophobicContact CB-CG 4.35Å; A96-I131 HydrophobicContact CB-CG2 3.74Å
97	N	86.3	Confident	89	Confident	115 Å²	115	48.4 Å²	48.4	62%	0.615	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-11.3	-179.4	-71.9	1.3	0	0	0	113.6	M95 R130	M95-N97 PolarHBondContact O-N 3.17Å; M95-N97 VanDerWaalsContact O-N 3.14Å; N97-R130 PolarHBondContact ND2-NH2 3.49Å; N97-R130 PolarHBondContact OD1-NH2 3.44Å
98	I	89.4	Confident	88.9	Confident	52 Å²	52	48.6 Å²	48.6	27%	0.267	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-25	-173.3	-48	173.3	0	0	0	110.5	L55 T63 A66 M95	L55-I98 HydrophobicContact CD2-CD1 3.98Å; T63-I98 WeakPolarHBondContact CA-O 3.41Å; T63-I98 WeakPolarHBondContact CG2-O 3.41Å; A66-I98 HydrophobicContact CB-CB 4.15Å; A66-I98 HydrophobicContact CB-CG2 3.71Å; M95-I98 PolarHBondContact O-N 2.9Å
99	S	88.4	Confident	88.9	Confident	12 Å²	12	48.6 Å²	48.6	8%	0.084	26%	0.262	C	S	.	.			trans	-96.4	150.2	-176.5	-47.3	0	0	0	0	111.2	A66 T67 M95 V102	A66-S99 PolarHBondContact O-OG 3.45Å; T67-S99 WeakPolarHBondContact OG1-CA 3.23Å; M95-S99 WeakPolarHBondContact O-CB 3.41Å; M95-S99 PolarHBondContact O-N 3.46Å; M95-S99 PolarHBondContact O-OG 2.64Å; S99-V102 WeakPolarHBondContact O-CG2 3.34Å
100	E	87.2	Confident	88.7	Confident	122 Å²	122	49.4 Å²	49.4	57%	0.57	27%	0.267	S	S	*	.	S	Bend	trans	-91.3	163.8	170.7	-69.1	176.3	-178.8	0	0	110.7	T63 T67 V102	T63-E100 HydrophobicContact CG2-CG 3.74Å; T67-E100 HydrophobicContact CG2-CB 4.42Å; T67-E100 PolarHBondContact OG1-N 2.71Å; E100-V102 PolarHBondContact O-N 3.04Å
101	D	85	Confident	88.7	Confident	109 Å²	109	53.5 Å²	53.5	58%	0.583	28%	0.282	S	S	*	.			trans	51.7	30.6	175.4	-67.4	-31.4	0	0	0	115.6	F71 I103 I104	F71-D101 HydrophobicContact CE1-CB 4.16Å; F71-D101 HydrophobicContact CZ-CB 3.78Å; D101-I103 PolarHBondContact O-N 3.16Å; D101-I104 PolarHBondContact O-N 2.94Å; D101-I104 VanDerWaalsContact O-N 3.15Å
102	V	85.5	Confident	88.8	Confident	14 Å²	14	54.2 Å²	54.2	9%	0.085	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-57.3	-21.1	-178.9	-171.5	0	0	0	0	112.2	F70 A96 S99 E100 I104 V105 I131	F70-V102 HydrophobicContact CE1-CB 4.41Å; F70-V102 HydrophobicContact CE1-CG1 4.07Å; F70-V102 HydrophobicContact CE2-CG1 3.86Å; F70-V102 HydrophobicContact CZ-CB 4.25Å; F70-V102 HydrophobicContact CZ-CG1 3.45Å; F70-V102 VanDerWaalsContact CZ-CG1 3.45Å; A96-V102 HydrophobicContact CB-CG1 4.17Å; S99-V102 WeakPolarHBondContact O-CG2 3.34Å; E100-V102 PolarHBondContact O-N 3.04Å; V102-I104 PolarHBondContact O-N 2.9Å; V102-V105 WeakPolarHBondContact O-CG2 3.3Å; V102-V105 PolarHBondContact O-N 3.38Å; V102-I131 HydrophobicContact CG1-CB 3.8Å; V102-I131 HydrophobicContact CG1-CD1 4.41Å; V102-I131 HydrophobicContact CG1-CG2 3.4Å
103	I	84.2	Confident	88.8	Confident	89 Å²	89	54.5 Å²	54.5	46%	0.456	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-59.3	-16.5	178.1	70.8	174.6	0	0	0	114	D101 V105 T106 M136	D101-I103 PolarHBondContact O-N 3.16Å; I103-V105 PolarHBondContact O-N 3.21Å; I103-V105 VanDerWaalsContact O-N 3.16Å; I103-T106 WeakPolarHBondContact O-CB 3.47Å; I103-T106 PolarHBondContact O-N 3.11Å; I103-T106 PolarHBondContact O-OG1 3.22Å; I103-M136 HydrophobicContact CB-CE 4.02Å; I103-M136 HydrophobicContact CB-SD 3.98Å; I103-M136 HydrophobicContact CG2-CE 3.3Å; I103-M136 HydrophobicContact CG2-SD 3.84Å
104	I	86.6	Confident	88.8	Confident	92 Å²	92	54.3 Å²	54.3	47%	0.472	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-57.9	-28.5	179.6	-166.4	167.3	0	0	0	113.3	F70 F71 T74 D101 V102 T106	F70-I104 HydrophobicContact CE1-CG2 3.88Å; F71-I104 HydrophobicContact CD1-CD1 4.19Å; F71-I104 HydrophobicContact CD1-CG2 3.95Å; F71-I104 HydrophobicContact CE1-CB 4.35Å; F71-I104 HydrophobicContact CE1-CD1 4.05Å; F71-I104 HydrophobicContact CE1-CG2 3.79Å; T74-I104 HydrophobicContact CG2-CG2 3.95Å; D101-I104 PolarHBondContact O-N 2.94Å; D101-I104 VanDerWaalsContact O-N 3.15Å; V102-I104 PolarHBondContact O-N 2.9Å; I104-T106 VanDerWaalsContact C-N 3.34Å
105	V	89.4	Confident	88.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-85.1	-4.3	179.2	-60.2	0	0	0	0	113.6	F70 T74 F77 I92 V102 I103 S107 S108 L109 I131	F70-V105 HydrophobicContact CE1-CG1 3.98Å; F70-V105 HydrophobicContact CZ-CG1 3.91Å; F70-V105 HydrophobicContact CZ-CG2 3.98Å; T74-V105 HydrophobicContact CG2-CG1 3.58Å; F77-V105 HydrophobicContact CE2-CG1 4.34Å; I92-V105 HydrophobicContact CD1-CG1 4.48Å; I92-V105 HydrophobicContact CD1-CG2 4.18Å; V102-V105 WeakPolarHBondContact O-CG2 3.3Å; V102-V105 PolarHBondContact O-N 3.38Å; I103-V105 PolarHBondContact O-N 3.21Å; I103-V105 VanDerWaalsContact O-N 3.16Å; V105-S107 VanDerWaalsContact C-N 3.32Å; V105-S107 PolarHBondContact O-N 3.49Å; V105-S108 PolarHBondContact O-N 3Å; V105-S108 VanDerWaalsContact O-N 3.14Å; V105-L109 HydrophobicContact CB-CD1 4.4Å; V105-L109 HydrophobicContact CB-CG 4.4Å; V105-L109 HydrophobicContact CG2-CD1 3.7Å; V105-L109 HydrophobicContact CG2-CG 4.22Å; V105-L109 WeakPolarHBondContact O-CG 3.24Å; V105-L109 PolarHBondContact O-N 3.38Å; V105-I131 HydrophobicContact CG2-CD1 3.4Å; V105-I131 VanDerWaalsContact CG2-CD1 3.4Å
106	T	88.4	Confident	88.5	Confident	26 Å²	26	61.5 Å²	61.5	16%	0.16	33%	0.331	C	S	.	.	H	α-helix	trans	-55	-43.4	-176.7	-65.1	0	0	0	0	112.6	I103 I104 L109 T110 L128	I103-T106 WeakPolarHBondContact O-CB 3.47Å; I103-T106 PolarHBondContact O-N 3.11Å; I103-T106 PolarHBondContact O-OG1 3.22Å; I104-T106 VanDerWaalsContact C-N 3.34Å; T106-L109 PolarHBondContact O-N 3.19Å; T106-T110 VanDerWaalsContact O-CB 3.3Å; T106-T110 WeakPolarHBondContact O-CB 3.39Å; T106-T110 PolarHBondContact O-N 3.12Å; T106-T110 PolarHBondContact O-OG1 3.43Å; T106-L128 HydrophobicContact CG2-CD1 4.05Å
107	S	89	Confident	88.6	Confident	96 Å²	96	65.2 Å²	65.2	67%	0.671	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-44.7	178.4	-174.8	0	0	0	0	112.2	V105 T110 K111	V105-S107 VanDerWaalsContact C-N 3.32Å; V105-S107 PolarHBondContact O-N 3.49Å; S107-T110 PolarHBondContact O-N 3.23Å; S107-K111 WeakPolarHBondContact O-CB 3.25Å; S107-K111 PolarHBondContact O-N 2.93Å
108	S	91.2	Very high	88.6	Confident	41 Å²	41	63.1 Å²	63.1	29%	0.287	33%	0.334	S	S	.	.	H	α-helix	trans	-62.9	-44.5	176.9	-61.8	0	0	0	0	111.9	V105 K111 D112	V105-S108 PolarHBondContact O-N 3Å; V105-S108 VanDerWaalsContact O-N 3.14Å; S108-K111 WeakPolarHBondContact O-CB 3.42Å; S108-K111 PolarHBondContact O-N 3.12Å; S108-D112 PolarHBondContact O-N 3.26Å
109	L	92.4	Very high	88.5	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-66.8	-38.8	177.4	-65.7	177.3	0	0	0	112	F77 Y89 I92 V105 T106 K111 D112 M113 A124 A127 L128 I131	F77-L109 HydrophobicContact CE1-CD2 3.98Å; F77-L109 HydrophobicContact CZ-CD2 3.96Å; Y89-L109 HydrophobicContact CD1-CD2 3.69Å; Y89-L109 HydrophobicContact CE1-CD2 3.55Å; I92-L109 HydrophobicContact CD1-CD2 4.34Å; V105-L109 HydrophobicContact CB-CD1 4.4Å; V105-L109 HydrophobicContact CB-CG 4.4Å; V105-L109 HydrophobicContact CG2-CD1 3.7Å; V105-L109 HydrophobicContact CG2-CG 4.22Å; V105-L109 WeakPolarHBondContact O-CG 3.24Å; V105-L109 PolarHBondContact O-N 3.38Å; T106-L109 PolarHBondContact O-N 3.19Å; L109-K111 VanDerWaalsContact C-N 3.32Å; L109-K111 PolarHBondContact O-N 2.97Å; L109-D112 PolarHBondContact O-N 3.05Å; L109-M113 WeakPolarHBondContact O-CB 3.44Å; L109-M113 PolarHBondContact O-N 3.48Å; L109-A124 HydrophobicContact CD2-CB 4.46Å; L109-A127 HydrophobicContact CD1-CB 4.22Å; L109-A127 HydrophobicContact CD2-CB 4.07Å; L109-L128 HydrophobicContact CB-CB 4.12Å; L109-L128 HydrophobicContact CB-CD1 4.17Å; L109-L128 HydrophobicContact CD1-CB 4.07Å; L109-L128 HydrophobicContact CD1-CD1 4.23Å; L109-I131 HydrophobicContact CD1-CD1 3.68Å; L109-I131 HydrophobicContact CD1-CG1 4.42Å
110	T	90.6	Very high	88.7	Confident	23 Å²	23	63.1 Å²	63.1	14%	0.141	34%	0.335	C	S	.	.	H	α-helix	trans	-65.2	-37.7	176	-57.4	0	0	0	0	111.3	T106 S107 M113 T114 Y143	T106-T110 VanDerWaalsContact O-CB 3.3Å; T106-T110 WeakPolarHBondContact O-CB 3.39Å; T106-T110 PolarHBondContact O-N 3.12Å; T106-T110 PolarHBondContact O-OG1 3.43Å; S107-T110 PolarHBondContact O-N 3.23Å; T110-M113 PolarHBondContact O-N 3.38Å; T110-T114 PolarHBondContact O-N 3.38Å; T110-T114 VanDerWaalsContact O-N 3.08Å; T110-T114 PolarHBondContact O-OG1 3.19Å; T110-Y143 HydrophobicContact CG2-CD2 4.18Å; T110-Y143 HydrophobicContact CG2-CE2 3.89Å
111	K	91.6	Very high	88.9	Confident	154 Å²	154	59 Å²	59	67%	0.67	31%	0.314	S	S	*	.	H	α-helix	trans	-64.1	-45.6	173.5	-176.9	-176	177.2	-176.2	0	111.4	S107 S108 L109 M113 T114 G115	S107-K111 WeakPolarHBondContact O-CB 3.25Å; S107-K111 PolarHBondContact O-N 2.93Å; S108-K111 WeakPolarHBondContact O-CB 3.42Å; S108-K111 PolarHBondContact O-N 3.12Å; L109-K111 VanDerWaalsContact C-N 3.32Å; L109-K111 PolarHBondContact O-N 2.97Å; K111-M113 VanDerWaalsContact C-N 3.31Å; K111-M113 PolarHBondContact O-N 2.93Å; K111-T114 PolarHBondContact O-N 3.19Å; K111-T114 PolarHBondContact O-OG1 3.26Å; K111-G115 WeakPolarHBondContact O-CA 3.34Å; K111-G115 PolarHBondContact O-N 3.32Å
112	D	92.4	Very high	89.3	Confident	17 Å²	17	53.9 Å²	53.9	9%	0.091	29%	0.287	C	S	.	.	H	α-helix	trans	-70.8	-29.5	-179.4	-73.1	-12.7	0	0	0	111.9	R85 Y89 S108 L109 R121 A124	R85-D112 IonicContact CZ-OD2 2.86Å; R85-D112 IonicContact NH1-OD1 3.17Å; R85-D112 PolarHBondContact NH1-OD1 3.44Å; R85-D112 IonicContact NH1-OD2 3.26Å; R85-D112 PolarHBondContact NH1-OD2 3.12Å; Y89-D112 WeakPolarHBondContact OH-CB 3.36Å; Y89-D112 PolarHBondContact OH-OD2 3.1Å; S108-D112 PolarHBondContact O-N 3.26Å; L109-D112 PolarHBondContact O-N 3.05Å; D112-R121 WeakPolarHBondContact O-CG 3.28Å; D112-A124 HydrophobicContact CB-CB 3.89Å
113	M	91.1	Very high	89.6	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-68.8	-38.7	173.7	-179.9	168	102.4	0	0	113.8	L109 T110 K111 R121 A124 I125 L128 Y143	L109-M113 WeakPolarHBondContact O-CB 3.44Å; L109-M113 PolarHBondContact O-N 3.48Å; T110-M113 PolarHBondContact O-N 3.38Å; K111-M113 VanDerWaalsContact C-N 3.31Å; K111-M113 PolarHBondContact O-N 2.93Å; M113-R121 WeakPolarHBondContact O-CG 3.32Å; M113-R121 PolarHBondContact O-NE 3.22Å; M113-A124 HydrophobicContact CB-CB 4.4Å; M113-I125 HydrophobicContact CB-CG1 4.43Å; M113-I125 HydrophobicContact CG-CD1 4.2Å; M113-I125 HydrophobicContact CG-CG1 3.52Å; M113-I125 HydrophobicContact SD-CB 4.41Å; M113-I125 HydrophobicContact SD-CG1 3.48Å; M113-I125 WeakPolarHBondContact SD-CG1 3.28Å; M113-L128 HydrophobicContact CE-CD2 4.25Å; M113-L128 HydrophobicContact SD-CD2 3.82Å; M113-Y143 HydrophobicContact CE-CD2 4.26Å; M113-Y143 HydrophobicContact CE-CG 3.86Å
114	T	90	Very high	90.1	Very high	74 Å²	74	50.2 Å²	50.2	45%	0.454	27%	0.269	S	S	.	.	H	α-helix	trans	-95.2	-3.2	179.8	56.2	0	0	0	0	113.3	T110 K111 Y143	T110-T114 PolarHBondContact O-N 3.38Å; T110-T114 VanDerWaalsContact O-N 3.08Å; T110-T114 PolarHBondContact O-OG1 3.19Å; K111-T114 PolarHBondContact O-N 3.19Å; K111-T114 PolarHBondContact O-OG1 3.26Å; T114-Y143 HydrophobicContact CG2-CD1 3.46Å; T114-Y143 VanDerWaalsContact CG2-CD1 3.46Å; T114-Y143 HydrophobicContact CG2-CE1 3.72Å; T114-Y143 HydrophobicContact CG2-CG 4.21Å
115	G	88	Confident	90.4	Very high	28 Å²	28	45.8 Å²	45.8	29%	0.289	25%	0.247	S	C	.	.	S	Bend	trans	-66.3	167.7	-179.7	0	0	0	0	0	113.7	K111 E117 R121	K111-G115 WeakPolarHBondContact O-CA 3.34Å; K111-G115 PolarHBondContact O-N 3.32Å; G115-E117 VanDerWaalsContact C-N 3.31Å; G115-R121 VanDerWaalsContact O-CD 3.32Å; G115-R121 WeakPolarHBondContact O-CD 3.29Å
116	K	86.1	Confident	90.6	Very high	208 Å²	208	50.9 Å²	50.9	90%	0.904	27%	0.266	S	S	*	.	S	Bend	trans	-76.4	-17.1	178.1	-64.3	-176.1	179.5	-179.2	0	113.6	D118	K116-D118 PolarHBondContact O-N 3.41Å
117	E	87.8	Confident	90.8	Very high	91 Å²	91	49.6 Å²	49.6	43%	0.425	26%	0.258	S	S	.	.			trans	-88.7	97.7	-174.7	-66.6	-171.9	-146.9	0	0	111.1	G115 V119 Y120 R121	G115-E117 VanDerWaalsContact C-N 3.31Å; E117-V119 PolarHBondContact O-N 3.13Å; E117-Y120 HydrophobicContact CB-CD2 3.74Å; E117-Y120 HydrophobicContact CB-CE2 4.07Å; E117-Y120 HydrophobicContact CB-CG 4.3Å; E117-Y120 VanDerWaalsContact CD-CE2 3.46Å; E117-Y120 HydrophobicContact CG-CD2 4.44Å; E117-Y120 HydrophobicContact CG-CE2 4.35Å; E117-Y120 PolarHBondContact O-N 3.31Å; E117-Y120 WeakPolarHBondContact OE2-CE2 3.25Å; E117-Y120 PolarHBondContact OE2-OH 3.33Å; E117-R121 PolarHBondContact O-N 2.76Å
118	D	86.6	Confident	91	Very high	72 Å²	72	45 Å²	45	39%	0.385	23%	0.226	S	C	.	.	H	α-helix	trans	-56	-25.8	-177.8	-68.1	-34	0	0	0	114.2	K116 Y120 R121 V152	K116-D118 PolarHBondContact O-N 3.41Å; D118-Y120 PolarHBondContact O-N 3.45Å; D118-R121 WeakPolarHBondContact OD1-CD 3.44Å; D118-R121 IonicContact OD1-NH1 2.77Å; D118-R121 PolarHBondContact OD1-NH1 3.21Å; D118-R121 VanDerWaalsContact OD1-NH1 3.17Å; D118-V152 HydrophobicContact CB-CG1 4.39Å
119	V	87.9	Confident	90.9	Very high	53 Å²	53	43.9 Å²	43.9	32%	0.321	22%	0.218	S	C	.	.	H	α-helix	trans	-62.5	-29.4	176.5	178.5	0	0	0	0	112.3	E117 P123	E117-V119 PolarHBondContact O-N 3.13Å; V119-P123 WeakPolarHBondContact O-CD 3.36Å; V119-P123 WeakPolarHBondContact O-CG 3.48Å
120	Y	91	Very high	90.8	Very high	10 Å²	10	49.9 Å²	49.9	4%	0.039	24%	0.241	C	C	.	.	H	α-helix	trans	-91.7	-34.7	-179.2	-61.3	-23.4	0	0	0	113	N80 Q82 R85 E117 D118 G122 P123 A124	N80-Y120 PolarHBondContact O-OH 2.94Å; Q82-Y120 HydrophobicContact CB-CE1 4.17Å; Q82-Y120 HydrophobicContact CG-CE1 3.85Å; Q82-Y120 WeakPolarHBondContact CG-OH 3.15Å; R85-Y120 HydrophobicContact CB-CD1 4.41Å; R85-Y120 HydrophobicContact CB-CE1 3.95Å; R85-Y120 HydrophobicContact CG-CD1 3.93Å; R85-Y120 HydrophobicContact CG-CE1 3.89Å; R85-Y120 HydrophobicContact CG-CG 4.4Å; E117-Y120 HydrophobicContact CB-CD2 3.74Å; E117-Y120 HydrophobicContact CB-CE2 4.07Å; E117-Y120 HydrophobicContact CB-CG 4.3Å; E117-Y120 VanDerWaalsContact CD-CE2 3.46Å; E117-Y120 HydrophobicContact CG-CD2 4.44Å; E117-Y120 HydrophobicContact CG-CE2 4.35Å; E117-Y120 PolarHBondContact O-N 3.31Å; E117-Y120 WeakPolarHBondContact OE2-CE2 3.25Å; E117-Y120 PolarHBondContact OE2-OH 3.33Å; D118-Y120 PolarHBondContact O-N 3.45Å; Y120-G122 PolarHBondContact O-N 3.28Å; Y120-P123 WeakPolarHBondContact O-CD 3.37Å; Y120-A124 WeakPolarHBondContact O-CB 3Å; Y120-A124 PolarHBondContact O-N 3.21Å
121	R	93.2	Very high	90.7	Very high	36 Å²	36	49.7 Å²	49.7	14%	0.136	24%	0.238	C	C	.	.	H	α-helix	trans	-55.8	-54	-169.8	-60.5	174.1	71.5	-155.2	-3.1	112.8	D112 M113 G115 E117 D118 A124 I125 D150 V155	D112-R121 WeakPolarHBondContact O-CG 3.28Å; M113-R121 WeakPolarHBondContact O-CG 3.32Å; M113-R121 PolarHBondContact O-NE 3.22Å; G115-R121 VanDerWaalsContact O-CD 3.32Å; G115-R121 WeakPolarHBondContact O-CD 3.29Å; E117-R121 PolarHBondContact O-N 2.76Å; D118-R121 WeakPolarHBondContact OD1-CD 3.44Å; D118-R121 IonicContact OD1-NH1 2.77Å; D118-R121 PolarHBondContact OD1-NH1 3.21Å; D118-R121 VanDerWaalsContact OD1-NH1 3.17Å; R121-A124 PolarHBondContact O-N 3.12Å; R121-I125 WeakPolarHBondContact O-CD1 3.44Å; R121-I125 VanDerWaalsContact O-CG1 3.25Å; R121-I125 WeakPolarHBondContact O-CG1 3.05Å; R121-I125 PolarHBondContact O-N 3.1Å; R121-D150 IonicContact CZ-OD2 3.35Å; R121-D150 IonicContact NH1-OD1 3.38Å; R121-D150 PolarHBondContact NH1-OD1 3.39Å; R121-D150 IonicContact NH1-OD2 3.17Å; R121-D150 PolarHBondContact NH1-OD2 2.86Å; R121-D150 IonicContact NH2-OD2 2.66Å; R121-D150 PolarHBondContact NH2-OD2 3.03Å; R121-V155 HydrophobicContact CB-CG1 4.41Å; R121-V155 HydrophobicContact CB-CG2 3.78Å
122	G	92.1	Very high	90.5	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-54.1	-179.7	0	0	0	0	0	114	Y120 A124 I125 R126	Y120-G122 PolarHBondContact O-N 3.28Å; G122-A124 VanDerWaalsContact C-N 3.33Å; G122-A124 PolarHBondContact O-N 3.32Å; G122-I125 PolarHBondContact O-N 2.89Å; G122-R126 PolarHBondContact O-N 3.31Å
123	P	92.7	Very high	90.1	Very high	26 Å²	26	45.1 Å²	45.1	17%	0.169	22%	0.222	C	C	.	.	H	α-helix	trans	-58	-39.3	173.9	-27.2	35.3	0	0	0	114.3	Y89 V119 Y120 R126 A127	Y89-P123 HydrophobicContact CD2-CB 3.4Å; Y89-P123 HydrophobicContact CE2-CB 3.75Å; Y89-P123 HydrophobicContact CG-CB 4.18Å; V119-P123 WeakPolarHBondContact O-CD 3.36Å; V119-P123 WeakPolarHBondContact O-CG 3.48Å; Y120-P123 WeakPolarHBondContact O-CD 3.37Å; P123-R126 PolarHBondContact O-N 3.33Å; P123-A127 PolarHBondContact O-N 3.47Å
124	A	93.6	Very high	89.7	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.4	-42.7	177.4	0	0	0	0	0	111.6	Y89 L109 D112 M113 Y120 R121 G122 R126 A127 L128	Y89-A124 HydrophobicContact CE1-CB 4.11Å; L109-A124 HydrophobicContact CD2-CB 4.46Å; D112-A124 HydrophobicContact CB-CB 3.89Å; M113-A124 HydrophobicContact CB-CB 4.4Å; Y120-A124 WeakPolarHBondContact O-CB 3Å; Y120-A124 PolarHBondContact O-N 3.21Å; R121-A124 PolarHBondContact O-N 3.12Å; G122-A124 VanDerWaalsContact C-N 3.33Å; G122-A124 PolarHBondContact O-N 3.32Å; A124-R126 VanDerWaalsContact C-N 3.35Å; A124-R126 PolarHBondContact O-N 3.36Å; A124-A127 PolarHBondContact O-N 3.47Å; A124-L128 VanDerWaalsContact O-CB 3.23Å; A124-L128 WeakPolarHBondContact O-CB 3.46Å; A124-L128 PolarHBondContact O-N 3.45Å
125	I	94.2	Very high	89.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-55.7	-49.4	173.2	-68.2	159.5	0	0	0	110.6	M113 R121 G122 A127 L128 C129 M144 A147 V155 A159	M113-I125 HydrophobicContact CB-CG1 4.43Å; M113-I125 HydrophobicContact CG-CD1 4.2Å; M113-I125 HydrophobicContact CG-CG1 3.52Å; M113-I125 HydrophobicContact SD-CB 4.41Å; M113-I125 HydrophobicContact SD-CG1 3.48Å; M113-I125 WeakPolarHBondContact SD-CG1 3.28Å; R121-I125 WeakPolarHBondContact O-CD1 3.44Å; R121-I125 VanDerWaalsContact O-CG1 3.25Å; R121-I125 WeakPolarHBondContact O-CG1 3.05Å; R121-I125 PolarHBondContact O-N 3.1Å; G122-I125 PolarHBondContact O-N 2.89Å; I125-A127 VanDerWaalsContact C-N 3.35Å; I125-A127 PolarHBondContact O-N 2.97Å; I125-L128 PolarHBondContact O-N 3.29Å; I125-C129 WeakPolarHBondContact O-CB 3.45Å; I125-C129 PolarHBondContact O-N 2.78Å; I125-C129 PolarHBondContact O-SG 3.23Å; I125-M144 HydrophobicContact CG2-CE 4.13Å; I125-M144 HydrophobicContact CG2-SD 4.03Å; I125-A147 HydrophobicContact CD1-CB 3.84Å; I125-V155 HydrophobicContact CD1-CG1 3.72Å; I125-A159 HydrophobicContact CD1-CB 4.42Å; I125-A159 HydrophobicContact CG2-CB 4.49Å
126	R	93.3	Very high	89.2	Confident	107 Å²	107	49.5 Å²	49.5	40%	0.404	24%	0.242	S	C	.	.	H	α-helix	trans	-64.8	-37.6	-178.4	-66.8	-172.6	-61.9	-104.8	6.5	113	G122 P123 A124 R130 S158	G122-R126 PolarHBondContact O-N 3.31Å; P123-R126 PolarHBondContact O-N 3.33Å; A124-R126 VanDerWaalsContact C-N 3.35Å; A124-R126 PolarHBondContact O-N 3.36Å; R126-R130 PolarHBondContact O-N 3.25Å; R126-S158 PolarHBondContact NH1-OG 3.06Å
127	A	92.4	Very high	89.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-69.7	-43.2	175.5	0	0	0	0	0	111.1	Y89 I92 K93 L109 P123 A124 I125 R130 I131	Y89-A127 HydrophobicContact CD1-CB 4.2Å; I92-A127 HydrophobicContact CG2-CB 4.48Å; K93-A127 HydrophobicContact CG-CB 4.46Å; L109-A127 HydrophobicContact CD1-CB 4.22Å; L109-A127 HydrophobicContact CD2-CB 4.07Å; P123-A127 PolarHBondContact O-N 3.47Å; A124-A127 PolarHBondContact O-N 3.47Å; I125-A127 VanDerWaalsContact C-N 3.35Å; I125-A127 PolarHBondContact O-N 2.97Å; A127-R130 WeakPolarHBondContact O-CB 3.31Å; A127-R130 PolarHBondContact O-N 3.39Å; A127-I131 PolarHBondContact O-N 3.34Å
128	L	92.3	Very high	89.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-50.8	179.7	-178.5	58.5	0	0	0	111.2	T106 L109 M113 A124 I125 R130 I131 T132 I140	T106-L128 HydrophobicContact CG2-CD1 4.05Å; L109-L128 HydrophobicContact CB-CB 4.12Å; L109-L128 HydrophobicContact CB-CD1 4.17Å; L109-L128 HydrophobicContact CD1-CB 4.07Å; L109-L128 HydrophobicContact CD1-CD1 4.23Å; M113-L128 HydrophobicContact CE-CD2 4.25Å; M113-L128 HydrophobicContact SD-CD2 3.82Å; A124-L128 VanDerWaalsContact O-CB 3.23Å; A124-L128 WeakPolarHBondContact O-CB 3.46Å; A124-L128 PolarHBondContact O-N 3.45Å; I125-L128 PolarHBondContact O-N 3.29Å; L128-R130 PolarHBondContact O-N 3.46Å; L128-R130 VanDerWaalsContact O-N 3.12Å; L128-I131 HydrophobicContact CD1-CD1 4.5Å; L128-I131 HydrophobicContact CD1-CG1 4.44Å; L128-I131 WeakPolarHBondContact O-CG1 3.49Å; L128-I131 PolarHBondContact O-N 3.38Å; L128-T132 WeakPolarHBondContact O-CB 3.45Å; L128-T132 PolarHBondContact O-N 3.12Å; L128-T132 PolarHBondContact O-OG1 2.86Å; L128-I140 HydrophobicContact CD2-CD1 4.12Å; L128-I140 HydrophobicContact CD2-CG2 4.19Å; L128-I140 HydrophobicContact CG-CD1 4.16Å
129	C	90.5	Very high	89.1	Confident	17 Å²	17	41 Å²	41	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-63.9	-18.7	179.4	-65.7	0	0	0	0	113.4	I125 S162 M166	I125-C129 WeakPolarHBondContact O-CB 3.45Å; I125-C129 PolarHBondContact O-N 2.78Å; I125-C129 PolarHBondContact O-SG 3.23Å; C129-S162 VanDerWaalsContact SG-CB 3.56Å; C129-M166 HydrophobicContact CB-CG 4.34Å; C129-M166 HydrophobicContact CB-SD 3.92Å
130	R	89	Confident	89.2	Confident	126 Å²	126	38.7 Å²	38.7	48%	0.475	20%	0.202	S	C	.	.	H	α-helix	trans	-76.2	-32.4	174.6	-178.1	54.8	172.5	168.8	-7.1	112.8	K93 A96 N97 R126 A127 L128	K93-R130 HydrophobicContact CG-CB 4.41Å; K93-R130 HydrophobicContact CG-CG 4.42Å; A96-R130 HydrophobicContact CB-CG 4.35Å; N97-R130 PolarHBondContact ND2-NH2 3.49Å; N97-R130 PolarHBondContact OD1-NH2 3.44Å; R126-R130 PolarHBondContact O-N 3.25Å; A127-R130 WeakPolarHBondContact O-CB 3.31Å; A127-R130 PolarHBondContact O-N 3.39Å; L128-R130 PolarHBondContact O-N 3.46Å; L128-R130 VanDerWaalsContact O-N 3.12Å
131	I	89.1	Confident	89.2	Confident	18 Å²	18	39.5 Å²	39.5	9%	0.092	21%	0.206	C	C	.	.	H	α-helix	trans	-100.4	-4.9	-177	69.3	167.6	0	0	0	112.8	I92 A96 V102 V105 L109 A127 L128 M136	I92-I131 HydrophobicContact CG2-CG2 3.77Å; A96-I131 HydrophobicContact CB-CG2 3.74Å; V102-I131 HydrophobicContact CG1-CB 3.8Å; V102-I131 HydrophobicContact CG1-CD1 4.41Å; V102-I131 HydrophobicContact CG1-CG2 3.4Å; V105-I131 HydrophobicContact CG2-CD1 3.4Å; V105-I131 VanDerWaalsContact CG2-CD1 3.4Å; L109-I131 HydrophobicContact CD1-CD1 3.68Å; L109-I131 HydrophobicContact CD1-CG1 4.42Å; A127-I131 PolarHBondContact O-N 3.34Å; L128-I131 HydrophobicContact CD1-CD1 4.5Å; L128-I131 HydrophobicContact CD1-CG1 4.44Å; L128-I131 WeakPolarHBondContact O-CG1 3.49Å; L128-I131 PolarHBondContact O-N 3.38Å; I131-M136 WeakPolarHBondContact O-CE 3.27Å
132	T	87	Confident	89.1	Confident	9 Å²	9	46.1 Å²	46.1	6%	0.055	23%	0.231	C	C	.	.			trans	-78.3	133.3	-176.4	-62.9	0	0	0	0	110.2	L128 M136 L137 I140 M166 M169	L128-T132 WeakPolarHBondContact O-CB 3.45Å; L128-T132 PolarHBondContact O-N 3.12Å; L128-T132 PolarHBondContact O-OG1 2.86Å; T132-M136 HydrophobicContact CG2-CB 3.96Å; T132-L137 HydrophobicContact CG2-CB 3.87Å; T132-I140 HydrophobicContact CG2-CD1 3.93Å; T132-M166 HydrophobicContact CG2-CE 3.65Å; T132-M169 VanDerWaalsContact O-CE 3.3Å; T132-M169 WeakPolarHBondContact O-CE 3.45Å
133	D	83.8	Confident	89.2	Confident	66 Å²	66	50.1 Å²	50.1	35%	0.353	25%	0.246	S	C	.	.			trans	-97.7	178.1	169.3	68.8	29.7	0	0	0	112.1	T135 M136 L137	D133-T135 PolarHBondContact O-N 2.66Å; D133-T135 WeakPolarHBondContact OD1-CA 3.45Å; D133-T135 PolarHBondContact OD1-N 3.48Å; D133-T135 PolarHBondContact OD1-OG1 2.9Å; D133-M136 PolarHBondContact O-N 3.19Å; D133-M136 WeakPolarHBondContact OD1-CB 3.43Å; D133-M136 WeakPolarHBondContact OD1-CG 3.41Å; D133-M136 PolarHBondContact OD1-N 2.69Å; D133-L137 WeakPolarHBondContact O-CB 3.24Å; D133-L137 PolarHBondContact O-N 3.26Å
134	T	83.3	Confident	89.2	Confident	67 Å²	67	48.9 Å²	48.9	41%	0.411	24%	0.238	S	C	.	.	H	α-helix	trans	-59.2	-32.2	-178.6	-51.1	0	0	0	0	113.5
135	T	83	Confident	89.3	Confident	102 Å²	102	51.2 Å²	51.2	63%	0.626	25%	0.248	S	C	*	.	H	α-helix	trans	-78.7	-45.8	-178.3	67.9	0	0	0	0	111.3	D133 L137 Q138	D133-T135 PolarHBondContact O-N 2.66Å; D133-T135 WeakPolarHBondContact OD1-CA 3.45Å; D133-T135 PolarHBondContact OD1-N 3.48Å; D133-T135 PolarHBondContact OD1-OG1 2.9Å; T135-L137 VanDerWaalsContact C-N 3.27Å; T135-L137 PolarHBondContact O-N 2.82Å; T135-Q138 PolarHBondContact O-N 3.42Å
136	M	83.8	Confident	89.2	Confident	31 Å²	31	56 Å²	56	15%	0.153	27%	0.271	C	S	.	.	H	α-helix	trans	-68.2	-27.5	177.9	-70	-158.7	-68.1	0	0	112.4	I103 I131 T132 D133 Q138 A139 I140	I103-M136 HydrophobicContact CB-CE 4.02Å; I103-M136 HydrophobicContact CB-SD 3.98Å; I103-M136 HydrophobicContact CG2-CE 3.3Å; I103-M136 HydrophobicContact CG2-SD 3.84Å; I131-M136 WeakPolarHBondContact O-CE 3.27Å; T132-M136 HydrophobicContact CG2-CB 3.96Å; D133-M136 PolarHBondContact O-N 3.19Å; D133-M136 WeakPolarHBondContact OD1-CB 3.43Å; D133-M136 WeakPolarHBondContact OD1-CG 3.41Å; D133-M136 PolarHBondContact OD1-N 2.69Å; M136-Q138 PolarHBondContact O-N 3.39Å; M136-A139 WeakPolarHBondContact O-CB 3.45Å; M136-A139 PolarHBondContact O-N 3.35Å; M136-I140 PolarHBondContact O-N 3.19Å; M136-I140 VanDerWaalsContact O-N 3.15Å
137	L	86.3	Confident	89.3	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-56.6	-37.6	175.4	172.5	53.4	0	0	0	112	T132 D133 T135 A139 I140 E141 M166 M169 V173 W177	T132-L137 HydrophobicContact CG2-CB 3.87Å; D133-L137 WeakPolarHBondContact O-CB 3.24Å; D133-L137 PolarHBondContact O-N 3.26Å; T135-L137 VanDerWaalsContact C-N 3.27Å; T135-L137 PolarHBondContact O-N 2.82Å; L137-A139 VanDerWaalsContact C-N 3.33Å; L137-A139 PolarHBondContact O-N 3.12Å; L137-I140 HydrophobicContact CD1-CG1 4.35Å; L137-I140 WeakPolarHBondContact O-CG1 3.48Å; L137-I140 PolarHBondContact O-N 3.02Å; L137-E141 PolarHBondContact O-N 3.15Å; L137-E141 VanDerWaalsContact O-N 3.1Å; L137-M166 HydrophobicContact CB-CE 4.07Å; L137-M166 HydrophobicContact CD1-CE 3.15Å; L137-M166 HydrophobicContact CD1-SD 3.82Å; L137-M166 HydrophobicContact CD2-CE 4.02Å; L137-M166 HydrophobicContact CG-CE 3.88Å; L137-M169 HydrophobicContact CB-CE 4.5Å; L137-M169 HydrophobicContact CD2-CE 4.29Å; L137-V173 HydrophobicContact CD1-CG1 4.44Å; L137-V173 HydrophobicContact CD2-CB 3.96Å; L137-V173 HydrophobicContact CD2-CG1 4.09Å; L137-V173 HydrophobicContact CD2-CG2 4.46Å; L137-V173 HydrophobicContact CG-CB 4.3Å; L137-V173 HydrophobicContact CG-CG1 3.89Å; L137-W177 HydrophobicContact CD1-CH2 3.49Å; L137-W177 VanDerWaalsContact CD1-CH2 3.49Å; L137-W177 HydrophobicContact CD1-CZ2 3.77Å
138	Q	85.9	Confident	89.5	Confident	114 Å²	114	51.1 Å²	51.1	53%	0.533	25%	0.253	S	S	.	.	H	α-helix	trans	-66.2	-36.6	175.9	-60.9	-174.6	3.6	0	0	111.8	T135 M136 I140 E141 V173	T135-Q138 PolarHBondContact O-N 3.42Å; M136-Q138 PolarHBondContact O-N 3.39Å; Q138-I140 VanDerWaalsContact C-N 3.31Å; Q138-I140 PolarHBondContact O-N 3.39Å; Q138-E141 WeakPolarHBondContact O-CB 3.3Å; Q138-E141 PolarHBondContact O-N 3.33Å; Q138-V173 HydrophobicContact CG-CG2 4.27Å
139	A	86.8	Confident	89.6	Confident	77 Å²	77	53.5 Å²	53.5	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-67.5	-31.8	179	0	0	0	0	0	112.5	M136 L137	M136-A139 WeakPolarHBondContact O-CB 3.45Å; M136-A139 PolarHBondContact O-N 3.35Å; L137-A139 VanDerWaalsContact C-N 3.33Å; L137-A139 PolarHBondContact O-N 3.12Å
140	I	89.7	Confident	89.8	Confident	6 Å²	6	54.5 Å²	54.5	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-95.1	-4.6	-179.8	69.1	168.5	0	0	0	114	L128 T132 M136 L137 Q138 R142 Y143 M144 M166	L128-I140 HydrophobicContact CD2-CD1 4.12Å; L128-I140 HydrophobicContact CD2-CG2 4.19Å; L128-I140 HydrophobicContact CG-CD1 4.16Å; T132-I140 HydrophobicContact CG2-CD1 3.93Å; M136-I140 PolarHBondContact O-N 3.19Å; M136-I140 VanDerWaalsContact O-N 3.15Å; L137-I140 HydrophobicContact CD1-CG1 4.35Å; L137-I140 WeakPolarHBondContact O-CG1 3.48Å; L137-I140 PolarHBondContact O-N 3.02Å; Q138-I140 VanDerWaalsContact C-N 3.31Å; Q138-I140 PolarHBondContact O-N 3.39Å; I140-R142 VanDerWaalsContact C-N 3.33Å; I140-R142 PolarHBondContact O-N 2.85Å; I140-Y143 PolarHBondContact O-N 3.02Å; I140-M144 HydrophobicContact CD1-CG 4.26Å; I140-M144 HydrophobicContact CG1-CG 4.3Å; I140-M144 PolarHBondContact O-N 2.92Å; I140-M166 HydrophobicContact CD1-CE 4.41Å
141	E	90.7	Very high	89.9	Confident	26 Å²	26	58.3 Å²	58.3	12%	0.121	29%	0.292	C	S	.	.	H	α-helix	trans	-50.2	-48.6	-175.4	166.6	165.9	-170.6	0	0	112.5	L137 Q138 Y143 M144 K145 R176 W177	L137-E141 PolarHBondContact O-N 3.15Å; L137-E141 VanDerWaalsContact O-N 3.1Å; Q138-E141 WeakPolarHBondContact O-CB 3.3Å; Q138-E141 PolarHBondContact O-N 3.33Å; E141-Y143 VanDerWaalsContact C-N 3.28Å; E141-Y143 PolarHBondContact O-N 3.16Å; E141-M144 PolarHBondContact O-N 3.28Å; E141-K145 HydrophobicContact CG-CD 4.26Å; E141-K145 PolarHBondContact O-N 2.94Å; E141-K145 IonicContact OE1-NZ 2.65Å; E141-K145 PolarHBondContact OE1-NZ 3.43Å; E141-R176 IonicContact OE2-NH1 3.03Å; E141-R176 PolarHBondContact OE2-NH1 2.92Å; E141-W177 HydrophobicContact CB-CZ2 4.22Å; E141-W177 HydrophobicContact CG-CZ2 4.22Å; E141-W177 PolarHBondContact OE1-NE1 3.4Å
142	R	92.3	Very high	90.1	Very high	176 Å²	176	59.1 Å²	59.1	66%	0.664	30%	0.297	S	S	*	.	H	α-helix	trans	-57.8	-42.9	-179	179	-179	175.3	-175.3	0.9	111.7	I140 Q146	I140-R142 VanDerWaalsContact C-N 3.33Å; I140-R142 PolarHBondContact O-N 2.85Å; R142-Q146 WeakPolarHBondContact O-CG 3.49Å; R142-Q146 PolarHBondContact O-N 3.08Å
143	Y	92.6	Very high	90.4	Very high	85 Å²	85	61.2 Å²	61.2	33%	0.333	31%	0.311	S	S	.	.	H	α-helix	trans	-75.3	-32.9	-177.4	-54.4	-71.2	0	0	0	111.7	T110 M113 T114 I140 E141 Q146 A147	T110-Y143 HydrophobicContact CG2-CD2 4.18Å; T110-Y143 HydrophobicContact CG2-CE2 3.89Å; M113-Y143 HydrophobicContact CE-CD2 4.26Å; M113-Y143 HydrophobicContact CE-CG 3.86Å; T114-Y143 HydrophobicContact CG2-CD1 3.46Å; T114-Y143 VanDerWaalsContact CG2-CD1 3.46Å; T114-Y143 HydrophobicContact CG2-CE1 3.72Å; T114-Y143 HydrophobicContact CG2-CG 4.21Å; I140-Y143 PolarHBondContact O-N 3.02Å; E141-Y143 VanDerWaalsContact C-N 3.28Å; E141-Y143 PolarHBondContact O-N 3.16Å; Y143-Q146 PolarHBondContact O-N 3.01Å; Y143-A147 WeakPolarHBondContact O-CB 3.49Å; Y143-A147 PolarHBondContact O-N 2.99Å
144	M	94.4	Very high	90.9	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64	-44.9	173.3	-72.2	-58.6	-65.4	0	0	111.8	I125 I140 E141 Q146 A147 I148 A159 W177	I125-M144 HydrophobicContact CG2-CE 4.13Å; I125-M144 HydrophobicContact CG2-SD 4.03Å; I140-M144 HydrophobicContact CD1-CG 4.26Å; I140-M144 HydrophobicContact CG1-CG 4.3Å; I140-M144 PolarHBondContact O-N 2.92Å; E141-M144 PolarHBondContact O-N 3.28Å; M144-Q146 VanDerWaalsContact C-N 3.32Å; M144-Q146 PolarHBondContact O-N 3.23Å; M144-A147 PolarHBondContact O-N 3.36Å; M144-A147 VanDerWaalsContact O-N 3.14Å; M144-I148 VanDerWaalsContact O-CG1 3.28Å; M144-I148 WeakPolarHBondContact O-CG1 3.31Å; M144-I148 PolarHBondContact O-N 3.07Å; M144-A159 HydrophobicContact CE-CB 4.25Å; M144-W177 HydrophobicContact CB-CE3 4.47Å; M144-W177 HydrophobicContact CB-CH2 3.73Å; M144-W177 HydrophobicContact CB-CZ2 4.16Å; M144-W177 HydrophobicContact CB-CZ3 3.93Å; M144-W177 HydrophobicContact CE-CZ3 4.27Å; M144-W177 HydrophobicContact CG-CH2 3.93Å; M144-W177 HydrophobicContact CG-CZ3 4.33Å
145	K	94.2	Very high	91.4	Very high	48 Å²	48	57.9 Å²	57.9	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-55.1	-46.8	173.8	-77.9	175.9	156.6	157.7	0	112.1	E141 I148 W177 E180	E141-K145 HydrophobicContact CG-CD 4.26Å; E141-K145 PolarHBondContact O-N 2.94Å; E141-K145 IonicContact OE1-NZ 2.65Å; E141-K145 PolarHBondContact OE1-NZ 3.43Å; K145-I148 PolarHBondContact O-N 3.46Å; K145-W177 HydrophobicContact CG-CG 4.17Å; K145-E180 HydrophobicContact CB-CG 4.06Å; K145-E180 VanDerWaalsContact CD-OE1 3.24Å; K145-E180 WeakPolarHBondContact CD-OE1 3.45Å; K145-E180 WeakPolarHBondContact CE-OE1 3.39Å; K145-E180 HydrophobicContact CG-CG 4.13Å; K145-E180 WeakPolarHBondContact CG-OE1 3.37Å
146	Q	93.8	Very high	92	Very high	101 Å²	101	53.1 Å²	53.1	47%	0.472	27%	0.267	S	S	.	.	H	α-helix	trans	-63.6	-40.9	176.2	-70.4	177	-12.5	0	0	112.5	R142 Y143 M144 D150	R142-Q146 WeakPolarHBondContact O-CG 3.49Å; R142-Q146 PolarHBondContact O-N 3.08Å; Y143-Q146 PolarHBondContact O-N 3.01Å; M144-Q146 VanDerWaalsContact C-N 3.32Å; M144-Q146 PolarHBondContact O-N 3.23Å; Q146-D150 PolarHBondContact O-N 3.4Å
147	A	94.7	Very high	92.6	Very high	4 Å²	4	52.7 Å²	52.7	3%	0.033	27%	0.267	C	S	.	.	H	α-helix	trans	-67.1	-35.2	179.3	0	0	0	0	0	112.3	I125 Y143 M144 V149 D150 V155 S156 A159	I125-A147 HydrophobicContact CD1-CB 3.84Å; Y143-A147 WeakPolarHBondContact O-CB 3.49Å; Y143-A147 PolarHBondContact O-N 2.99Å; M144-A147 PolarHBondContact O-N 3.36Å; M144-A147 VanDerWaalsContact O-N 3.14Å; A147-V149 PolarHBondContact O-N 2.92Å; A147-D150 VanDerWaalsContact O-CB 3.25Å; A147-D150 WeakPolarHBondContact O-CB 3.37Å; A147-D150 PolarHBondContact O-N 3.36Å; A147-V155 HydrophobicContact CB-CG1 4.2Å; A147-S156 WeakPolarHBondContact O-CA 3.22Å; A147-A159 HydrophobicContact CB-CB 3.68Å
148	I	95.8	Very high	93	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-42.9	178.4	-72.7	164.7	0	0	0	111.7	M144 K145 D150 S156 A159 L160 W177 E180 A184	M144-I148 VanDerWaalsContact O-CG1 3.28Å; M144-I148 WeakPolarHBondContact O-CG1 3.31Å; M144-I148 PolarHBondContact O-N 3.07Å; K145-I148 PolarHBondContact O-N 3.46Å; I148-D150 VanDerWaalsContact C-N 3.32Å; I148-S156 WeakPolarHBondContact O-CB 3.49Å; I148-S156 PolarHBondContact O-OG 3.45Å; I148-A159 HydrophobicContact CG1-CB 3.95Å; I148-L160 HydrophobicContact CG1-CD2 4.38Å; I148-L160 HydrophobicContact CG2-CD2 3.71Å; I148-L160 HydrophobicContact CG2-CG 4.3Å; I148-W177 HydrophobicContact CD1-CB 4.22Å; I148-W177 HydrophobicContact CD1-CD2 4.42Å; I148-W177 HydrophobicContact CD1-CE3 3.86Å; I148-E180 HydrophobicContact CB-CB 4.29Å; I148-E180 HydrophobicContact CG2-CB 3.85Å; I148-A184 HydrophobicContact CG2-CB 4.08Å
149	V	94.9	Very high	93.4	Very high	51 Å²	51	47.7 Å²	47.7	31%	0.309	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	16	179.8	-61.3	0	0	0	0	113	A147 E180 E183	A147-V149 PolarHBondContact O-N 2.92Å; V149-E180 HydrophobicContact CG1-CB 3.88Å; V149-E180 HydrophobicContact CG1-CG 4.3Å; V149-E180 WeakPolarHBondContact CG1-O 3.44Å; V149-E183 HydrophobicContact CG1-CB 4.1Å; V149-E183 HydrophobicContact CG1-CG 4.2Å
150	D	94.4	Very high	93.9	Very high	38 Å²	38	44 Å²	44	20%	0.203	21%	0.214	C	C	.	.			trans	-64.7	143.2	-178.4	-162.7	-84.3	0	0	0	111.8	R121 Q146 A147 I148 V152 V155	R121-D150 IonicContact CZ-OD2 3.35Å; R121-D150 IonicContact NH1-OD1 3.38Å; R121-D150 PolarHBondContact NH1-OD1 3.39Å; R121-D150 IonicContact NH1-OD2 3.17Å; R121-D150 PolarHBondContact NH1-OD2 2.86Å; R121-D150 IonicContact NH2-OD2 2.66Å; R121-D150 PolarHBondContact NH2-OD2 3.03Å; Q146-D150 PolarHBondContact O-N 3.4Å; A147-D150 VanDerWaalsContact O-CB 3.25Å; A147-D150 WeakPolarHBondContact O-CB 3.37Å; A147-D150 PolarHBondContact O-N 3.36Å; I148-D150 VanDerWaalsContact C-N 3.32Å; D150-V152 PolarHBondContact O-N 3.21Å; D150-V152 VanDerWaalsContact OD1-CB 3.28Å; D150-V152 WeakPolarHBondContact OD1-CB 3.49Å; D150-V152 WeakPolarHBondContact OD1-CG2 3.45Å; D150-V152 PolarHBondContact OD1-N 2.85Å; D150-V155 HydrophobicContact CB-CB 4.23Å; D150-V155 HydrophobicContact CB-CG1 4Å
151	K	91.3	Very high	94.2	Very high	206 Å²	206	46 Å²	46	90%	0.896	23%	0.226	S	C	*	.	S	Bend	trans	-66.1	-25.2	179.4	-65.3	-175.4	179.4	-178.2	0	112.5	P153	K151-P153 VanDerWaalsContact O-CD 3.3Å; K151-P153 WeakPolarHBondContact O-CD 3.34Å
152	V	94.2	Very high	94.3	Very high	34 Å²	34	45 Å²	45	21%	0.206	22%	0.222	C	C	.	.	S	Bend	trans	-83.1	113.2	179.2	-176.1	0	0	0	0	108.9	D118 D150 S154 V155 S156	D118-V152 HydrophobicContact CB-CG1 4.39Å; D150-V152 PolarHBondContact O-N 3.21Å; D150-V152 VanDerWaalsContact OD1-CB 3.28Å; D150-V152 WeakPolarHBondContact OD1-CB 3.49Å; D150-V152 WeakPolarHBondContact OD1-CG2 3.45Å; D150-V152 PolarHBondContact OD1-N 2.85Å; V152-S154 VanDerWaalsContact C-N 3.27Å; V152-S154 WeakPolarHBondContact CG1-OG 3.17Å; V152-S154 PolarHBondContact O-N 2.86Å; V152-S154 VanDerWaalsContact O-N 3.16Å; V152-V155 HydrophobicContact CB-CB 4.28Å; V152-V155 HydrophobicContact CB-CG2 3.94Å; V152-V155 HydrophobicContact CG1-CG2 3.95Å; V152-V155 PolarHBondContact O-N 3.1Å; V152-S156 PolarHBondContact O-N 3.49Å; V152-S156 VanDerWaalsContact O-N 3.15Å
153	P	93.8	Very high	94.4	Very high	53 Å²	53	36.6 Å²	36.6	34%	0.344	19%	0.19	S	C	.	.	H	α-helix	trans	-61.5	-32	-172.2	-26.6	36.3	0	0	0	114.3	K151 V155 S157 N189 V192	K151-P153 VanDerWaalsContact O-CD 3.3Å; K151-P153 WeakPolarHBondContact O-CD 3.34Å; P153-V155 VanDerWaalsContact C-N 3.31Å; P153-V155 PolarHBondContact O-N 3.45Å; P153-S157 WeakPolarHBondContact O-CB 3.33Å; P153-S157 PolarHBondContact O-N 2.7Å; P153-N189 HydrophobicContact CB-CB 4.15Å; P153-N189 WeakPolarHBondContact CB-ND2 3.41Å; P153-N189 HydrophobicContact CG-CB 4.23Å; P153-V192 HydrophobicContact CB-CG2 3.87Å
154	S	92.7	Very high	94.5	Very high	64 Å²	64	35 Å²	35	45%	0.448	19%	0.188	S	C	.	.	H	α-helix	trans	-66.9	-33.4	178.3	60.9	0	0	0	0	112.3	V152 S158	V152-S154 VanDerWaalsContact C-N 3.27Å; V152-S154 WeakPolarHBondContact CG1-OG 3.17Å; V152-S154 PolarHBondContact O-N 2.86Å; V152-S154 VanDerWaalsContact O-N 3.16Å; S154-S158 VanDerWaalsContact O-CB 3.27Å; S154-S158 WeakPolarHBondContact O-CB 3.47Å; S154-S158 PolarHBondContact O-N 3.25Å; S154-S158 VanDerWaalsContact O-N 3.09Å; S154-S158 PolarHBondContact O-OG 3.36Å
155	V	94.8	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-73.6	-52.7	177.6	-180	0	0	0	0	109.6	R121 I125 A147 D150 V152 P153 S157 S158 A159	R121-V155 HydrophobicContact CB-CG1 4.41Å; R121-V155 HydrophobicContact CB-CG2 3.78Å; I125-V155 HydrophobicContact CD1-CG1 3.72Å; A147-V155 HydrophobicContact CB-CG1 4.2Å; D150-V155 HydrophobicContact CB-CB 4.23Å; D150-V155 HydrophobicContact CB-CG1 4Å; V152-V155 HydrophobicContact CB-CB 4.28Å; V152-V155 HydrophobicContact CB-CG2 3.94Å; V152-V155 HydrophobicContact CG1-CG2 3.95Å; V152-V155 PolarHBondContact O-N 3.1Å; P153-V155 VanDerWaalsContact C-N 3.31Å; P153-V155 PolarHBondContact O-N 3.45Å; V155-S157 PolarHBondContact O-N 3.16Å; V155-S158 PolarHBondContact O-N 3.19Å; V155-S158 VanDerWaalsContact O-N 3.15Å; V155-A159 WeakPolarHBondContact O-CB 3.4Å; V155-A159 PolarHBondContact O-N 3.07Å
156	S	95.6	Very high	94.1	Very high	2 Å²	2	39 Å²	39	1%	0.014	21%	0.206	C	C	.	.	H	α-helix	trans	-56.8	-48.3	176.6	172.3	0	0	0	0	112.5	A147 I148 V152 S158 A159 L160 V192	A147-S156 WeakPolarHBondContact O-CA 3.22Å; I148-S156 WeakPolarHBondContact O-CB 3.49Å; I148-S156 PolarHBondContact O-OG 3.45Å; V152-S156 PolarHBondContact O-N 3.49Å; V152-S156 VanDerWaalsContact O-N 3.15Å; S156-S158 PolarHBondContact O-N 3.43Å; S156-A159 PolarHBondContact O-N 3.41Å; S156-L160 WeakPolarHBondContact O-CB 3.35Å; S156-L160 VanDerWaalsContact O-CG 3.28Å; S156-L160 WeakPolarHBondContact O-CG 3.39Å; S156-L160 PolarHBondContact O-N 3.04Å; S156-V192 VanDerWaalsContact OG-CG1 3.26Å; S156-V192 WeakPolarHBondContact OG-CG1 3.45Å
157	S	95.6	Very high	93.9	Very high	22 Å²	22	35.1 Å²	35.1	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-59.3	-43.3	175.7	179.1	0	0	0	0	112.4	P153 V155 L160 V161 H195	P153-S157 WeakPolarHBondContact O-CB 3.33Å; P153-S157 PolarHBondContact O-N 2.7Å; V155-S157 PolarHBondContact O-N 3.16Å; S157-L160 PolarHBondContact O-N 3.24Å; S157-V161 WeakPolarHBondContact O-CG2 3.32Å; S157-V161 PolarHBondContact O-N 2.88Å; S157-V161 VanDerWaalsContact O-N 3.12Å; S157-H195 PolarHBondContact OG-CE1 2.84Å; S157-H195 PolarHBondContact OG-ND1 3.22Å
158	S	94.7	Very high	93.5	Very high	8 Å²	8	44.3 Å²	44.3	6%	0.056	23%	0.229	C	C	.	.	H	α-helix	trans	-65.2	-40.5	176.8	-60.6	0	0	0	0	112.1	R126 S154 V155 S156 S162	R126-S158 PolarHBondContact NH1-OG 3.06Å; S154-S158 VanDerWaalsContact O-CB 3.27Å; S154-S158 WeakPolarHBondContact O-CB 3.47Å; S154-S158 PolarHBondContact O-N 3.25Å; S154-S158 VanDerWaalsContact O-N 3.09Å; S154-S158 PolarHBondContact O-OG 3.36Å; V155-S158 PolarHBondContact O-N 3.19Å; V155-S158 VanDerWaalsContact O-N 3.15Å; S156-S158 PolarHBondContact O-N 3.43Å; S158-S162 VanDerWaalsContact O-CB 3.23Å; S158-S162 WeakPolarHBondContact O-CB 3.41Å; S158-S162 PolarHBondContact O-N 3.49Å; S158-S162 PolarHBondContact O-OG 2.65Å
159	A	95.7	Very high	93	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-48.2	177	0	0	0	0	0	111.2	I125 M144 A147 I148 V155 S156 V161 S162 S163	I125-A159 HydrophobicContact CD1-CB 4.42Å; I125-A159 HydrophobicContact CG2-CB 4.49Å; M144-A159 HydrophobicContact CE-CB 4.25Å; A147-A159 HydrophobicContact CB-CB 3.68Å; I148-A159 HydrophobicContact CG1-CB 3.95Å; V155-A159 WeakPolarHBondContact O-CB 3.4Å; V155-A159 PolarHBondContact O-N 3.07Å; S156-A159 PolarHBondContact O-N 3.41Å; A159-V161 PolarHBondContact O-N 3.08Å; A159-S162 PolarHBondContact O-N 2.65Å; A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.47Å; A159-S163 PolarHBondContact O-OG 3.42Å
160	L	96.4	Very high	92.7	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-58.9	-46.8	179.5	-73.7	165	0	0	0	112.9	I148 S156 S157 S163 L164 A181 A184 V192 H195 A196 L199	I148-L160 HydrophobicContact CG1-CD2 4.38Å; I148-L160 HydrophobicContact CG2-CD2 3.71Å; I148-L160 HydrophobicContact CG2-CG 4.3Å; S156-L160 WeakPolarHBondContact O-CB 3.35Å; S156-L160 VanDerWaalsContact O-CG 3.28Å; S156-L160 WeakPolarHBondContact O-CG 3.39Å; S156-L160 PolarHBondContact O-N 3.04Å; S157-L160 PolarHBondContact O-N 3.24Å; L160-S163 WeakPolarHBondContact O-CB 3.46Å; L160-S163 PolarHBondContact O-N 3.15Å; L160-L164 PolarHBondContact O-N 2.62Å; L160-A181 HydrophobicContact CD2-CB 4.49Å; L160-A184 HydrophobicContact CD1-CB 4.18Å; L160-A184 HydrophobicContact CD2-CB 4.39Å; L160-V192 HydrophobicContact CD1-CG1 3.94Å; L160-H195 HydrophobicContact CB-CB 3.84Å; L160-H195 HydrophobicContact CD1-CB 4.07Å; L160-A196 HydrophobicContact CD1-CB 3.84Å; L160-A196 HydrophobicContact CD2-CB 4.06Å; L160-L199 HydrophobicContact CD2-CD2 3.85Å
161	V	95.1	Very high	92.5	Very high	46 Å²	46	47.5 Å²	47.5	28%	0.279	24%	0.239	S	C	.	.	H	α-helix	trans	-67.9	-40	177.7	176.7	0	0	0	0	110.9	S157 A159 L164 H165 H195	S157-V161 WeakPolarHBondContact O-CG2 3.32Å; S157-V161 PolarHBondContact O-N 2.88Å; S157-V161 VanDerWaalsContact O-N 3.12Å; A159-V161 PolarHBondContact O-N 3.08Å; V161-L164 WeakPolarHBondContact O-CB 3.22Å; V161-L164 PolarHBondContact O-N 3.47Å; V161-H165 PolarHBondContact O-CD2 3.48Å; V161-H165 PolarHBondContact O-N 3.3Å; V161-H165 VanDerWaalsContact O-N 3.11Å; V161-H195 HydrophobicContact CG2-CB 4.18Å
162	S	93.7	Very high	92.4	Very high	5 Å²	5	43 Å²	43	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-64.6	-43.1	176.8	-56.1	0	0	0	0	111.3	C129 S158 A159 L164 H165 M166	C129-S162 VanDerWaalsContact SG-CB 3.56Å; S158-S162 VanDerWaalsContact O-CB 3.23Å; S158-S162 WeakPolarHBondContact O-CB 3.41Å; S158-S162 PolarHBondContact O-N 3.49Å; S158-S162 PolarHBondContact O-OG 2.65Å; A159-S162 PolarHBondContact O-N 2.65Å; S162-L164 VanDerWaalsContact C-N 3.27Å; S162-L164 PolarHBondContact O-N 3.03Å; S162-H165 WeakPolarHBondContact O-CB 3.46Å; S162-H165 PolarHBondContact O-N 3.01Å; S162-H165 VanDerWaalsContact O-N 3.12Å; S162-M166 VanDerWaalsContact O-CG 3.28Å; S162-M166 WeakPolarHBondContact O-CG 3.33Å; S162-M166 PolarHBondContact O-N 3.02Å
163	S	94.6	Very high	92.2	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-55.3	-42.4	171.9	-60.6	0	0	0	0	111.6	A159 L160 H165 M166 V167 W177	A159-S163 WeakPolarHBondContact O-CB 3.43Å; A159-S163 PolarHBondContact O-N 3.47Å; A159-S163 PolarHBondContact O-OG 3.42Å; L160-S163 WeakPolarHBondContact O-CB 3.46Å; L160-S163 PolarHBondContact O-N 3.15Å; S163-H165 PolarHBondContact O-N 3.4Å; S163-M166 WeakPolarHBondContact O-CB 3.49Å; S163-M166 PolarHBondContact O-N 3.45Å; S163-M166 VanDerWaalsContact O-N 3.12Å; S163-V167 WeakPolarHBondContact O-CG2 3.39Å; S163-V167 PolarHBondContact O-N 3.46Å; S163-W177 VanDerWaalsContact OG-CZ3 3.24Å; S163-W177 WeakPolarHBondContact OG-CZ3 3.24Å
164	L	93.4	Very high	92.2	Very high	53 Å²	53	39 Å²	39	28%	0.277	20%	0.2	S	C	.	.	H	α-helix	trans	-61.7	-41.5	176.8	178.6	62.8	0	0	0	112.5	L160 V161 S162 M166 V167 L199 H202	L160-L164 PolarHBondContact O-N 2.62Å; V161-L164 WeakPolarHBondContact O-CB 3.22Å; V161-L164 PolarHBondContact O-N 3.47Å; S162-L164 VanDerWaalsContact C-N 3.27Å; S162-L164 PolarHBondContact O-N 3.03Å; L164-M166 VanDerWaalsContact C-N 3.28Å; L164-M166 PolarHBondContact O-N 3.25Å; L164-V167 WeakPolarHBondContact O-CB 3.29Å; L164-V167 PolarHBondContact O-N 2.94Å; L164-L199 HydrophobicContact CB-CD1 4.19Å; L164-L199 HydrophobicContact CD1-CD1 4.46Å; L164-H202 HydrophobicContact CD1-CB 3.65Å; L164-H202 WeakPolarHBondContact CD1-CD2 3.42Å
165	H	90.8	Very high	92.1	Very high	126 Å²	126	41.1 Å²	41.1	58%	0.583	20%	0.201	S	C	*	.	H	α-helix	trans	-62.5	-38.1	173.6	-71.3	-68.5	0	0	0	111.9	V161 S162 S163 V167 K168	V161-H165 PolarHBondContact O-CD2 3.48Å; V161-H165 PolarHBondContact O-N 3.3Å; V161-H165 VanDerWaalsContact O-N 3.11Å; S162-H165 WeakPolarHBondContact O-CB 3.46Å; S162-H165 PolarHBondContact O-N 3.01Å; S162-H165 VanDerWaalsContact O-N 3.12Å; S163-H165 PolarHBondContact O-N 3.4Å; H165-V167 VanDerWaalsContact C-N 3.3Å; H165-V167 PolarHBondContact O-N 2.61Å; H165-K168 PolarHBondContact O-N 2.83Å
166	M	90.3	Very high	92	Very high	4 Å²	4	47 Å²	47	2%	0.02	22%	0.224	C	C	.	.	H	α-helix	trans	-70.9	-22.6	179.3	-62.7	179.8	97.5	0	0	113.4	C129 T132 L137 I140 S162 S163 L164 K168 M169 S170 V174	C129-M166 HydrophobicContact CB-CG 4.34Å; C129-M166 HydrophobicContact CB-SD 3.92Å; T132-M166 HydrophobicContact CG2-CE 3.65Å; L137-M166 HydrophobicContact CB-CE 4.07Å; L137-M166 HydrophobicContact CD1-CE 3.15Å; L137-M166 HydrophobicContact CD1-SD 3.82Å; L137-M166 HydrophobicContact CD2-CE 4.02Å; L137-M166 HydrophobicContact CG-CE 3.88Å; I140-M166 HydrophobicContact CD1-CE 4.41Å; S162-M166 VanDerWaalsContact O-CG 3.28Å; S162-M166 WeakPolarHBondContact O-CG 3.33Å; S162-M166 PolarHBondContact O-N 3.02Å; S163-M166 WeakPolarHBondContact O-CB 3.49Å; S163-M166 PolarHBondContact O-N 3.45Å; S163-M166 VanDerWaalsContact O-N 3.12Å; L164-M166 VanDerWaalsContact C-N 3.28Å; L164-M166 PolarHBondContact O-N 3.25Å; M166-K168 PolarHBondContact O-N 3.25Å; M166-K168 VanDerWaalsContact O-N 3.17Å; M166-M169 HydrophobicContact CE-CE 3.99Å; M166-M169 PolarHBondContact O-N 3.11Å; M166-S170 PolarHBondContact O-N 2.83Å; M166-V174 HydrophobicContact CB-CG2 3.98Å
167	V	90	Very high	91.9	Very high	21 Å²	21	47 Å²	47	13%	0.127	22%	0.223	C	C	.	.	H	α-helix	trans	-54.2	-35.1	173.8	177.2	0	0	0	0	111.5	S163 L164 H165 M169 Y171 V174 L199 L203	S163-V167 WeakPolarHBondContact O-CG2 3.39Å; S163-V167 PolarHBondContact O-N 3.46Å; L164-V167 WeakPolarHBondContact O-CB 3.29Å; L164-V167 PolarHBondContact O-N 2.94Å; H165-V167 VanDerWaalsContact C-N 3.3Å; H165-V167 PolarHBondContact O-N 2.61Å; V167-M169 VanDerWaalsContact C-N 3.31Å; V167-M169 PolarHBondContact O-N 2.85Å; V167-Y171 HydrophobicContact CG1-CD2 3.81Å; V167-Y171 PolarHBondContact O-N 3.13Å; V167-V174 HydrophobicContact CG2-CB 4.18Å; V167-V174 HydrophobicContact CG2-CG1 3.76Å; V167-L199 HydrophobicContact CG2-CD1 3.86Å; V167-L203 HydrophobicContact CG1-CD2 4.46Å; V167-L203 HydrophobicContact CG2-CD2 3.88Å
168	K	85.4	Confident	91.8	Very high	196 Å²	196	47.1 Å²	47.1	85%	0.852	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-29.5	177.2	-66.1	-172.1	178.3	-173.3	0	113.2	H165 M166	H165-K168 PolarHBondContact O-N 2.83Å; M166-K168 PolarHBondContact O-N 3.25Å; M166-K168 VanDerWaalsContact O-N 3.17Å
169	M	85.8	Confident	91.8	Very high	78 Å²	78	52.8 Å²	52.8	38%	0.384	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-41.7	-177.2	-175.5	177.8	71.6	0	0	111.9	T132 L137 M166 V167	T132-M169 VanDerWaalsContact O-CE 3.3Å; T132-M169 WeakPolarHBondContact O-CE 3.45Å; L137-M169 HydrophobicContact CB-CE 4.5Å; L137-M169 HydrophobicContact CD2-CE 4.29Å; M166-M169 HydrophobicContact CE-CE 3.99Å; M166-M169 PolarHBondContact O-N 3.11Å; V167-M169 VanDerWaalsContact C-N 3.31Å; V167-M169 PolarHBondContact O-N 2.85Å
170	S	88.5	Confident	91.8	Very high	14 Å²	14	54.6 Å²	54.6	10%	0.098	26%	0.261	C	S	.	.			trans	-150.5	88.1	-178.4	-170.4	0	0	0	0	111.1	M166 V173 V174	M166-S170 PolarHBondContact O-N 2.83Å; S170-V173 WeakPolarHBondContact OG-CG2 3.1Å; S170-V174 WeakPolarHBondContact O-CG2 3.5Å; S170-V174 PolarHBondContact O-N 2.95Å
171	Y	90.4	Very high	91.7	Very high	64 Å²	64	54.6 Å²	54.6	25%	0.251	26%	0.261	S	S	.	.	H	α-helix	trans	-61.5	-43.3	179.6	175.6	-95.6	0	0	0	112.2	V167 V173 V174 K175 L203	V167-Y171 HydrophobicContact CG1-CD2 3.81Å; V167-Y171 PolarHBondContact O-N 3.13Å; Y171-V173 VanDerWaalsContact C-N 3.34Å; Y171-V173 PolarHBondContact O-N 2.92Å; Y171-V174 PolarHBondContact O-N 3.47Å; Y171-K175 HydrophobicContact CD1-CD 4.48Å; Y171-K175 HydrophobicContact CE1-CB 4.44Å; Y171-K175 HydrophobicContact CE1-CD 3.65Å; Y171-K175 HydrophobicContact CE1-CG 4.49Å; Y171-K175 VanDerWaalsContact O-CB 3.3Å; Y171-K175 WeakPolarHBondContact O-CB 3.47Å; Y171-K175 PolarHBondContact O-N 2.66Å; Y171-L203 HydrophobicContact CD2-CD2 4.43Å; Y171-L203 HydrophobicContact CE2-CD2 4.17Å; Y171-L203 PolarHBondContact OH-O 3.46Å
172	D	89.6	Confident	91.6	Very high	113 Å²	113	53.7 Å²	53.7	60%	0.604	25%	0.254	S	S	*	.	H	α-helix	trans	-66.3	-32.2	-173.2	-63.1	-46.2	0	0	0	114.1	R176	D172-R176 PolarHBondContact O-NE 3.01Å
173	V	90.3	Very high	91.5	Very high	3 Å²	3	59.4 Å²	59.4	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-74.2	-48.8	176.9	-179.1	0	0	0	0	109.9	L137 Q138 S170 Y171 K175 R176 W177	L137-V173 HydrophobicContact CD1-CG1 4.44Å; L137-V173 HydrophobicContact CD2-CB 3.96Å; L137-V173 HydrophobicContact CD2-CG1 4.09Å; L137-V173 HydrophobicContact CD2-CG2 4.46Å; L137-V173 HydrophobicContact CG-CB 4.3Å; L137-V173 HydrophobicContact CG-CG1 3.89Å; Q138-V173 HydrophobicContact CG-CG2 4.27Å; S170-V173 WeakPolarHBondContact OG-CG2 3.1Å; Y171-V173 VanDerWaalsContact C-N 3.34Å; Y171-V173 PolarHBondContact O-N 2.92Å; V173-K175 VanDerWaalsContact C-N 3.29Å; V173-K175 PolarHBondContact O-N 2.88Å; V173-R176 WeakPolarHBondContact O-CB 3.48Å; V173-R176 PolarHBondContact O-N 3.22Å; V173-R176 VanDerWaalsContact O-N 3.14Å; V173-W177 HydrophobicContact CG1-CZ2 4.07Å; V173-W177 PolarHBondContact O-NE1 3.11Å
174	V	92.3	Very high	91.5	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-67.5	-30.4	-178.1	-174.2	0	0	0	0	111.7	M166 V167 S170 Y171 R176 W177 L199 L203	M166-V174 HydrophobicContact CB-CG2 3.98Å; V167-V174 HydrophobicContact CG2-CB 4.18Å; V167-V174 HydrophobicContact CG2-CG1 3.76Å; S170-V174 WeakPolarHBondContact O-CG2 3.5Å; S170-V174 PolarHBondContact O-N 2.95Å; Y171-V174 PolarHBondContact O-N 3.47Å; V174-R176 PolarHBondContact O-N 2.87Å; V174-R176 VanDerWaalsContact O-N 3.13Å; V174-W177 HydrophobicContact CB-CE3 4.32Å; V174-W177 HydrophobicContact CG1-CD2 4.32Å; V174-W177 HydrophobicContact CG1-CE3 3.77Å; V174-W177 HydrophobicContact CG1-CZ3 4.15Å; V174-W177 HydrophobicContact CG2-CE3 4.36Å; V174-W177 HydrophobicContact CG2-CH2 4.23Å; V174-W177 HydrophobicContact CG2-CZ3 4.05Å; V174-W177 VanDerWaalsContact O-CB 3.3Å; V174-W177 WeakPolarHBondContact O-CB 3.36Å; V174-W177 PolarHBondContact O-N 3.17Å; V174-L199 HydrophobicContact CG1-CD1 4.18Å; V174-L203 HydrophobicContact CB-CD2 4.41Å; V174-L203 HydrophobicContact CG1-CD1 4.45Å; V174-L203 HydrophobicContact CG1-CD2 4.1Å
175	K	92	Very high	91.4	Very high	107 Å²	107	57.2 Å²	57.2	47%	0.465	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-57.9	-25.3	174.1	-174.1	177.3	-176.7	174.4	0	113.1	Y171 V173 W177 V178	Y171-K175 HydrophobicContact CD1-CD 4.48Å; Y171-K175 HydrophobicContact CE1-CB 4.44Å; Y171-K175 HydrophobicContact CE1-CD 3.65Å; Y171-K175 HydrophobicContact CE1-CG 4.49Å; Y171-K175 VanDerWaalsContact O-CB 3.3Å; Y171-K175 WeakPolarHBondContact O-CB 3.47Å; Y171-K175 PolarHBondContact O-N 2.66Å; V173-K175 VanDerWaalsContact C-N 3.29Å; V173-K175 PolarHBondContact O-N 2.88Å; K175-W177 PolarHBondContact O-N 3.03Å; K175-V178 WeakPolarHBondContact O-CG2 3.38Å
176	R	92.5	Very high	91.4	Very high	125 Å²	125	54.7 Å²	54.7	47%	0.472	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-71.3	-9.9	175.7	-54.8	174.3	-156.1	169.6	-2.5	113.2	E141 D172 V173 V174	E141-R176 IonicContact OE2-NH1 3.03Å; E141-R176 PolarHBondContact OE2-NH1 2.92Å; D172-R176 PolarHBondContact O-NE 3.01Å; V173-R176 WeakPolarHBondContact O-CB 3.48Å; V173-R176 PolarHBondContact O-N 3.22Å; V173-R176 VanDerWaalsContact O-N 3.14Å; V174-R176 PolarHBondContact O-N 2.87Å; V174-R176 VanDerWaalsContact O-N 3.13Å
177	W	93.9	Very high	91.4	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-99.7	10.8	-174.2	-47.6	-7.2	0	0	0	112	L137 E141 M144 K145 I148 S163 V173 V174 K175 N179 E180 A181	L137-W177 HydrophobicContact CD1-CH2 3.49Å; L137-W177 VanDerWaalsContact CD1-CH2 3.49Å; L137-W177 HydrophobicContact CD1-CZ2 3.77Å; E141-W177 HydrophobicContact CB-CZ2 4.22Å; E141-W177 HydrophobicContact CG-CZ2 4.22Å; E141-W177 PolarHBondContact OE1-NE1 3.4Å; M144-W177 HydrophobicContact CB-CE3 4.47Å; M144-W177 HydrophobicContact CB-CH2 3.73Å; M144-W177 HydrophobicContact CB-CZ2 4.16Å; M144-W177 HydrophobicContact CB-CZ3 3.93Å; M144-W177 HydrophobicContact CE-CZ3 4.27Å; M144-W177 HydrophobicContact CG-CH2 3.93Å; M144-W177 HydrophobicContact CG-CZ3 4.33Å; K145-W177 HydrophobicContact CG-CG 4.17Å; I148-W177 HydrophobicContact CD1-CB 4.22Å; I148-W177 HydrophobicContact CD1-CD2 4.42Å; I148-W177 HydrophobicContact CD1-CE3 3.86Å; S163-W177 VanDerWaalsContact OG-CZ3 3.24Å; S163-W177 WeakPolarHBondContact OG-CZ3 3.24Å; V173-W177 HydrophobicContact CG1-CZ2 4.07Å; V173-W177 PolarHBondContact O-NE1 3.11Å; V174-W177 HydrophobicContact CB-CE3 4.32Å; V174-W177 HydrophobicContact CG1-CD2 4.32Å; V174-W177 HydrophobicContact CG1-CE3 3.77Å; V174-W177 HydrophobicContact CG1-CZ3 4.15Å; V174-W177 HydrophobicContact CG2-CE3 4.36Å; V174-W177 HydrophobicContact CG2-CH2 4.23Å; V174-W177 HydrophobicContact CG2-CZ3 4.05Å; V174-W177 VanDerWaalsContact O-CB 3.3Å; V174-W177 WeakPolarHBondContact O-CB 3.36Å; V174-W177 PolarHBondContact O-N 3.17Å; K175-W177 PolarHBondContact O-N 3.03Å; W177-N179 PolarHBondContact O-N 2.9Å; W177-E180 VanDerWaalsContact CA-OE2 3.28Å; W177-E180 WeakPolarHBondContact CA-OE2 3.37Å; W177-E180 PolarHBondContact O-N 2.93Å; W177-A181 WeakPolarHBondContact O-CB 3.41Å; W177-A181 PolarHBondContact O-N 3.27Å
178	V	92.6	Very high	91.4	Very high	26 Å²	26	60.8 Å²	60.8	16%	0.158	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-33.5	-177.6	166.9	0	0	0	0	111.8	K175 Q182 L200 L203 R204	K175-V178 WeakPolarHBondContact O-CG2 3.38Å; V178-Q182 WeakPolarHBondContact O-CB 3.24Å; V178-Q182 PolarHBondContact O-N 2.8Å; V178-L200 HydrophobicContact CG1-CD2 4.11Å; V178-L203 HydrophobicContact CG2-CB 4.22Å; V178-L203 HydrophobicContact CG2-CD1 3.67Å; V178-R204 VanDerWaalsContact CG1-NH2 3.26Å
179	N	93.8	Very high	91.8	Very high	126 Å²	126	54.1 Å²	54.1	67%	0.674	28%	0.275	S	S	*	.	H	α-helix	trans	-69.1	-45.4	-179.6	-69.6	-25	0	0	0	111.2	W177 Q182 E183	W177-N179 PolarHBondContact O-N 2.9Å; N179-Q182 WeakPolarHBondContact O-CB 3.35Å; N179-Q182 PolarHBondContact O-N 2.84Å; N179-Q182 VanDerWaalsContact O-N 3.16Å; N179-E183 PolarHBondContact O-N 2.73Å
180	E	95.8	Very high	92.2	Very high	39 Å²	39	54.2 Å²	54.2	18%	0.182	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-43	176.3	-65.7	84	170.4	0	0	111	K145 I148 V149 W177 Q182 E183 A184	K145-E180 HydrophobicContact CB-CG 4.06Å; K145-E180 VanDerWaalsContact CD-OE1 3.24Å; K145-E180 WeakPolarHBondContact CD-OE1 3.45Å; K145-E180 WeakPolarHBondContact CE-OE1 3.39Å; K145-E180 HydrophobicContact CG-CG 4.13Å; K145-E180 WeakPolarHBondContact CG-OE1 3.37Å; I148-E180 HydrophobicContact CB-CB 4.29Å; I148-E180 HydrophobicContact CG2-CB 3.85Å; V149-E180 HydrophobicContact CG1-CB 3.88Å; V149-E180 HydrophobicContact CG1-CG 4.3Å; V149-E180 WeakPolarHBondContact CG1-O 3.44Å; W177-E180 VanDerWaalsContact CA-OE2 3.28Å; W177-E180 WeakPolarHBondContact CA-OE2 3.37Å; W177-E180 PolarHBondContact O-N 2.93Å; E180-Q182 VanDerWaalsContact C-N 3.29Å; E180-Q182 PolarHBondContact O-N 2.69Å; E180-E183 PolarHBondContact O-N 2.61Å; E180-A184 WeakPolarHBondContact O-CB 3.45Å; E180-A184 PolarHBondContact O-N 2.92Å
181	A	94.6	Very high	92.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-63.5	-36.1	173.6	0	0	0	0	0	111.9	L160 W177 A184 A185 L199 L200	L160-A181 HydrophobicContact CD2-CB 4.49Å; W177-A181 WeakPolarHBondContact O-CB 3.41Å; W177-A181 PolarHBondContact O-N 3.27Å; A181-A184 PolarHBondContact O-N 3.36Å; A181-A185 WeakPolarHBondContact O-CB 3.23Å; A181-A185 PolarHBondContact O-N 3.4Å; A181-L199 HydrophobicContact CB-CD2 4.04Å; A181-L199 HydrophobicContact CB-CG 4.5Å; A181-L200 HydrophobicContact CB-CD2 3.73Å; A181-L200 HydrophobicContact CB-CG 3.97Å
182	Q	92.8	Very high	92.8	Very high	27 Å²	27	54.5 Å²	54.5	13%	0.126	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-35.1	177.4	-175.7	65	76.8	0	0	112.7	V178 N179 E180 L200	V178-Q182 WeakPolarHBondContact O-CB 3.24Å; V178-Q182 PolarHBondContact O-N 2.8Å; N179-Q182 WeakPolarHBondContact O-CB 3.35Å; N179-Q182 PolarHBondContact O-N 2.84Å; N179-Q182 VanDerWaalsContact O-N 3.16Å; E180-Q182 VanDerWaalsContact C-N 3.29Å; E180-Q182 PolarHBondContact O-N 2.69Å; Q182-L200 HydrophobicContact CB-CD2 4.34Å
183	E	93.1	Very high	93	Very high	126 Å²	126	49.6 Å²	49.6	59%	0.589	25%	0.252	S	S	*	.	H	α-helix	trans	-67.5	-48.6	171.3	-176.5	178.8	166	0	0	110.7	V149 N179 E180 A185 S186	V149-E183 HydrophobicContact CG1-CB 4.1Å; V149-E183 HydrophobicContact CG1-CG 4.2Å; N179-E183 PolarHBondContact O-N 2.73Å; E180-E183 PolarHBondContact O-N 2.61Å; E183-A185 PolarHBondContact O-N 3.26Å; E183-S186 WeakPolarHBondContact O-CB 3.4Å; E183-S186 PolarHBondContact O-N 3.43Å
184	A	93.9	Very high	93.2	Very high	6 Å²	6	53.1 Å²	53.1	5%	0.05	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-31.2	178.6	0	0	0	0	0	113	I148 L160 E180 A181 S186 S187 V192 A196	I148-A184 HydrophobicContact CG2-CB 4.08Å; L160-A184 HydrophobicContact CD1-CB 4.18Å; L160-A184 HydrophobicContact CD2-CB 4.39Å; E180-A184 WeakPolarHBondContact O-CB 3.45Å; E180-A184 PolarHBondContact O-N 2.92Å; A181-A184 PolarHBondContact O-N 3.36Å; A184-S186 PolarHBondContact O-N 2.9Å; A184-S187 WeakPolarHBondContact O-CB 3.29Å; A184-S187 PolarHBondContact O-N 3.09Å; A184-V192 HydrophobicContact CB-CG1 4.15Å; A184-A196 HydrophobicContact CB-CB 3.87Å
185	A	91.8	Very high	93.4	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.9	175.3	0	0	0	0	0	113.8	A181 E183 S187 Q193 A196 L200 F218	A181-A185 WeakPolarHBondContact O-CB 3.23Å; A181-A185 PolarHBondContact O-N 3.4Å; E183-A185 PolarHBondContact O-N 3.26Å; A185-S187 VanDerWaalsContact C-N 3.29Å; A185-Q193 WeakPolarHBondContact O-CG 3.38Å; A185-Q193 PolarHBondContact O-NE2 2.76Å; A185-Q193 VanDerWaalsContact O-NE2 3.07Å; A185-A196 HydrophobicContact CB-CB 3.78Å; A185-A196 VanDerWaalsContact N-CB 3.35Å; A185-L200 HydrophobicContact CB-CD1 3.76Å; A185-F218 HydrophobicContact CB-CE1 4.06Å; A185-F218 HydrophobicContact CB-CZ 3.53Å
186	S	89.9	Confident	93.6	Very high	73 Å²	73	50.2 Å²	50.2	51%	0.51	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	3.8	172.1	-51.9	0	0	0	0	112.8	E183 A184	E183-S186 WeakPolarHBondContact O-CB 3.4Å; E183-S186 PolarHBondContact O-N 3.43Å; A184-S186 PolarHBondContact O-N 2.9Å
187	S	90.6	Very high	93.7	Very high	39 Å²	39	44.3 Å²	44.3	27%	0.273	23%	0.232	S	C	.	.			trans	-64.3	147.6	179.2	-174.6	0	0	0	0	112.4	A184 A185 N189	A184-S187 WeakPolarHBondContact O-CB 3.29Å; A184-S187 PolarHBondContact O-N 3.09Å; A185-S187 VanDerWaalsContact C-N 3.29Å; S187-N189 PolarHBondContact O-N 3.43Å; S187-N189 PolarHBondContact OG-N 3.39Å
188	D	89.8	Confident	93.7	Very high	115 Å²	115	44.7 Å²	44.7	62%	0.615	24%	0.236	S	C	*	.	S	Bend	trans	-74.1	-15.6	173.9	-71.7	-15.2	0	0	0	113.2	K224	D188-K224 HydrophobicContact CB-CD 4.5Å; D188-K224 IonicContact OD1-NZ 2.63Å; D188-K224 PolarHBondContact OD1-NZ 3.48Å; D188-K224 IonicContact OD2-NZ 3.57Å
189	N	94.4	Very high	93.8	Very high	56 Å²	56	43.4 Å²	43.4	30%	0.299	23%	0.228	S	C	.	.	S	Bend	trans	-79.8	126.9	179.5	-173.5	-79.1	0	0	0	111.5	P153 S187 M191 V192 Q193	P153-N189 HydrophobicContact CB-CB 4.15Å; P153-N189 WeakPolarHBondContact CB-ND2 3.41Å; P153-N189 HydrophobicContact CG-CB 4.23Å; S187-N189 PolarHBondContact O-N 3.43Å; S187-N189 PolarHBondContact OG-N 3.39Å; N189-M191 VanDerWaalsContact C-N 3.32Å; N189-M191 PolarHBondContact O-N 2.62Å; N189-M191 PolarHBondContact OD1-N 3Å; N189-V192 HydrophobicContact CB-CB 4.05Å; N189-V192 HydrophobicContact CB-CG2 3.93Å; N189-V192 PolarHBondContact O-N 3.01Å; N189-V192 PolarHBondContact OD1-N 3.42Å; N189-Q193 WeakPolarHBondContact O-CB 3.47Å; N189-Q193 PolarHBondContact O-N 2.98Å
190	I	94.3	Very high	93.8	Very high	79 Å²	79	37.4 Å²	37.4	41%	0.405	20%	0.196	S	C	.	.	H	α-helix	trans	-52.3	-46.2	-177.2	-65.7	174.9	0	0	0	112.6	Y194 S225 F227	I190-Y194 WeakPolarHBondContact O-CB 3.28Å; I190-Y194 PolarHBondContact O-N 2.85Å; I190-S225 WeakPolarHBondContact CG2-OG 3.45Å; I190-S225 WeakPolarHBondContact O-CB 3.45Å; I190-S225 PolarHBondContact O-OG 2.54Å; I190-F227 HydrophobicContact CG2-CD2 3.81Å; I190-F227 HydrophobicContact CG2-CE2 4.13Å
191	M	94.8	Very high	93.7	Very high	81 Å²	81	37.4 Å²	37.4	40%	0.399	20%	0.195	S	C	.	.	H	α-helix	trans	-80.2	-37.5	-175	-69.1	-60.8	-177.8	0	0	112.3	N189 Y194 H195 F227	N189-M191 VanDerWaalsContact C-N 3.32Å; N189-M191 PolarHBondContact O-N 2.62Å; N189-M191 PolarHBondContact OD1-N 3Å; M191-Y194 PolarHBondContact O-N 3.3Å; M191-H195 WeakPolarHBondContact O-CB 3.48Å; M191-H195 VanDerWaalsContact O-CG 3.28Å; M191-H195 PolarHBondContact O-N 3.46Å; M191-H195 PolarHBondContact O-ND1 3.43Å; M191-F227 HydrophobicContact CE-CD2 4.08Å; M191-F227 HydrophobicContact CE-CE2 3.57Å; M191-F227 HydrophobicContact CE-CZ 4.15Å; M191-F227 HydrophobicContact SD-CD2 4.2Å; M191-F227 HydrophobicContact SD-CE2 4.29Å
192	V	95.4	Very high	93.6	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.018	21%	0.209	C	C	.	.	H	α-helix	trans	-62.1	-47.8	176	176.4	0	0	0	0	110.2	P153 S156 L160 A184 N189 Y194 H195 A196	P153-V192 HydrophobicContact CB-CG2 3.87Å; S156-V192 VanDerWaalsContact OG-CG1 3.26Å; S156-V192 WeakPolarHBondContact OG-CG1 3.45Å; L160-V192 HydrophobicContact CD1-CG1 3.94Å; A184-V192 HydrophobicContact CB-CG1 4.15Å; N189-V192 HydrophobicContact CB-CB 4.05Å; N189-V192 HydrophobicContact CB-CG2 3.93Å; N189-V192 PolarHBondContact O-N 3.01Å; N189-V192 PolarHBondContact OD1-N 3.42Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.35Å; V192-H195 PolarHBondContact O-N 3.27Å; V192-A196 WeakPolarHBondContact O-CB 3.26Å; V192-A196 PolarHBondContact O-N 3.4Å
193	Q	94.6	Very high	93.6	Very high	10 Å²	10	39.5 Å²	39.5	5%	0.047	20%	0.204	C	C	.	.	H	α-helix	trans	-58.8	-42.6	176.6	175.3	168	79.3	0	0	112.1	A185 N189 L197 L223 A228	A185-Q193 WeakPolarHBondContact O-CG 3.38Å; A185-Q193 PolarHBondContact O-NE2 2.76Å; A185-Q193 VanDerWaalsContact O-NE2 3.07Å; N189-Q193 WeakPolarHBondContact O-CB 3.47Å; N189-Q193 PolarHBondContact O-N 2.98Å; Q193-L197 WeakPolarHBondContact O-CB 3.49Å; Q193-L197 PolarHBondContact O-N 3.2Å; Q193-L223 HydrophobicContact CG-CD2 4.18Å; Q193-A228 HydrophobicContact CG-CB 4.05Å
194	Y	95.4	Very high	93.5	Very high	78 Å²	78	35.6 Å²	35.6	31%	0.306	18%	0.184	S	C	.	.	H	α-helix	trans	-64.3	-51.5	177.3	169.5	-121.7	0	0	0	112.5	I190 M191 V192 A196 L197 G198 F227 M231	I190-Y194 WeakPolarHBondContact O-CB 3.28Å; I190-Y194 PolarHBondContact O-N 2.85Å; M191-Y194 PolarHBondContact O-N 3.3Å; V192-Y194 VanDerWaalsContact C-N 3.31Å; V192-Y194 PolarHBondContact O-N 3.35Å; Y194-A196 VanDerWaalsContact C-N 3.3Å; Y194-A196 PolarHBondContact O-N 3.21Å; Y194-L197 PolarHBondContact O-N 3.37Å; Y194-G198 PolarHBondContact O-N 2.68Å; Y194-F227 HydrophobicContact CD1-CB 4.05Å; Y194-F227 HydrophobicContact CD2-CB 3.66Å; Y194-F227 HydrophobicContact CE1-CB 4.49Å; Y194-F227 HydrophobicContact CE2-CB 4.15Å; Y194-F227 HydrophobicContact CG-CB 3.61Å; Y194-M231 HydrophobicContact CD2-CB 4.41Å; Y194-M231 HydrophobicContact CD2-SD 4.4Å; Y194-M231 HydrophobicContact CE2-CB 4.12Å; Y194-M231 HydrophobicContact CE2-SD 3.96Å
195	H	96.2	Very high	93.3	Very high	45 Å²	45	40.7 Å²	40.7	21%	0.208	21%	0.205	C	C	.	.	H	α-helix	trans	-65.7	-34.2	-179.8	-63.4	154.7	0	0	0	112.5	S157 L160 V161 M191 V192 G198 L199	S157-H195 PolarHBondContact OG-CE1 2.84Å; S157-H195 PolarHBondContact OG-ND1 3.22Å; L160-H195 HydrophobicContact CB-CB 3.84Å; L160-H195 HydrophobicContact CD1-CB 4.07Å; V161-H195 HydrophobicContact CG2-CB 4.18Å; M191-H195 WeakPolarHBondContact O-CB 3.48Å; M191-H195 VanDerWaalsContact O-CG 3.28Å; M191-H195 PolarHBondContact O-N 3.46Å; M191-H195 PolarHBondContact O-ND1 3.43Å; V192-H195 PolarHBondContact O-N 3.27Å; H195-G198 WeakPolarHBondContact O-CA 3.46Å; H195-G198 PolarHBondContact O-N 3.03Å; H195-L199 PolarHBondContact O-N 3.41Å
196	A	95.4	Very high	93.1	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-67.2	-45.6	176.1	0	0	0	0	0	111.7	L160 A184 A185 V192 Y194 G198 L199 L200	L160-A196 HydrophobicContact CD1-CB 3.84Å; L160-A196 HydrophobicContact CD2-CB 4.06Å; A184-A196 HydrophobicContact CB-CB 3.87Å; A185-A196 HydrophobicContact CB-CB 3.78Å; A185-A196 VanDerWaalsContact N-CB 3.35Å; V192-A196 WeakPolarHBondContact O-CB 3.26Å; V192-A196 PolarHBondContact O-N 3.4Å; Y194-A196 VanDerWaalsContact C-N 3.3Å; Y194-A196 PolarHBondContact O-N 3.21Å; A196-G198 PolarHBondContact O-N 3.23Å; A196-L199 PolarHBondContact O-N 3.28Å; A196-L200 WeakPolarHBondContact O-CB 3.41Å; A196-L200 VanDerWaalsContact O-CG 3.25Å; A196-L200 WeakPolarHBondContact O-CG 3.45Å; A196-L200 PolarHBondContact O-N 3.04Å
197	L	94.3	Very high	93	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-59.6	-39.9	171.8	-176.8	63.9	0	0	0	111.2	Q193 Y194 L200 Y201 M214 F218 A228 M231 L232	Q193-L197 WeakPolarHBondContact O-CB 3.49Å; Q193-L197 PolarHBondContact O-N 3.2Å; Y194-L197 PolarHBondContact O-N 3.37Å; L197-L200 PolarHBondContact O-N 2.94Å; L197-Y201 WeakPolarHBondContact O-CB 3.4Å; L197-Y201 PolarHBondContact O-N 3.44Å; L197-M214 HydrophobicContact CD1-CE 4.07Å; L197-M214 HydrophobicContact CD1-SD 4.09Å; L197-F218 HydrophobicContact CD1-CD2 3.98Å; L197-F218 HydrophobicContact CD1-CE2 3.92Å; L197-A228 HydrophobicContact CD2-CB 4.01Å; L197-A228 WeakPolarHBondContact CD2-O 3.17Å; L197-M231 HydrophobicContact CD2-CB 4.27Å; L197-M231 HydrophobicContact CD2-CG 4.31Å; L197-M231 HydrophobicContact CG-SD 4.47Å; L197-L232 HydrophobicContact CD1-CD1 4.44Å; L197-L232 HydrophobicContact CD2-CB 4.31Å; L197-L232 HydrophobicContact CD2-CD1 4.39Å
198	G	93.9	Very high	92.8	Very high	8 Å²	8	51.4 Å²	51.4	8%	0.082	24%	0.244	C	C	.	.	H	α-helix	trans	-51.5	-57.8	172.2	0	0	0	0	0	113.4	Y194 H195 A196 Y201 H202 M231	Y194-G198 PolarHBondContact O-N 2.68Å; H195-G198 WeakPolarHBondContact O-CA 3.46Å; H195-G198 PolarHBondContact O-N 3.03Å; A196-G198 PolarHBondContact O-N 3.23Å; G198-Y201 PolarHBondContact O-N 3.38Å; G198-H202 PolarHBondContact O-CD2 3.36Å; G198-H202 VanDerWaalsContact O-CD2 3.25Å; G198-H202 PolarHBondContact O-N 3.1Å; G198-M231 VanDerWaalsContact CA-CE 3.48Å
199	L	94.8	Very high	92.6	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-46	179	-178.8	60.5	0	0	0	111.7	L160 L164 V167 V174 A181 H195 A196 Y201 H202 L203	L160-L199 HydrophobicContact CD2-CD2 3.85Å; L164-L199 HydrophobicContact CB-CD1 4.19Å; L164-L199 HydrophobicContact CD1-CD1 4.46Å; V167-L199 HydrophobicContact CG2-CD1 3.86Å; V174-L199 HydrophobicContact CG1-CD1 4.18Å; A181-L199 HydrophobicContact CB-CD2 4.04Å; A181-L199 HydrophobicContact CB-CG 4.5Å; H195-L199 PolarHBondContact O-N 3.41Å; A196-L199 PolarHBondContact O-N 3.28Å; L199-Y201 VanDerWaalsContact C-N 3.33Å; L199-Y201 PolarHBondContact O-N 3.13Å; L199-H202 PolarHBondContact O-N 3.35Å; L199-L203 HydrophobicContact CD1-CD1 4.09Å; L199-L203 HydrophobicContact CD1-CG 4.16Å; L199-L203 HydrophobicContact CG-CD1 3.94Å; L199-L203 HydrophobicContact CG-CG 4.4Å; L199-L203 VanDerWaalsContact O-CG 3.31Å; L199-L203 WeakPolarHBondContact O-CG 3.41Å; L199-L203 PolarHBondContact O-N 3.4Å
200	L	94.1	Very high	92.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-59.1	-43.3	179.8	-73.8	171	0	0	0	112.4	V178 A181 Q182 A185 A196 L197 L203 R204 M214	V178-L200 HydrophobicContact CG1-CD2 4.11Å; A181-L200 HydrophobicContact CB-CD2 3.73Å; A181-L200 HydrophobicContact CB-CG 3.97Å; Q182-L200 HydrophobicContact CB-CD2 4.34Å; A185-L200 HydrophobicContact CB-CD1 3.76Å; A196-L200 WeakPolarHBondContact O-CB 3.41Å; A196-L200 VanDerWaalsContact O-CG 3.25Å; A196-L200 WeakPolarHBondContact O-CG 3.45Å; A196-L200 PolarHBondContact O-N 3.04Å; L197-L200 PolarHBondContact O-N 2.94Å; L200-L203 PolarHBondContact O-N 3.3Å; L200-R204 WeakPolarHBondContact O-CB 3.36Å; L200-R204 WeakPolarHBondContact O-CG 3.24Å; L200-R204 PolarHBondContact O-N 2.84Å; L200-M214 HydrophobicContact CB-SD 3.73Å; L200-M214 HydrophobicContact CD1-SD 4.49Å
201	Y	93.6	Very high	92.1	Very high	39 Å²	39	45.6 Å²	45.6	15%	0.153	22%	0.216	C	C	.	.	H	α-helix	trans	-61.1	-49.8	175.9	175.5	-111.5	0	0	0	111.1	L197 G198 L199 L203 R204 K205 V211 M231 I235	L197-Y201 WeakPolarHBondContact O-CB 3.4Å; L197-Y201 PolarHBondContact O-N 3.44Å; G198-Y201 PolarHBondContact O-N 3.38Å; L199-Y201 VanDerWaalsContact C-N 3.33Å; L199-Y201 PolarHBondContact O-N 3.13Å; Y201-L203 PolarHBondContact O-N 3.08Å; Y201-R204 CarbonylContact O-C 3.58Å; Y201-R204 PolarHBondContact O-N 3.18Å; Y201-K205 HydrophobicContact CE1-CB 4.5Å; Y201-K205 HydrophobicContact CE2-CB 4.27Å; Y201-K205 WeakPolarHBondContact O-CA 3.37Å; Y201-K205 WeakPolarHBondContact O-CB 3.48Å; Y201-K205 PolarHBondContact O-N 3.09Å; Y201-V211 HydrophobicContact CD2-CG1 4.29Å; Y201-V211 HydrophobicContact CE2-CG1 4.31Å; Y201-M231 HydrophobicContact CD1-CE 3.85Å; Y201-M231 HydrophobicContact CG-CE 4.08Å; Y201-I235 HydrophobicContact CD1-CD1 4.37Å; Y201-I235 HydrophobicContact CD1-CG1 4.41Å; Y201-I235 HydrophobicContact CD2-CB 4.48Å; Y201-I235 HydrophobicContact CD2-CD1 3.55Å; Y201-I235 HydrophobicContact CD2-CG1 3.65Å; Y201-I235 HydrophobicContact CD2-CG2 3.96Å; Y201-I235 HydrophobicContact CE1-CG1 4.49Å; Y201-I235 HydrophobicContact CE2-CB 4.38Å; Y201-I235 HydrophobicContact CE2-CD1 4.2Å; Y201-I235 HydrophobicContact CE2-CG1 3.75Å; Y201-I235 HydrophobicContact CE2-CG2 3.84Å; Y201-I235 HydrophobicContact CG-CD1 3.64Å; Y201-I235 HydrophobicContact CG-CG1 3.99Å
202	H	92.6	Very high	91.8	Very high	66 Å²	66	43.8 Å²	43.8	31%	0.306	21%	0.21	S	C	.	.	H	α-helix	trans	-64.3	-28.1	179.7	-80.1	-72.1	0	0	0	113.9	L164 G198 L199	L164-H202 HydrophobicContact CD1-CB 3.65Å; L164-H202 WeakPolarHBondContact CD1-CD2 3.42Å; G198-H202 PolarHBondContact O-CD2 3.36Å; G198-H202 VanDerWaalsContact O-CD2 3.25Å; G198-H202 PolarHBondContact O-N 3.1Å; L199-H202 PolarHBondContact O-N 3.35Å
203	L	92.3	Very high	91.4	Very high	4 Å²	4	50 Å²	50	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-75.6	-30.9	173.4	-69.3	177	0	0	0	112.7	V167 Y171 V174 V178 L199 L200 Y201	V167-L203 HydrophobicContact CG1-CD2 4.46Å; V167-L203 HydrophobicContact CG2-CD2 3.88Å; Y171-L203 HydrophobicContact CD2-CD2 4.43Å; Y171-L203 HydrophobicContact CE2-CD2 4.17Å; Y171-L203 PolarHBondContact OH-O 3.46Å; V174-L203 HydrophobicContact CB-CD2 4.41Å; V174-L203 HydrophobicContact CG1-CD1 4.45Å; V174-L203 HydrophobicContact CG1-CD2 4.1Å; V178-L203 HydrophobicContact CG2-CB 4.22Å; V178-L203 HydrophobicContact CG2-CD1 3.67Å; L199-L203 HydrophobicContact CD1-CD1 4.09Å; L199-L203 HydrophobicContact CD1-CG 4.16Å; L199-L203 HydrophobicContact CG-CD1 3.94Å; L199-L203 HydrophobicContact CG-CG 4.4Å; L199-L203 VanDerWaalsContact O-CG 3.31Å; L199-L203 WeakPolarHBondContact O-CG 3.41Å; L199-L203 PolarHBondContact O-N 3.4Å; L200-L203 PolarHBondContact O-N 3.3Å; Y201-L203 PolarHBondContact O-N 3.08Å
204	R	92.2	Very high	91.2	Very high	45 Å²	45	49.6 Å²	49.6	17%	0.17	24%	0.235	C	C	.	.	H	α-helix	trans	-104.4	-7.5	-175.1	-64.9	177.9	-176.6	174.1	9.8	114.5	V178 L200 Y201 N206 D207 A210 V211	V178-R204 VanDerWaalsContact CG1-NH2 3.26Å; L200-R204 WeakPolarHBondContact O-CB 3.36Å; L200-R204 WeakPolarHBondContact O-CG 3.24Å; L200-R204 PolarHBondContact O-N 2.84Å; Y201-R204 CarbonylContact O-C 3.58Å; Y201-R204 PolarHBondContact O-N 3.18Å; R204-N206 PolarHBondContact O-N 3.28Å; R204-D207 CarbonylContact O-C 3.49Å; R204-D207 WeakPolarHBondContact O-CA 3.47Å; R204-D207 PolarHBondContact O-N 2.9Å; R204-D207 VanDerWaalsContact O-O 3.08Å; R204-A210 HydrophobicContact CB-CB 4.15Å; R204-A210 HydrophobicContact CG-CB 4.13Å; R204-V211 HydrophobicContact CB-CG2 4.08Å; R204-V211 VanDerWaalsContact O-CG2 3.28Å; R204-V211 WeakPolarHBondContact O-CG2 3.42Å
205	K	88.8	Confident	90.9	Very high	112 Å²	112	45.9 Å²	45.9	49%	0.487	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.8	-172.3	64.6	172.5	-174.4	163.8	0	114.9	Y201	Y201-K205 HydrophobicContact CE1-CB 4.5Å; Y201-K205 HydrophobicContact CE2-CB 4.27Å; Y201-K205 WeakPolarHBondContact O-CA 3.37Å; Y201-K205 WeakPolarHBondContact O-CB 3.48Å; Y201-K205 PolarHBondContact O-N 3.09Å
206	N	86.9	Confident	90.4	Very high	129 Å²	129	46.9 Å²	46.9	69%	0.69	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.7	177.5	-61.8	-6.8	0	0	0	112.7	R204	R204-N206 PolarHBondContact O-N 3.28Å
207	D	88.9	Confident	90.1	Very high	87 Å²	87	51.4 Å²	51.4	47%	0.465	25%	0.247	S	C	.	.			trans	-116.9	96.6	178.6	177.5	-12.3	0	0	0	109.3	R204 L209 A210 V211	R204-D207 CarbonylContact O-C 3.49Å; R204-D207 WeakPolarHBondContact O-CA 3.47Å; R204-D207 PolarHBondContact O-N 2.9Å; R204-D207 VanDerWaalsContact O-O 3.08Å; D207-L209 VanDerWaalsContact C-N 3.31Å; D207-L209 PolarHBondContact O-N 2.83Å; D207-L209 PolarHBondContact OD1-N 3.24Å; D207-L209 VanDerWaalsContact OD1-N 3.13Å; D207-A210 HydrophobicContact CB-CB 3.9Å; D207-A210 VanDerWaalsContact CG-CB 3.43Å; D207-A210 PolarHBondContact O-N 3.1Å; D207-A210 VanDerWaalsContact O-N 3.15Å; D207-A210 PolarHBondContact OD1-N 3.41Å; D207-A210 WeakPolarHBondContact OD2-CB 3.2Å; D207-V211 WeakPolarHBondContact O-CG2 3.44Å; D207-V211 PolarHBondContact O-N 3.49Å; D207-V211 VanDerWaalsContact O-N 3.08Å
208	R	85.3	Confident	89.8	Confident	121 Å²	121	51.5 Å²	51.5	46%	0.457	25%	0.247	S	C	.	.	H	α-helix	trans	-55.4	-43.8	-178	179.1	166.4	162.7	166.1	-15.7	112.4	A210 V211 T212 L239 E242	R208-A210 VanDerWaalsContact C-N 3.31Å; R208-A210 PolarHBondContact O-N 3.46Å; R208-V211 PolarHBondContact O-N 3.5Å; R208-T212 PolarHBondContact O-N 3.28Å; R208-T212 PolarHBondContact O-OG1 3.19Å; R208-T212 VanDerWaalsContact O-OG1 3.07Å; R208-L239 HydrophobicContact CG-CD2 4.32Å; R208-E242 PolarHBondContact NH1-O 2.88Å
209	L	87	Confident	89.5	Confident	107 Å²	107	53.4 Å²	53.4	56%	0.56	26%	0.257	S	S	*	.	H	α-helix	trans	-64.1	-39.3	-179.1	-175.8	66.2	0	0	0	111.3	D207 T212 K213	D207-L209 VanDerWaalsContact C-N 3.31Å; D207-L209 PolarHBondContact O-N 2.83Å; D207-L209 PolarHBondContact OD1-N 3.24Å; D207-L209 VanDerWaalsContact OD1-N 3.13Å; L209-T212 PolarHBondContact O-N 3.48Å; L209-K213 HydrophobicContact CG-CD 4.36Å; L209-K213 WeakPolarHBondContact O-CB 3.4Å; L209-K213 WeakPolarHBondContact O-CG 3.34Å; L209-K213 PolarHBondContact O-N 3Å
210	A	88	Confident	89	Confident	18 Å²	18	62.3 Å²	62.3	15%	0.149	30%	0.296	C	S	.	.	H	α-helix	trans	-66.3	-36.5	176	0	0	0	0	0	112.7	R204 D207 R208 M214	R204-A210 HydrophobicContact CB-CB 4.15Å; R204-A210 HydrophobicContact CG-CB 4.13Å; D207-A210 HydrophobicContact CB-CB 3.9Å; D207-A210 VanDerWaalsContact CG-CB 3.43Å; D207-A210 PolarHBondContact O-N 3.1Å; D207-A210 VanDerWaalsContact O-N 3.15Å; D207-A210 PolarHBondContact OD1-N 3.41Å; D207-A210 WeakPolarHBondContact OD2-CB 3.2Å; R208-A210 VanDerWaalsContact C-N 3.31Å; R208-A210 PolarHBondContact O-N 3.46Å; A210-M214 WeakPolarHBondContact O-CB 3.46Å; A210-M214 PolarHBondContact O-N 2.87Å
211	V	89.8	Confident	88.4	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-67.7	-46.4	173.9	-174.5	0	0	0	0	110.7	Y201 R204 D207 R208 K213 M214 L215 I235 L239	Y201-V211 HydrophobicContact CD2-CG1 4.29Å; Y201-V211 HydrophobicContact CE2-CG1 4.31Å; R204-V211 HydrophobicContact CB-CG2 4.08Å; R204-V211 VanDerWaalsContact O-CG2 3.28Å; R204-V211 WeakPolarHBondContact O-CG2 3.42Å; D207-V211 WeakPolarHBondContact O-CG2 3.44Å; D207-V211 PolarHBondContact O-N 3.49Å; D207-V211 VanDerWaalsContact O-N 3.08Å; R208-V211 PolarHBondContact O-N 3.5Å; V211-K213 PolarHBondContact O-N 3.34Å; V211-M214 HydrophobicContact CG1-CE 4.37Å; V211-M214 WeakPolarHBondContact O-CB 3.43Å; V211-M214 PolarHBondContact O-N 3.37Å; V211-L215 WeakPolarHBondContact O-CB 3.13Å; V211-L215 PolarHBondContact O-N 2.96Å; V211-I235 HydrophobicContact CG1-CG2 3.53Å; V211-L239 HydrophobicContact CB-CD1 4.41Å; V211-L239 HydrophobicContact CG1-CD1 3.72Å; V211-L239 HydrophobicContact CG1-CD2 4.49Å; V211-L239 HydrophobicContact CG1-CG 4.35Å
212	T	87.6	Confident	87.8	Confident	43 Å²	43	65.8 Å²	65.8	26%	0.264	33%	0.331	S	S	.	.	H	α-helix	trans	-60.8	-43.7	177.9	-53.8	0	0	0	0	111.9	R208 L209 M214 L215 N216	R208-T212 PolarHBondContact O-N 3.28Å; R208-T212 PolarHBondContact O-OG1 3.19Å; R208-T212 VanDerWaalsContact O-OG1 3.07Å; L209-T212 PolarHBondContact O-N 3.48Å; T212-M214 VanDerWaalsContact C-N 3.33Å; T212-M214 PolarHBondContact O-N 3.15Å; T212-L215 PolarHBondContact O-N 3.44Å; T212-N216 WeakPolarHBondContact O-CB 3.41Å; T212-N216 PolarHBondContact O-N 2.97Å; T212-N216 PolarHBondContact O-ND2 3.33Å
213	K	88.1	Confident	87.6	Confident	133 Å²	133	63.3 Å²	63.3	58%	0.578	32%	0.32	S	S	*	.	H	α-helix	trans	-61.4	-41.5	175.1	-77	177.2	179.5	174.7	0	112.2	L209 V211 K217	L209-K213 HydrophobicContact CG-CD 4.36Å; L209-K213 WeakPolarHBondContact O-CB 3.4Å; L209-K213 WeakPolarHBondContact O-CG 3.34Å; L209-K213 PolarHBondContact O-N 3Å; V211-K213 PolarHBondContact O-N 3.34Å; K213-K217 PolarHBondContact O-N 3.48Å; K213-K217 VanDerWaalsContact O-N 3.15Å
214	M	89.7	Confident	87.4	Confident	2 Å²	2	69 Å²	69	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-46.6	176.1	-175.4	-178.3	70.9	0	0	111.2	L197 L200 A210 V211 T212 K217 F218 I235	L197-M214 HydrophobicContact CD1-CE 4.07Å; L197-M214 HydrophobicContact CD1-SD 4.09Å; L200-M214 HydrophobicContact CB-SD 3.73Å; L200-M214 HydrophobicContact CD1-SD 4.49Å; A210-M214 WeakPolarHBondContact O-CB 3.46Å; A210-M214 PolarHBondContact O-N 2.87Å; V211-M214 HydrophobicContact CG1-CE 4.37Å; V211-M214 WeakPolarHBondContact O-CB 3.43Å; V211-M214 PolarHBondContact O-N 3.37Å; T212-M214 VanDerWaalsContact C-N 3.33Å; T212-M214 PolarHBondContact O-N 3.15Å; M214-K217 WeakPolarHBondContact O-CB 3.25Å; M214-K217 PolarHBondContact O-N 3.38Å; M214-F218 HydrophobicContact CG-CD2 3.8Å; M214-F218 HydrophobicContact CG-CE2 3.65Å; M214-F218 VanDerWaalsContact O-CD2 3.24Å; M214-F218 WeakPolarHBondContact O-CD2 3.32Å; M214-F218 PolarHBondContact O-N 3.44Å; M214-F218 VanDerWaalsContact O-N 3.16Å; M214-F218 HydrophobicContact SD-CE2 4.48Å; M214-I235 HydrophobicContact CE-CD1 4.36Å
215	L	88.6	Confident	87.4	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-49.7	-178.5	-157.8	112.5	0	0	0	110.9	V211 T212 K217 F218 T219 L232 I235 A236 L251	V211-L215 WeakPolarHBondContact O-CB 3.13Å; V211-L215 PolarHBondContact O-N 2.96Å; T212-L215 PolarHBondContact O-N 3.44Å; L215-K217 PolarHBondContact O-N 2.86Å; L215-K217 VanDerWaalsContact O-N 3.16Å; L215-F218 PolarHBondContact O-N 2.96Å; L215-F218 VanDerWaalsContact O-N 3.08Å; L215-T219 WeakPolarHBondContact O-CB 3.32Å; L215-T219 PolarHBondContact O-N 2.61Å; L215-T219 PolarHBondContact O-OG1 3.19Å; L215-L232 HydrophobicContact CD1-CD1 3.47Å; L215-L232 VanDerWaalsContact CD1-CD1 3.47Å; L215-L232 HydrophobicContact CD1-CG 3.89Å; L215-L232 HydrophobicContact CG-CD1 3.88Å; L215-L232 HydrophobicContact CG-CG 4.25Å; L215-I235 HydrophobicContact CD1-CB 4.13Å; L215-I235 HydrophobicContact CD1-CG2 3.8Å; L215-A236 HydrophobicContact CD1-CB 4.02Å; L215-A236 HydrophobicContact CD2-CB 4.07Å; L215-L251 HydrophobicContact CD2-CD2 3.14Å; L215-L251 HydrophobicContact CD2-CG 4.36Å
216	N	87.4	Confident	87.7	Confident	66 Å²	66	62.8 Å²	62.8	35%	0.353	32%	0.321	S	S	.	.	H	α-helix	trans	-55.5	-35.4	176.2	-76.3	-21	0	0	0	113.1	T212 K220	T212-N216 WeakPolarHBondContact O-CB 3.41Å; T212-N216 PolarHBondContact O-N 2.97Å; T212-N216 PolarHBondContact O-ND2 3.33Å; N216-K220 WeakPolarHBondContact O-CG 3.38Å; N216-K220 PolarHBondContact O-N 3.43Å
217	K	88.4	Confident	88.1	Confident	95 Å²	95	60.6 Å²	60.6	41%	0.413	31%	0.306	S	S	.	.	H	α-helix	trans	-65.6	-52.4	175.6	-178.1	-177.2	175.9	-176.5	0	111.3	K213 M214 L215 K220 S221	K213-K217 PolarHBondContact O-N 3.48Å; K213-K217 VanDerWaalsContact O-N 3.15Å; M214-K217 WeakPolarHBondContact O-CB 3.25Å; M214-K217 PolarHBondContact O-N 3.38Å; L215-K217 PolarHBondContact O-N 2.86Å; L215-K217 VanDerWaalsContact O-N 3.16Å; K217-K220 PolarHBondContact O-N 2.86Å; K217-S221 PolarHBondContact O-N 3.4Å; K217-S221 PolarHBondContact O-OG 3.49Å
218	F	88.3	Confident	88.3	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.018	28%	0.283	C	S	.	.	H	α-helix	trans	-74.3	-29.4	-175	-71.9	-62.6	0	0	0	113.6	A185 L197 M214 L215 K220 G222 L223 L232	A185-F218 HydrophobicContact CB-CE1 4.06Å; A185-F218 HydrophobicContact CB-CZ 3.53Å; L197-F218 HydrophobicContact CD1-CD2 3.98Å; L197-F218 HydrophobicContact CD1-CE2 3.92Å; M214-F218 HydrophobicContact CG-CD2 3.8Å; M214-F218 HydrophobicContact CG-CE2 3.65Å; M214-F218 VanDerWaalsContact O-CD2 3.24Å; M214-F218 WeakPolarHBondContact O-CD2 3.32Å; M214-F218 PolarHBondContact O-N 3.44Å; M214-F218 VanDerWaalsContact O-N 3.16Å; M214-F218 HydrophobicContact SD-CE2 4.48Å; L215-F218 PolarHBondContact O-N 2.96Å; L215-F218 VanDerWaalsContact O-N 3.08Å; F218-K220 VanDerWaalsContact C-N 3.32Å; F218-G222 PolarHBondContact O-N 3.13Å; F218-G222 VanDerWaalsContact O-N 3.1Å; F218-L223 HydrophobicContact CB-CD2 4.18Å; F218-L223 HydrophobicContact CB-CG 4.41Å; F218-L223 HydrophobicContact CD1-CD2 3.58Å; F218-L223 HydrophobicContact CE1-CD2 4.27Å; F218-L223 HydrophobicContact CG-CD2 4.1Å; F218-L232 HydrophobicContact CB-CD1 4.41Å; F218-L232 HydrophobicContact CB-CD2 3.9Å
219	T	86.2	Confident	88.7	Confident	48 Å²	48	52.7 Å²	52.7	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-40.4	170.7	-62.6	0	0	0	0	111.3	L215 F254	L215-T219 WeakPolarHBondContact O-CB 3.32Å; L215-T219 PolarHBondContact O-N 2.61Å; L215-T219 PolarHBondContact O-OG1 3.19Å; T219-F254 HydrophobicContact CG2-CB 3.93Å; T219-F254 HydrophobicContact CG2-CD2 3.45Å; T219-F254 VanDerWaalsContact CG2-CD2 3.45Å; T219-F254 HydrophobicContact CG2-CE2 4.19Å; T219-F254 HydrophobicContact CG2-CG 3.81Å
220	K	84.5	Confident	89.1	Confident	186 Å²	186	47.9 Å²	47.9	81%	0.809	25%	0.245	S	C	*	.	H	α-helix	trans	-78.9	-39.5	179	-70.9	180	-178.1	-175.7	0	113.9	N216 K217 F218 G222	N216-K220 WeakPolarHBondContact O-CG 3.38Å; N216-K220 PolarHBondContact O-N 3.43Å; K217-K220 PolarHBondContact O-N 2.86Å; F218-K220 VanDerWaalsContact C-N 3.32Å; K220-G222 VanDerWaalsContact C-N 3.3Å
221	S	82.2	Confident	89.4	Confident	81 Å²	81	48.3 Å²	48.3	57%	0.566	24%	0.244	S	C	*	.	H	α-helix	trans	-77.1	-18.6	-178	66.6	0	0	0	0	113.4	K217	K217-S221 PolarHBondContact O-N 3.4Å; K217-S221 PolarHBondContact O-OG 3.49Å
222	G	80.7	Confident	89.6	Confident	31 Å²	31	48.2 Å²	48.2	32%	0.32	24%	0.243	S	C	.	.			trans	71.8	158.6	-168	0	0	0	0	0	112.2	F218 K220	F218-G222 PolarHBondContact O-N 3.13Å; F218-G222 VanDerWaalsContact O-N 3.1Å; K220-G222 VanDerWaalsContact C-N 3.3Å
223	L	87.9	Confident	89.9	Confident	14 Å²	14	46.1 Å²	46.1	7%	0.073	23%	0.231	C	C	.	.			trans	-117.6	154.1	175	-66	169.9	0	0	0	109.2	Q193 F218 A228 Y229 L232	Q193-L223 HydrophobicContact CG-CD2 4.18Å; F218-L223 HydrophobicContact CB-CD2 4.18Å; F218-L223 HydrophobicContact CB-CG 4.41Å; F218-L223 HydrophobicContact CD1-CD2 3.58Å; F218-L223 HydrophobicContact CE1-CD2 4.27Å; F218-L223 HydrophobicContact CG-CD2 4.1Å; L223-A228 HydrophobicContact CD1-CB 3.97Å; L223-A228 HydrophobicContact CD2-CB 4.45Å; L223-Y229 HydrophobicContact CB-CD1 4.5Å; L223-Y229 HydrophobicContact CB-CD2 3.88Å; L223-Y229 HydrophobicContact CB-CE1 4.25Å; L223-Y229 HydrophobicContact CB-CE2 3.62Å; L223-Y229 HydrophobicContact CB-CG 4.31Å; L223-Y229 HydrophobicContact CD1-CD1 4.27Å; L223-Y229 HydrophobicContact CD1-CG 4.34Å; L223-Y229 PolarHBondContact N-OH 3.09Å; L223-Y229 VanDerWaalsContact N-OH 3.17Å; L223-Y229 WeakPolarHBondContact O-CE2 3.39Å; L223-Y229 PolarHBondContact O-OH 2.86Å; L223-L232 HydrophobicContact CD1-CB 4.21Å; L223-L232 HydrophobicContact CD1-CD2 3.79Å
224	K	88.8	Confident	90.1	Very high	125 Å²	125	46.8 Å²	46.8	54%	0.543	23%	0.23	S	C	.	.	S	Bend	trans	-98.7	-29.7	174.4	-68.9	-178.3	175.6	179.8	0	111.5	D188 P226	D188-K224 HydrophobicContact CB-CD 4.5Å; D188-K224 IonicContact OD1-NZ 2.63Å; D188-K224 PolarHBondContact OD1-NZ 3.48Å; D188-K224 IonicContact OD2-NZ 3.57Å; K224-P226 WeakPolarHBondContact O-CD 3.47Å
225	S	92.9	Very high	90.2	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.23	C	C	.	.			trans	-84.4	121.4	-177.2	-179.8	0	0	0	0	112.2	I190 F227 A228 Y229	I190-S225 WeakPolarHBondContact CG2-OG 3.45Å; I190-S225 WeakPolarHBondContact O-CB 3.45Å; I190-S225 PolarHBondContact O-OG 2.54Å; S225-F227 VanDerWaalsContact C-N 3.25Å; S225-F227 PolarHBondContact O-N 2.9Å; S225-F227 PolarHBondContact OG-N 2.84Å; S225-A228 PolarHBondContact O-N 2.82Å; S225-A228 PolarHBondContact OG-N 2.88Å; S225-Y229 WeakPolarHBondContact O-CD2 3.18Å; S225-Y229 PolarHBondContact O-N 3.43Å
226	P	94.1	Very high	90.3	Very high	25 Å²	25	46.9 Å²	46.9	16%	0.162	23%	0.23	C	C	.	.	H	α-helix	trans	-59.7	-35.6	171.4	-25	35.9	0	0	0	112.7	K224 Y229 C230 N263 M265 V266	K224-P226 WeakPolarHBondContact O-CD 3.47Å; P226-Y229 WeakPolarHBondContact O-CB 3.5Å; P226-Y229 PolarHBondContact O-N 2.94Å; P226-C230 PolarHBondContact O-N 3.23Å; P226-C230 PolarHBondContact O-SG 2.79Å; P226-C230 VanDerWaalsContact O-SG 3.4Å; P226-N263 HydrophobicContact CB-CB 4.38Å; P226-N263 HydrophobicContact CG-CB 4.42Å; P226-N263 WeakPolarHBondContact CG-ND2 3.33Å; P226-M265 HydrophobicContact CB-CE 3.63Å; P226-V266 HydrophobicContact CB-CG2 3.98Å
227	F	94.9	Very high	90.5	Very high	83 Å²	83	44.6 Å²	44.6	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-66.6	-38.2	176.7	-56.9	-73	0	0	0	111.9	I190 M191 Y194 S225 C230 M231 M265	I190-F227 HydrophobicContact CG2-CD2 3.81Å; I190-F227 HydrophobicContact CG2-CE2 4.13Å; M191-F227 HydrophobicContact CE-CD2 4.08Å; M191-F227 HydrophobicContact CE-CE2 3.57Å; M191-F227 HydrophobicContact CE-CZ 4.15Å; M191-F227 HydrophobicContact SD-CD2 4.2Å; M191-F227 HydrophobicContact SD-CE2 4.29Å; Y194-F227 HydrophobicContact CD1-CB 4.05Å; Y194-F227 HydrophobicContact CD2-CB 3.66Å; Y194-F227 HydrophobicContact CE1-CB 4.49Å; Y194-F227 HydrophobicContact CE2-CB 4.15Å; Y194-F227 HydrophobicContact CG-CB 3.61Å; S225-F227 VanDerWaalsContact C-N 3.25Å; S225-F227 PolarHBondContact O-N 2.9Å; S225-F227 PolarHBondContact OG-N 2.84Å; F227-C230 PolarHBondContact O-N 2.89Å; F227-M231 WeakPolarHBondContact O-CB 3.49Å; F227-M231 PolarHBondContact O-N 3Å; F227-M265 HydrophobicContact CD1-CE 3.64Å; F227-M265 HydrophobicContact CD1-SD 4.2Å; F227-M265 HydrophobicContact CE1-CE 3.88Å; F227-M265 HydrophobicContact CE1-SD 4.04Å; F227-M265 HydrophobicContact CG-CE 4.18Å
228	A	93.4	Very high	90.5	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.6	-38.4	174.4	0	0	0	0	0	111.6	Q193 L197 L223 S225 M231 L232	Q193-A228 HydrophobicContact CG-CB 4.05Å; L197-A228 HydrophobicContact CD2-CB 4.01Å; L197-A228 WeakPolarHBondContact CD2-O 3.17Å; L223-A228 HydrophobicContact CD1-CB 3.97Å; L223-A228 HydrophobicContact CD2-CB 4.45Å; S225-A228 PolarHBondContact O-N 2.82Å; S225-A228 PolarHBondContact OG-N 2.88Å; A228-M231 PolarHBondContact O-N 2.81Å; A228-L232 WeakPolarHBondContact O-CB 3.39Å; A228-L232 PolarHBondContact O-N 3.39Å
229	Y	94.3	Very high	90.4	Very high	42 Å²	42	45.1 Å²	45.1	17%	0.165	22%	0.222	C	C	.	.	H	α-helix	trans	-59.6	-50	172.1	-90.1	-67.6	0	0	0	112.1	L223 S225 P226 M231 L232 I233 F254 V266	L223-Y229 HydrophobicContact CB-CD1 4.5Å; L223-Y229 HydrophobicContact CB-CD2 3.88Å; L223-Y229 HydrophobicContact CB-CE1 4.25Å; L223-Y229 HydrophobicContact CB-CE2 3.62Å; L223-Y229 HydrophobicContact CB-CG 4.31Å; L223-Y229 HydrophobicContact CD1-CD1 4.27Å; L223-Y229 HydrophobicContact CD1-CG 4.34Å; L223-Y229 PolarHBondContact N-OH 3.09Å; L223-Y229 VanDerWaalsContact N-OH 3.17Å; L223-Y229 WeakPolarHBondContact O-CE2 3.39Å; L223-Y229 PolarHBondContact O-OH 2.86Å; S225-Y229 WeakPolarHBondContact O-CD2 3.18Å; S225-Y229 PolarHBondContact O-N 3.43Å; P226-Y229 WeakPolarHBondContact O-CB 3.5Å; P226-Y229 PolarHBondContact O-N 2.94Å; Y229-M231 VanDerWaalsContact C-N 3.27Å; Y229-M231 PolarHBondContact O-N 2.96Å; Y229-L232 PolarHBondContact O-N 2.95Å; Y229-L232 VanDerWaalsContact O-N 3.11Å; Y229-I233 WeakPolarHBondContact O-CG1 3.38Å; Y229-I233 PolarHBondContact O-N 2.72Å; Y229-F254 HydrophobicContact CD1-CZ 4.27Å; Y229-F254 HydrophobicContact CE1-CE2 4.33Å; Y229-F254 HydrophobicContact CE1-CZ 4.43Å; Y229-V266 HydrophobicContact CD1-CG1 4.49Å; Y229-V266 HydrophobicContact CD2-CG2 4.5Å; Y229-V266 HydrophobicContact CG-CG1 4.19Å; Y229-V266 HydrophobicContact CG-CG2 4.32Å
230	C	95.6	Very high	90.4	Very high	7 Å²	7	43.1 Å²	43.1	5%	0.047	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-40.9	177.7	-66.4	0	0	0	0	111.7	P226 F227 I233 R234 E269	P226-C230 PolarHBondContact O-N 3.23Å; P226-C230 PolarHBondContact O-SG 2.79Å; P226-C230 VanDerWaalsContact O-SG 3.4Å; F227-C230 PolarHBondContact O-N 2.89Å; C230-I233 PolarHBondContact O-N 2.88Å; C230-R234 WeakPolarHBondContact O-CG 3.42Å; C230-R234 PolarHBondContact O-N 2.86Å; C230-R234 VanDerWaalsContact O-N 3.07Å; C230-E269 HydrophobicContact CB-CB 4.3Å; C230-E269 HydrophobicContact CB-CG 3.96Å
231	M	93.9	Very high	90.3	Very high	27 Å²	27	37.7 Å²	37.7	13%	0.133	19%	0.189	C	C	.	.	H	α-helix	trans	-64.3	-42	174.9	-177.4	162.1	-173	0	0	112.3	Y194 L197 G198 Y201 F227 A228 Y229 R234 I235	Y194-M231 HydrophobicContact CD2-CB 4.41Å; Y194-M231 HydrophobicContact CD2-SD 4.4Å; Y194-M231 HydrophobicContact CE2-CB 4.12Å; Y194-M231 HydrophobicContact CE2-SD 3.96Å; L197-M231 HydrophobicContact CD2-CB 4.27Å; L197-M231 HydrophobicContact CD2-CG 4.31Å; L197-M231 HydrophobicContact CG-SD 4.47Å; G198-M231 VanDerWaalsContact CA-CE 3.48Å; Y201-M231 HydrophobicContact CD1-CE 3.85Å; Y201-M231 HydrophobicContact CG-CE 4.08Å; F227-M231 WeakPolarHBondContact O-CB 3.49Å; F227-M231 PolarHBondContact O-N 3Å; A228-M231 PolarHBondContact O-N 2.81Å; Y229-M231 VanDerWaalsContact C-N 3.27Å; Y229-M231 PolarHBondContact O-N 2.96Å; M231-R234 PolarHBondContact O-N 2.98Å; M231-I235 HydrophobicContact CE-CD1 4.07Å; M231-I235 HydrophobicContact CG-CD1 3.95Å; M231-I235 VanDerWaalsContact O-CG1 3.26Å; M231-I235 WeakPolarHBondContact O-CG1 3.49Å; M231-I235 PolarHBondContact O-N 2.97Å
232	L	93.5	Very high	90.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-38.9	178.6	-163.2	69.1	0	0	0	111.7	L197 L215 F218 L223 A228 Y229 I235 A236 F254	L197-L232 HydrophobicContact CD1-CD1 4.44Å; L197-L232 HydrophobicContact CD2-CB 4.31Å; L197-L232 HydrophobicContact CD2-CD1 4.39Å; L215-L232 HydrophobicContact CD1-CD1 3.47Å; L215-L232 VanDerWaalsContact CD1-CD1 3.47Å; L215-L232 HydrophobicContact CD1-CG 3.89Å; L215-L232 HydrophobicContact CG-CD1 3.88Å; L215-L232 HydrophobicContact CG-CG 4.25Å; F218-L232 HydrophobicContact CB-CD1 4.41Å; F218-L232 HydrophobicContact CB-CD2 3.9Å; L223-L232 HydrophobicContact CD1-CB 4.21Å; L223-L232 HydrophobicContact CD1-CD2 3.79Å; A228-L232 WeakPolarHBondContact O-CB 3.39Å; A228-L232 PolarHBondContact O-N 3.39Å; Y229-L232 PolarHBondContact O-N 2.95Å; Y229-L232 VanDerWaalsContact O-N 3.11Å; L232-I235 PolarHBondContact O-N 3.43Å; L232-A236 WeakPolarHBondContact O-CB 3.46Å; L232-A236 PolarHBondContact O-N 3.24Å; L232-F254 HydrophobicContact CB-CE1 4.49Å; L232-F254 HydrophobicContact CD2-CE1 3.94Å; L232-F254 HydrophobicContact CD2-CE2 4.38Å; L232-F254 HydrophobicContact CD2-CZ 3.59Å; L232-F254 HydrophobicContact CG-CE1 4.05Å; L232-F254 HydrophobicContact CG-CZ 4.15Å
233	I	94	Very high	89.9	Confident	0 Å²	0	39 Å²	39	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-60.5	-46.2	173.4	-69.2	162.3	0	0	0	110.5	Y229 C230 I235 A236 S237 F254 I255 C258 V266 E269 A270 A273	Y229-I233 WeakPolarHBondContact O-CG1 3.38Å; Y229-I233 PolarHBondContact O-N 2.72Å; C230-I233 PolarHBondContact O-N 2.88Å; I233-I235 VanDerWaalsContact C-N 3.33Å; I233-I235 PolarHBondContact O-N 3.49Å; I233-A236 PolarHBondContact O-N 3.33Å; I233-S237 WeakPolarHBondContact O-CB 3.38Å; I233-S237 PolarHBondContact O-N 3.35Å; I233-F254 HydrophobicContact CG1-CE1 4.29Å; I233-I255 HydrophobicContact CG2-CG2 4.42Å; I233-C258 HydrophobicContact CD1-CB 3.94Å; I233-C258 HydrophobicContact CG1-CB 4.46Å; I233-V266 HydrophobicContact CD1-CG1 3.88Å; I233-E269 HydrophobicContact CB-CG 4.22Å; I233-E269 HydrophobicContact CD1-CB 4.36Å; I233-E269 HydrophobicContact CD1-CG 4.43Å; I233-E269 HydrophobicContact CG2-CG 3.99Å; I233-A270 HydrophobicContact CD1-CB 4.05Å; I233-A273 HydrophobicContact CG2-CB 3.69Å
234	R	93.4	Very high	88.7	Confident	146 Å²	146	47.4 Å²	47.4	55%	0.551	22%	0.221	S	C	*	.	H	α-helix	trans	-61.2	-40.4	176.7	-70.3	175.6	-171.5	170.1	7.6	112.6	C230 M231 K238 E269	C230-R234 WeakPolarHBondContact O-CG 3.42Å; C230-R234 PolarHBondContact O-N 2.86Å; C230-R234 VanDerWaalsContact O-N 3.07Å; M231-R234 PolarHBondContact O-N 2.98Å; R234-K238 WeakPolarHBondContact O-CB 3.48Å; R234-K238 PolarHBondContact O-N 3.49Å; R234-E269 WeakPolarHBondContact CG-OE1 3.41Å; R234-E269 IonicContact CZ-OE1 2.69Å; R234-E269 IonicContact CZ-OE2 3.09Å; R234-E269 IonicContact NE-OE1 3.48Å; R234-E269 PolarHBondContact NE-OE1 2.98Å; R234-E269 IonicContact NE-OE2 2.66Å; R234-E269 PolarHBondContact NE-OE2 2.87Å; R234-E269 IonicContact NH2-OE1 2.65Å; R234-E269 IonicContact NH2-OE2 3.5Å; R234-E269 PolarHBondContact NH2-OE2 3.46Å
235	I	92.1	Very high	87.4	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-66.6	-43.3	176.5	-64.1	164.8	0	0	0	110.4	Y201 V211 M214 L215 M231 L232 I233 K238 L239	Y201-I235 HydrophobicContact CD1-CD1 4.37Å; Y201-I235 HydrophobicContact CD1-CG1 4.41Å; Y201-I235 HydrophobicContact CD2-CB 4.48Å; Y201-I235 HydrophobicContact CD2-CD1 3.55Å; Y201-I235 HydrophobicContact CD2-CG1 3.65Å; Y201-I235 HydrophobicContact CD2-CG2 3.96Å; Y201-I235 HydrophobicContact CE1-CG1 4.49Å; Y201-I235 HydrophobicContact CE2-CB 4.38Å; Y201-I235 HydrophobicContact CE2-CD1 4.2Å; Y201-I235 HydrophobicContact CE2-CG1 3.75Å; Y201-I235 HydrophobicContact CE2-CG2 3.84Å; Y201-I235 HydrophobicContact CG-CD1 3.64Å; Y201-I235 HydrophobicContact CG-CG1 3.99Å; V211-I235 HydrophobicContact CG1-CG2 3.53Å; M214-I235 HydrophobicContact CE-CD1 4.36Å; L215-I235 HydrophobicContact CD1-CB 4.13Å; L215-I235 HydrophobicContact CD1-CG2 3.8Å; M231-I235 HydrophobicContact CE-CD1 4.07Å; M231-I235 HydrophobicContact CG-CD1 3.95Å; M231-I235 VanDerWaalsContact O-CG1 3.26Å; M231-I235 WeakPolarHBondContact O-CG1 3.49Å; M231-I235 PolarHBondContact O-N 2.97Å; L232-I235 PolarHBondContact O-N 3.43Å; I233-I235 VanDerWaalsContact C-N 3.33Å; I233-I235 PolarHBondContact O-N 3.49Å; I235-K238 PolarHBondContact O-N 3.46Å; I235-L239 HydrophobicContact CG2-CD1 4.36Å; I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 3.24Å
236	A	90.7	Very high	85.9	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-63.1	-46	177.8	0	0	0	0	0	111.7	L215 L232 I233 L239 L240 F254 I255	L215-A236 HydrophobicContact CD1-CB 4.02Å; L215-A236 HydrophobicContact CD2-CB 4.07Å; L232-A236 WeakPolarHBondContact O-CB 3.46Å; L232-A236 PolarHBondContact O-N 3.24Å; I233-A236 PolarHBondContact O-N 3.33Å; A236-L239 PolarHBondContact O-N 3.22Å; A236-L240 WeakPolarHBondContact O-CG 3.39Å; A236-L240 PolarHBondContact O-N 2.96Å; A236-F254 HydrophobicContact CB-CD1 4.37Å; A236-I255 HydrophobicContact CB-CD1 4.03Å; A236-I255 HydrophobicContact CB-CG1 4.16Å
237	S	90.1	Very high	84.3	Confident	17 Å²	17	48.9 Å²	48.9	12%	0.119	25%	0.247	C	C	.	.	H	α-helix	trans	-58.7	-47.7	175.6	-170.3	0	0	0	0	111.3	I233 L239 L240 D241	I233-S237 WeakPolarHBondContact O-CB 3.38Å; I233-S237 PolarHBondContact O-N 3.35Å; S237-L239 VanDerWaalsContact C-N 3.32Å; S237-L239 PolarHBondContact O-N 3.4Å; S237-L240 WeakPolarHBondContact O-CB 3.43Å; S237-L240 PolarHBondContact O-N 2.9Å; S237-D241 VanDerWaalsContact O-CG 3.27Å; S237-D241 PolarHBondContact O-N 3.26Å
238	K	89	Confident	82.9	Confident	101 Å²	101	51.3 Å²	51.3	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-61.7	-40.6	178.4	-165.8	-173.9	-174	-112.3	0	112.3	R234 I235 E242	R234-K238 WeakPolarHBondContact O-CB 3.48Å; R234-K238 PolarHBondContact O-N 3.49Å; I235-K238 PolarHBondContact O-N 3.46Å; K238-E242 WeakPolarHBondContact CE-OE1 3.49Å; K238-E242 IonicContact NZ-OE1 2.82Å; K238-E242 PolarHBondContact NZ-OE1 3.48Å; K238-E242 WeakPolarHBondContact O-CG 3.36Å; K238-E242 PolarHBondContact O-N 3.34Å; K238-E242 VanDerWaalsContact O-N 3.1Å
239	L	87	Confident	82.3	Confident	9 Å²	9	52.3 Å²	52.3	5%	0.047	27%	0.271	C	S	.	.	H	α-helix	trans	-66.9	-39.7	176.7	-78.4	177.5	0	0	0	112	R208 V211 I235 A236 S237 D241 E242 T243 L251	R208-L239 HydrophobicContact CG-CD2 4.32Å; V211-L239 HydrophobicContact CB-CD1 4.41Å; V211-L239 HydrophobicContact CG1-CD1 3.72Å; V211-L239 HydrophobicContact CG1-CD2 4.49Å; V211-L239 HydrophobicContact CG1-CG 4.35Å; I235-L239 HydrophobicContact CG2-CD1 4.36Å; I235-L239 WeakPolarHBondContact O-CG 3.32Å; I235-L239 PolarHBondContact O-N 3.24Å; A236-L239 PolarHBondContact O-N 3.22Å; S237-L239 VanDerWaalsContact C-N 3.32Å; S237-L239 PolarHBondContact O-N 3.4Å; L239-D241 VanDerWaalsContact C-N 3.35Å; L239-E242 PolarHBondContact O-N 3.18Å; L239-T243 WeakPolarHBondContact O-CB 3.43Å; L239-T243 WeakPolarHBondContact O-CG2 3.38Å; L239-T243 PolarHBondContact O-N 3.3Å; L239-T243 PolarHBondContact O-OG1 2.99Å; L239-L251 HydrophobicContact CB-CD1 3.99Å
240	L	85.6	Confident	81.8	Confident	6 Å²	6	54.4 Å²	54.4	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-57.6	-50.1	175.1	-80	167.9	0	0	0	110.4	A236 S237 E242 T243 E244 G245 S249 L251 F252 I255 M277	A236-L240 WeakPolarHBondContact O-CG 3.39Å; A236-L240 PolarHBondContact O-N 2.96Å; S237-L240 WeakPolarHBondContact O-CB 3.43Å; S237-L240 PolarHBondContact O-N 2.9Å; L240-E242 VanDerWaalsContact C-N 3.33Å; L240-E242 PolarHBondContact O-N 2.92Å; L240-T243 WeakPolarHBondContact CA-OG1 3.34Å; L240-T243 PolarHBondContact O-N 3.15Å; L240-T243 VanDerWaalsContact O-N 3.08Å; L240-T243 PolarHBondContact O-OG1 2.97Å; L240-E244 PolarHBondContact O-N 3.24Å; L240-G245 WeakPolarHBondContact CD2-O 3.14Å; L240-S249 WeakPolarHBondContact CD2-OG 3.44Å; L240-L251 HydrophobicContact CD1-CB 3.95Å; L240-L251 HydrophobicContact CD2-CB 3.82Å; L240-L251 HydrophobicContact CD2-CD1 4.36Å; L240-L251 HydrophobicContact CG-CB 3.79Å; L240-L251 HydrophobicContact CG-CD1 4.19Å; L240-F252 HydrophobicContact CD1-CB 4.46Å; L240-I255 HydrophobicContact CD1-CD1 3.68Å; L240-M277 HydrophobicContact CB-SD 4.43Å; L240-M277 HydrophobicContact CD1-SD 3.81Å
241	D	83.1	Confident	81.3	Confident	73 Å²	73	54.7 Å²	54.7	39%	0.39	29%	0.29	S	S	.	.	H	α-helix	trans	-57.7	-42.7	177.6	-61.1	-22.1	0	0	0	112.1	S237 L239 T243 P278	S237-D241 VanDerWaalsContact O-CG 3.27Å; S237-D241 PolarHBondContact O-N 3.26Å; L239-D241 VanDerWaalsContact C-N 3.35Å; D241-T243 VanDerWaalsContact C-N 3.31Å; D241-T243 PolarHBondContact O-N 3.31Å; D241-P278 WeakPolarHBondContact OD1-CD 3.26Å
242	E	81.5	Confident	81	Confident	92 Å²	92	54 Å²	54	43%	0.43	29%	0.287	S	S	.	.	H	α-helix	trans	-75.1	-14.2	178.6	-71.9	175	-172	0	0	114.7	R208 K238 L239 L240	R208-E242 PolarHBondContact NH1-O 2.88Å; K238-E242 WeakPolarHBondContact CE-OE1 3.49Å; K238-E242 IonicContact NZ-OE1 2.82Å; K238-E242 PolarHBondContact NZ-OE1 3.48Å; K238-E242 WeakPolarHBondContact O-CG 3.36Å; K238-E242 PolarHBondContact O-N 3.34Å; K238-E242 VanDerWaalsContact O-N 3.1Å; L239-E242 PolarHBondContact O-N 3.18Å; L240-E242 VanDerWaalsContact C-N 3.33Å; L240-E242 PolarHBondContact O-N 2.92Å
243	T	72	Confident	80.8	Confident	48 Å²	48	58.6 Å²	58.6	29%	0.294	31%	0.311	S	S	.	.	H	α-helix	trans	-99.6	-10.6	-176.1	56.5	0	0	0	0	113.2	L239 L240 D241 G245	L239-T243 WeakPolarHBondContact O-CB 3.43Å; L239-T243 WeakPolarHBondContact O-CG2 3.38Å; L239-T243 PolarHBondContact O-N 3.3Å; L239-T243 PolarHBondContact O-OG1 2.99Å; L240-T243 WeakPolarHBondContact CA-OG1 3.34Å; L240-T243 PolarHBondContact O-N 3.15Å; L240-T243 VanDerWaalsContact O-N 3.08Å; L240-T243 PolarHBondContact O-OG1 2.97Å; D241-T243 VanDerWaalsContact C-N 3.31Å; D241-T243 PolarHBondContact O-N 3.31Å; T243-G245 PolarHBondContact O-N 2.94Å; T243-G245 PolarHBondContact OG1-N 3.23Å; T243-G245 VanDerWaalsContact OG1-N 3.17Å
244	E	63.5	Low	80.6	Confident	190 Å²	190	59.2 Å²	59.2	89%	0.888	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	23.6	-160.6	-62	-172.9	165.8	0	0	112.3	L240 G246	L240-E244 PolarHBondContact O-N 3.24Å; E244-G246 PolarHBondContact O-N 2.89Å; E244-G246 VanDerWaalsContact O-N 3.09Å
245	G	60.4	Low	80.5	Confident	29 Å²	29	52.3 Å²	52.3	30%	0.299	29%	0.288	S	S	.	.			trans	-71.6	108.3	-179.6	0	0	0	0	0	108.3	L240 T243	L240-G245 WeakPolarHBondContact CD2-O 3.14Å; T243-G245 PolarHBondContact O-N 2.94Å; T243-G245 PolarHBondContact OG1-N 3.23Å; T243-G245 VanDerWaalsContact OG1-N 3.17Å
246	G	61.4	Low	80.4	Confident	46 Å²	46	55.3 Å²	55.3	47%	0.474	30%	0.302	S	S	.	.			trans	-68.1	-164.8	174.3	0	0	0	0	0	113.4	E244 D248 S249	E244-G246 PolarHBondContact O-N 2.89Å; E244-G246 VanDerWaalsContact O-N 3.09Å; G246-D248 PolarHBondContact O-N 2.67Å; G246-S249 VanDerWaalsContact O-CB 3.31Å; G246-S249 WeakPolarHBondContact O-CB 3.33Å; G246-S249 PolarHBondContact O-N 3.07Å
247	H	61.5	Low	80.5	Confident	105 Å²	105	58.7 Å²	58.7	49%	0.486	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-27.3	-179.8	64.1	-73.7	0	0	0	115.9	S249	H247-S249 PolarHBondContact O-N 3.12Å
248	D	65.8	Low	80.6	Confident	135 Å²	135	58 Å²	58	72%	0.722	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-0.4	179.2	-68.5	-37.9	0	0	0	114	G246	G246-D248 PolarHBondContact O-N 2.67Å
249	S	80.4	Confident	80.8	Confident	20 Å²	20	53.9 Å²	53.9	14%	0.14	30%	0.303	C	S	.	.	S	Bend	trans	-75.4	131.7	178.5	-178.6	0	0	0	0	111.3	L240 G246 H247 L251 F252 D253	L240-S249 WeakPolarHBondContact CD2-OG 3.44Å; G246-S249 VanDerWaalsContact O-CB 3.31Å; G246-S249 WeakPolarHBondContact O-CB 3.33Å; G246-S249 PolarHBondContact O-N 3.07Å; H247-S249 PolarHBondContact O-N 3.12Å; S249-L251 PolarHBondContact O-N 3.26Å; S249-L251 WeakPolarHBondContact OG-CB 3.49Å; S249-L251 PolarHBondContact OG-N 3.31Å; S249-F252 WeakPolarHBondContact O-CB 3.29Å; S249-F252 PolarHBondContact O-N 2.84Å; S249-D253 PolarHBondContact O-N 3.27Å
250	P	83	Confident	81.1	Confident	86 Å²	86	64.3 Å²	64.3	56%	0.558	34%	0.342	S	S	*	.	H	α-helix	trans	-61.9	-12.9	173.9	27.2	-35.6	0	0	0	113	F254	P250-F254 PolarHBondContact O-N 3Å
251	L	86.1	Confident	81.4	Confident	13 Å²	13	66.3 Å²	66.3	7%	0.068	35%	0.353	C	S	.	.	H	α-helix	trans	-73.5	-36.6	173	-54.8	-169.6	0	0	0	111.8	L215 L239 L240 S249 F254 I255	L215-L251 HydrophobicContact CD2-CD2 3.14Å; L215-L251 HydrophobicContact CD2-CG 4.36Å; L239-L251 HydrophobicContact CB-CD1 3.99Å; L240-L251 HydrophobicContact CD1-CB 3.95Å; L240-L251 HydrophobicContact CD2-CB 3.82Å; L240-L251 HydrophobicContact CD2-CD1 4.36Å; L240-L251 HydrophobicContact CG-CB 3.79Å; L240-L251 HydrophobicContact CG-CD1 4.19Å; S249-L251 PolarHBondContact O-N 3.26Å; S249-L251 WeakPolarHBondContact OG-CB 3.49Å; S249-L251 PolarHBondContact OG-N 3.31Å; L251-F254 WeakPolarHBondContact O-CB 3.31Å; L251-F254 PolarHBondContact O-N 2.91Å; L251-I255 WeakPolarHBondContact O-CG1 3.45Å; L251-I255 PolarHBondContact O-N 3.21Å; L251-I255 VanDerWaalsContact O-N 3.16Å
252	F	87.5	Confident	81.8	Confident	13 Å²	13	72.9 Å²	72.9	6%	0.057	38%	0.378	C	S	.	.	H	α-helix	trans	-66.6	-47.6	176.4	-174.8	-86.4	0	0	0	110.2	L240 S249 F254 I255 E256 M277 E284	L240-F252 HydrophobicContact CD1-CB 4.46Å; S249-F252 WeakPolarHBondContact O-CB 3.29Å; S249-F252 PolarHBondContact O-N 2.84Å; F252-F254 PolarHBondContact O-N 3.21Å; F252-I255 PolarHBondContact O-N 2.82Å; F252-E256 HydrophobicContact CE1-CB 4.42Å; F252-E256 PolarHBondContact O-N 3.34Å; F252-M277 HydrophobicContact CD2-CE 3.54Å; F252-M277 HydrophobicContact CD2-SD 4.14Å; F252-M277 HydrophobicContact CE2-CE 3.45Å; F252-M277 VanDerWaalsContact CE2-CE 3.45Å; F252-M277 HydrophobicContact CE2-SD 4.46Å; F252-E284 HydrophobicContact CE1-CG 4.5Å; F252-E284 HydrophobicContact CE2-CG 4.5Å; F252-E284 HydrophobicContact CZ-CB 3.96Å; F252-E284 HydrophobicContact CZ-CG 3.9Å
253	D	88.1	Confident	82.3	Confident	97 Å²	97	71.3 Å²	71.3	52%	0.519	37%	0.373	S	S	.	.	H	α-helix	trans	-52.6	-40	174.5	-71.9	-22.2	0	0	0	112.3	S249 S257	S249-D253 PolarHBondContact O-N 3.27Å; D253-S257 WeakPolarHBondContact O-CB 3.3Å; D253-S257 PolarHBondContact O-N 3.04Å
254	F	90.5	Very high	83.3	Confident	13 Å²	13	72.7 Å²	72.7	6%	0.057	38%	0.376	C	S	.	.	H	α-helix	trans	-64.5	-47.8	175.9	168.4	-110.4	0	0	0	112.1	T219 Y229 L232 I233 A236 P250 L251 F252 E256 S257 C258	T219-F254 HydrophobicContact CG2-CB 3.93Å; T219-F254 HydrophobicContact CG2-CD2 3.45Å; T219-F254 VanDerWaalsContact CG2-CD2 3.45Å; T219-F254 HydrophobicContact CG2-CE2 4.19Å; T219-F254 HydrophobicContact CG2-CG 3.81Å; Y229-F254 HydrophobicContact CD1-CZ 4.27Å; Y229-F254 HydrophobicContact CE1-CE2 4.33Å; Y229-F254 HydrophobicContact CE1-CZ 4.43Å; L232-F254 HydrophobicContact CB-CE1 4.49Å; L232-F254 HydrophobicContact CD2-CE1 3.94Å; L232-F254 HydrophobicContact CD2-CE2 4.38Å; L232-F254 HydrophobicContact CD2-CZ 3.59Å; L232-F254 HydrophobicContact CG-CE1 4.05Å; L232-F254 HydrophobicContact CG-CZ 4.15Å; I233-F254 HydrophobicContact CG1-CE1 4.29Å; A236-F254 HydrophobicContact CB-CD1 4.37Å; P250-F254 PolarHBondContact O-N 3Å; L251-F254 WeakPolarHBondContact O-CB 3.31Å; L251-F254 PolarHBondContact O-N 2.91Å; F252-F254 PolarHBondContact O-N 3.21Å; F254-E256 VanDerWaalsContact C-N 3.34Å; F254-E256 PolarHBondContact O-N 3.43Å; F254-S257 PolarHBondContact O-N 3.29Å; F254-S257 PolarHBondContact O-OG 3.05Å; F254-C258 VanDerWaalsContact CE2-SG 3.59Å; F254-C258 PolarHBondContact O-N 3.38Å; F254-C258 VanDerWaalsContact O-N 3.13Å; F254-C258 PolarHBondContact O-SG 3Å
255	I	91.4	Very high	84.8	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-42.8	178.4	-62.3	170.8	0	0	0	110.1	I233 A236 L240 L251 F252 S257 C258 A270 A273 I274	I233-I255 HydrophobicContact CG2-CG2 4.42Å; A236-I255 HydrophobicContact CB-CD1 4.03Å; A236-I255 HydrophobicContact CB-CG1 4.16Å; L240-I255 HydrophobicContact CD1-CD1 3.68Å; L251-I255 WeakPolarHBondContact O-CG1 3.45Å; L251-I255 PolarHBondContact O-N 3.21Å; L251-I255 VanDerWaalsContact O-N 3.16Å; F252-I255 PolarHBondContact O-N 2.82Å; I255-S257 PolarHBondContact O-N 3.46Å; I255-C258 VanDerWaalsContact O-CB 3.31Å; I255-C258 WeakPolarHBondContact O-CB 3.44Å; I255-C258 PolarHBondContact O-N 3.41Å; I255-C258 VanDerWaalsContact O-N 3.09Å; I255-A270 HydrophobicContact CG2-CB 4.17Å; I255-A273 HydrophobicContact CG2-CB 4.23Å; I255-I274 HydrophobicContact CG2-CD1 4.03Å; I255-I274 HydrophobicContact CG2-CG1 3.71Å
256	E	90.4	Very high	86.4	Confident	69 Å²	69	65.7 Å²	65.7	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-61.9	-42.6	176.4	-168	-176.3	173.4	0	0	111.4	F252 F254 C258 L259	F252-E256 HydrophobicContact CE1-CB 4.42Å; F252-E256 PolarHBondContact O-N 3.34Å; F254-E256 VanDerWaalsContact C-N 3.34Å; F254-E256 PolarHBondContact O-N 3.43Å; E256-C258 PolarHBondContact O-N 3.46Å; E256-L259 HydrophobicContact CG-CD1 4.25Å; E256-L259 VanDerWaalsContact O-CB 3.25Å; E256-L259 WeakPolarHBondContact O-CB 3.46Å; E256-L259 WeakPolarHBondContact O-CG 3.41Å; E256-L259 PolarHBondContact O-N 3.06Å
257	S	91.7	Very high	88.1	Confident	70 Å²	70	64.1 Å²	64.1	49%	0.49	32%	0.317	S	S	.	.	H	α-helix	trans	-60.5	-29.9	175.7	80.8	0	0	0	0	112.7	D253 F254 I255 L259 R260	D253-S257 WeakPolarHBondContact O-CB 3.3Å; D253-S257 PolarHBondContact O-N 3.04Å; F254-S257 PolarHBondContact O-N 3.29Å; F254-S257 PolarHBondContact O-OG 3.05Å; I255-S257 PolarHBondContact O-N 3.46Å; S257-L259 PolarHBondContact O-N 2.78Å; S257-R260 PolarHBondContact O-N 3.32Å
258	C	93.3	Very high	89.7	Confident	3 Å²	3	61.5 Å²	61.5	2%	0.02	30%	0.303	C	S	.	.	H	α-helix	trans	-69.7	-18	177.8	-68.6	0	0	0	0	113.3	I233 F254 I255 E256 R260 N261 V266 A270	I233-C258 HydrophobicContact CD1-CB 3.94Å; I233-C258 HydrophobicContact CG1-CB 4.46Å; F254-C258 VanDerWaalsContact CE2-SG 3.59Å; F254-C258 PolarHBondContact O-N 3.38Å; F254-C258 VanDerWaalsContact O-N 3.13Å; F254-C258 PolarHBondContact O-SG 3Å; I255-C258 VanDerWaalsContact O-CB 3.31Å; I255-C258 WeakPolarHBondContact O-CB 3.44Å; I255-C258 PolarHBondContact O-N 3.41Å; I255-C258 VanDerWaalsContact O-N 3.09Å; E256-C258 PolarHBondContact O-N 3.46Å; C258-R260 PolarHBondContact O-N 3.5Å; C258-N261 VanDerWaalsContact O-CB 3.23Å; C258-N261 WeakPolarHBondContact O-CB 3.26Å; C258-N261 PolarHBondContact O-N 3.08Å; C258-N261 VanDerWaalsContact O-N 3.15Å; C258-V266 HydrophobicContact CB-CG1 4.15Å; C258-A270 HydrophobicContact CB-CB 3.74Å
259	L	93.3	Very high	91.1	Very high	15 Å²	15	56.5 Å²	56.5	8%	0.079	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.9	172.8	-65.5	174.4	0	0	0	112.8	E256 S257 A270 A271 I274 P287 V291	E256-L259 HydrophobicContact CG-CD1 4.25Å; E256-L259 VanDerWaalsContact O-CB 3.25Å; E256-L259 WeakPolarHBondContact O-CB 3.46Å; E256-L259 WeakPolarHBondContact O-CG 3.41Å; E256-L259 PolarHBondContact O-N 3.06Å; S257-L259 PolarHBondContact O-N 2.78Å; L259-A270 HydrophobicContact CD2-CB 3.92Å; L259-A270 HydrophobicContact CG-CB 4.34Å; L259-A271 HydrophobicContact CD2-CB 3.8Å; L259-I274 HydrophobicContact CD1-CD1 3.76Å; L259-I274 HydrophobicContact CD2-CD1 4.28Å; L259-I274 HydrophobicContact CG-CD1 4.14Å; L259-P287 HydrophobicContact CD1-CB 3.67Å; L259-V291 HydrophobicContact CB-CG2 4.36Å; L259-V291 HydrophobicContact CD2-CG2 4.4Å
260	R	91.8	Very high	91.8	Very high	227 Å²	227	55.6 Å²	55.6	86%	0.857	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	11.7	179	-56.9	-176.1	-173.8	-167.6	2.9	113.1	S257 C258	S257-R260 PolarHBondContact O-N 3.32Å; C258-R260 PolarHBondContact O-N 3.5Å
261	N	92.8	Very high	92.3	Very high	48 Å²	48	51.5 Å²	51.5	26%	0.257	24%	0.242	S	C	.	.			trans	-68	152.8	-179.7	-161.2	-64.3	0	0	0	111.4	C258 N263 V266 V267	C258-N261 VanDerWaalsContact O-CB 3.23Å; C258-N261 WeakPolarHBondContact O-CB 3.26Å; C258-N261 PolarHBondContact O-N 3.08Å; C258-N261 VanDerWaalsContact O-N 3.15Å; N261-N263 VanDerWaalsContact C-N 3.27Å; N261-N263 PolarHBondContact O-N 2.64Å; N261-N263 PolarHBondContact OD1-N 2.85Å; N261-V266 HydrophobicContact CB-CB 4.13Å; N261-V266 HydrophobicContact CB-CG1 3.87Å; N261-V267 HydrophobicContact CB-CG2 3.98Å; N261-V267 WeakPolarHBondContact O-CG2 3.31Å
262	K	90.8	Very high	92.6	Very high	211 Å²	211	51.9 Å²	51.9	92%	0.917	25%	0.246	S	C	*	.	S	Bend	trans	-70.7	-23.3	177.2	-64.3	-176.6	-179.5	-179.1	0	113
263	N	93.1	Very high	92.9	Very high	60 Å²	60	51.7 Å²	51.7	32%	0.321	25%	0.247	S	C	.	.	S	Bend	trans	-96.5	119.4	-176.8	-165.5	-59.1	0	0	0	111.4	P226 N261 M265 V266 V267	P226-N263 HydrophobicContact CB-CB 4.38Å; P226-N263 HydrophobicContact CG-CB 4.42Å; P226-N263 WeakPolarHBondContact CG-ND2 3.33Å; N261-N263 VanDerWaalsContact C-N 3.27Å; N261-N263 PolarHBondContact O-N 2.64Å; N261-N263 PolarHBondContact OD1-N 2.85Å; N263-M265 PolarHBondContact O-N 2.84Å; N263-M265 VanDerWaalsContact O-N 3.14Å; N263-M265 VanDerWaalsContact OD1-CB 3.28Å; N263-M265 WeakPolarHBondContact OD1-CB 3.47Å; N263-M265 PolarHBondContact OD1-N 2.83Å; N263-V266 HydrophobicContact CB-CG2 4.15Å; N263-V266 PolarHBondContact O-N 3.33Å; N263-V267 WeakPolarHBondContact O-CG2 3.48Å; N263-V267 PolarHBondContact O-N 3.16Å; N263-V267 VanDerWaalsContact O-N 3.14Å
264	E	93.3	Very high	93	Very high	77 Å²	77	47.1 Å²	47.1	36%	0.36	22%	0.223	S	C	.	.	H	α-helix	trans	-54.3	-33.3	-179.1	-60.9	163.4	160.9	0	0	113.2	V267 Y268 F295 K300 L303	E264-V267 PolarHBondContact O-N 2.66Å; E264-Y268 WeakPolarHBondContact O-CB 3.49Å; E264-Y268 PolarHBondContact O-N 2.92Å; E264-F295 HydrophobicContact CB-CZ 4.35Å; E264-K300 IonicContact OE1-NZ 3.02Å; E264-K300 PolarHBondContact OE1-NZ 2.92Å; E264-K300 IonicContact OE2-NZ 3.79Å; E264-K300 PolarHBondContact OE2-NZ 3.16Å; E264-L303 HydrophobicContact CB-CD1 4.3Å; E264-L303 HydrophobicContact CB-CD2 4.28Å; E264-L303 HydrophobicContact CG-CD1 4.2Å
265	M	93.6	Very high	92.9	Very high	72 Å²	72	47.2 Å²	47.2	36%	0.355	22%	0.224	S	C	.	.	H	α-helix	trans	-66.9	-40.1	179.1	-173.2	-178.2	70.4	0	0	111.9	P226 F227 N263 E269	P226-M265 HydrophobicContact CB-CE 3.63Å; F227-M265 HydrophobicContact CD1-CE 3.64Å; F227-M265 HydrophobicContact CD1-SD 4.2Å; F227-M265 HydrophobicContact CE1-CE 3.88Å; F227-M265 HydrophobicContact CE1-SD 4.04Å; F227-M265 HydrophobicContact CG-CE 4.18Å; N263-M265 PolarHBondContact O-N 2.84Å; N263-M265 VanDerWaalsContact O-N 3.14Å; N263-M265 VanDerWaalsContact OD1-CB 3.28Å; N263-M265 WeakPolarHBondContact OD1-CB 3.47Å; N263-M265 PolarHBondContact OD1-N 2.83Å; M265-E269 WeakPolarHBondContact O-CB 3.25Å; M265-E269 PolarHBondContact O-N 2.87Å
266	V	95.3	Very high	92.7	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.6	-43.1	177.8	177.9	0	0	0	0	110.1	P226 Y229 I233 C258 N261 N263 E269 A270	P226-V266 HydrophobicContact CB-CG2 3.98Å; Y229-V266 HydrophobicContact CD1-CG1 4.49Å; Y229-V266 HydrophobicContact CD2-CG2 4.5Å; Y229-V266 HydrophobicContact CG-CG1 4.19Å; Y229-V266 HydrophobicContact CG-CG2 4.32Å; I233-V266 HydrophobicContact CD1-CG1 3.88Å; C258-V266 HydrophobicContact CB-CG1 4.15Å; N261-V266 HydrophobicContact CB-CB 4.13Å; N261-V266 HydrophobicContact CB-CG1 3.87Å; N263-V266 HydrophobicContact CB-CG2 4.15Å; N263-V266 PolarHBondContact O-N 3.33Å; V266-E269 PolarHBondContact O-N 2.79Å; V266-A270 WeakPolarHBondContact O-CB 3.35Å; V266-A270 PolarHBondContact O-N 2.81Å
267	V	95.7	Very high	92.3	Very high	12 Å²	12	48.9 Å²	48.9	7%	0.073	23%	0.232	C	C	.	.	H	α-helix	trans	-60.6	-45.7	177.2	173.1	0	0	0	0	111	N261 N263 E264 A270 A271 V291 F295	N261-V267 HydrophobicContact CB-CG2 3.98Å; N261-V267 WeakPolarHBondContact O-CG2 3.31Å; N263-V267 WeakPolarHBondContact O-CG2 3.48Å; N263-V267 PolarHBondContact O-N 3.16Å; N263-V267 VanDerWaalsContact O-N 3.14Å; E264-V267 PolarHBondContact O-N 2.66Å; V267-A270 PolarHBondContact O-N 2.88Å; V267-A271 WeakPolarHBondContact O-CB 3.19Å; V267-A271 PolarHBondContact O-N 3.49Å; V267-V291 HydrophobicContact CG1-CB 4.43Å; V267-V291 HydrophobicContact CG1-CG1 3.19Å; V267-V291 HydrophobicContact CG1-CG2 4.42Å; V267-F295 HydrophobicContact CB-CZ 4.1Å; V267-F295 HydrophobicContact CG1-CE2 4.18Å; V267-F295 HydrophobicContact CG1-CZ 3.65Å
268	Y	95.4	Very high	91.3	Very high	50 Å²	50	49.3 Å²	49.3	20%	0.196	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-44.5	176.3	-179.9	-102.8	0	0	0	112.6	E264 A270 A271 S272 L292 F295 A306 T310	E264-Y268 WeakPolarHBondContact O-CB 3.49Å; E264-Y268 PolarHBondContact O-N 2.92Å; Y268-A270 VanDerWaalsContact C-N 3.3Å; Y268-A270 PolarHBondContact O-N 3.24Å; Y268-A271 PolarHBondContact O-N 2.98Å; Y268-S272 VanDerWaalsContact O-CB 3.31Å; Y268-S272 WeakPolarHBondContact O-CB 3.46Å; Y268-S272 PolarHBondContact O-N 2.87Å; Y268-L292 HydrophobicContact CD2-CD2 4.09Å; Y268-L292 HydrophobicContact CE2-CD2 4.05Å; Y268-F295 HydrophobicContact CD2-CD2 4.3Å; Y268-F295 HydrophobicContact CD2-CE2 4.26Å; Y268-A306 HydrophobicContact CD2-CB 4.1Å; Y268-A306 HydrophobicContact CE1-CB 4.18Å; Y268-A306 HydrophobicContact CE2-CB 3.54Å; Y268-A306 WeakPolarHBondContact CE2-O 3.5Å; Y268-A306 PolarHBondContact OH-O 3.37Å; Y268-A306 VanDerWaalsContact OH-O 3.11Å; Y268-T310 PolarHBondContact OH-OG1 3.35Å
269	E	95.7	Very high	90.2	Very high	31 Å²	31	56.7 Å²	56.7	15%	0.145	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-40.4	178.5	-171.5	75.7	-150.7	0	0	111.1	C230 I233 R234 M265 V266 S272 A273	C230-E269 HydrophobicContact CB-CB 4.3Å; C230-E269 HydrophobicContact CB-CG 3.96Å; I233-E269 HydrophobicContact CB-CG 4.22Å; I233-E269 HydrophobicContact CD1-CB 4.36Å; I233-E269 HydrophobicContact CD1-CG 4.43Å; I233-E269 HydrophobicContact CG2-CG 3.99Å; R234-E269 WeakPolarHBondContact CG-OE1 3.41Å; R234-E269 IonicContact CZ-OE1 2.69Å; R234-E269 IonicContact CZ-OE2 3.09Å; R234-E269 IonicContact NE-OE1 3.48Å; R234-E269 PolarHBondContact NE-OE1 2.98Å; R234-E269 IonicContact NE-OE2 2.66Å; R234-E269 PolarHBondContact NE-OE2 2.87Å; R234-E269 IonicContact NH2-OE1 2.65Å; R234-E269 IonicContact NH2-OE2 3.5Å; R234-E269 PolarHBondContact NH2-OE2 3.46Å; M265-E269 WeakPolarHBondContact O-CB 3.25Å; M265-E269 PolarHBondContact O-N 2.87Å; V266-E269 PolarHBondContact O-N 2.79Å; E269-S272 PolarHBondContact O-N 2.79Å; E269-A273 WeakPolarHBondContact O-CB 3.37Å; E269-A273 PolarHBondContact O-N 2.98Å
270	A	94.6	Very high	89.3	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-63.2	-48.2	174.6	0	0	0	0	0	112.1	I233 I255 C258 L259 V266 V267 Y268 S272 A273 I274	I233-A270 HydrophobicContact CD1-CB 4.05Å; I255-A270 HydrophobicContact CG2-CB 4.17Å; C258-A270 HydrophobicContact CB-CB 3.74Å; L259-A270 HydrophobicContact CD2-CB 3.92Å; L259-A270 HydrophobicContact CG-CB 4.34Å; V266-A270 WeakPolarHBondContact O-CB 3.35Å; V266-A270 PolarHBondContact O-N 2.81Å; V267-A270 PolarHBondContact O-N 2.88Å; Y268-A270 VanDerWaalsContact C-N 3.3Å; Y268-A270 PolarHBondContact O-N 3.24Å; A270-S272 VanDerWaalsContact C-N 3.31Å; A270-S272 PolarHBondContact O-N 3.38Å; A270-A273 PolarHBondContact O-N 2.97Å; A270-I274 WeakPolarHBondContact O-CG1 3.46Å; A270-I274 PolarHBondContact O-N 2.69Å
271	A	94.1	Very high	88.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-40.5	177	0	0	0	0	0	111.8	L259 V267 Y268 I274 V275 A288 L292	L259-A271 HydrophobicContact CD2-CB 3.8Å; V267-A271 WeakPolarHBondContact O-CB 3.19Å; V267-A271 PolarHBondContact O-N 3.49Å; Y268-A271 PolarHBondContact O-N 2.98Å; A271-I274 PolarHBondContact O-N 3.09Å; A271-V275 WeakPolarHBondContact O-CG2 3.49Å; A271-V275 PolarHBondContact O-N 2.87Å; A271-V275 VanDerWaalsContact O-N 3.08Å; A271-A288 HydrophobicContact CB-CB 4.15Å; A271-L292 HydrophobicContact CB-CD2 4.22Å; A271-L292 HydrophobicContact CB-CG 4.21Å
272	S	93.2	Very high	88.1	Confident	21 Å²	21	49.4 Å²	49.4	15%	0.147	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-43	175.9	-174.3	0	0	0	0	111.6	Y268 E269 A270 V275 H276	Y268-S272 VanDerWaalsContact O-CB 3.31Å; Y268-S272 WeakPolarHBondContact O-CB 3.46Å; Y268-S272 PolarHBondContact O-N 2.87Å; E269-S272 PolarHBondContact O-N 2.79Å; A270-S272 VanDerWaalsContact C-N 3.31Å; A270-S272 PolarHBondContact O-N 3.38Å; S272-V275 PolarHBondContact O-N 2.97Å; S272-H276 PolarHBondContact O-N 3.23Å; S272-H276 VanDerWaalsContact O-N 3.16Å; S272-H276 PolarHBondContact O-ND1 2.64Å; S272-H276 PolarHBondContact OG-CE1 3.19Å; S272-H276 PolarHBondContact OG-ND1 3.28Å
273	A	91.8	Very high	87.6	Confident	9 Å²	9	49.9 Å²	49.9	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-46	176.6	0	0	0	0	0	111.3	I233 I255 E269 A270 V275 H276 M277	I233-A273 HydrophobicContact CG2-CB 3.69Å; I255-A273 HydrophobicContact CG2-CB 4.23Å; E269-A273 WeakPolarHBondContact O-CB 3.37Å; E269-A273 PolarHBondContact O-N 2.98Å; A270-A273 PolarHBondContact O-N 2.97Å; A273-V275 VanDerWaalsContact C-N 3.34Å; A273-V275 PolarHBondContact O-N 3.16Å; A273-H276 PolarHBondContact O-N 3.41Å; A273-M277 PolarHBondContact O-N 3.34Å
274	I	90.6	Very high	87.1	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-58.9	-43.9	177.3	-64.7	166.2	0	0	0	112.1	I255 L259 A270 A271 H276 M277 C280 L285 A288	I255-I274 HydrophobicContact CG2-CD1 4.03Å; I255-I274 HydrophobicContact CG2-CG1 3.71Å; L259-I274 HydrophobicContact CD1-CD1 3.76Å; L259-I274 HydrophobicContact CD2-CD1 4.28Å; L259-I274 HydrophobicContact CG-CD1 4.14Å; A270-I274 WeakPolarHBondContact O-CG1 3.46Å; A270-I274 PolarHBondContact O-N 2.69Å; A271-I274 PolarHBondContact O-N 3.09Å; I274-H276 VanDerWaalsContact C-N 3.31Å; I274-H276 PolarHBondContact O-N 2.78Å; I274-M277 VanDerWaalsContact CA-CE 3.49Å; I274-M277 HydrophobicContact CB-CE 4.15Å; I274-M277 HydrophobicContact CG1-CE 3.93Å; I274-M277 HydrophobicContact CG2-CE 4.45Å; I274-C280 PolarHBondContact O-SG 3Å; I274-C280 VanDerWaalsContact O-SG 3.36Å; I274-L285 HydrophobicContact CG2-CD2 4.43Å; I274-A288 HydrophobicContact CB-CB 4.07Å; I274-A288 HydrophobicContact CD1-CB 4.32Å; I274-A288 HydrophobicContact CG2-CB 3.95Å
275	V	88.9	Confident	86.8	Confident	16 Å²	16	45.2 Å²	45.2	10%	0.097	24%	0.235	C	C	.	.	H	α-helix	trans	-67.1	-29.2	-179.8	162	0	0	0	0	113.6	A271 S272 A273 L285 A288 L292 T310 V314	A271-V275 WeakPolarHBondContact O-CG2 3.49Å; A271-V275 PolarHBondContact O-N 2.87Å; A271-V275 VanDerWaalsContact O-N 3.08Å; S272-V275 PolarHBondContact O-N 2.97Å; A273-V275 VanDerWaalsContact C-N 3.34Å; A273-V275 PolarHBondContact O-N 3.16Å; V275-L285 HydrophobicContact CG2-CD2 4.2Å; V275-A288 HydrophobicContact CG2-CB 4.5Å; V275-L292 HydrophobicContact CG2-CD1 4.31Å; V275-T310 HydrophobicContact CB-CG2 4.07Å; V275-T310 HydrophobicContact CG1-CG2 3.83Å; V275-T310 HydrophobicContact CG2-CG2 4.03Å; V275-V314 HydrophobicContact CB-CG2 4.04Å; V275-V314 HydrophobicContact CG1-CG2 3.31Å; V275-V314 HydrophobicContact CG2-CG2 3.52Å
276	H	86.6	Confident	86.6	Confident	87 Å²	87	44.4 Å²	44.4	40%	0.403	24%	0.239	S	C	.	.	H	α-helix	trans	-92.5	-6	-176.1	-69.8	85.7	0	0	0	113.8	S272 A273 I274 K313	S272-H276 PolarHBondContact O-N 3.23Å; S272-H276 VanDerWaalsContact O-N 3.16Å; S272-H276 PolarHBondContact O-ND1 2.64Å; S272-H276 PolarHBondContact OG-CE1 3.19Å; S272-H276 PolarHBondContact OG-ND1 3.28Å; A273-H276 PolarHBondContact O-N 3.41Å; I274-H276 VanDerWaalsContact C-N 3.31Å; I274-H276 PolarHBondContact O-N 2.78Å; H276-K313 PolarHBondContact NE2-NZ 3.1Å
277	M	82.9	Confident	86.4	Confident	17 Å²	17	46.3 Å²	46.3	8%	0.084	25%	0.252	C	S	.	.	S	Bend	trans	-65	138.6	177.4	-82.6	-171.5	-80.8	0	0	111.6	L240 F252 A273 I274 C280	L240-M277 HydrophobicContact CB-SD 4.43Å; L240-M277 HydrophobicContact CD1-SD 3.81Å; F252-M277 HydrophobicContact CD2-CE 3.54Å; F252-M277 HydrophobicContact CD2-SD 4.14Å; F252-M277 HydrophobicContact CE2-CE 3.45Å; F252-M277 VanDerWaalsContact CE2-CE 3.45Å; F252-M277 HydrophobicContact CE2-SD 4.46Å; A273-M277 PolarHBondContact O-N 3.34Å; I274-M277 VanDerWaalsContact CA-CE 3.49Å; I274-M277 HydrophobicContact CB-CE 4.15Å; I274-M277 HydrophobicContact CG1-CE 3.93Å; I274-M277 HydrophobicContact CG2-CE 4.45Å; M277-C280 VanDerWaalsContact CB-SG 3.57Å
278	P	69.6	Low	86.3	Confident	78 Å²	78	45.8 Å²	45.8	51%	0.506	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	139.4	173.3	28.3	-30.7	0	0	0	109.8	D241 C280	D241-P278 WeakPolarHBondContact OD1-CD 3.26Å; P278-C280 PolarHBondContact O-N 3.06Å
279	N	70.3	Confident	86.2	Confident	158 Å²	158	43.7 Å²	43.7	85%	0.845	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	29	176	-54.4	-26.5	0	0	0	117.3
280	C	75.1	Confident	86	Confident	12 Å²	12	45.6 Å²	45.6	8%	0.081	26%	0.257	C	S	.	.			trans	-67.1	135.2	173.8	-85	0	0	0	0	113.9	I274 M277 P278 E284 L285	I274-C280 PolarHBondContact O-SG 3Å; I274-C280 VanDerWaalsContact O-SG 3.36Å; M277-C280 VanDerWaalsContact CB-SG 3.57Å; P278-C280 PolarHBondContact O-N 3.06Å; C280-E284 WeakPolarHBondContact CA-OE2 3.28Å; C280-L285 HydrophobicContact CB-CD1 4.47Å; C280-L285 HydrophobicContact CB-CD2 4.17Å; C280-L285 HydrophobicContact CB-CG 4.1Å
281	T	81.1	Confident	86	Confident	68 Å²	68	46.7 Å²	46.7	42%	0.417	26%	0.264	S	S	.	.			trans	-81.3	158.2	173.9	69.7	0	0	0	0	112	R283 E284 L285	T281-R283 PolarHBondContact O-N 2.98Å; T281-R283 VanDerWaalsContact O-N 3.14Å; T281-E284 WeakPolarHBondContact CG2-OE1 3.37Å; T281-E284 PolarHBondContact N-OE2 3.49Å; T281-E284 PolarHBondContact O-N 3.41Å; T281-E284 VanDerWaalsContact O-N 3.13Å; T281-E284 WeakPolarHBondContact OG1-CG 3.31Å; T281-E284 PolarHBondContact OG1-N 3.49Å; T281-E284 PolarHBondContact OG1-OE1 2.78Å; T281-L285 PolarHBondContact O-N 3.22Å; T281-L285 VanDerWaalsContact O-N 3.11Å
282	A	78.9	Confident	86	Confident	58 Å²	58	46.7 Å²	46.7	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-27.3	176.9	0	0	0	0	0	113.1	A286	A282-A286 PolarHBondContact O-N 2.74Å
283	R	80.4	Confident	86.1	Confident	221 Å²	221	48.3 Å²	48.3	83%	0.834	27%	0.269	S	S	*	.	H	α-helix	trans	-71.3	-41.6	176.9	-175.7	179.5	175.8	-176.2	-3.2	111.7	T281 L285 A286 P287	T281-R283 PolarHBondContact O-N 2.98Å; T281-R283 VanDerWaalsContact O-N 3.14Å; R283-L285 VanDerWaalsContact C-N 3.33Å; R283-A286 PolarHBondContact O-N 2.85Å; R283-P287 WeakPolarHBondContact O-CD 3.38Å
284	E	81.5	Confident	86.2	Confident	36 Å²	36	53.9 Å²	53.9	17%	0.168	30%	0.297	C	S	.	.	H	α-helix	trans	-69.2	-32.2	177.7	-71.6	150.9	-143.6	0	0	112.4	F252 C280 T281 A286 P287	F252-E284 HydrophobicContact CE1-CG 4.5Å; F252-E284 HydrophobicContact CE2-CG 4.5Å; F252-E284 HydrophobicContact CZ-CB 3.96Å; F252-E284 HydrophobicContact CZ-CG 3.9Å; C280-E284 WeakPolarHBondContact CA-OE2 3.28Å; T281-E284 WeakPolarHBondContact CG2-OE1 3.37Å; T281-E284 PolarHBondContact N-OE2 3.49Å; T281-E284 PolarHBondContact O-N 3.41Å; T281-E284 VanDerWaalsContact O-N 3.13Å; T281-E284 WeakPolarHBondContact OG1-CG 3.31Å; T281-E284 PolarHBondContact OG1-N 3.49Å; T281-E284 PolarHBondContact OG1-OE1 2.78Å; E284-A286 VanDerWaalsContact C-N 3.35Å; E284-P287 WeakPolarHBondContact O-CD 3.06Å
285	L	87.9	Confident	86.4	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-73.3	-26.5	177.2	-70.5	170	0	0	0	112.8	I274 V275 C280 T281 R283 A288 V289 H318	I274-L285 HydrophobicContact CG2-CD2 4.43Å; V275-L285 HydrophobicContact CG2-CD2 4.2Å; C280-L285 HydrophobicContact CB-CD1 4.47Å; C280-L285 HydrophobicContact CB-CD2 4.17Å; C280-L285 HydrophobicContact CB-CG 4.1Å; T281-L285 PolarHBondContact O-N 3.22Å; T281-L285 VanDerWaalsContact O-N 3.11Å; R283-L285 VanDerWaalsContact C-N 3.33Å; L285-A288 PolarHBondContact O-N 2.75Å; L285-A288 VanDerWaalsContact O-N 3.15Å; L285-V289 HydrophobicContact CB-CG2 4.47Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.87Å; L285-H318 HydrophobicContact CD1-CB 4.1Å; L285-H318 VanDerWaalsContact CD1-CD2 3.5Å; L285-H318 WeakPolarHBondContact CD1-CD2 3.27Å
286	A	89.4	Confident	86.6	Confident	54 Å²	54	54 Å²	54	45%	0.446	30%	0.296	S	S	.	.	H	α-helix	trans	-58.2	-45.1	-171.1	0	0	0	0	0	114.3	A282 R283 E284 A288 V289 S290	A282-A286 PolarHBondContact O-N 2.74Å; R283-A286 PolarHBondContact O-N 2.85Å; E284-A286 VanDerWaalsContact C-N 3.35Å; A286-A288 PolarHBondContact O-N 2.92Å; A286-V289 PolarHBondContact O-N 3.26Å; A286-S290 WeakPolarHBondContact O-CB 3.34Å; A286-S290 PolarHBondContact O-N 2.83Å
287	P	91	Very high	86.9	Confident	41 Å²	41	53.6 Å²	53.6	27%	0.266	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-41.9	175.4	-23.1	34.7	0	0	0	112.9	L259 R283 E284 S290 V291	L259-P287 HydrophobicContact CD1-CB 3.67Å; R283-P287 WeakPolarHBondContact O-CD 3.38Å; E284-P287 WeakPolarHBondContact O-CD 3.06Å; P287-S290 PolarHBondContact O-N 2.87Å; P287-V291 WeakPolarHBondContact O-CG2 3.29Å; P287-V291 PolarHBondContact O-N 3.14Å
288	A	92.8	Very high	87.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66.4	-43.8	178.6	0	0	0	0	0	111.4	A271 I274 V275 L285 A286 S290 V291 L292	A271-A288 HydrophobicContact CB-CB 4.15Å; I274-A288 HydrophobicContact CB-CB 4.07Å; I274-A288 HydrophobicContact CD1-CB 4.32Å; I274-A288 HydrophobicContact CG2-CB 3.95Å; V275-A288 HydrophobicContact CG2-CB 4.5Å; L285-A288 PolarHBondContact O-N 2.75Å; L285-A288 VanDerWaalsContact O-N 3.15Å; A286-A288 PolarHBondContact O-N 2.92Å; A288-S290 PolarHBondContact O-N 2.78Å; A288-V291 PolarHBondContact O-N 3.24Å; A288-L292 VanDerWaalsContact O-CG 3.29Å; A288-L292 WeakPolarHBondContact O-CG 3.41Å; A288-L292 PolarHBondContact O-N 2.91Å
289	V	92.9	Very high	88.5	Confident	6 Å²	6	55.4 Å²	55.4	4%	0.036	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-41.2	176.8	173.4	0	0	0	0	111.3	L285 A286 V291 L292 Q293 L311	L285-V289 HydrophobicContact CB-CG2 4.47Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.87Å; A286-V289 PolarHBondContact O-N 3.26Å; V289-V291 VanDerWaalsContact C-N 3.31Å; V289-V291 PolarHBondContact O-N 3.49Å; V289-L292 PolarHBondContact O-N 3.41Å; V289-Q293 WeakPolarHBondContact O-CB 3.49Å; V289-Q293 PolarHBondContact O-N 3.01Å; V289-L311 HydrophobicContact CG1-CD2 4.16Å
290	S	93.3	Very high	89.7	Confident	71 Å²	71	52.8 Å²	52.8	50%	0.497	30%	0.298	S	S	.	.	H	α-helix	trans	-60.9	-39.1	177.6	-177.3	0	0	0	0	112.6	A286 P287 A288 Q293 L294	A286-S290 WeakPolarHBondContact O-CB 3.34Å; A286-S290 PolarHBondContact O-N 2.83Å; P287-S290 PolarHBondContact O-N 2.87Å; A288-S290 PolarHBondContact O-N 2.78Å; S290-Q293 WeakPolarHBondContact O-CB 3.4Å; S290-Q293 PolarHBondContact O-N 3.49Å; S290-L294 PolarHBondContact O-N 3.03Å; S290-L294 VanDerWaalsContact O-N 3.16Å
291	V	94	Very high	90.5	Very high	24 Å²	24	54.1 Å²	54.1	15%	0.145	31%	0.31	C	S	.	.	H	α-helix	trans	-67.7	-43.5	174.2	166.1	0	0	0	0	111.7	L259 V267 P287 A288 V289 Q293 L294 F295	L259-V291 HydrophobicContact CB-CG2 4.36Å; L259-V291 HydrophobicContact CD2-CG2 4.4Å; V267-V291 HydrophobicContact CG1-CB 4.43Å; V267-V291 HydrophobicContact CG1-CG1 3.19Å; V267-V291 HydrophobicContact CG1-CG2 4.42Å; P287-V291 WeakPolarHBondContact O-CG2 3.29Å; P287-V291 PolarHBondContact O-N 3.14Å; A288-V291 PolarHBondContact O-N 3.24Å; V289-V291 VanDerWaalsContact C-N 3.31Å; V289-V291 PolarHBondContact O-N 3.49Å; V291-Q293 VanDerWaalsContact C-N 3.28Å; V291-Q293 PolarHBondContact O-N 3.21Å; V291-L294 WeakPolarHBondContact O-CB 3.03Å; V291-L294 PolarHBondContact O-N 2.91Å; V291-F295 HydrophobicContact CG1-CD2 4.48Å; V291-F295 HydrophobicContact CG1-CE2 4.03Å; V291-F295 HydrophobicContact CG1-CZ 4.14Å; V291-F295 PolarHBondContact O-N 2.9Å; V291-F295 VanDerWaalsContact O-N 3.1Å
292	L	94.4	Very high	91.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-36.9	176.7	-66.3	169	0	0	0	111.2	Y268 A271 V275 A288 V289 L294 F295 C296 A307 T310 L311	Y268-L292 HydrophobicContact CD2-CD2 4.09Å; Y268-L292 HydrophobicContact CE2-CD2 4.05Å; A271-L292 HydrophobicContact CB-CD2 4.22Å; A271-L292 HydrophobicContact CB-CG 4.21Å; V275-L292 HydrophobicContact CG2-CD1 4.31Å; A288-L292 VanDerWaalsContact O-CG 3.29Å; A288-L292 WeakPolarHBondContact O-CG 3.41Å; A288-L292 PolarHBondContact O-N 2.91Å; V289-L292 PolarHBondContact O-N 3.41Å; L292-L294 VanDerWaalsContact C-N 3.35Å; L292-L294 PolarHBondContact O-N 3.16Å; L292-F295 WeakPolarHBondContact O-CB 3.47Å; L292-F295 PolarHBondContact O-N 3.09Å; L292-F295 VanDerWaalsContact O-N 3.13Å; L292-C296 PolarHBondContact O-N 3.37Å; L292-C296 VanDerWaalsContact O-N 3.07Å; L292-C296 PolarHBondContact O-SG 3.42Å; L292-C296 VanDerWaalsContact O-SG 3.42Å; L292-A307 HydrophobicContact CD2-CB 4.35Å; L292-A307 WeakPolarHBondContact O-CB 3.17Å; L292-T310 HydrophobicContact CD1-CG2 3.69Å; L292-T310 HydrophobicContact CD2-CG2 4.34Å; L292-L311 HydrophobicContact CB-CD1 4.31Å; L292-L311 HydrophobicContact CB-CD2 3.9Å; L292-L311 HydrophobicContact CB-CG 4.02Å; L292-L311 HydrophobicContact CD1-CD2 3.96Å; L292-L311 HydrophobicContact CD1-CG 4.32Å
293	Q	94.4	Very high	91.9	Very high	54 Å²	54	52.8 Å²	52.8	25%	0.252	30%	0.303	S	S	.	.	H	α-helix	trans	-58.2	-46.1	172.7	-171.3	179.3	6.4	0	0	111.4	V289 S290 V291 F295 C296 A324 C325 D328	V289-Q293 WeakPolarHBondContact O-CB 3.49Å; V289-Q293 PolarHBondContact O-N 3.01Å; S290-Q293 WeakPolarHBondContact O-CB 3.4Å; S290-Q293 PolarHBondContact O-N 3.49Å; V291-Q293 VanDerWaalsContact C-N 3.28Å; V291-Q293 PolarHBondContact O-N 3.21Å; Q293-F295 VanDerWaalsContact C-N 3.26Å; Q293-F295 PolarHBondContact O-N 2.95Å; Q293-C296 VanDerWaalsContact O-CB 3.3Å; Q293-C296 WeakPolarHBondContact O-CB 3.48Å; Q293-C296 PolarHBondContact O-N 3.41Å; Q293-C296 VanDerWaalsContact O-N 3.14Å; Q293-A324 PolarHBondContact NE2-O 3.41Å; Q293-C325 HydrophobicContact CG-CB 4.43Å; Q293-D328 VanDerWaalsContact CG-OD2 3.25Å; Q293-D328 WeakPolarHBondContact CG-OD2 3.31Å; Q293-D328 PolarHBondContact NE2-OD2 3.26Å
294	L	93.5	Very high	92.6	Very high	127 Å²	127	44 Å²	44	67%	0.665	27%	0.27	S	S	*	.	H	α-helix	trans	-60	-37.9	175.6	-178.3	64.7	0	0	0	111.8	S290 V291 L292 C296 S297	S290-L294 PolarHBondContact O-N 3.03Å; S290-L294 VanDerWaalsContact O-N 3.16Å; V291-L294 WeakPolarHBondContact O-CB 3.03Å; V291-L294 PolarHBondContact O-N 2.91Å; L292-L294 VanDerWaalsContact C-N 3.35Å; L292-L294 PolarHBondContact O-N 3.16Å; L294-C296 VanDerWaalsContact C-N 3.34Å; L294-C296 PolarHBondContact O-N 2.99Å; L294-S297 PolarHBondContact O-N 3.17Å
295	F	95	Very high	93.2	Very high	16 Å²	16	46.1 Å²	46.1	7%	0.07	28%	0.277	C	S	.	.	H	α-helix	trans	-69.6	-26.1	177.3	-71	-13.4	0	0	0	113.9	E264 V267 Y268 V291 L292 Q293 S297 S298 L303 A307	E264-F295 HydrophobicContact CB-CZ 4.35Å; V267-F295 HydrophobicContact CB-CZ 4.1Å; V267-F295 HydrophobicContact CG1-CE2 4.18Å; V267-F295 HydrophobicContact CG1-CZ 3.65Å; Y268-F295 HydrophobicContact CD2-CD2 4.3Å; Y268-F295 HydrophobicContact CD2-CE2 4.26Å; V291-F295 HydrophobicContact CG1-CD2 4.48Å; V291-F295 HydrophobicContact CG1-CE2 4.03Å; V291-F295 HydrophobicContact CG1-CZ 4.14Å; V291-F295 PolarHBondContact O-N 2.9Å; V291-F295 VanDerWaalsContact O-N 3.1Å; L292-F295 WeakPolarHBondContact O-CB 3.47Å; L292-F295 PolarHBondContact O-N 3.09Å; L292-F295 VanDerWaalsContact O-N 3.13Å; Q293-F295 VanDerWaalsContact C-N 3.26Å; Q293-F295 PolarHBondContact O-N 2.95Å; F295-S297 PolarHBondContact O-N 3.43Å; F295-S298 WeakPolarHBondContact O-CB 3.48Å; F295-S298 PolarHBondContact O-N 2.98Å; F295-S298 VanDerWaalsContact O-N 3.12Å; F295-L303 HydrophobicContact CD1-CD1 4.49Å; F295-A307 HydrophobicContact CB-CB 3.6Å
296	C	93.9	Very high	93.5	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-58.6	-35.7	171.4	-68.2	0	0	0	0	111.9	L292 Q293 L294 S298 R304 D328 L332	L292-C296 PolarHBondContact O-N 3.37Å; L292-C296 VanDerWaalsContact O-N 3.07Å; L292-C296 PolarHBondContact O-SG 3.42Å; L292-C296 VanDerWaalsContact O-SG 3.42Å; Q293-C296 VanDerWaalsContact O-CB 3.3Å; Q293-C296 WeakPolarHBondContact O-CB 3.48Å; Q293-C296 PolarHBondContact O-N 3.41Å; Q293-C296 VanDerWaalsContact O-N 3.14Å; L294-C296 VanDerWaalsContact C-N 3.34Å; L294-C296 PolarHBondContact O-N 2.99Å; C296-S298 VanDerWaalsContact C-N 3.33Å; C296-S298 PolarHBondContact O-N 3.23Å; C296-R304 WeakPolarHBondContact O-CD 3.18Å; C296-R304 WeakPolarHBondContact O-CG 3.39Å; C296-D328 HydrophobicContact CB-CB 4.02Å; C296-L332 HydrophobicContact CB-CD1 3.88Å
297	S	93.3	Very high	93.8	Very high	80 Å²	80	44.2 Å²	44.2	56%	0.559	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.3	9	178.7	-74.1	0	0	0	0	114	L294 F295 D328	L294-S297 PolarHBondContact O-N 3.17Å; F295-S297 PolarHBondContact O-N 3.43Å; S297-D328 PolarHBondContact OG-OD1 2.81Å
298	S	93.4	Very high	93.9	Very high	14 Å²	14	42.2 Å²	42.2	10%	0.098	25%	0.249	C	C	.	.			trans	-70.4	143.8	-179.4	-175.7	0	0	0	0	112.3	F295 C296 K300 L303 R304	F295-S298 WeakPolarHBondContact O-CB 3.48Å; F295-S298 PolarHBondContact O-N 2.98Å; F295-S298 VanDerWaalsContact O-N 3.12Å; C296-S298 VanDerWaalsContact C-N 3.33Å; C296-S298 PolarHBondContact O-N 3.23Å; S298-K300 PolarHBondContact O-N 3.17Å; S298-K300 PolarHBondContact OG-N 3.4Å; S298-L303 WeakPolarHBondContact OG-CD1 3.31Å; S298-R304 WeakPolarHBondContact O-CD 3.18Å; S298-R304 VanDerWaalsContact O-CG 3.27Å; S298-R304 WeakPolarHBondContact O-CG 3.4Å; S298-R304 PolarHBondContact O-NH1 2.89Å
299	P	92.7	Very high	94	Very high	119 Å²	119	48.1 Å²	48.1	77%	0.773	27%	0.271	S	S	*	.	S	Bend	trans	-66.9	-19.2	171.1	27.8	-35.3	0	0	0	113.1	R304	P299-R304 VanDerWaalsContact C-NH1 3.25Å; P299-R304 PolarHBondContact O-NH1 3.35Å
300	K	94.1	Very high	94	Very high	102 Å²	102	48 Å²	48	44%	0.443	27%	0.27	S	S	.	.			trans	-85.6	114.5	-178.3	-63.7	171.9	-177.7	156.1	0	110.8	E264 S298 A302 L303 R304	E264-K300 IonicContact OE1-NZ 3.02Å; E264-K300 PolarHBondContact OE1-NZ 2.92Å; E264-K300 IonicContact OE2-NZ 3.79Å; E264-K300 PolarHBondContact OE2-NZ 3.16Å; S298-K300 PolarHBondContact O-N 3.17Å; S298-K300 PolarHBondContact OG-N 3.4Å; K300-A302 PolarHBondContact O-N 2.88Å; K300-A302 VanDerWaalsContact O-N 3.16Å; K300-L303 HydrophobicContact CB-CB 4.37Å; K300-L303 HydrophobicContact CB-CD1 4.21Å; K300-L303 HydrophobicContact CB-CG 4.22Å; K300-L303 HydrophobicContact CD-CD1 3.86Å; K300-L303 HydrophobicContact CD-CG 4.41Å; K300-L303 PolarHBondContact O-N 3.3Å; K300-R304 PolarHBondContact O-N 3.3Å
301	A	93.5	Very high	94	Very high	41 Å²	41	44.6 Å²	44.6	34%	0.339	25%	0.247	S	C	.	.	H	α-helix	trans	-55.5	-35	178.5	0	0	0	0	0	113.5	L303 R304 Y305 I340	A301-L303 PolarHBondContact O-N 2.79Å; A301-R304 PolarHBondContact O-N 3.38Å; A301-Y305 WeakPolarHBondContact O-CB 3.46Å; A301-Y305 PolarHBondContact O-N 3.02Å; A301-I340 HydrophobicContact CB-CD1 4.43Å
302	A	93.7	Very high	93.8	Very high	77 Å²	77	44.5 Å²	44.5	64%	0.636	25%	0.246	S	C	*	.	H	α-helix	trans	-62.3	-39.3	177.4	0	0	0	0	0	112.9	K300 A306	K300-A302 PolarHBondContact O-N 2.88Å; K300-A302 VanDerWaalsContact O-N 3.16Å; A302-A306 VanDerWaalsContact O-CB 3.23Å; A302-A306 WeakPolarHBondContact O-CB 3.44Å; A302-A306 PolarHBondContact O-N 3.4Å
303	L	93.9	Very high	93.6	Very high	21 Å²	21	49.1 Å²	49.1	11%	0.11	27%	0.265	C	S	.	.	H	α-helix	trans	-72.6	-42.5	177.6	-70	179.2	0	0	0	111.5	E264 F295 S298 K300 A301 Y305 A306 A307	E264-L303 HydrophobicContact CB-CD1 4.3Å; E264-L303 HydrophobicContact CB-CD2 4.28Å; E264-L303 HydrophobicContact CG-CD1 4.2Å; F295-L303 HydrophobicContact CD1-CD1 4.49Å; S298-L303 WeakPolarHBondContact OG-CD1 3.31Å; K300-L303 HydrophobicContact CB-CB 4.37Å; K300-L303 HydrophobicContact CB-CD1 4.21Å; K300-L303 HydrophobicContact CB-CG 4.22Å; K300-L303 HydrophobicContact CD-CD1 3.86Å; K300-L303 HydrophobicContact CD-CG 4.41Å; K300-L303 PolarHBondContact O-N 3.3Å; A301-L303 PolarHBondContact O-N 2.79Å; L303-Y305 VanDerWaalsContact C-N 3.34Å; L303-Y305 PolarHBondContact O-N 3.29Å; L303-A306 PolarHBondContact O-N 3.48Å; L303-A307 VanDerWaalsContact O-CB 3.28Å; L303-A307 WeakPolarHBondContact O-CB 3.25Å; L303-A307 PolarHBondContact O-N 3.12Å
304	R	95.3	Very high	93.3	Very high	36 Å²	36	46.8 Å²	46.8	14%	0.136	26%	0.255	C	S	.	.	H	α-helix	trans	-57.3	-49.2	174.4	-64	-160	-61.9	-94	6.8	110.8	C296 S298 P299 K300 A301 A306 A307 V308 D335 I340	C296-R304 WeakPolarHBondContact O-CD 3.18Å; C296-R304 WeakPolarHBondContact O-CG 3.39Å; S298-R304 WeakPolarHBondContact O-CD 3.18Å; S298-R304 VanDerWaalsContact O-CG 3.27Å; S298-R304 WeakPolarHBondContact O-CG 3.4Å; S298-R304 PolarHBondContact O-NH1 2.89Å; P299-R304 VanDerWaalsContact C-NH1 3.25Å; P299-R304 PolarHBondContact O-NH1 3.35Å; K300-R304 PolarHBondContact O-N 3.3Å; A301-R304 PolarHBondContact O-N 3.38Å; R304-A306 PolarHBondContact O-N 2.79Å; R304-A307 PolarHBondContact O-N 3.08Å; R304-V308 VanDerWaalsContact O-CG2 3.3Å; R304-V308 WeakPolarHBondContact O-CG2 3.35Å; R304-V308 PolarHBondContact O-N 3.22Å; R304-D335 IonicContact CZ-OD2 3.71Å; R304-D335 IonicContact NE-OD2 3.03Å; R304-D335 PolarHBondContact NE-OD2 3.5Å; R304-D335 IonicContact NH2-OD1 3.77Å; R304-D335 IonicContact NH2-OD2 2.67Å; R304-D335 PolarHBondContact NH2-OD2 3.39Å; R304-I340 HydrophobicContact CB-CD1 3.88Å
305	Y	95	Very high	93.1	Very high	80 Å²	80	40.8 Å²	40.8	31%	0.314	22%	0.224	S	C	.	.	H	α-helix	trans	-59.1	-48.6	176.9	178.7	-98.4	0	0	0	112.4	A301 L303 A307 R309 I340 L343	A301-Y305 WeakPolarHBondContact O-CB 3.46Å; A301-Y305 PolarHBondContact O-N 3.02Å; L303-Y305 VanDerWaalsContact C-N 3.34Å; L303-Y305 PolarHBondContact O-N 3.29Å; Y305-A307 VanDerWaalsContact C-N 3.3Å; Y305-A307 PolarHBondContact O-N 3.06Å; Y305-R309 WeakPolarHBondContact O-CB 3.49Å; Y305-R309 PolarHBondContact O-N 2.77Å; Y305-I340 HydrophobicContact CD2-CG1 4.06Å; Y305-I340 HydrophobicContact CG-CG1 4.49Å; Y305-L343 HydrophobicContact CD2-CD1 4.08Å; Y305-L343 HydrophobicContact CE2-CD1 3.61Å
306	A	94.1	Very high	92.5	Very high	17 Å²	17	45.3 Å²	45.3	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-60.8	-40.8	179.6	0	0	0	0	0	111.8	Y268 A302 L303 R304 T310	Y268-A306 HydrophobicContact CD2-CB 4.1Å; Y268-A306 HydrophobicContact CE1-CB 4.18Å; Y268-A306 HydrophobicContact CE2-CB 3.54Å; Y268-A306 WeakPolarHBondContact CE2-O 3.5Å; Y268-A306 PolarHBondContact OH-O 3.37Å; Y268-A306 VanDerWaalsContact OH-O 3.11Å; A302-A306 VanDerWaalsContact O-CB 3.23Å; A302-A306 WeakPolarHBondContact O-CB 3.44Å; A302-A306 PolarHBondContact O-N 3.4Å; L303-A306 PolarHBondContact O-N 3.48Å; R304-A306 PolarHBondContact O-N 2.79Å; A306-T310 PolarHBondContact O-N 3.27Å; A306-T310 VanDerWaalsContact O-N 3.14Å; A306-T310 PolarHBondContact O-OG1 2.81Å
307	A	95	Very high	92	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-65.6	-54.5	178.2	0	0	0	0	0	112.4	L292 F295 L303 R304 Y305 R309 T310 L311	L292-A307 HydrophobicContact CD2-CB 4.35Å; L292-A307 WeakPolarHBondContact O-CB 3.17Å; F295-A307 HydrophobicContact CB-CB 3.6Å; L303-A307 VanDerWaalsContact O-CB 3.28Å; L303-A307 WeakPolarHBondContact O-CB 3.25Å; L303-A307 PolarHBondContact O-N 3.12Å; R304-A307 PolarHBondContact O-N 3.08Å; Y305-A307 VanDerWaalsContact C-N 3.3Å; Y305-A307 PolarHBondContact O-N 3.06Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 2.75Å; A307-T310 PolarHBondContact O-N 2.81Å; A307-T310 VanDerWaalsContact O-N 3.14Å; A307-L311 WeakPolarHBondContact O-CG 3.23Å; A307-L311 PolarHBondContact O-N 2.86Å
308	V	94.4	Very high	91.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-38.4	-178.9	-176.7	0	0	0	0	111	R304 T310 L311 N312 L329 L332 I340 L343 A344	R304-V308 VanDerWaalsContact O-CG2 3.3Å; R304-V308 WeakPolarHBondContact O-CG2 3.35Å; R304-V308 PolarHBondContact O-N 3.22Å; V308-T310 VanDerWaalsContact C-N 3.35Å; V308-T310 PolarHBondContact O-N 3.41Å; V308-L311 PolarHBondContact O-N 2.91Å; V308-N312 WeakPolarHBondContact O-CB 3.39Å; V308-N312 PolarHBondContact O-N 2.84Å; V308-L329 HydrophobicContact CB-CD2 4.47Å; V308-L329 HydrophobicContact CG1-CD2 4Å; V308-L329 HydrophobicContact CG2-CD2 3.91Å; V308-L332 HydrophobicContact CG2-CD1 3.34Å; V308-I340 HydrophobicContact CG2-CG2 4.2Å; V308-L343 HydrophobicContact CB-CB 4.43Å; V308-L343 VanDerWaalsContact CG1-C 3.47Å; V308-L343 HydrophobicContact CG1-CB 3.53Å; V308-A344 HydrophobicContact CG1-CB 4.15Å
309	R	93.8	Very high	91.2	Very high	123 Å²	123	53.2 Å²	53.2	46%	0.464	28%	0.275	S	S	.	.	H	α-helix	trans	-60.8	-43.2	175.1	-174.9	-179.6	177.8	-166.6	0.2	112	Y305 A307 K313 L343	Y305-R309 WeakPolarHBondContact O-CB 3.49Å; Y305-R309 PolarHBondContact O-N 2.77Å; A307-R309 VanDerWaalsContact C-N 3.3Å; A307-R309 PolarHBondContact O-N 2.75Å; R309-K313 PolarHBondContact O-N 2.94Å; R309-L343 HydrophobicContact CB-CD1 3.99Å; R309-L343 HydrophobicContact CG-CD1 4.47Å
310	T	93.4	Very high	90.8	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.025	27%	0.265	C	S	.	.	H	α-helix	trans	-70.1	-43.8	177.7	-58.3	0	0	0	0	111.2	Y268 V275 L292 A306 A307 V308 N312 K313 V314	Y268-T310 PolarHBondContact OH-OG1 3.35Å; V275-T310 HydrophobicContact CB-CG2 4.07Å; V275-T310 HydrophobicContact CG1-CG2 3.83Å; V275-T310 HydrophobicContact CG2-CG2 4.03Å; L292-T310 HydrophobicContact CD1-CG2 3.69Å; L292-T310 HydrophobicContact CD2-CG2 4.34Å; A306-T310 PolarHBondContact O-N 3.27Å; A306-T310 VanDerWaalsContact O-N 3.14Å; A306-T310 PolarHBondContact O-OG1 2.81Å; A307-T310 PolarHBondContact O-N 2.81Å; A307-T310 VanDerWaalsContact O-N 3.14Å; V308-T310 VanDerWaalsContact C-N 3.35Å; V308-T310 PolarHBondContact O-N 3.41Å; T310-N312 VanDerWaalsContact C-N 3.3Å; T310-N312 PolarHBondContact O-N 2.89Å; T310-K313 WeakPolarHBondContact O-CB 3.47Å; T310-K313 PolarHBondContact O-N 3.02Å; T310-K313 VanDerWaalsContact O-N 3.11Å; T310-V314 WeakPolarHBondContact O-CG2 3.34Å; T310-V314 PolarHBondContact O-N 3.3Å
311	L	93.6	Very high	90.5	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.7	-37.4	176.2	-70.3	173.9	0	0	0	112.4	V289 L292 A307 V308 K313 V314 A315 V322 C325 L329 T347	V289-L311 HydrophobicContact CG1-CD2 4.16Å; L292-L311 HydrophobicContact CB-CD1 4.31Å; L292-L311 HydrophobicContact CB-CD2 3.9Å; L292-L311 HydrophobicContact CB-CG 4.02Å; L292-L311 HydrophobicContact CD1-CD2 3.96Å; L292-L311 HydrophobicContact CD1-CG 4.32Å; A307-L311 WeakPolarHBondContact O-CG 3.23Å; A307-L311 PolarHBondContact O-N 2.86Å; V308-L311 PolarHBondContact O-N 2.91Å; L311-K313 VanDerWaalsContact C-N 3.28Å; L311-K313 PolarHBondContact O-N 2.85Å; L311-V314 PolarHBondContact O-N 2.91Å; L311-A315 WeakPolarHBondContact O-CB 3.19Å; L311-A315 PolarHBondContact O-N 3.17Å; L311-V322 HydrophobicContact CB-CG1 4.25Å; L311-V322 HydrophobicContact CD2-CG1 4.23Å; L311-V322 HydrophobicContact CD2-CG2 4.42Å; L311-C325 HydrophobicContact CD1-CB 4.26Å; L311-L329 HydrophobicContact CD1-CD2 4.35Å; L311-T347 HydrophobicContact CB-CG2 4.49Å
312	N	90.4	Very high	90.3	Very high	22 Å²	22	45.7 Å²	45.7	12%	0.118	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-37.9	175.5	-169.6	-97	0	0	0	112.6	V308 T310 T347 K350	V308-N312 WeakPolarHBondContact O-CB 3.39Å; V308-N312 PolarHBondContact O-N 2.84Å; T310-N312 VanDerWaalsContact C-N 3.3Å; T310-N312 PolarHBondContact O-N 2.89Å; N312-T347 WeakPolarHBondContact CA-OG1 3.47Å; N312-T347 VanDerWaalsContact CB-OG1 3.27Å; N312-T347 WeakPolarHBondContact CB-OG1 3.2Å; N312-T347 PolarHBondContact ND2-N 3.01Å; N312-T347 PolarHBondContact ND2-OG1 3.14Å; N312-K350 PolarHBondContact ND2-NZ 2.88Å; N312-K350 PolarHBondContact OD1-NZ 2.79Å; N312-K350 VanDerWaalsContact OD1-NZ 3.15Å
313	K	88.4	Confident	90	Very high	96 Å²	96	45.3 Å²	45.3	42%	0.417	23%	0.226	S	C	.	.	H	α-helix	trans	-68.2	-43.8	174.3	-69	-178.8	172.6	-171.6	0	111.4	H276 R309 T310 L311 A315 M316	H276-K313 PolarHBondContact NE2-NZ 3.1Å; R309-K313 PolarHBondContact O-N 2.94Å; T310-K313 WeakPolarHBondContact O-CB 3.47Å; T310-K313 PolarHBondContact O-N 3.02Å; T310-K313 VanDerWaalsContact O-N 3.11Å; L311-K313 VanDerWaalsContact C-N 3.28Å; L311-K313 PolarHBondContact O-N 2.85Å; K313-A315 VanDerWaalsContact C-N 3.29Å; K313-A315 PolarHBondContact O-N 2.95Å; K313-M316 WeakPolarHBondContact O-CB 3.26Å; K313-M316 PolarHBondContact O-N 2.81Å
314	V	89.4	Confident	89.7	Confident	5 Å²	5	47.4 Å²	47.4	3%	0.03	25%	0.247	C	C	.	.	H	α-helix	trans	-59.5	-43.5	175.6	-177.6	0	0	0	0	110.3	V275 T310 L311 M316 K317 H318 V322	V275-V314 HydrophobicContact CB-CG2 4.04Å; V275-V314 HydrophobicContact CG1-CG2 3.31Å; V275-V314 HydrophobicContact CG2-CG2 3.52Å; T310-V314 WeakPolarHBondContact O-CG2 3.34Å; T310-V314 PolarHBondContact O-N 3.3Å; L311-V314 PolarHBondContact O-N 2.91Å; V314-M316 PolarHBondContact O-N 2.74Å; V314-M316 VanDerWaalsContact O-N 3.09Å; V314-K317 PolarHBondContact O-N 3.18Å; V314-H318 HydrophobicContact CG1-CB 4.33Å; V314-H318 CarbonylContact O-C 3.57Å; V314-H318 PolarHBondContact O-N 2.83Å; V314-V322 HydrophobicContact CB-CG2 3.73Å; V314-V322 HydrophobicContact CG1-CG2 3.52Å
315	A	87.9	Confident	89.5	Confident	2 Å²	2	45.7 Å²	45.7	2%	0.017	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-18.1	-178.8	0	0	0	0	0	113.9	L311 K313 P319 V322 T347 K350 T351	L311-A315 WeakPolarHBondContact O-CB 3.19Å; L311-A315 PolarHBondContact O-N 3.17Å; K313-A315 VanDerWaalsContact C-N 3.29Å; K313-A315 PolarHBondContact O-N 2.95Å; A315-P319 WeakPolarHBondContact O-CG 3.49Å; A315-V322 HydrophobicContact CB-CG2 4.28Å; A315-T347 HydrophobicContact CB-CG2 3.99Å; A315-K350 HydrophobicContact CB-CB 4.27Å; A315-K350 HydrophobicContact CB-CD 4.26Å; A315-T351 HydrophobicContact CB-CG2 3.75Å
316	M	82.7	Confident	89.2	Confident	110 Å²	110	43 Å²	43	54%	0.542	23%	0.231	S	C	.	.	H	α-helix	trans	-74.3	-34.3	171.9	-67.6	-61.7	-146.3	0	0	112.7	K313 V314 K350 I593	K313-M316 WeakPolarHBondContact O-CB 3.26Å; K313-M316 PolarHBondContact O-N 2.81Å; V314-M316 PolarHBondContact O-N 2.74Å; V314-M316 VanDerWaalsContact O-N 3.09Å; M316-K350 HydrophobicContact SD-CD 3.68Å; M316-K350 WeakPolarHBondContact SD-CE 3.49Å; M316-K350 PolarHBondContact SD-NZ 3.19Å; M316-I593 HydrophobicContact CE-CD1 4.29Å
317	K	83.5	Confident	89	Confident	151 Å²	151	47.5 Å²	47.5	66%	0.657	25%	0.252	S	S	*	.	H	α-helix	trans	-99.9	-41.5	-175.9	-64.3	-172.8	177.4	-172.3	0	112.8	V314	V314-K317 PolarHBondContact O-N 3.18Å
318	H	84.7	Confident	88.8	Confident	62 Å²	62	49 Å²	49	29%	0.287	26%	0.26	S	S	.	.			trans	-133.7	71.8	-176.1	-55.2	-80.8	0	0	0	111.4	L285 V314 S320 A321	L285-H318 HydrophobicContact CD1-CB 4.1Å; L285-H318 VanDerWaalsContact CD1-CD2 3.5Å; L285-H318 WeakPolarHBondContact CD1-CD2 3.27Å; V314-H318 HydrophobicContact CG1-CB 4.33Å; V314-H318 CarbonylContact O-C 3.57Å; V314-H318 PolarHBondContact O-N 2.83Å; H318-S320 PolarHBondContact O-N 3.35Å; H318-A321 HydrophobicContact CB-CB 4.24Å; H318-A321 PolarHBondContact O-N 3Å
319	P	85.6	Confident	88.7	Confident	50 Å²	50	49 Å²	49	33%	0.325	26%	0.26	S	S	.	.	H	α-helix	trans	-55.5	-37.8	-179.4	-20.5	26.6	0	0	0	113.7	A315 A321 V322 T323	A315-P319 WeakPolarHBondContact O-CG 3.49Å; P319-A321 VanDerWaalsContact C-N 3.33Å; P319-A321 PolarHBondContact O-N 2.83Å; P319-V322 PolarHBondContact O-N 3.01Å; P319-T323 PolarHBondContact O-N 3.42Å
320	S	85.3	Confident	88.4	Confident	82 Å²	82	43.8 Å²	43.8	57%	0.573	24%	0.241	S	C	*	.	H	α-helix	trans	-61.4	-38	-177.7	53.3	0	0	0	0	112.9	H318 V322 T323	H318-S320 PolarHBondContact O-N 3.35Å; S320-V322 VanDerWaalsContact C-N 3.26Å; S320-V322 PolarHBondContact O-N 2.93Å; S320-T323 PolarHBondContact O-N 3.02Å; S320-T323 PolarHBondContact O-OG1 3.5Å
321	A	86.6	Confident	88.2	Confident	22 Å²	22	49.1 Å²	49.1	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-64.8	-30.6	179.8	0	0	0	0	0	112.5	H318 P319	H318-A321 HydrophobicContact CB-CB 4.24Å; H318-A321 PolarHBondContact O-N 3Å; P319-A321 VanDerWaalsContact C-N 3.33Å; P319-A321 PolarHBondContact O-N 2.83Å
322	V	90.1	Very high	88.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-87.3	-15.1	-176.1	-175.7	0	0	0	0	112.6	L311 V314 A315 P319 S320 A324 C325 L329 T347 T351	L311-V322 HydrophobicContact CB-CG1 4.25Å; L311-V322 HydrophobicContact CD2-CG1 4.23Å; L311-V322 HydrophobicContact CD2-CG2 4.42Å; V314-V322 HydrophobicContact CB-CG2 3.73Å; V314-V322 HydrophobicContact CG1-CG2 3.52Å; A315-V322 HydrophobicContact CB-CG2 4.28Å; P319-V322 PolarHBondContact O-N 3.01Å; S320-V322 VanDerWaalsContact C-N 3.26Å; S320-V322 PolarHBondContact O-N 2.93Å; V322-A324 PolarHBondContact O-N 3.32Å; V322-A324 VanDerWaalsContact O-N 3.08Å; V322-C325 HydrophobicContact CG1-CB 4.39Å; V322-C325 VanDerWaalsContact O-CB 3.31Å; V322-C325 WeakPolarHBondContact O-CB 3.09Å; V322-C325 PolarHBondContact O-N 2.95Å; V322-L329 HydrophobicContact CG1-CD1 4.29Å; V322-T347 HydrophobicContact CG1-CG2 3.95Å; V322-T351 HydrophobicContact CB-CG2 3.73Å; V322-T351 HydrophobicContact CG1-CG2 3.82Å
323	T	86.9	Confident	88	Confident	68 Å²	68	48.9 Å²	48.9	42%	0.417	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-54.7	-32.8	-177.4	56.5	0	0	0	0	114	P319 S320 C325 N326	P319-T323 PolarHBondContact O-N 3.42Å; S320-T323 PolarHBondContact O-N 3.02Å; S320-T323 PolarHBondContact O-OG1 3.5Å; T323-C325 PolarHBondContact O-N 3.4Å; T323-N326 WeakPolarHBondContact O-CB 3.15Å; T323-N326 VanDerWaalsContact O-CG 3.23Å; T323-N326 PolarHBondContact O-N 3.47Å; T323-N326 VanDerWaalsContact O-N 3.12Å
324	A	86.9	Confident	87.9	Confident	65 Å²	65	50.2 Å²	50.2	54%	0.537	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-60.9	-24.4	175.9	0	0	0	0	0	113.4	Q293 V322	Q293-A324 PolarHBondContact NE2-O 3.41Å; V322-A324 PolarHBondContact O-N 3.32Å; V322-A324 VanDerWaalsContact O-N 3.08Å
325	C	91.5	Very high	87.9	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-88	-2.8	179.6	-56.7	0	0	0	0	113.3	Q293 L311 V322 T323 L327 D328 L329	Q293-C325 HydrophobicContact CG-CB 4.43Å; L311-C325 HydrophobicContact CD1-CB 4.26Å; V322-C325 HydrophobicContact CG1-CB 4.39Å; V322-C325 VanDerWaalsContact O-CB 3.31Å; V322-C325 WeakPolarHBondContact O-CB 3.09Å; V322-C325 PolarHBondContact O-N 2.95Å; T323-C325 PolarHBondContact O-N 3.4Å; C325-L327 VanDerWaalsContact C-N 3.31Å; C325-L327 PolarHBondContact O-N 2.93Å; C325-D328 PolarHBondContact O-N 2.9Å; C325-D328 VanDerWaalsContact O-N 3.16Å; C325-L329 HydrophobicContact CB-CD1 4.16Å; C325-L329 HydrophobicContact CB-CG 4.34Å; C325-L329 WeakPolarHBondContact O-CG 3.43Å; C325-L329 PolarHBondContact O-N 2.95Å
326	N	89.9	Confident	87.9	Confident	23 Å²	23	56 Å²	56	12%	0.123	32%	0.324	C	S	.	.	H	α-helix	trans	-59.3	-39.6	-171	-76.3	-3.2	0	0	0	112.7	T323 L329 E330 L348 T351	T323-N326 WeakPolarHBondContact O-CB 3.15Å; T323-N326 VanDerWaalsContact O-CG 3.23Å; T323-N326 PolarHBondContact O-N 3.47Å; T323-N326 VanDerWaalsContact O-N 3.12Å; N326-L329 PolarHBondContact O-N 3.32Å; N326-E330 WeakPolarHBondContact O-CG 3.25Å; N326-E330 PolarHBondContact O-N 3.1Å; N326-L348 HydrophobicContact CB-CD2 3.94Å; N326-T351 PolarHBondContact ND2-O 2.97Å; N326-T351 VanDerWaalsContact ND2-O 3.13Å; N326-T351 WeakPolarHBondContact OD1-CB 3.12Å; N326-T351 PolarHBondContact OD1-OG1 2.66Å
327	L	88.6	Confident	88.2	Confident	112 Å²	112	53.4 Å²	53.4	59%	0.586	31%	0.312	S	S	*	.	H	α-helix	trans	-64.3	-42.2	178.1	-68.4	173.8	0	0	0	112.2	C325 E330 N331	C325-L327 VanDerWaalsContact C-N 3.31Å; C325-L327 PolarHBondContact O-N 2.93Å; L327-E330 PolarHBondContact O-N 3.06Å; L327-N331 PolarHBondContact O-N 2.98Å; L327-N331 PolarHBondContact O-ND2 2.88Å
328	D	91.5	Very high	88.2	Confident	31 Å²	31	51.5 Å²	51.5	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-66.7	-40.9	176.5	-60.8	-79.3	0	0	0	111.2	Q293 C296 S297 C325 E330 N331 L332	Q293-D328 VanDerWaalsContact CG-OD2 3.25Å; Q293-D328 WeakPolarHBondContact CG-OD2 3.31Å; Q293-D328 PolarHBondContact NE2-OD2 3.26Å; C296-D328 HydrophobicContact CB-CB 4.02Å; S297-D328 PolarHBondContact OG-OD1 2.81Å; C325-D328 PolarHBondContact O-N 2.9Å; C325-D328 VanDerWaalsContact O-N 3.16Å; D328-E330 PolarHBondContact O-N 3.17Å; D328-N331 PolarHBondContact O-N 3.39Å; D328-L332 WeakPolarHBondContact O-CG 3.44Å; D328-L332 PolarHBondContact O-N 2.87Å
329	L	91.6	Very high	88.3	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-65.1	-36.5	177.3	-69.8	170.9	0	0	0	112.4	V308 L311 V322 C325 N326 N331 L332 I333 A344 T347 L348	V308-L329 HydrophobicContact CB-CD2 4.47Å; V308-L329 HydrophobicContact CG1-CD2 4Å; V308-L329 HydrophobicContact CG2-CD2 3.91Å; L311-L329 HydrophobicContact CD1-CD2 4.35Å; V322-L329 HydrophobicContact CG1-CD1 4.29Å; C325-L329 HydrophobicContact CB-CD1 4.16Å; C325-L329 HydrophobicContact CB-CG 4.34Å; C325-L329 WeakPolarHBondContact O-CG 3.43Å; C325-L329 PolarHBondContact O-N 2.95Å; N326-L329 PolarHBondContact O-N 3.32Å; L329-N331 VanDerWaalsContact C-N 3.31Å; L329-N331 PolarHBondContact O-N 2.96Å; L329-L332 WeakPolarHBondContact O-CB 3.24Å; L329-L332 PolarHBondContact O-N 2.82Å; L329-I333 PolarHBondContact O-N 3.19Å; L329-A344 HydrophobicContact CD2-CB 4.43Å; L329-T347 HydrophobicContact CD1-CG2 3.63Å; L329-L348 HydrophobicContact CB-CD1 4.09Å; L329-L348 HydrophobicContact CB-CD2 3.83Å; L329-L348 HydrophobicContact CB-CG 3.85Å; L329-L348 HydrophobicContact CD1-CD2 4.41Å
330	E	88.6	Confident	88.6	Confident	14 Å²	14	49.3 Å²	49.3	7%	0.065	29%	0.293	C	S	.	.	H	α-helix	trans	-62.9	-38.5	176	-79.4	178.7	-174.8	0	0	112	N326 L327 D328 L332 I333 L348 R359 L360	N326-E330 WeakPolarHBondContact O-CG 3.25Å; N326-E330 PolarHBondContact O-N 3.1Å; L327-E330 PolarHBondContact O-N 3.06Å; D328-E330 PolarHBondContact O-N 3.17Å; E330-L332 PolarHBondContact O-N 3.1Å; E330-I333 HydrophobicContact CG-CD1 4.49Å; E330-I333 WeakPolarHBondContact O-CB 3.36Å; E330-I333 WeakPolarHBondContact O-CG1 3.18Å; E330-I333 PolarHBondContact O-N 2.94Å; E330-L348 HydrophobicContact CB-CD1 4.46Å; E330-L348 HydrophobicContact CG-CD1 3.79Å; E330-L348 HydrophobicContact CG-CD2 4.03Å; E330-R359 VanDerWaalsContact CD-CZ 3.48Å; E330-R359 IonicContact OE1-CZ 3.58Å; E330-R359 VanDerWaalsContact OE1-CZ 3.24Å; E330-R359 IonicContact OE1-NE 3.48Å; E330-R359 PolarHBondContact OE1-NE 3.16Å; E330-R359 VanDerWaalsContact OE1-NE 3.14Å; E330-R359 IonicContact OE1-NH2 3.61Å; E330-R359 PolarHBondContact OE1-NH2 3.12Å; E330-R359 IonicContact OE2-CZ 2.77Å; E330-R359 IonicContact OE2-NE 2.62Å; E330-R359 PolarHBondContact OE2-NE 3.26Å; E330-R359 IonicContact OE2-NH1 3.56Å; E330-R359 IonicContact OE2-NH2 2.82Å; E330-R359 PolarHBondContact OE2-NH2 3.45Å; E330-L360 HydrophobicContact CG-CD2 4.23Å
331	N	89.4	Confident	88.7	Confident	116 Å²	116	45.4 Å²	45.4	62%	0.62	27%	0.266	S	S	*	.	H	α-helix	trans	-64.5	-22.5	174.6	-66.7	-32.7	0	0	0	112.6	L327 D328 L329 T334	L327-N331 PolarHBondContact O-N 2.98Å; L327-N331 PolarHBondContact O-ND2 2.88Å; D328-N331 PolarHBondContact O-N 3.39Å; L329-N331 VanDerWaalsContact C-N 3.31Å; L329-N331 PolarHBondContact O-N 2.96Å; N331-T334 PolarHBondContact O-OG1 3.24Å
332	L	91.3	Very high	88.6	Confident	10 Å²	10	45 Å²	45	5%	0.052	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-9	178.7	-63	-178.6	0	0	0	114	C296 V308 D328 L329 E330 T334 D335 I340 A341 A344	C296-L332 HydrophobicContact CB-CD1 3.88Å; V308-L332 HydrophobicContact CG2-CD1 3.34Å; D328-L332 WeakPolarHBondContact O-CG 3.44Å; D328-L332 PolarHBondContact O-N 2.87Å; L329-L332 WeakPolarHBondContact O-CB 3.24Å; L329-L332 PolarHBondContact O-N 2.82Å; E330-L332 PolarHBondContact O-N 3.1Å; L332-T334 PolarHBondContact O-N 3.08Å; L332-D335 VanDerWaalsContact O-CB 3.28Å; L332-D335 WeakPolarHBondContact O-CB 3.28Å; L332-D335 PolarHBondContact O-N 3.49Å; L332-D335 VanDerWaalsContact O-N 3.12Å; L332-I340 HydrophobicContact CB-CG2 4.16Å; L332-I340 HydrophobicContact CD1-CG2 4.17Å; L332-I340 HydrophobicContact CD2-CG2 4.45Å; L332-A341 WeakPolarHBondContact O-CA 3.49Å; L332-A344 HydrophobicContact CB-CB 3.95Å
333	I	87.6	Confident	88.5	Confident	7 Å²	7	46.8 Å²	46.8	4%	0.036	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-34.4	173.6	-61.9	174.3	0	0	0	110.5	L329 E330 D335 A341 I345 L348 Q363	L329-I333 PolarHBondContact O-N 3.19Å; E330-I333 HydrophobicContact CG-CD1 4.49Å; E330-I333 WeakPolarHBondContact O-CB 3.36Å; E330-I333 WeakPolarHBondContact O-CG1 3.18Å; E330-I333 PolarHBondContact O-N 2.94Å; I333-D335 VanDerWaalsContact C-N 3.34Å; I333-A341 WeakPolarHBondContact O-CB 3.5Å; I333-I345 HydrophobicContact CD1-CG1 4.47Å; I333-I345 HydrophobicContact CG1-CG1 4.02Å; I333-I345 HydrophobicContact CG2-CD1 4.18Å; I333-I345 HydrophobicContact CG2-CG1 4.17Å; I333-L348 HydrophobicContact CD1-CD1 3.66Å; I333-L348 HydrophobicContact CG1-CD1 3.99Å; I333-Q363 HydrophobicContact CD1-CB 4.16Å; I333-Q363 HydrophobicContact CG2-CB 4.48Å
334	T	87.1	Confident	88.7	Confident	124 Å²	124	43.5 Å²	43.5	76%	0.761	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	12.1	179.1	57.7	0	0	0	0	113.2	N331 L332	N331-T334 PolarHBondContact O-OG1 3.24Å; L332-T334 PolarHBondContact O-N 3.08Å
335	D	89.1	Confident	88.6	Confident	18 Å²	18	40.5 Å²	40.5	10%	0.096	23%	0.226	C	C	.	.			trans	-64	138.3	177.9	-164.7	-55.3	0	0	0	110.9	R304 L332 I333 N337 I340	R304-D335 IonicContact CZ-OD2 3.71Å; R304-D335 IonicContact NE-OD2 3.03Å; R304-D335 PolarHBondContact NE-OD2 3.5Å; R304-D335 IonicContact NH2-OD1 3.77Å; R304-D335 IonicContact NH2-OD2 2.67Å; R304-D335 PolarHBondContact NH2-OD2 3.39Å; L332-D335 VanDerWaalsContact O-CB 3.28Å; L332-D335 WeakPolarHBondContact O-CB 3.28Å; L332-D335 PolarHBondContact O-N 3.49Å; L332-D335 VanDerWaalsContact O-N 3.12Å; I333-D335 VanDerWaalsContact C-N 3.34Å; D335-N337 PolarHBondContact O-N 3.16Å; D335-N337 VanDerWaalsContact O-N 3.13Å; D335-N337 PolarHBondContact OD1-N 3.04Å; D335-I340 HydrophobicContact CB-CB 4.42Å; D335-I340 HydrophobicContact CB-CG2 4.32Å
336	S	87.9	Confident	88.3	Confident	110 Å²	110	41.2 Å²	41.2	77%	0.769	23%	0.23	S	C	*	.	S	Bend	trans	-51.4	-30.7	172.5	57.8	0	0	0	0	114.2
337	N	88.3	Confident	88.2	Confident	56 Å²	56	40.1 Å²	40.1	30%	0.299	22%	0.224	S	C	.	.			trans	-89.6	108.6	177.7	-173.8	-28.6	0	0	0	110.4	D335 S339 I340 A341	D335-N337 PolarHBondContact O-N 3.16Å; D335-N337 VanDerWaalsContact O-N 3.13Å; D335-N337 PolarHBondContact OD1-N 3.04Å; N337-S339 VanDerWaalsContact C-N 3.26Å; N337-S339 PolarHBondContact O-N 3.38Å; N337-S339 WeakPolarHBondContact OD1-CB 3.48Å; N337-S339 PolarHBondContact OD1-N 3.44Å; N337-I340 HydrophobicContact CB-CB 4.38Å; N337-I340 HydrophobicContact CB-CD1 3.8Å; N337-I340 HydrophobicContact CB-CG1 3.9Å; N337-I340 WeakPolarHBondContact O-CB 3.5Å; N337-I340 PolarHBondContact O-N 3.43Å; N337-A341 PolarHBondContact O-N 3.47Å
338	R	84.5	Confident	88.2	Confident	112 Å²	112	34.9 Å²	34.9	42%	0.423	20%	0.197	S	C	.	.	H	α-helix	trans	-56.9	-35.6	-178.7	-59	-57.1	-179.5	164.1	2.5	113.6	I340 A341 T342 E370	R338-I340 VanDerWaalsContact C-N 3.27Å; R338-I340 PolarHBondContact O-N 3.49Å; R338-A341 PolarHBondContact O-N 3.1Å; R338-T342 WeakPolarHBondContact O-CB 3.24Å; R338-T342 PolarHBondContact O-N 3.2Å; R338-T342 PolarHBondContact O-OG1 3.23Å; R338-E370 IonicContact CZ-OE2 3.21Å; R338-E370 IonicContact NH1-OE2 3.65Å; R338-E370 PolarHBondContact NH1-OE2 2.85Å; R338-E370 IonicContact NH2-OE1 2.94Å; R338-E370 IonicContact NH2-OE2 3.64Å; R338-E370 PolarHBondContact NH2-OE2 3.49Å
339	S	86.9	Confident	87.8	Confident	65 Å²	65	33.7 Å²	33.7	46%	0.455	19%	0.191	S	C	.	.	H	α-helix	trans	-65.1	-32.5	177.5	-52.6	0	0	0	0	112.4	N337 L343	N337-S339 VanDerWaalsContact C-N 3.26Å; N337-S339 PolarHBondContact O-N 3.38Å; N337-S339 WeakPolarHBondContact OD1-CB 3.48Å; N337-S339 PolarHBondContact OD1-N 3.44Å; S339-L343 WeakPolarHBondContact O-CB 3.46Å; S339-L343 WeakPolarHBondContact O-CD1 3.13Å; S339-L343 VanDerWaalsContact O-CG 3.26Å; S339-L343 WeakPolarHBondContact O-CG 3.22Å; S339-L343 PolarHBondContact O-N 3.05Å
340	I	91	Very high	87.5	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-70.5	-49.9	175.3	-58.5	-179.1	0	0	0	109.5	A301 R304 Y305 V308 L332 D335 N337 R338 T342 L343 A344	A301-I340 HydrophobicContact CB-CD1 4.43Å; R304-I340 HydrophobicContact CB-CD1 3.88Å; Y305-I340 HydrophobicContact CD2-CG1 4.06Å; Y305-I340 HydrophobicContact CG-CG1 4.49Å; V308-I340 HydrophobicContact CG2-CG2 4.2Å; L332-I340 HydrophobicContact CB-CG2 4.16Å; L332-I340 HydrophobicContact CD1-CG2 4.17Å; L332-I340 HydrophobicContact CD2-CG2 4.45Å; D335-I340 HydrophobicContact CB-CB 4.42Å; D335-I340 HydrophobicContact CB-CG2 4.32Å; N337-I340 HydrophobicContact CB-CB 4.38Å; N337-I340 HydrophobicContact CB-CD1 3.8Å; N337-I340 HydrophobicContact CB-CG1 3.9Å; N337-I340 WeakPolarHBondContact O-CB 3.5Å; N337-I340 PolarHBondContact O-N 3.43Å; R338-I340 VanDerWaalsContact C-N 3.27Å; R338-I340 PolarHBondContact O-N 3.49Å; I340-T342 PolarHBondContact O-N 3.07Å; I340-L343 PolarHBondContact O-N 3.13Å; I340-A344 WeakPolarHBondContact O-CB 3.46Å; I340-A344 PolarHBondContact O-N 3.49Å
341	A	87.8	Confident	87.4	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58	-45.9	179.2	0	0	0	0	0	112.3	L332 I333 N337 R338 L343 A344 I345 F367	L332-A341 WeakPolarHBondContact O-CA 3.49Å; I333-A341 WeakPolarHBondContact O-CB 3.5Å; N337-A341 PolarHBondContact O-N 3.47Å; R338-A341 PolarHBondContact O-N 3.1Å; A341-L343 PolarHBondContact O-N 2.64Å; A341-A344 WeakPolarHBondContact O-CB 3.05Å; A341-A344 PolarHBondContact O-N 3.37Å; A341-I345 WeakPolarHBondContact O-CG1 3.29Å; A341-I345 PolarHBondContact O-N 3.12Å; A341-F367 HydrophobicContact CB-CD2 4.21Å; A341-F367 HydrophobicContact CB-CE2 3.41Å; A341-F367 VanDerWaalsContact CB-CE2 3.41Å; A341-F367 HydrophobicContact CB-CZ 3.69Å
342	T	84.4	Confident	86.9	Confident	15 Å²	15	29.8 Å²	29.8	9%	0.092	17%	0.168	C	C	.	.	H	α-helix	trans	-60.4	-45.9	176.9	-60.8	0	0	0	0	112.1	R338 I340 A344 I345 T346 F367 F375	R338-T342 WeakPolarHBondContact O-CB 3.24Å; R338-T342 PolarHBondContact O-N 3.2Å; R338-T342 PolarHBondContact O-OG1 3.23Å; I340-T342 PolarHBondContact O-N 3.07Å; T342-A344 VanDerWaalsContact C-N 3.31Å; T342-A344 PolarHBondContact O-N 3.15Å; T342-I345 PolarHBondContact O-N 2.96Å; T342-T346 WeakPolarHBondContact O-CB 3.38Å; T342-T346 PolarHBondContact O-N 2.9Å; T342-T346 PolarHBondContact O-OG1 3.27Å; T342-F367 WeakPolarHBondContact OG1-CZ 3.15Å; T342-F375 HydrophobicContact CG2-CD1 3.65Å; T342-F375 HydrophobicContact CG2-CE1 4.08Å; T342-F375 HydrophobicContact CG2-CG 4.21Å
343	L	87.6	Confident	86.5	Confident	36 Å²	36	31.5 Å²	31.5	19%	0.188	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-34.4	177.8	-71	170.5	0	0	0	111.6	Y305 V308 R309 S339 I340 A341 T347	Y305-L343 HydrophobicContact CD2-CD1 4.08Å; Y305-L343 HydrophobicContact CE2-CD1 3.61Å; V308-L343 HydrophobicContact CB-CB 4.43Å; V308-L343 VanDerWaalsContact CG1-C 3.47Å; V308-L343 HydrophobicContact CG1-CB 3.53Å; R309-L343 HydrophobicContact CB-CD1 3.99Å; R309-L343 HydrophobicContact CG-CD1 4.47Å; S339-L343 WeakPolarHBondContact O-CB 3.46Å; S339-L343 WeakPolarHBondContact O-CD1 3.13Å; S339-L343 VanDerWaalsContact O-CG 3.26Å; S339-L343 WeakPolarHBondContact O-CG 3.22Å; S339-L343 PolarHBondContact O-N 3.05Å; I340-L343 PolarHBondContact O-N 3.13Å; A341-L343 PolarHBondContact O-N 2.64Å; L343-T347 WeakPolarHBondContact O-CB 3.5Å; L343-T347 PolarHBondContact O-N 2.68Å; L343-T347 PolarHBondContact O-OG1 3.31Å
344	A	90.4	Very high	86.3	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.3	-49	176.6	0	0	0	0	0	110.9	V308 L329 L332 I340 A341 T342 T346 T347 L348	V308-A344 HydrophobicContact CG1-CB 4.15Å; L329-A344 HydrophobicContact CD2-CB 4.43Å; L332-A344 HydrophobicContact CB-CB 3.95Å; I340-A344 WeakPolarHBondContact O-CB 3.46Å; I340-A344 PolarHBondContact O-N 3.49Å; A341-A344 WeakPolarHBondContact O-CB 3.05Å; A341-A344 PolarHBondContact O-N 3.37Å; T342-A344 VanDerWaalsContact C-N 3.31Å; T342-A344 PolarHBondContact O-N 3.15Å; A344-T346 PolarHBondContact O-N 2.94Å; A344-T347 PolarHBondContact O-N 3.01Å; A344-T347 VanDerWaalsContact O-N 3.14Å; A344-L348 WeakPolarHBondContact O-CB 3.41Å; A344-L348 WeakPolarHBondContact O-CG 3.11Å; A344-L348 PolarHBondContact O-N 2.93Å
345	I	85.9	Confident	86.1	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-56.7	-50.2	174.6	-68.4	167.5	0	0	0	110.8	I333 A341 T342 T347 L348 L349 I364 F367 V379	I333-I345 HydrophobicContact CD1-CG1 4.47Å; I333-I345 HydrophobicContact CG1-CG1 4.02Å; I333-I345 HydrophobicContact CG2-CD1 4.18Å; I333-I345 HydrophobicContact CG2-CG1 4.17Å; A341-I345 WeakPolarHBondContact O-CG1 3.29Å; A341-I345 PolarHBondContact O-N 3.12Å; T342-I345 PolarHBondContact O-N 2.96Å; I345-T347 PolarHBondContact O-N 3.23Å; I345-L348 PolarHBondContact O-N 3.06Å; I345-L349 HydrophobicContact CG2-CD1 3.91Å; I345-L349 HydrophobicContact CG2-CG 4.35Å; I345-L349 WeakPolarHBondContact O-CG 3.21Å; I345-L349 PolarHBondContact O-N 2.93Å; I345-I364 HydrophobicContact CD1-CG1 4.39Å; I345-I364 HydrophobicContact CG1-CG1 4.19Å; I345-I364 HydrophobicContact CG2-CD1 3.77Å; I345-I364 HydrophobicContact CG2-CG1 3.8Å; I345-I364 HydrophobicContact CG2-CG2 4.41Å; I345-F367 HydrophobicContact CD1-CB 4.13Å; I345-F367 HydrophobicContact CD1-CD1 3.17Å; I345-F367 HydrophobicContact CD1-CD2 4.45Å; I345-F367 HydrophobicContact CD1-CE1 3.55Å; I345-F367 HydrophobicContact CD1-CG 3.68Å; I345-F367 HydrophobicContact CD1-CZ 4.35Å; I345-V379 HydrophobicContact CG2-CG2 4.44Å
346	T	84.8	Confident	85.8	Confident	16 Å²	16	33.3 Å²	33.3	10%	0.098	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-32.6	-179.2	-53.2	0	0	0	0	111.6	T342 A344 K350 V378	T342-T346 WeakPolarHBondContact O-CB 3.38Å; T342-T346 PolarHBondContact O-N 2.9Å; T342-T346 PolarHBondContact O-OG1 3.27Å; A344-T346 PolarHBondContact O-N 2.94Å; T346-K350 WeakPolarHBondContact O-CD 3.49Å; T346-K350 WeakPolarHBondContact O-CE 3.5Å; T346-K350 WeakPolarHBondContact O-CG 3.28Å; T346-V378 HydrophobicContact CG2-CG1 4.33Å
347	T	88.6	Confident	85.6	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-73.5	-46.6	176.4	-52.7	0	0	0	0	110.7	L311 N312 A315 V322 L329 L343 A344 I345 L349 K350 T351	L311-T347 HydrophobicContact CB-CG2 4.49Å; N312-T347 WeakPolarHBondContact CA-OG1 3.47Å; N312-T347 VanDerWaalsContact CB-OG1 3.27Å; N312-T347 WeakPolarHBondContact CB-OG1 3.2Å; N312-T347 PolarHBondContact ND2-N 3.01Å; N312-T347 PolarHBondContact ND2-OG1 3.14Å; A315-T347 HydrophobicContact CB-CG2 3.99Å; V322-T347 HydrophobicContact CG1-CG2 3.95Å; L329-T347 HydrophobicContact CD1-CG2 3.63Å; L343-T347 WeakPolarHBondContact O-CB 3.5Å; L343-T347 PolarHBondContact O-N 2.68Å; L343-T347 PolarHBondContact O-OG1 3.31Å; A344-T347 PolarHBondContact O-N 3.01Å; A344-T347 VanDerWaalsContact O-N 3.14Å; I345-T347 PolarHBondContact O-N 3.23Å; T347-L349 VanDerWaalsContact C-N 3.33Å; T347-L349 PolarHBondContact O-N 3.06Å; T347-K350 WeakPolarHBondContact O-CB 3.33Å; T347-K350 PolarHBondContact O-N 3.02Å; T347-T351 HydrophobicContact CG2-CG2 4.34Å; T347-T351 WeakPolarHBondContact O-CG2 3.46Å; T347-T351 PolarHBondContact O-N 2.88Å; T347-T351 PolarHBondContact O-OG1 2.85Å; T347-T351 VanDerWaalsContact O-OG1 3.12Å
348	L	88.3	Confident	85.5	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-36.2	179	-74.7	167.2	0	0	0	113.3	N326 L329 E330 I333 A344 I345 K350 T351 G352 L360	N326-L348 HydrophobicContact CB-CD2 3.94Å; L329-L348 HydrophobicContact CB-CD1 4.09Å; L329-L348 HydrophobicContact CB-CD2 3.83Å; L329-L348 HydrophobicContact CB-CG 3.85Å; L329-L348 HydrophobicContact CD1-CD2 4.41Å; E330-L348 HydrophobicContact CB-CD1 4.46Å; E330-L348 HydrophobicContact CG-CD1 3.79Å; E330-L348 HydrophobicContact CG-CD2 4.03Å; I333-L348 HydrophobicContact CD1-CD1 3.66Å; I333-L348 HydrophobicContact CG1-CD1 3.99Å; A344-L348 WeakPolarHBondContact O-CB 3.41Å; A344-L348 WeakPolarHBondContact O-CG 3.11Å; A344-L348 PolarHBondContact O-N 2.93Å; I345-L348 PolarHBondContact O-N 3.06Å; L348-K350 PolarHBondContact O-N 2.89Å; L348-T351 PolarHBondContact O-N 3.14Å; L348-G352 VanDerWaalsContact O-CA 3.26Å; L348-G352 WeakPolarHBondContact O-CA 3.28Å; L348-G352 PolarHBondContact O-N 2.87Å; L348-L360 HydrophobicContact CB-CD1 4.46Å; L348-L360 HydrophobicContact CB-CD2 3.89Å; L348-L360 HydrophobicContact CD1-CD2 3.87Å; L348-L360 HydrophobicContact CD2-CD2 4.36Å; L348-L360 HydrophobicContact CG-CD2 4.28Å
349	L	83.4	Confident	85.4	Confident	7 Å²	7	28.3 Å²	28.3	4%	0.037	16%	0.157	C	C	.	.	H	α-helix	trans	-65	-27.8	175.7	-70	172	0	0	0	112.3	I345 T347 M361 I364 V379 A382 I383 L386	I345-L349 HydrophobicContact CG2-CD1 3.91Å; I345-L349 HydrophobicContact CG2-CG 4.35Å; I345-L349 WeakPolarHBondContact O-CG 3.21Å; I345-L349 PolarHBondContact O-N 2.93Å; T347-L349 VanDerWaalsContact C-N 3.33Å; T347-L349 PolarHBondContact O-N 3.06Å; L349-M361 HydrophobicContact CD2-CE 3.66Å; L349-I364 HydrophobicContact CD1-CD1 4.31Å; L349-I364 HydrophobicContact CD2-CD1 3.77Å; L349-I364 HydrophobicContact CG-CD1 4.14Å; L349-V379 HydrophobicContact CD1-CG1 4.29Å; L349-A382 HydrophobicContact CB-CB 3.79Å; L349-A382 HydrophobicContact CD1-CB 3.54Å; L349-A382 HydrophobicContact CG-CB 4.27Å; L349-I383 HydrophobicContact CD2-CG1 4.47Å; L349-L386 HydrophobicContact CD2-CD2 4.21Å
350	K	83.8	Confident	85.2	Confident	42 Å²	42	25.2 Å²	25.2	18%	0.183	14%	0.136	C	C	.	.	H	α-helix	trans	-83.4	-36.8	176.6	-62.2	168.8	-169.5	172.3	0	112.4	N312 A315 M316 T346 T347 L348	N312-K350 PolarHBondContact ND2-NZ 2.88Å; N312-K350 PolarHBondContact OD1-NZ 2.79Å; N312-K350 VanDerWaalsContact OD1-NZ 3.15Å; A315-K350 HydrophobicContact CB-CB 4.27Å; A315-K350 HydrophobicContact CB-CD 4.26Å; M316-K350 HydrophobicContact SD-CD 3.68Å; M316-K350 WeakPolarHBondContact SD-CE 3.49Å; M316-K350 PolarHBondContact SD-NZ 3.19Å; T346-K350 WeakPolarHBondContact O-CD 3.49Å; T346-K350 WeakPolarHBondContact O-CE 3.5Å; T346-K350 WeakPolarHBondContact O-CG 3.28Å; T347-K350 WeakPolarHBondContact O-CB 3.33Å; T347-K350 PolarHBondContact O-N 3.02Å; L348-K350 PolarHBondContact O-N 2.89Å
351	T	87.1	Confident	85	Confident	4 Å²	4	25.5 Å²	25.5	3%	0.025	14%	0.137	C	C	.	.	H	α-helix	trans	-96.4	-2.6	-175.7	62.3	0	0	0	0	113.5	A315 V322 N326 T347 L348	A315-T351 HydrophobicContact CB-CG2 3.75Å; V322-T351 HydrophobicContact CB-CG2 3.73Å; V322-T351 HydrophobicContact CG1-CG2 3.82Å; N326-T351 PolarHBondContact ND2-O 2.97Å; N326-T351 VanDerWaalsContact ND2-O 3.13Å; N326-T351 WeakPolarHBondContact OD1-CB 3.12Å; N326-T351 PolarHBondContact OD1-OG1 2.66Å; T347-T351 HydrophobicContact CG2-CG2 4.34Å; T347-T351 WeakPolarHBondContact O-CG2 3.46Å; T347-T351 PolarHBondContact O-N 2.88Å; T347-T351 PolarHBondContact O-OG1 2.85Å; T347-T351 VanDerWaalsContact O-OG1 3.12Å; L348-T351 PolarHBondContact O-N 3.14Å
352	G	80	Confident	84.8	Confident	1 Å²	1	33.4 Å²	33.4	1%	0.01	17%	0.171	C	C	.	.			trans	-61.2	141.9	-177.9	0	0	0	0	0	112.3	L348 Y390	L348-G352 VanDerWaalsContact O-CA 3.26Å; L348-G352 WeakPolarHBondContact O-CA 3.28Å; L348-G352 PolarHBondContact O-N 2.87Å; G352-Y390 WeakPolarHBondContact O-CE2 3.38Å; G352-Y390 PolarHBondContact O-OH 2.8Å; G352-Y390 VanDerWaalsContact O-OH 3.04Å
353	S	82.6	Confident	84.7	Confident	47 Å²	47	35.6 Å²	35.6	33%	0.329	18%	0.181	S	C	.	.			trans	-97.5	160.4	169	62	0	0	0	0	110.6	S355 S356 V357	S353-S355 PolarHBondContact O-N 2.81Å; S353-S355 VanDerWaalsContact O-N 3.11Å; S353-S355 PolarHBondContact OG-OG 3.3Å; S353-S356 PolarHBondContact N-OG 3.47Å; S353-S356 PolarHBondContact O-N 2.8Å; S353-S356 PolarHBondContact O-OG 2.79Å; S353-S356 PolarHBondContact OG-OG 2.99Å; S353-V357 WeakPolarHBondContact O-CG2 3.42Å; S353-V357 PolarHBondContact O-N 2.81Å
354	E	83.1	Confident	84.5	Confident	76 Å²	76	33.9 Å²	33.9	36%	0.355	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-36.2	178.1	-168.5	179.1	177.6	0	0	113.2	S356 Y390 K393	E354-S356 VanDerWaalsContact C-N 3.33Å; E354-S356 PolarHBondContact O-N 2.77Å; E354-Y390 HydrophobicContact CB-CD1 3.74Å; E354-Y390 HydrophobicContact CB-CE1 3.97Å; E354-Y390 HydrophobicContact CB-CG 4.27Å; E354-Y390 HydrophobicContact CG-CD1 4.17Å; E354-Y390 HydrophobicContact CG-CG 4.48Å; E354-K393 HydrophobicContact CG-CG 3.81Å
355	S	83.4	Confident	84	Confident	102 Å²	102	36.8 Å²	36.8	71%	0.713	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24	177.9	54.7	0	0	0	0	114.5	S353	S353-S355 PolarHBondContact O-N 2.81Å; S353-S355 VanDerWaalsContact O-N 3.11Å; S353-S355 PolarHBondContact OG-OG 3.3Å
356	S	82.3	Confident	83.6	Confident	9 Å²	9	40.6 Å²	40.6	6%	0.063	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-19.2	-176.7	66.5	0	0	0	0	113.4	S353 E354 D358 R359 L360	S353-S356 PolarHBondContact N-OG 3.47Å; S353-S356 PolarHBondContact O-N 2.8Å; S353-S356 PolarHBondContact O-OG 2.79Å; S353-S356 PolarHBondContact OG-OG 2.99Å; E354-S356 VanDerWaalsContact C-N 3.33Å; E354-S356 PolarHBondContact O-N 2.77Å; S356-D358 VanDerWaalsContact C-N 3.34Å; S356-D358 PolarHBondContact O-N 3.08Å; S356-R359 PolarHBondContact O-N 3.19Å; S356-L360 WeakPolarHBondContact O-CG 3.37Å; S356-L360 PolarHBondContact O-N 3.43Å
357	V	84.4	Confident	83.4	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-53.5	-48.4	-173.1	-179.8	0	0	0	0	111.7	S353 R359 L360 M361 L386 Y390 K393 M397	S353-V357 WeakPolarHBondContact O-CG2 3.42Å; S353-V357 PolarHBondContact O-N 2.81Å; V357-R359 VanDerWaalsContact C-N 3.3Å; V357-R359 PolarHBondContact O-N 2.88Å; V357-L360 PolarHBondContact O-N 3.36Å; V357-M361 HydrophobicContact CG1-CG 4.21Å; V357-M361 WeakPolarHBondContact O-CG 3.47Å; V357-M361 PolarHBondContact O-N 3.25Å; V357-L386 HydrophobicContact CG1-CD2 4.12Å; V357-L386 HydrophobicContact CG2-CD2 4.1Å; V357-L386 HydrophobicContact CG2-CG 4.45Å; V357-Y390 HydrophobicContact CG2-CD2 4.41Å; V357-K393 HydrophobicContact CG1-CB 4.47Å; V357-M397 HydrophobicContact CG1-CG 4.07Å; V357-M397 HydrophobicContact CG1-SD 4.17Å
358	D	84.6	Confident	82.9	Confident	57 Å²	57	40.3 Å²	40.3	31%	0.305	22%	0.216	S	C	.	.	H	α-helix	trans	-58.7	-39.8	-179.6	-68.1	-81.2	0	0	0	113.1	S356 K362 K393 V396	S356-D358 VanDerWaalsContact C-N 3.34Å; S356-D358 PolarHBondContact O-N 3.08Å; D358-K362 WeakPolarHBondContact O-CG 3.22Å; D358-K393 IonicContact OD2-NZ 3.6Å; D358-K393 PolarHBondContact OD2-NZ 3.43Å; D358-V396 WeakPolarHBondContact OD1-CG2 3.49Å
359	R	83.3	Confident	82.5	Confident	115 Å²	115	44.2 Å²	44.2	43%	0.434	24%	0.243	S	C	.	.	H	α-helix	trans	-73.5	-44.3	178.5	-179.3	173.3	65.1	-168	-1.1	111.1	E330 S356 V357 K362 Q363	E330-R359 VanDerWaalsContact CD-CZ 3.48Å; E330-R359 IonicContact OE1-CZ 3.58Å; E330-R359 VanDerWaalsContact OE1-CZ 3.24Å; E330-R359 IonicContact OE1-NE 3.48Å; E330-R359 PolarHBondContact OE1-NE 3.16Å; E330-R359 VanDerWaalsContact OE1-NE 3.14Å; E330-R359 IonicContact OE1-NH2 3.61Å; E330-R359 PolarHBondContact OE1-NH2 3.12Å; E330-R359 IonicContact OE2-CZ 2.77Å; E330-R359 IonicContact OE2-NE 2.62Å; E330-R359 PolarHBondContact OE2-NE 3.26Å; E330-R359 IonicContact OE2-NH1 3.56Å; E330-R359 IonicContact OE2-NH2 2.82Å; E330-R359 PolarHBondContact OE2-NH2 3.45Å; S356-R359 PolarHBondContact O-N 3.19Å; V357-R359 VanDerWaalsContact C-N 3.3Å; V357-R359 PolarHBondContact O-N 2.88Å; R359-K362 PolarHBondContact O-N 2.92Å; R359-Q363 PolarHBondContact O-N 3.28Å; R359-Q363 VanDerWaalsContact O-N 3.14Å
360	L	83.4	Confident	82.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-60.3	-48.3	179.7	-71	174.6	0	0	0	111.2	E330 L348 S356 V357 K362 Q363 I364	E330-L360 HydrophobicContact CG-CD2 4.23Å; L348-L360 HydrophobicContact CB-CD1 4.46Å; L348-L360 HydrophobicContact CB-CD2 3.89Å; L348-L360 HydrophobicContact CD1-CD2 3.87Å; L348-L360 HydrophobicContact CD2-CD2 4.36Å; L348-L360 HydrophobicContact CG-CD2 4.28Å; S356-L360 WeakPolarHBondContact O-CG 3.37Å; S356-L360 PolarHBondContact O-N 3.43Å; V357-L360 PolarHBondContact O-N 3.36Å; L360-K362 VanDerWaalsContact C-N 3.29Å; L360-K362 PolarHBondContact O-N 3.36Å; L360-Q363 PolarHBondContact O-N 3.03Å; L360-I364 HydrophobicContact CB-CD1 4.29Å; L360-I364 WeakPolarHBondContact O-CB 3.47Å; L360-I364 WeakPolarHBondContact O-CD1 3.31Å; L360-I364 WeakPolarHBondContact O-CG1 3.49Å; L360-I364 PolarHBondContact O-N 3.42Å
361	M	85.6	Confident	82.1	Confident	6 Å²	6	48.2 Å²	48.2	3%	0.03	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-40.8	179.2	-67	-59.4	114.9	0	0	112	L349 V357 I364 S365 I383 L386 V396 F400	L349-M361 HydrophobicContact CD2-CE 3.66Å; V357-M361 HydrophobicContact CG1-CG 4.21Å; V357-M361 WeakPolarHBondContact O-CG 3.47Å; V357-M361 PolarHBondContact O-N 3.25Å; M361-I364 HydrophobicContact CE-CD1 4.24Å; M361-S365 PolarHBondContact O-N 3.32Å; M361-I383 HydrophobicContact CE-CG1 4.12Å; M361-I383 HydrophobicContact SD-CD1 4.38Å; M361-I383 HydrophobicContact SD-CG1 4.36Å; M361-L386 HydrophobicContact CE-CD2 4.04Å; M361-V396 HydrophobicContact CG-CG1 4.36Å; M361-F400 HydrophobicContact CB-CD2 4.17Å; M361-F400 HydrophobicContact CB-CG 4.36Å; M361-F400 HydrophobicContact CG-CG 4.5Å; M361-F400 VanDerWaalsContact O-CE2 3.24Å; M361-F400 WeakPolarHBondContact O-CE2 3.31Å; M361-F400 HydrophobicContact SD-CB 4.31Å; M361-F400 HydrophobicContact SD-CD1 3.62Å; M361-F400 HydrophobicContact SD-CD2 4.45Å; M361-F400 HydrophobicContact SD-CE1 4.02Å; M361-F400 HydrophobicContact SD-CG 3.86Å
362	K	84.3	Confident	81.9	Confident	165 Å²	165	50.9 Å²	50.9	72%	0.717	28%	0.282	S	S	*	.	H	α-helix	trans	-63.3	-43.8	176.9	-74.7	178	-178.7	178	0	112.9	D358 R359 L360	D358-K362 WeakPolarHBondContact O-CG 3.22Å; R359-K362 PolarHBondContact O-N 2.92Å; L360-K362 VanDerWaalsContact C-N 3.29Å; L360-K362 PolarHBondContact O-N 3.36Å
363	Q	81.8	Confident	82	Confident	62 Å²	62	53.5 Å²	53.5	29%	0.29	30%	0.295	S	S	.	.	H	α-helix	trans	-71.5	-37	-179.8	-71.8	177.5	-32.5	0	0	112.4	I333 R359 L360 S365 S366	I333-Q363 HydrophobicContact CD1-CB 4.16Å; I333-Q363 HydrophobicContact CG2-CB 4.48Å; R359-Q363 PolarHBondContact O-N 3.28Å; R359-Q363 VanDerWaalsContact O-N 3.14Å; L360-Q363 PolarHBondContact O-N 3.03Å; Q363-S365 VanDerWaalsContact C-N 3.33Å; Q363-S366 PolarHBondContact O-OG 3.14Å
364	I	83.1	Confident	82	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-68.6	-35.2	179	-66.4	166.8	0	0	0	110.5	I345 L349 L360 M361 S366 F367 V368 V379 F400	I345-I364 HydrophobicContact CD1-CG1 4.39Å; I345-I364 HydrophobicContact CG1-CG1 4.19Å; I345-I364 HydrophobicContact CG2-CD1 3.77Å; I345-I364 HydrophobicContact CG2-CG1 3.8Å; I345-I364 HydrophobicContact CG2-CG2 4.41Å; L349-I364 HydrophobicContact CD1-CD1 4.31Å; L349-I364 HydrophobicContact CD2-CD1 3.77Å; L349-I364 HydrophobicContact CG-CD1 4.14Å; L360-I364 HydrophobicContact CB-CD1 4.29Å; L360-I364 WeakPolarHBondContact O-CB 3.47Å; L360-I364 WeakPolarHBondContact O-CD1 3.31Å; L360-I364 WeakPolarHBondContact O-CG1 3.49Å; L360-I364 PolarHBondContact O-N 3.42Å; M361-I364 HydrophobicContact CE-CD1 4.24Å; I364-S366 VanDerWaalsContact C-N 3.29Å; I364-S366 PolarHBondContact O-N 3.1Å; I364-F367 PolarHBondContact O-N 3.08Å; I364-V368 HydrophobicContact CG2-CG2 3.39Å; I364-V368 WeakPolarHBondContact O-CG2 3.43Å; I364-V368 PolarHBondContact O-N 3.23Å; I364-V379 HydrophobicContact CG2-CG1 4.01Å; I364-F400 HydrophobicContact CB-CZ 4.31Å; I364-F400 HydrophobicContact CG2-CE1 4.43Å; I364-F400 HydrophobicContact CG2-CZ 3.92Å
365	S	80.8	Confident	81.8	Confident	60 Å²	60	59.6 Å²	59.6	42%	0.42	32%	0.317	S	S	.	.	H	α-helix	trans	-52.2	-43.3	179.9	-156.1	0	0	0	0	113.7	M361 Q363 F367	M361-S365 PolarHBondContact O-N 3.32Å; Q363-S365 VanDerWaalsContact C-N 3.33Å; S365-F367 VanDerWaalsContact C-N 3.3Å; S365-F367 PolarHBondContact O-N 3.04Å
366	S	78	Confident	81.9	Confident	81 Å²	81	55.7 Å²	55.7	57%	0.566	29%	0.288	S	S	*	.	H	α-helix	trans	-73.4	-22.5	179.9	50.5	0	0	0	0	113.4	Q363 I364 S369	Q363-S366 PolarHBondContact O-OG 3.14Å; I364-S366 VanDerWaalsContact C-N 3.29Å; I364-S366 PolarHBondContact O-N 3.1Å; S366-S369 PolarHBondContact O-OG 3.28Å
367	F	79.4	Confident	82.1	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.026	29%	0.292	C	S	.	.	H	α-helix	trans	-91.4	-34.3	-177	-178.8	-95.7	0	0	0	112.5	A341 T342 I345 I364 S365 S369 E370 I371	A341-F367 HydrophobicContact CB-CD2 4.21Å; A341-F367 HydrophobicContact CB-CE2 3.41Å; A341-F367 VanDerWaalsContact CB-CE2 3.41Å; A341-F367 HydrophobicContact CB-CZ 3.69Å; T342-F367 WeakPolarHBondContact OG1-CZ 3.15Å; I345-F367 HydrophobicContact CD1-CB 4.13Å; I345-F367 HydrophobicContact CD1-CD1 3.17Å; I345-F367 HydrophobicContact CD1-CD2 4.45Å; I345-F367 HydrophobicContact CD1-CE1 3.55Å; I345-F367 HydrophobicContact CD1-CG 3.68Å; I345-F367 HydrophobicContact CD1-CZ 4.35Å; I364-F367 PolarHBondContact O-N 3.08Å; S365-F367 VanDerWaalsContact C-N 3.3Å; S365-F367 PolarHBondContact O-N 3.04Å; F367-S369 VanDerWaalsContact C-N 3.26Å; F367-S369 PolarHBondContact O-N 3.31Å; F367-E370 PolarHBondContact O-N 2.94Å; F367-I371 HydrophobicContact CD1-CD1 4.24Å; F367-I371 HydrophobicContact CD1-CG2 3.91Å; F367-I371 HydrophobicContact CE1-CD1 4.11Å; F367-I371 HydrophobicContact CE1-CG2 3.31Å; F367-I371 HydrophobicContact CE2-CG2 4.28Å; F367-I371 HydrophobicContact CZ-CG2 3.52Å
368	V	79.4	Confident	82	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-62	-31.9	-175.5	164.4	0	0	0	0	112.7	I364 E370 I371 K376 V379 M404	I364-V368 HydrophobicContact CG2-CG2 3.39Å; I364-V368 WeakPolarHBondContact O-CG2 3.43Å; I364-V368 PolarHBondContact O-N 3.23Å; V368-E370 PolarHBondContact O-N 3.06Å; V368-I371 VanDerWaalsContact O-CG1 3.24Å; V368-I371 WeakPolarHBondContact O-CG1 3.46Å; V368-K376 HydrophobicContact CG1-CD 4.28Å; V368-K376 HydrophobicContact CG1-CG 4.16Å; V368-K376 WeakPolarHBondContact O-CE 3.34Å; V368-V379 HydrophobicContact CG2-CG1 4.18Å; V368-M404 HydrophobicContact CG1-CE 3.72Å; V368-M404 HydrophobicContact CG1-CG 4.34Å; V368-M404 HydrophobicContact CG1-SD 4.22Å
369	S	78.4	Confident	81.9	Confident	83 Å²	83	56.8 Å²	56.8	58%	0.58	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-19.6	176	55.1	0	0	0	0	113.4	S366 F367	S366-S369 PolarHBondContact O-OG 3.28Å; F367-S369 VanDerWaalsContact C-N 3.26Å; F367-S369 PolarHBondContact O-N 3.31Å
370	E	79.3	Confident	82.1	Confident	116 Å²	116	51.3 Å²	51.3	54%	0.542	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	1.1	-173.5	-56.9	-175.5	148.5	0	0	113.5	R338 F367 V368	R338-E370 IonicContact CZ-OE2 3.21Å; R338-E370 IonicContact NH1-OE2 3.65Å; R338-E370 PolarHBondContact NH1-OE2 2.85Å; R338-E370 IonicContact NH2-OE1 2.94Å; R338-E370 IonicContact NH2-OE2 3.64Å; R338-E370 PolarHBondContact NH2-OE2 3.49Å; F367-E370 PolarHBondContact O-N 2.94Å; V368-E370 PolarHBondContact O-N 3.06Å
371	I	79.9	Confident	82.1	Confident	18 Å²	18	57 Å²	57	9%	0.092	30%	0.302	C	S	.	.	S	Bend	trans	-112.6	160.3	-177.2	58	171.8	0	0	0	112.7	F367 V368 F375 K376 V379	F367-I371 HydrophobicContact CD1-CD1 4.24Å; F367-I371 HydrophobicContact CD1-CG2 3.91Å; F367-I371 HydrophobicContact CE1-CD1 4.11Å; F367-I371 HydrophobicContact CE1-CG2 3.31Å; F367-I371 HydrophobicContact CE2-CG2 4.28Å; F367-I371 HydrophobicContact CZ-CG2 3.52Å; V368-I371 VanDerWaalsContact O-CG1 3.24Å; V368-I371 WeakPolarHBondContact O-CG1 3.46Å; I371-F375 HydrophobicContact CB-CB 4.36Å; I371-F375 HydrophobicContact CD1-CB 3.88Å; I371-F375 HydrophobicContact CG1-CB 4.47Å; I371-K376 HydrophobicContact CD1-CG 4.05Å; I371-K376 HydrophobicContact CG1-CG 3.84Å; I371-K376 VanDerWaalsContact O-CE 3.27Å; I371-K376 WeakPolarHBondContact O-CE 3.15Å; I371-V379 HydrophobicContact CD1-CG2 4.45Å
372	S	83.4	Confident	81.9	Confident	59 Å²	59	57.6 Å²	57.6	41%	0.413	31%	0.307	S	S	.	.			trans	-69.5	155.5	177	66.3	0	0	0	0	112.2	E374 F375 K376	S372-E374 PolarHBondContact O-N 3.42Å; S372-F375 PolarHBondContact O-N 3.46Å; S372-F375 WeakPolarHBondContact OG-CD2 3.46Å; S372-K376 PolarHBondContact O-N 3.4Å; S372-K376 VanDerWaalsContact O-N 3.09Å
373	D	82.6	Confident	81.9	Confident	56 Å²	56	49.7 Å²	49.7	30%	0.299	27%	0.273	S	S	.	.	H	α-helix	trans	-58.6	-33.1	-178.1	-72.7	-4.3	0	0	0	113.2	F375 K376 V377 G410	D373-F375 VanDerWaalsContact C-N 3.32Å; D373-F375 PolarHBondContact O-N 3.22Å; D373-K376 PolarHBondContact O-N 2.98Å; D373-K376 VanDerWaalsContact O-N 3.16Å; D373-K376 IonicContact OD1-NZ 2.99Å; D373-K376 PolarHBondContact OD1-NZ 3.5Å; D373-V377 WeakPolarHBondContact O-CG2 3.5Å; D373-V377 PolarHBondContact O-N 3.48Å; D373-G410 WeakPolarHBondContact OD2-CA 3.4Å; D373-G410 PolarHBondContact OD2-N 3.26Å
374	E	81.8	Confident	82	Confident	155 Å²	155	47.9 Å²	47.9	72%	0.724	27%	0.267	S	S	*	.	H	α-helix	trans	-56.4	-44.4	173.5	-67.3	179.7	179.1	0	0	112	S372 V378	S372-E374 PolarHBondContact O-N 3.42Å; E374-V378 PolarHBondContact O-N 3.07Å
375	F	79	Confident	81.9	Confident	96 Å²	96	50.4 Å²	50.4	42%	0.421	29%	0.288	S	S	.	.	H	α-helix	trans	-74.4	-33.9	177.4	-70.1	-64.6	0	0	0	112	T342 I371 S372 D373 V377 V378 V379	T342-F375 HydrophobicContact CG2-CD1 3.65Å; T342-F375 HydrophobicContact CG2-CE1 4.08Å; T342-F375 HydrophobicContact CG2-CG 4.21Å; I371-F375 HydrophobicContact CB-CB 4.36Å; I371-F375 HydrophobicContact CD1-CB 3.88Å; I371-F375 HydrophobicContact CG1-CB 4.47Å; S372-F375 PolarHBondContact O-N 3.46Å; S372-F375 WeakPolarHBondContact OG-CD2 3.46Å; D373-F375 VanDerWaalsContact C-N 3.32Å; D373-F375 PolarHBondContact O-N 3.22Å; F375-V377 VanDerWaalsContact C-N 3.28Å; F375-V377 PolarHBondContact O-N 3.22Å; F375-V378 PolarHBondContact O-N 2.96Å; F375-V379 WeakPolarHBondContact O-CG2 3.49Å; F375-V379 PolarHBondContact O-N 3.04Å; F375-V379 VanDerWaalsContact O-N 3.1Å
376	K	86	Confident	82	Confident	21 Å²	21	47.7 Å²	47.7	9%	0.091	27%	0.269	C	S	.	.	H	α-helix	trans	-61.3	-38.8	175	-59.6	-177.5	-171.9	154.5	0	111.4	V368 I371 S372 D373 V378 V379 V380 Y413	V368-K376 HydrophobicContact CG1-CD 4.28Å; V368-K376 HydrophobicContact CG1-CG 4.16Å; V368-K376 WeakPolarHBondContact O-CE 3.34Å; I371-K376 HydrophobicContact CD1-CG 4.05Å; I371-K376 HydrophobicContact CG1-CG 3.84Å; I371-K376 VanDerWaalsContact O-CE 3.27Å; I371-K376 WeakPolarHBondContact O-CE 3.15Å; S372-K376 PolarHBondContact O-N 3.4Å; S372-K376 VanDerWaalsContact O-N 3.09Å; D373-K376 PolarHBondContact O-N 2.98Å; D373-K376 VanDerWaalsContact O-N 3.16Å; D373-K376 IonicContact OD1-NZ 2.99Å; D373-K376 PolarHBondContact OD1-NZ 3.5Å; K376-V378 VanDerWaalsContact C-N 3.33Å; K376-V378 PolarHBondContact O-N 3.3Å; K376-V379 WeakPolarHBondContact O-CB 3.24Å; K376-V379 PolarHBondContact O-N 3.02Å; K376-V380 WeakPolarHBondContact O-CG2 3.41Å; K376-V380 PolarHBondContact O-N 3.22Å; K376-Y413 HydrophobicContact CB-CD2 3.4Å; K376-Y413 HydrophobicContact CB-CE2 3.36Å; K376-Y413 HydrophobicContact CB-CG 4.19Å; K376-Y413 HydrophobicContact CD-CD1 4.21Å; K376-Y413 HydrophobicContact CD-CD2 4.1Å; K376-Y413 HydrophobicContact CD-CE1 3.9Å; K376-Y413 HydrophobicContact CD-CE2 3.79Å; K376-Y413 HydrophobicContact CD-CG 4.27Å; K376-Y413 HydrophobicContact CG-CD2 4.42Å; K376-Y413 HydrophobicContact CG-CE2 4.18Å
377	V	86.5	Confident	82.2	Confident	25 Å²	25	44.2 Å²	44.2	15%	0.152	24%	0.244	C	C	.	.	H	α-helix	trans	-58	-44.4	174.1	171.7	0	0	0	0	111.4	D373 F375 V379 V380 Q381 A416	D373-V377 WeakPolarHBondContact O-CG2 3.5Å; D373-V377 PolarHBondContact O-N 3.48Å; F375-V377 VanDerWaalsContact C-N 3.28Å; F375-V377 PolarHBondContact O-N 3.22Å; V377-V379 VanDerWaalsContact C-N 3.31Å; V377-V379 PolarHBondContact O-N 3.46Å; V377-V380 PolarHBondContact O-N 3.09Å; V377-Q381 WeakPolarHBondContact O-CG 3.44Å; V377-Q381 PolarHBondContact O-N 3.46Å; V377-A416 HydrophobicContact CG1-CB 4.2Å; V377-A416 HydrophobicContact CG2-CB 4.32Å
378	V	81.1	Confident	82.3	Confident	59 Å²	59	48.7 Å²	48.7	36%	0.358	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-39.5	177.2	178.1	0	0	0	0	111.6	T346 E374 F375 K376 Q381 A382	T346-V378 HydrophobicContact CG2-CG1 4.33Å; E374-V378 PolarHBondContact O-N 3.07Å; F375-V378 PolarHBondContact O-N 2.96Å; K376-V378 VanDerWaalsContact C-N 3.33Å; K376-V378 PolarHBondContact O-N 3.3Å; V378-Q381 PolarHBondContact O-N 2.73Å; V378-A382 WeakPolarHBondContact O-CB 3.38Å; V378-A382 PolarHBondContact O-N 2.88Å; V378-A382 VanDerWaalsContact O-N 3.08Å
379	V	83.3	Confident	82.5	Confident	4 Å²	4	53.6 Å²	53.6	2%	0.024	29%	0.286	C	S	.	.	H	α-helix	trans	-63.3	-44.7	175.8	173.8	0	0	0	0	110.9	I345 L349 I364 V368 I371 F375 K376 V377 Q381 A382 I383	I345-V379 HydrophobicContact CG2-CG2 4.44Å; L349-V379 HydrophobicContact CD1-CG1 4.29Å; I364-V379 HydrophobicContact CG2-CG1 4.01Å; V368-V379 HydrophobicContact CG2-CG1 4.18Å; I371-V379 HydrophobicContact CD1-CG2 4.45Å; F375-V379 WeakPolarHBondContact O-CG2 3.49Å; F375-V379 PolarHBondContact O-N 3.04Å; F375-V379 VanDerWaalsContact O-N 3.1Å; K376-V379 WeakPolarHBondContact O-CB 3.24Å; K376-V379 PolarHBondContact O-N 3.02Å; V377-V379 VanDerWaalsContact C-N 3.31Å; V377-V379 PolarHBondContact O-N 3.46Å; V379-Q381 PolarHBondContact O-N 3.29Å; V379-A382 PolarHBondContact O-N 3.36Å; V379-I383 HydrophobicContact CG1-CD1 3.81Å; V379-I383 HydrophobicContact CG1-CG1 4.49Å; V379-I383 VanDerWaalsContact O-CG1 3.31Å; V379-I383 WeakPolarHBondContact O-CG1 3.32Å; V379-I383 PolarHBondContact O-N 3.33Å
380	V	87.2	Confident	82.8	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-61.8	-44.5	178.3	174.3	0	0	0	0	111.6	K376 V377 A382 I383 S384 L401 M404 Y413 A416 I417 C420	K376-V380 WeakPolarHBondContact O-CG2 3.41Å; K376-V380 PolarHBondContact O-N 3.22Å; V377-V380 PolarHBondContact O-N 3.09Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.76Å; V380-I383 PolarHBondContact O-N 3.07Å; V380-I383 VanDerWaalsContact O-N 3.17Å; V380-S384 PolarHBondContact O-N 2.88Å; V380-L401 HydrophobicContact CG1-CD2 4.19Å; V380-L401 HydrophobicContact CG2-CD2 4.45Å; V380-M404 HydrophobicContact CG2-CE 3.63Å; V380-Y413 HydrophobicContact CG2-CD2 4.39Å; V380-Y413 HydrophobicContact CG2-CE2 3.99Å; V380-A416 HydrophobicContact CG1-CB 4.16Å; V380-A416 WeakPolarHBondContact CG1-O 3.41Å; V380-I417 HydrophobicContact CG1-CG1 4.12Å; V380-I417 HydrophobicContact CG2-CD1 4.43Å; V380-I417 HydrophobicContact CG2-CG1 3.58Å; V380-C420 HydrophobicContact CG1-CB 3.93Å
381	Q	83.4	Confident	83	Confident	121 Å²	121	49.5 Å²	49.5	57%	0.565	26%	0.263	S	S	*	.	H	α-helix	trans	-60.1	-41.6	175.9	-71.7	174.9	-11	0	0	112	V377 V378 V379 I383 S384 A385	V377-Q381 WeakPolarHBondContact O-CG 3.44Å; V377-Q381 PolarHBondContact O-N 3.46Å; V378-Q381 PolarHBondContact O-N 2.73Å; V379-Q381 PolarHBondContact O-N 3.29Å; Q381-I383 VanDerWaalsContact C-N 3.34Å; Q381-S384 WeakPolarHBondContact O-CB 3.43Å; Q381-S384 PolarHBondContact O-N 3Å; Q381-A385 PolarHBondContact O-N 3.21Å; Q381-A385 VanDerWaalsContact O-N 3.12Å
382	A	80.5	Confident	83.2	Confident	17 Å²	17	59 Å²	59	14%	0.14	30%	0.297	C	S	.	.	H	α-helix	trans	-67.9	-33.8	177.2	0	0	0	0	0	112.5	L349 V378 V379 V380 A385 L386	L349-A382 HydrophobicContact CB-CB 3.79Å; L349-A382 HydrophobicContact CD1-CB 3.54Å; L349-A382 HydrophobicContact CG-CB 4.27Å; V378-A382 WeakPolarHBondContact O-CB 3.38Å; V378-A382 PolarHBondContact O-N 2.88Å; V378-A382 VanDerWaalsContact O-N 3.08Å; V379-A382 PolarHBondContact O-N 3.36Å; V380-A382 VanDerWaalsContact C-N 3.31Å; V380-A382 PolarHBondContact O-N 2.76Å; A382-A385 PolarHBondContact O-N 3.24Å; A382-L386 WeakPolarHBondContact O-CB 3.49Å; A382-L386 PolarHBondContact O-N 2.92Å
383	I	84.6	Confident	83.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.7	-39.3	171.8	-67.1	161.6	0	0	0	111	L349 M361 V379 V380 Q381 A385 L386 C387 M397 F400 L401	L349-I383 HydrophobicContact CD2-CG1 4.47Å; M361-I383 HydrophobicContact CE-CG1 4.12Å; M361-I383 HydrophobicContact SD-CD1 4.38Å; M361-I383 HydrophobicContact SD-CG1 4.36Å; V379-I383 HydrophobicContact CG1-CD1 3.81Å; V379-I383 HydrophobicContact CG1-CG1 4.49Å; V379-I383 VanDerWaalsContact O-CG1 3.31Å; V379-I383 WeakPolarHBondContact O-CG1 3.32Å; V379-I383 PolarHBondContact O-N 3.33Å; V380-I383 PolarHBondContact O-N 3.07Å; V380-I383 VanDerWaalsContact O-N 3.17Å; Q381-I383 VanDerWaalsContact C-N 3.34Å; I383-A385 PolarHBondContact O-N 3.43Å; I383-L386 WeakPolarHBondContact O-CB 3.28Å; I383-L386 PolarHBondContact O-N 2.97Å; I383-L386 VanDerWaalsContact O-N 3.16Å; I383-C387 PolarHBondContact O-N 3.01Å; I383-C387 PolarHBondContact O-SG 2.88Å; I383-M397 HydrophobicContact CG2-CB 4.2Å; I383-M397 HydrophobicContact CG2-CG 4.44Å; I383-F400 HydrophobicContact CD1-CD1 3.73Å; I383-F400 HydrophobicContact CD1-CE1 3.53Å; I383-L401 HydrophobicContact CD1-CD2 4.38Å; I383-L401 HydrophobicContact CG2-CD1 4.15Å; I383-L401 HydrophobicContact CG2-CD2 4.14Å; I383-L401 HydrophobicContact CG2-CG 4.16Å
384	S	84	Confident	83.6	Confident	23 Å²	23	57 Å²	57	16%	0.161	28%	0.278	C	S	.	.	H	α-helix	trans	-58.2	-47.8	175.1	-163.6	0	0	0	0	111.4	V380 Q381 L386 C387 Q388 C420	V380-S384 PolarHBondContact O-N 2.88Å; Q381-S384 WeakPolarHBondContact O-CB 3.43Å; Q381-S384 PolarHBondContact O-N 3Å; S384-L386 VanDerWaalsContact C-N 3.29Å; S384-L386 PolarHBondContact O-N 3.44Å; S384-C387 WeakPolarHBondContact O-CB 3.47Å; S384-C387 PolarHBondContact O-N 3.46Å; S384-Q388 PolarHBondContact O-N 3.25Å; S384-Q388 VanDerWaalsContact O-N 3.1Å; S384-C420 WeakPolarHBondContact CB-SG 3.43Å
385	A	81.9	Confident	83.9	Confident	54 Å²	54	52.3 Å²	52.3	45%	0.446	26%	0.263	S	S	.	.	H	α-helix	trans	-62.7	-36.5	176.4	0	0	0	0	0	112.1	Q381 A382 I383 Q388 K389	Q381-A385 PolarHBondContact O-N 3.21Å; Q381-A385 VanDerWaalsContact O-N 3.12Å; A382-A385 PolarHBondContact O-N 3.24Å; I383-A385 PolarHBondContact O-N 3.43Å; A385-Q388 PolarHBondContact O-N 3.39Å; A385-K389 WeakPolarHBondContact O-CB 3.47Å; A385-K389 PolarHBondContact O-N 3.19Å
386	L	82.8	Confident	84.4	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	26%	0.256	C	S	.	.	H	α-helix	trans	-68	-37.1	175.9	-167.1	68.6	0	0	0	112.3	L349 V357 M361 A382 I383 S384 K389 Y390 M397	L349-L386 HydrophobicContact CD2-CD2 4.21Å; V357-L386 HydrophobicContact CG1-CD2 4.12Å; V357-L386 HydrophobicContact CG2-CD2 4.1Å; V357-L386 HydrophobicContact CG2-CG 4.45Å; M361-L386 HydrophobicContact CE-CD2 4.04Å; A382-L386 WeakPolarHBondContact O-CB 3.49Å; A382-L386 PolarHBondContact O-N 2.92Å; I383-L386 WeakPolarHBondContact O-CB 3.28Å; I383-L386 PolarHBondContact O-N 2.97Å; I383-L386 VanDerWaalsContact O-N 3.16Å; S384-L386 VanDerWaalsContact C-N 3.29Å; S384-L386 PolarHBondContact O-N 3.44Å; L386-K389 PolarHBondContact O-N 3.18Å; L386-Y390 HydrophobicContact CD1-CD2 3.5Å; L386-Y390 HydrophobicContact CD1-CE2 3.6Å; L386-Y390 HydrophobicContact CG-CD2 4.13Å; L386-Y390 PolarHBondContact O-N 3.23Å; L386-M397 HydrophobicContact CB-SD 4.13Å; L386-M397 HydrophobicContact CD2-SD 3.95Å; L386-M397 HydrophobicContact CG-SD 3.93Å
387	C	82.1	Confident	84.5	Confident	7 Å²	7	48.8 Å²	48.8	5%	0.047	25%	0.251	C	S	.	.	H	α-helix	trans	-61.7	-45.7	174.3	-68.9	0	0	0	0	111.7	I383 S384 K389 Y390 P391 M397 I424	I383-C387 PolarHBondContact O-N 3.01Å; I383-C387 PolarHBondContact O-SG 2.88Å; S384-C387 WeakPolarHBondContact O-CB 3.47Å; S384-C387 PolarHBondContact O-N 3.46Å; C387-K389 VanDerWaalsContact C-N 3.29Å; C387-K389 PolarHBondContact O-N 3.48Å; C387-Y390 CarbonylContact O-C 3.6Å; C387-Y390 PolarHBondContact O-N 3.47Å; C387-P391 WeakPolarHBondContact O-CA 3.42Å; C387-M397 HydrophobicContact CB-CE 4.19Å; C387-M397 HydrophobicContact CB-SD 4.34Å; C387-M397 WeakPolarHBondContact SG-CB 3.29Å; C387-M397 PolarHBondContact SG-SD 2.91Å; C387-I424 HydrophobicContact CB-CD1 4.12Å; C387-I424 HydrophobicContact CB-CG1 3.95Å; C387-I424 VanDerWaalsContact SG-CD1 3.53Å
388	Q	81	Confident	84.6	Confident	101 Å²	101	47.7 Å²	47.7	47%	0.472	24%	0.244	S	C	.	.	H	α-helix	trans	-60.7	-40.2	175.5	-77	172.8	-4.5	0	0	111.7	S384 A385 E427	S384-Q388 PolarHBondContact O-N 3.25Å; S384-Q388 VanDerWaalsContact O-N 3.1Å; A385-Q388 PolarHBondContact O-N 3.39Å; Q388-E427 WeakPolarHBondContact CG-OE2 3.32Å; Q388-E427 PolarHBondContact NE2-OE1 3.13Å
389	K	83.1	Confident	85	Confident	107 Å²	107	48 Å²	48	47%	0.465	24%	0.244	S	C	.	.	H	α-helix	trans	-74.4	-34.9	-179.3	-167.2	-179.9	-179.2	-163	0	113.6	A385 L386 C387	A385-K389 WeakPolarHBondContact O-CB 3.47Å; A385-K389 PolarHBondContact O-N 3.19Å; L386-K389 PolarHBondContact O-N 3.18Å; C387-K389 VanDerWaalsContact C-N 3.29Å; C387-K389 PolarHBondContact O-N 3.48Å
390	Y	85.7	Confident	85.3	Confident	44 Å²	44	48.4 Å²	48.4	17%	0.173	25%	0.245	C	C	.	.			trans	-127.9	71.3	-178.4	-57	-65.4	0	0	0	112.2	G352 E354 V357 L386 C387 R392 K393	G352-Y390 WeakPolarHBondContact O-CE2 3.38Å; G352-Y390 PolarHBondContact O-OH 2.8Å; G352-Y390 VanDerWaalsContact O-OH 3.04Å; E354-Y390 HydrophobicContact CB-CD1 3.74Å; E354-Y390 HydrophobicContact CB-CE1 3.97Å; E354-Y390 HydrophobicContact CB-CG 4.27Å; E354-Y390 HydrophobicContact CG-CD1 4.17Å; E354-Y390 HydrophobicContact CG-CG 4.48Å; V357-Y390 HydrophobicContact CG2-CD2 4.41Å; L386-Y390 HydrophobicContact CD1-CD2 3.5Å; L386-Y390 HydrophobicContact CD1-CE2 3.6Å; L386-Y390 HydrophobicContact CG-CD2 4.13Å; L386-Y390 PolarHBondContact O-N 3.23Å; C387-Y390 CarbonylContact O-C 3.6Å; C387-Y390 PolarHBondContact O-N 3.47Å; Y390-R392 PolarHBondContact O-N 3.18Å; Y390-R392 VanDerWaalsContact O-N 3.13Å; Y390-K393 PolarHBondContact O-N 3.19Å
391	P	82.4	Confident	85.5	Confident	69 Å²	69	48.3 Å²	48.3	45%	0.448	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-58.1	-33	-173.7	-26.7	35.4	0	0	0	113.9	C387 K393 H394	C387-P391 WeakPolarHBondContact O-CA 3.42Å; P391-K393 PolarHBondContact O-N 3.31Å; P391-K393 VanDerWaalsContact O-N 3.15Å; P391-H394 VanDerWaalsContact O-CB 3.25Å; P391-H394 WeakPolarHBondContact O-CB 3.42Å; P391-H394 PolarHBondContact O-CD2 2.74Å; P391-H394 PolarHBondContact O-N 3.27Å
392	R	85.6	Confident	85.8	Confident	216 Å²	216	42.7 Å²	42.7	82%	0.815	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-62.2	-21.4	179.4	-68.9	-177.3	176.4	172.2	-0.5	114.2	Y390	Y390-R392 PolarHBondContact O-N 3.18Å; Y390-R392 VanDerWaalsContact O-N 3.13Å
393	K	86.9	Confident	86.2	Confident	52 Å²	52	46 Å²	46	23%	0.226	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-94.7	8.3	179	-68	-69.2	-172.4	167.1	0	112.9	E354 V357 D358 Y390 P391 S395 V396 M397	E354-K393 HydrophobicContact CG-CG 3.81Å; V357-K393 HydrophobicContact CG1-CB 4.47Å; D358-K393 IonicContact OD2-NZ 3.6Å; D358-K393 PolarHBondContact OD2-NZ 3.43Å; Y390-K393 PolarHBondContact O-N 3.19Å; P391-K393 PolarHBondContact O-N 3.31Å; P391-K393 VanDerWaalsContact O-N 3.15Å; K393-S395 PolarHBondContact O-N 3.46Å; K393-S395 VanDerWaalsContact O-N 3.12Å; K393-V396 PolarHBondContact O-N 3.27Å; K393-V396 VanDerWaalsContact O-N 3.12Å; K393-M397 VanDerWaalsContact C-CE 3.45Å; K393-M397 HydrophobicContact CB-CE 3.71Å; K393-M397 WeakPolarHBondContact O-CE 3.26Å; K393-M397 PolarHBondContact O-N 2.92Å
394	H	86.3	Confident	86.4	Confident	21 Å²	21	46.2 Å²	46.2	10%	0.097	24%	0.235	C	C	.	.	H	α-helix	trans	-51.2	-38.4	-177.7	72.3	95.6	0	0	0	113.3	P391 V396 M397 M398 I424 N428 S431	P391-H394 VanDerWaalsContact O-CB 3.25Å; P391-H394 WeakPolarHBondContact O-CB 3.42Å; P391-H394 PolarHBondContact O-CD2 2.74Å; P391-H394 PolarHBondContact O-N 3.27Å; H394-V396 PolarHBondContact O-N 3.32Å; H394-M397 PolarHBondContact O-N 3.06Å; H394-M398 VanDerWaalsContact O-CB 3.31Å; H394-M398 WeakPolarHBondContact O-CB 3.41Å; H394-M398 VanDerWaalsContact O-CG 3.3Å; H394-M398 WeakPolarHBondContact O-CG 3.46Å; H394-M398 PolarHBondContact O-N 3.35Å; H394-I424 HydrophobicContact CB-CG2 4.38Å; H394-N428 PolarHBondContact CD2-ND2 2.81Å; H394-S431 VanDerWaalsContact ND1-CB 3.34Å; H394-S431 WeakPolarHBondContact ND1-CB 3.43Å
395	S	88.3	Confident	86.7	Confident	57 Å²	57	45.2 Å²	45.2	40%	0.399	23%	0.228	S	C	.	.	H	α-helix	trans	-58.7	-44.1	-179.4	-179.9	0	0	0	0	112.8	K393 N399	K393-S395 PolarHBondContact O-N 3.46Å; K393-S395 VanDerWaalsContact O-N 3.12Å; S395-N399 WeakPolarHBondContact O-CB 3.37Å; S395-N399 VanDerWaalsContact O-CG 3.22Å; S395-N399 PolarHBondContact O-N 3.38Å; S395-N399 VanDerWaalsContact O-N 3.08Å; S395-N399 PolarHBondContact O-ND2 3.33Å
396	V	89.1	Confident	87	Confident	44 Å²	44	48.4 Å²	48.4	27%	0.267	23%	0.229	S	C	.	.	H	α-helix	trans	-67.4	-44.9	179.6	-179.2	0	0	0	0	110.6	D358 M361 K393 H394 N399 F400	D358-V396 WeakPolarHBondContact OD1-CG2 3.49Å; M361-V396 HydrophobicContact CG-CG1 4.36Å; K393-V396 PolarHBondContact O-N 3.27Å; K393-V396 VanDerWaalsContact O-N 3.12Å; H394-V396 PolarHBondContact O-N 3.32Å; V396-N399 PolarHBondContact O-N 3.01Å; V396-F400 WeakPolarHBondContact O-CB 3.29Å; V396-F400 PolarHBondContact O-N 2.88Å
397	M	88.1	Confident	87.2	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-69.5	-38.9	-178.6	-67.3	179.1	-76.6	0	0	112	V357 I383 L386 C387 K393 H394 F400 L401	V357-M397 HydrophobicContact CG1-CG 4.07Å; V357-M397 HydrophobicContact CG1-SD 4.17Å; I383-M397 HydrophobicContact CG2-CB 4.2Å; I383-M397 HydrophobicContact CG2-CG 4.44Å; L386-M397 HydrophobicContact CB-SD 4.13Å; L386-M397 HydrophobicContact CD2-SD 3.95Å; L386-M397 HydrophobicContact CG-SD 3.93Å; C387-M397 HydrophobicContact CB-CE 4.19Å; C387-M397 HydrophobicContact CB-SD 4.34Å; C387-M397 WeakPolarHBondContact SG-CB 3.29Å; C387-M397 PolarHBondContact SG-SD 2.91Å; K393-M397 VanDerWaalsContact C-CE 3.45Å; K393-M397 HydrophobicContact CB-CE 3.71Å; K393-M397 WeakPolarHBondContact O-CE 3.26Å; K393-M397 PolarHBondContact O-N 2.92Å; H394-M397 PolarHBondContact O-N 3.06Å; M397-F400 WeakPolarHBondContact O-CB 3.39Å; M397-F400 PolarHBondContact O-N 2.93Å; M397-L401 VanDerWaalsContact O-CG 3.31Å; M397-L401 WeakPolarHBondContact O-CG 3.46Å; M397-L401 PolarHBondContact O-N 2.77Å
398	M	88.4	Confident	87.1	Confident	1 Å²	1	59.5 Å²	59.5	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-65.6	-42.4	174.9	-76.8	-173	111.5	0	0	112.6	H394 F400 L401 S402 I421 I424 I425	H394-M398 VanDerWaalsContact O-CB 3.31Å; H394-M398 WeakPolarHBondContact O-CB 3.41Å; H394-M398 VanDerWaalsContact O-CG 3.3Å; H394-M398 WeakPolarHBondContact O-CG 3.46Å; H394-M398 PolarHBondContact O-N 3.35Å; M398-F400 VanDerWaalsContact C-N 3.25Å; M398-F400 PolarHBondContact O-N 3.36Å; M398-L401 PolarHBondContact O-N 3.09Å; M398-S402 VanDerWaalsContact O-CB 3.29Å; M398-S402 WeakPolarHBondContact O-CB 3.47Å; M398-S402 PolarHBondContact O-N 2.85Å; M398-I421 HydrophobicContact CE-CG2 4.05Å; M398-I424 HydrophobicContact CE-CB 4.37Å; M398-I424 HydrophobicContact CE-CG2 3.87Å; M398-I424 HydrophobicContact CG-CD1 4.24Å; M398-I424 HydrophobicContact CG-CG2 3.92Å; M398-I424 HydrophobicContact SD-CG2 3.85Å; M398-I425 HydrophobicContact CE-CG1 3.96Å
399	N	90.1	Very high	87.3	Confident	65 Å²	65	56 Å²	56	35%	0.348	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-36.9	175.9	-71.9	-28.4	0	0	0	111.2	S395 V396 S402 N403 H438	S395-N399 WeakPolarHBondContact O-CB 3.37Å; S395-N399 VanDerWaalsContact O-CG 3.22Å; S395-N399 PolarHBondContact O-N 3.38Å; S395-N399 VanDerWaalsContact O-N 3.08Å; S395-N399 PolarHBondContact O-ND2 3.33Å; V396-N399 PolarHBondContact O-N 3.01Å; N399-S402 PolarHBondContact O-N 3.42Å; N399-N403 VanDerWaalsContact O-CG 3.3Å; N399-N403 PolarHBondContact O-N 2.83Å; N399-N403 PolarHBondContact O-ND2 3.36Å; N399-H438 PolarHBondContact OD1-NE2 3.24Å
400	F	89.4	Confident	87.6	Confident	13 Å²	13	52.3 Å²	52.3	6%	0.057	27%	0.271	C	S	.	.	H	α-helix	trans	-64.1	-48.7	173.7	-174.8	-102.4	0	0	0	112.4	M361 I364 I383 V396 M397 M398 S402 N403 M404	M361-F400 HydrophobicContact CB-CD2 4.17Å; M361-F400 HydrophobicContact CB-CG 4.36Å; M361-F400 HydrophobicContact CG-CG 4.5Å; M361-F400 VanDerWaalsContact O-CE2 3.24Å; M361-F400 WeakPolarHBondContact O-CE2 3.31Å; M361-F400 HydrophobicContact SD-CB 4.31Å; M361-F400 HydrophobicContact SD-CD1 3.62Å; M361-F400 HydrophobicContact SD-CD2 4.45Å; M361-F400 HydrophobicContact SD-CE1 4.02Å; M361-F400 HydrophobicContact SD-CG 3.86Å; I364-F400 HydrophobicContact CB-CZ 4.31Å; I364-F400 HydrophobicContact CG2-CE1 4.43Å; I364-F400 HydrophobicContact CG2-CZ 3.92Å; I383-F400 HydrophobicContact CD1-CD1 3.73Å; I383-F400 HydrophobicContact CD1-CE1 3.53Å; V396-F400 WeakPolarHBondContact O-CB 3.29Å; V396-F400 PolarHBondContact O-N 2.88Å; M397-F400 WeakPolarHBondContact O-CB 3.39Å; M397-F400 PolarHBondContact O-N 2.93Å; M398-F400 VanDerWaalsContact C-N 3.25Å; M398-F400 PolarHBondContact O-N 3.36Å; F400-S402 VanDerWaalsContact C-N 3.3Å; F400-S402 PolarHBondContact O-N 3.5Å; F400-N403 PolarHBondContact O-N 2.98Å; F400-M404 HydrophobicContact CD1-SD 3.72Å; F400-M404 HydrophobicContact CE1-CG 4.2Å; F400-M404 HydrophobicContact CE1-SD 3.15Å; F400-M404 WeakPolarHBondContact CE1-SD 3.13Å; F400-M404 HydrophobicContact CZ-CG 4.34Å; F400-M404 HydrophobicContact CZ-SD 3.69Å; F400-M404 PolarHBondContact O-N 2.88Å
401	L	90.9	Very high	87.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-38	175.3	-70.7	170.3	0	0	0	112.1	V380 I383 M397 M398 M404 L405 I417 C420 I421 I424	V380-L401 HydrophobicContact CG1-CD2 4.19Å; V380-L401 HydrophobicContact CG2-CD2 4.45Å; I383-L401 HydrophobicContact CD1-CD2 4.38Å; I383-L401 HydrophobicContact CG2-CD1 4.15Å; I383-L401 HydrophobicContact CG2-CD2 4.14Å; I383-L401 HydrophobicContact CG2-CG 4.16Å; M397-L401 VanDerWaalsContact O-CG 3.31Å; M397-L401 WeakPolarHBondContact O-CG 3.46Å; M397-L401 PolarHBondContact O-N 2.77Å; M398-L401 PolarHBondContact O-N 3.09Å; L401-M404 WeakPolarHBondContact O-CB 3.38Å; L401-M404 PolarHBondContact O-N 2.81Å; L401-L405 VanDerWaalsContact O-CB 3.28Å; L401-L405 WeakPolarHBondContact O-CB 3.49Å; L401-L405 PolarHBondContact O-N 2.92Å; L401-I417 HydrophobicContact CB-CG2 4.09Å; L401-I417 HydrophobicContact CD2-CG2 4.25Å; L401-C420 HydrophobicContact CD1-CB 4.38Å; L401-C420 VanDerWaalsContact CD1-SG 3.57Å; L401-I421 HydrophobicContact CB-CD1 4.22Å; L401-I421 HydrophobicContact CB-CG1 4.14Å; L401-I421 HydrophobicContact CD1-CG1 4.18Å; L401-I424 HydrophobicContact CD1-CD1 3.7Å
402	S	90.9	Very high	88.1	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-63.5	-44.3	176.3	-178.3	0	0	0	0	112.1	M398 N399 F400 L405 R406 H438	M398-S402 VanDerWaalsContact O-CB 3.29Å; M398-S402 WeakPolarHBondContact O-CB 3.47Å; M398-S402 PolarHBondContact O-N 2.85Å; N399-S402 PolarHBondContact O-N 3.42Å; F400-S402 VanDerWaalsContact C-N 3.3Å; F400-S402 PolarHBondContact O-N 3.5Å; S402-L405 WeakPolarHBondContact O-CB 3.44Å; S402-L405 PolarHBondContact O-N 3.23Å; S402-R406 WeakPolarHBondContact O-CG 3.49Å; S402-R406 PolarHBondContact O-N 2.94Å; S402-H438 VanDerWaalsContact CB-CG 3.5Å; S402-H438 WeakPolarHBondContact CB-ND1 3.47Å; S402-H438 PolarHBondContact OG-CE1 2.94Å; S402-H438 PolarHBondContact OG-ND1 2.88Å
403	N	89.5	Confident	88.3	Confident	85 Å²	85	46.6 Å²	46.6	46%	0.455	25%	0.248	S	C	.	.	H	α-helix	trans	-61.7	-46.8	174.2	-68.2	-18	0	0	0	111.3	N399 F400 L405 R406 D407	N399-N403 VanDerWaalsContact O-CG 3.3Å; N399-N403 PolarHBondContact O-N 2.83Å; N399-N403 PolarHBondContact O-ND2 3.36Å; F400-N403 PolarHBondContact O-N 2.98Å; N403-L405 PolarHBondContact O-N 2.68Å; N403-R406 PolarHBondContact O-N 3.41Å; N403-D407 PolarHBondContact O-N 3.09Å
404	M	88.8	Confident	88.6	Confident	5 Å²	5	44.9 Å²	44.9	3%	0.025	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-32.5	175	-79.4	-178.2	65.6	0	0	113.5	V368 V380 F400 L401 R406 Y413 I417	V368-M404 HydrophobicContact CG1-CE 3.72Å; V368-M404 HydrophobicContact CG1-CG 4.34Å; V368-M404 HydrophobicContact CG1-SD 4.22Å; V380-M404 HydrophobicContact CG2-CE 3.63Å; F400-M404 HydrophobicContact CD1-SD 3.72Å; F400-M404 HydrophobicContact CE1-CG 4.2Å; F400-M404 HydrophobicContact CE1-SD 3.15Å; F400-M404 WeakPolarHBondContact CE1-SD 3.13Å; F400-M404 HydrophobicContact CZ-CG 4.34Å; F400-M404 HydrophobicContact CZ-SD 3.69Å; F400-M404 PolarHBondContact O-N 2.88Å; L401-M404 WeakPolarHBondContact O-CB 3.38Å; L401-M404 PolarHBondContact O-N 2.81Å; M404-R406 VanDerWaalsContact C-N 3.3Å; M404-Y413 WeakPolarHBondContact CB-OH 3.2Å; M404-Y413 HydrophobicContact CE-CE2 3.56Å; M404-Y413 WeakPolarHBondContact CE-OH 3.42Å; M404-Y413 PolarHBondContact O-OH 2.96Å; M404-I417 HydrophobicContact CB-CD1 4Å
405	L	90.2	Very high	89	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-73.9	-19.3	177.5	-171.5	63.1	0	0	0	112.5	L401 S402 N403 K414 I417 V418 I421 L439 F442	L401-L405 VanDerWaalsContact O-CB 3.28Å; L401-L405 WeakPolarHBondContact O-CB 3.49Å; L401-L405 PolarHBondContact O-N 2.92Å; S402-L405 WeakPolarHBondContact O-CB 3.44Å; S402-L405 PolarHBondContact O-N 3.23Å; N403-L405 PolarHBondContact O-N 2.68Å; L405-K414 VanDerWaalsContact C-NZ 3.29Å; L405-K414 HydrophobicContact CD1-CD 3.9Å; L405-K414 PolarHBondContact O-NZ 3.01Å; L405-I417 HydrophobicContact CB-CG2 3.92Å; L405-I417 HydrophobicContact CD1-CB 4.12Å; L405-I417 HydrophobicContact CD1-CD1 4.48Å; L405-I417 HydrophobicContact CD1-CG2 4.01Å; L405-I417 HydrophobicContact CD2-CG2 4.48Å; L405-I417 HydrophobicContact CG-CG2 4.35Å; L405-V418 HydrophobicContact CD1-CG2 3.9Å; L405-V418 HydrophobicContact CD2-CG2 4.35Å; L405-I421 HydrophobicContact CD2-CD1 4.06Å; L405-L439 HydrophobicContact CD2-CD2 4.21Å; L405-F442 HydrophobicContact CD1-CD1 4.26Å; L405-F442 HydrophobicContact CD1-CD2 3.99Å; L405-F442 HydrophobicContact CD1-CE1 4.12Å; L405-F442 HydrophobicContact CD1-CE2 3.84Å; L405-F442 HydrophobicContact CD1-CG 4.19Å; L405-F442 HydrophobicContact CD1-CZ 3.89Å; L405-F442 HydrophobicContact CD2-CB 3.73Å; L405-F442 HydrophobicContact CD2-CD1 3.99Å; L405-F442 HydrophobicContact CD2-CD2 4.05Å; L405-F442 HydrophobicContact CD2-CG 3.64Å; L405-F442 HydrophobicContact CG-CB 4.18Å; L405-F442 HydrophobicContact CG-CD1 4.22Å; L405-F442 HydrophobicContact CG-CD2 3.56Å; L405-F442 HydrophobicContact CG-CE2 3.92Å; L405-F442 HydrophobicContact CG-CG 3.71Å; L405-F442 HydrophobicContact CG-CZ 4.39Å; L405-F442 WeakPolarHBondContact O-CD2 3.46Å; L405-F442 WeakPolarHBondContact O-CE2 3.41Å
406	R	87.4	Confident	89.1	Confident	122 Å²	122	47.9 Å²	47.9	46%	0.46	25%	0.246	S	C	.	.	H	α-helix	trans	-86.2	-35.7	174.6	-64.9	173.1	-159.9	-141.2	-4.7	112.7	S402 N403 M404 E441	S402-R406 WeakPolarHBondContact O-CG 3.49Å; S402-R406 PolarHBondContact O-N 2.94Å; N403-R406 PolarHBondContact O-N 3.41Å; M404-R406 VanDerWaalsContact C-N 3.3Å; R406-E441 VanDerWaalsContact CZ-CD 3.41Å; R406-E441 IonicContact CZ-OE1 2.74Å; R406-E441 IonicContact CZ-OE2 3.67Å; R406-E441 IonicContact NH1-OE1 3.2Å; R406-E441 PolarHBondContact NH1-OE1 2.84Å; R406-E441 IonicContact NH1-OE2 2.88Å; R406-E441 IonicContact NH2-OE1 2.75Å; R406-E441 PolarHBondContact NH2-OE1 2.91Å; R406-E441 IonicContact NH2-OE2 2.73Å; R406-E441 PolarHBondContact NH2-OE2 2.79Å
407	D	86.3	Confident	89.3	Confident	88 Å²	88	45.8 Å²	45.8	47%	0.471	23%	0.234	S	C	.	.	S	Bend	trans	-64.2	150.9	-179	-65.8	-20.4	0	0	0	112.8	N403 G409 K414	N403-D407 PolarHBondContact O-N 3.09Å; D407-G409 PolarHBondContact O-N 2.94Å; D407-K414 WeakPolarHBondContact O-CE 3.38Å; D407-K414 PolarHBondContact O-NZ 3.32Å
408	D	81.4	Confident	89.6	Confident	155 Å²	155	45.8 Å²	45.8	83%	0.829	23%	0.234	S	C	*	.			trans	-56.2	138.8	179.3	-66.3	-33.4	0	0	0	113.2
409	G	84.6	Confident	89.7	Confident	27 Å²	27	48.1 Å²	48.1	28%	0.278	25%	0.246	S	C	.	.			trans	178.5	160.5	175.1	0	0	0	0	0	113.7	D407	D407-G409 PolarHBondContact O-N 2.94Å
410	G	88.6	Confident	89.8	Confident	30 Å²	30	45.2 Å²	45.2	31%	0.309	23%	0.231	S	C	.	.			trans	-72.8	168.3	-177	0	0	0	0	0	114.5	D373 E412 Y413 K414	D373-G410 WeakPolarHBondContact OD2-CA 3.4Å; D373-G410 PolarHBondContact OD2-N 3.26Å; G410-E412 PolarHBondContact O-N 3.18Å; G410-Y413 PolarHBondContact O-N 3.44Å; G410-K414 WeakPolarHBondContact O-CG 3.42Å; G410-K414 PolarHBondContact O-N 3.01Å; G410-K414 VanDerWaalsContact O-N 3.09Å
411	F	89.9	Confident	89.9	Confident	74 Å²	74	44.7 Å²	44.7	33%	0.325	23%	0.229	S	C	.	.	H	α-helix	trans	-54.9	-47.5	-175.2	173.8	-100.9	0	0	0	114	Y413 K414 R415 H448 V450 L451	F411-Y413 VanDerWaalsContact C-N 3.32Å; F411-Y413 PolarHBondContact O-N 3.22Å; F411-K414 PolarHBondContact O-N 3.35Å; F411-R415 VanDerWaalsContact O-CB 3.24Å; F411-R415 WeakPolarHBondContact O-CB 3.28Å; F411-R415 PolarHBondContact O-N 2.96Å; F411-H448 HydrophobicContact CD2-CB 4.17Å; F411-H448 AromaticContact CD2-CG 3.93Å; F411-V450 HydrophobicContact CE2-CB 4.08Å; F411-V450 HydrophobicContact CE2-CG1 4.48Å; F411-V450 HydrophobicContact CZ-CB 4.24Å; F411-V450 HydrophobicContact CZ-CG1 4.22Å; F411-L451 HydrophobicContact CD2-CD1 4.37Å; F411-L451 HydrophobicContact CD2-CG 4.29Å; F411-L451 HydrophobicContact CE2-CD1 4.42Å; F411-L451 HydrophobicContact CE2-CD2 4.06Å; F411-L451 HydrophobicContact CE2-CG 3.88Å
412	E	89.8	Confident	89.9	Confident	133 Å²	133	45.6 Å²	45.6	62%	0.621	23%	0.233	S	C	*	.	H	α-helix	trans	-65	-36.8	-176.7	-66.8	-152.2	158.4	0	0	112.5	G410 A416	G410-E412 PolarHBondContact O-N 3.18Å; E412-A416 WeakPolarHBondContact O-CB 3.3Å; E412-A416 PolarHBondContact O-N 3.33Å
413	Y	90.5	Very high	89.8	Confident	2 Å²	2	47 Å²	47	1%	0.008	24%	0.243	C	C	.	.	H	α-helix	trans	-66.2	-49.2	175.3	165	-117.9	0	0	0	111.9	K376 V380 M404 G410 F411 R415 A416 I417	K376-Y413 HydrophobicContact CB-CD2 3.4Å; K376-Y413 HydrophobicContact CB-CE2 3.36Å; K376-Y413 HydrophobicContact CB-CG 4.19Å; K376-Y413 HydrophobicContact CD-CD1 4.21Å; K376-Y413 HydrophobicContact CD-CD2 4.1Å; K376-Y413 HydrophobicContact CD-CE1 3.9Å; K376-Y413 HydrophobicContact CD-CE2 3.79Å; K376-Y413 HydrophobicContact CD-CG 4.27Å; K376-Y413 HydrophobicContact CG-CD2 4.42Å; K376-Y413 HydrophobicContact CG-CE2 4.18Å; V380-Y413 HydrophobicContact CG2-CD2 4.39Å; V380-Y413 HydrophobicContact CG2-CE2 3.99Å; M404-Y413 WeakPolarHBondContact CB-OH 3.2Å; M404-Y413 HydrophobicContact CE-CE2 3.56Å; M404-Y413 WeakPolarHBondContact CE-OH 3.42Å; M404-Y413 PolarHBondContact O-OH 2.96Å; G410-Y413 PolarHBondContact O-N 3.44Å; F411-Y413 VanDerWaalsContact C-N 3.32Å; F411-Y413 PolarHBondContact O-N 3.22Å; Y413-R415 VanDerWaalsContact C-N 3.32Å; Y413-R415 PolarHBondContact O-N 3.47Å; Y413-A416 PolarHBondContact O-N 3.12Å; Y413-I417 HydrophobicContact CD1-CD1 4.36Å; Y413-I417 HydrophobicContact CD2-CD1 4.02Å; Y413-I417 HydrophobicContact CD2-CG1 4.42Å; Y413-I417 HydrophobicContact CE1-CD1 3.85Å; Y413-I417 HydrophobicContact CE2-CD1 3.43Å; Y413-I417 VanDerWaalsContact CE2-CD1 3.43Å; Y413-I417 HydrophobicContact CE2-CG1 4.03Å; Y413-I417 HydrophobicContact CG-CD1 4.46Å; Y413-I417 WeakPolarHBondContact O-CG1 3.47Å; Y413-I417 PolarHBondContact O-N 3.36Å; Y413-I417 VanDerWaalsContact O-N 3.15Å
414	K	92.9	Very high	89.7	Confident	15 Å²	15	43.1 Å²	43.1	7%	0.065	22%	0.223	C	C	.	.	H	α-helix	trans	-60.3	-42.8	176	-65.2	-70.1	-171.9	176.8	0	111.7	L405 D407 G410 F411 A416 I417 V418 F442 L451	L405-K414 VanDerWaalsContact C-NZ 3.29Å; L405-K414 HydrophobicContact CD1-CD 3.9Å; L405-K414 PolarHBondContact O-NZ 3.01Å; D407-K414 WeakPolarHBondContact O-CE 3.38Å; D407-K414 PolarHBondContact O-NZ 3.32Å; G410-K414 WeakPolarHBondContact O-CG 3.42Å; G410-K414 PolarHBondContact O-N 3.01Å; G410-K414 VanDerWaalsContact O-N 3.09Å; F411-K414 PolarHBondContact O-N 3.35Å; K414-A416 PolarHBondContact O-N 3.5Å; K414-I417 PolarHBondContact O-N 3.08Å; K414-V418 WeakPolarHBondContact O-CG2 3.39Å; K414-V418 PolarHBondContact O-N 3Å; K414-F442 HydrophobicContact CD-CE2 4.25Å; K414-F442 HydrophobicContact CD-CZ 4.34Å; K414-L451 HydrophobicContact CB-CD1 3.62Å
415	R	93.3	Very high	89.6	Confident	122 Å²	122	42.9 Å²	42.9	46%	0.46	22%	0.221	S	C	.	.	H	α-helix	trans	-57.8	-48.2	175.3	-178.7	-179.2	168.9	176.3	0.2	111.4	F411 Y413 I417 V418 D419 L451	F411-R415 VanDerWaalsContact O-CB 3.24Å; F411-R415 WeakPolarHBondContact O-CB 3.28Å; F411-R415 PolarHBondContact O-N 2.96Å; Y413-R415 VanDerWaalsContact C-N 3.32Å; Y413-R415 PolarHBondContact O-N 3.47Å; R415-I417 VanDerWaalsContact C-N 3.26Å; R415-I417 PolarHBondContact O-N 3.41Å; R415-V418 PolarHBondContact O-N 3.28Å; R415-D419 IonicContact NE-OD2 3.39Å; R415-D419 WeakPolarHBondContact O-CB 3.44Å; R415-D419 VanDerWaalsContact O-CG 3.22Å; R415-D419 PolarHBondContact O-N 3.3Å; R415-L451 HydrophobicContact CB-CD2 3.87Å; R415-L451 HydrophobicContact CG-CD2 4.13Å
416	A	91.9	Very high	89.4	Confident	19 Å²	19	46 Å²	46	16%	0.157	24%	0.236	C	C	.	.	H	α-helix	trans	-59	-38.9	178.8	0	0	0	0	0	112.1	V377 V380 E412 Y413 K414 C420	V377-A416 HydrophobicContact CG1-CB 4.2Å; V377-A416 HydrophobicContact CG2-CB 4.32Å; V380-A416 HydrophobicContact CG1-CB 4.16Å; V380-A416 WeakPolarHBondContact CG1-O 3.41Å; E412-A416 WeakPolarHBondContact O-CB 3.3Å; E412-A416 PolarHBondContact O-N 3.33Å; Y413-A416 PolarHBondContact O-N 3.12Å; K414-A416 PolarHBondContact O-N 3.5Å; A416-C420 WeakPolarHBondContact O-CB 3.45Å; A416-C420 PolarHBondContact O-N 3.15Å
417	I	93.1	Very high	89.1	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-67.3	-47.8	176.6	-62.4	163.3	0	0	0	111.2	V380 L401 M404 L405 Y413 K414 R415 D419 C420 I421	V380-I417 HydrophobicContact CG1-CG1 4.12Å; V380-I417 HydrophobicContact CG2-CD1 4.43Å; V380-I417 HydrophobicContact CG2-CG1 3.58Å; L401-I417 HydrophobicContact CB-CG2 4.09Å; L401-I417 HydrophobicContact CD2-CG2 4.25Å; M404-I417 HydrophobicContact CB-CD1 4Å; L405-I417 HydrophobicContact CB-CG2 3.92Å; L405-I417 HydrophobicContact CD1-CB 4.12Å; L405-I417 HydrophobicContact CD1-CD1 4.48Å; L405-I417 HydrophobicContact CD1-CG2 4.01Å; L405-I417 HydrophobicContact CD2-CG2 4.48Å; L405-I417 HydrophobicContact CG-CG2 4.35Å; Y413-I417 HydrophobicContact CD1-CD1 4.36Å; Y413-I417 HydrophobicContact CD2-CD1 4.02Å; Y413-I417 HydrophobicContact CD2-CG1 4.42Å; Y413-I417 HydrophobicContact CE1-CD1 3.85Å; Y413-I417 HydrophobicContact CE2-CD1 3.43Å; Y413-I417 VanDerWaalsContact CE2-CD1 3.43Å; Y413-I417 HydrophobicContact CE2-CG1 4.03Å; Y413-I417 HydrophobicContact CG-CD1 4.46Å; Y413-I417 WeakPolarHBondContact O-CG1 3.47Å; Y413-I417 PolarHBondContact O-N 3.36Å; Y413-I417 VanDerWaalsContact O-N 3.15Å; K414-I417 PolarHBondContact O-N 3.08Å; R415-I417 VanDerWaalsContact C-N 3.26Å; R415-I417 PolarHBondContact O-N 3.41Å; I417-D419 VanDerWaalsContact C-N 3.31Å; I417-D419 PolarHBondContact O-N 2.95Å; I417-C420 WeakPolarHBondContact O-CB 3.47Å; I417-C420 PolarHBondContact O-N 3.41Å; I417-I421 HydrophobicContact CG2-CD1 3.85Å; I417-I421 HydrophobicContact CG2-CG1 4.34Å; I417-I421 WeakPolarHBondContact O-CG1 3.39Å; I417-I421 PolarHBondContact O-N 2.91Å
418	V	93.6	Very high	88.8	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.5	-44.8	178.5	171.5	0	0	0	0	110.6	L405 K414 R415 C420 I421 I422 L439 F442 I455	L405-V418 HydrophobicContact CD1-CG2 3.9Å; L405-V418 HydrophobicContact CD2-CG2 4.35Å; K414-V418 WeakPolarHBondContact O-CG2 3.39Å; K414-V418 PolarHBondContact O-N 3Å; R415-V418 PolarHBondContact O-N 3.28Å; V418-C420 VanDerWaalsContact C-N 3.34Å; V418-C420 PolarHBondContact O-N 3.09Å; V418-I421 PolarHBondContact O-N 3.31Å; V418-I422 HydrophobicContact CG1-CD1 3.77Å; V418-I422 HydrophobicContact CG1-CG1 4.42Å; V418-I422 VanDerWaalsContact O-CG1 3.24Å; V418-I422 WeakPolarHBondContact O-CG1 3.48Å; V418-I422 PolarHBondContact O-N 2.64Å; V418-L439 HydrophobicContact CG1-CD2 4.41Å; V418-L439 HydrophobicContact CG2-CD2 4.37Å; V418-F442 HydrophobicContact CG2-CE1 4.24Å; V418-I455 HydrophobicContact CG1-CD1 4.14Å; V418-I455 HydrophobicContact CG1-CG1 3.87Å; V418-I455 HydrophobicContact CG2-CD1 4.11Å
419	D	91.6	Very high	88.8	Confident	50 Å²	50	37.7 Å²	37.7	27%	0.267	20%	0.202	S	C	.	.	H	α-helix	trans	-62.5	-41.1	177.8	-69.6	-9	0	0	0	111.4	R415 I417 I422 S423 K454	R415-D419 IonicContact NE-OD2 3.39Å; R415-D419 WeakPolarHBondContact O-CB 3.44Å; R415-D419 VanDerWaalsContact O-CG 3.22Å; R415-D419 PolarHBondContact O-N 3.3Å; I417-D419 VanDerWaalsContact C-N 3.31Å; I417-D419 PolarHBondContact O-N 2.95Å; D419-I422 PolarHBondContact O-N 3.29Å; D419-S423 PolarHBondContact O-N 2.89Å; D419-K454 WeakPolarHBondContact OD1-CE 3.36Å; D419-K454 IonicContact OD1-NZ 2.66Å; D419-K454 PolarHBondContact OD1-NZ 2.92Å; D419-K454 IonicContact OD2-NZ 2.91Å
420	C	91.1	Very high	88.8	Confident	5 Å²	5	43.7 Å²	43.7	3%	0.034	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-45.2	174.2	-175.9	0	0	0	0	112.2	V380 S384 L401 A416 I417 V418 I422 S423 I424	V380-C420 HydrophobicContact CG1-CB 3.93Å; S384-C420 WeakPolarHBondContact CB-SG 3.43Å; L401-C420 HydrophobicContact CD1-CB 4.38Å; L401-C420 VanDerWaalsContact CD1-SG 3.57Å; A416-C420 WeakPolarHBondContact O-CB 3.45Å; A416-C420 PolarHBondContact O-N 3.15Å; I417-C420 WeakPolarHBondContact O-CB 3.47Å; I417-C420 PolarHBondContact O-N 3.41Å; V418-C420 VanDerWaalsContact C-N 3.34Å; V418-C420 PolarHBondContact O-N 3.09Å; C420-I422 VanDerWaalsContact C-N 3.33Å; C420-I422 PolarHBondContact O-N 3.33Å; C420-S423 WeakPolarHBondContact O-CB 3.34Å; C420-S423 PolarHBondContact O-N 2.97Å; C420-I424 WeakPolarHBondContact O-CD1 3.44Å; C420-I424 VanDerWaalsContact O-CG1 3.26Å; C420-I424 WeakPolarHBondContact O-CG1 3.42Å; C420-I424 PolarHBondContact O-N 2.96Å
421	I	92.5	Very high	88.6	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-41.3	177.8	-67.9	171	0	0	0	110.4	M398 L401 L405 I417 V418 I424 I425 L439	M398-I421 HydrophobicContact CE-CG2 4.05Å; L401-I421 HydrophobicContact CB-CD1 4.22Å; L401-I421 HydrophobicContact CB-CG1 4.14Å; L401-I421 HydrophobicContact CD1-CG1 4.18Å; L405-I421 HydrophobicContact CD2-CD1 4.06Å; I417-I421 HydrophobicContact CG2-CD1 3.85Å; I417-I421 HydrophobicContact CG2-CG1 4.34Å; I417-I421 WeakPolarHBondContact O-CG1 3.39Å; I417-I421 PolarHBondContact O-N 2.91Å; V418-I421 PolarHBondContact O-N 3.31Å; I421-I424 PolarHBondContact O-N 2.87Å; I421-I425 HydrophobicContact CG2-CD1 3.76Å; I421-I425 HydrophobicContact CG2-CG1 4.3Å; I421-I425 VanDerWaalsContact O-CG1 3.26Å; I421-I425 WeakPolarHBondContact O-CG1 3.44Å; I421-I425 PolarHBondContact O-N 3.12Å; I421-L439 HydrophobicContact CB-CD2 4.4Å; I421-L439 HydrophobicContact CD1-CD2 4.23Å; I421-L439 HydrophobicContact CG2-CD1 3.94Å; I421-L439 HydrophobicContact CG2-CD2 4.06Å; I421-L439 HydrophobicContact CG2-CG 3.89Å
422	I	90.3	Very high	88.5	Confident	19 Å²	19	40.8 Å²	40.8	10%	0.097	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-48.3	175.2	-70.3	167.7	0	0	0	110.4	V418 D419 C420 I424 I425 E426 K454 L458	V418-I422 HydrophobicContact CG1-CD1 3.77Å; V418-I422 HydrophobicContact CG1-CG1 4.42Å; V418-I422 VanDerWaalsContact O-CG1 3.24Å; V418-I422 WeakPolarHBondContact O-CG1 3.48Å; V418-I422 PolarHBondContact O-N 2.64Å; D419-I422 PolarHBondContact O-N 3.29Å; C420-I422 VanDerWaalsContact C-N 3.33Å; C420-I422 PolarHBondContact O-N 3.33Å; I422-I424 VanDerWaalsContact C-N 3.29Å; I422-I424 PolarHBondContact O-N 3.05Å; I422-I425 PolarHBondContact O-N 3.39Å; I422-E426 HydrophobicContact CG2-CG 4.36Å; I422-E426 WeakPolarHBondContact O-CG 3.49Å; I422-E426 PolarHBondContact O-N 3.02Å; I422-K454 HydrophobicContact CD1-CD 4.32Å; I422-K454 HydrophobicContact CD1-CG 4.27Å; I422-L458 HydrophobicContact CG1-CD1 4.45Å; I422-L458 HydrophobicContact CG1-CD2 3.77Å; I422-L458 HydrophobicContact CG2-CD1 4.16Å
423	S	88	Confident	88.5	Confident	33 Å²	33	39 Å²	39	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-55.8	-45.2	176.8	-156	0	0	0	0	111.2	D419 C420 I425 E426 E427	D419-S423 PolarHBondContact O-N 2.89Å; C420-S423 WeakPolarHBondContact O-CB 3.34Å; C420-S423 PolarHBondContact O-N 2.97Å; S423-I425 PolarHBondContact O-N 2.85Å; S423-E426 PolarHBondContact O-N 2.68Å; S423-E427 WeakPolarHBondContact O-CB 3.4Å; S423-E427 VanDerWaalsContact O-CG 3.23Å; S423-E427 WeakPolarHBondContact O-CG 3.4Å; S423-E427 PolarHBondContact O-N 3.14Å; S423-E427 PolarHBondContact OG-OE1 2.91Å
424	I	87.4	Confident	88.5	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-43.9	179	-64.6	162.6	0	0	0	111.5	C387 H394 M398 L401 C420 I421 I422 E426 E427 N428 S431	C387-I424 HydrophobicContact CB-CD1 4.12Å; C387-I424 HydrophobicContact CB-CG1 3.95Å; C387-I424 VanDerWaalsContact SG-CD1 3.53Å; H394-I424 HydrophobicContact CB-CG2 4.38Å; M398-I424 HydrophobicContact CE-CB 4.37Å; M398-I424 HydrophobicContact CE-CG2 3.87Å; M398-I424 HydrophobicContact CG-CD1 4.24Å; M398-I424 HydrophobicContact CG-CG2 3.92Å; M398-I424 HydrophobicContact SD-CG2 3.85Å; L401-I424 HydrophobicContact CD1-CD1 3.7Å; C420-I424 WeakPolarHBondContact O-CD1 3.44Å; C420-I424 VanDerWaalsContact O-CG1 3.26Å; C420-I424 WeakPolarHBondContact O-CG1 3.42Å; C420-I424 PolarHBondContact O-N 2.96Å; I421-I424 PolarHBondContact O-N 2.87Å; I422-I424 VanDerWaalsContact C-N 3.29Å; I422-I424 PolarHBondContact O-N 3.05Å; I424-E426 VanDerWaalsContact C-N 3.33Å; I424-E426 PolarHBondContact O-N 2.76Å; I424-E427 PolarHBondContact O-N 3.04Å; I424-N428 PolarHBondContact O-N 3.11Å; I424-S431 PolarHBondContact O-OG 2.87Å; I424-S431 VanDerWaalsContact O-OG 3.07Å
425	I	88.2	Confident	88.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.6	-41.6	177.2	-70.8	169.2	0	0	0	111	M398 I421 I422 S423 S431 K432 L436 L439 L458	M398-I425 HydrophobicContact CE-CG1 3.96Å; I421-I425 HydrophobicContact CG2-CD1 3.76Å; I421-I425 HydrophobicContact CG2-CG1 4.3Å; I421-I425 VanDerWaalsContact O-CG1 3.26Å; I421-I425 WeakPolarHBondContact O-CG1 3.44Å; I421-I425 PolarHBondContact O-N 3.12Å; I422-I425 PolarHBondContact O-N 3.39Å; S423-I425 PolarHBondContact O-N 2.85Å; I425-S431 WeakPolarHBondContact CA-OG 3.41Å; I425-K432 HydrophobicContact CG2-CG 4.03Å; I425-L436 HydrophobicContact CD1-CD2 4.22Å; I425-L436 HydrophobicContact CD1-CG 4.5Å; I425-L439 HydrophobicContact CD1-CD1 3.85Å; I425-L458 HydrophobicContact CD1-CD2 4.08Å
426	E	84.1	Confident	88.3	Confident	66 Å²	66	34.9 Å²	34.9	31%	0.308	18%	0.184	S	C	.	.	H	α-helix	trans	-71.7	-38.8	-179.6	-70.2	-169.7	146.1	0	0	111.4	I422 S423 I424 K461 R814	I422-E426 HydrophobicContact CG2-CG 4.36Å; I422-E426 WeakPolarHBondContact O-CG 3.49Å; I422-E426 PolarHBondContact O-N 3.02Å; S423-E426 PolarHBondContact O-N 2.68Å; I424-E426 VanDerWaalsContact C-N 3.33Å; I424-E426 PolarHBondContact O-N 2.76Å; E426-K461 IonicContact OE1-NZ 2.71Å; E426-K461 PolarHBondContact OE1-NZ 3.08Å; E426-R814 VanDerWaalsContact O-CZ 3.23Å; E426-R814 PolarHBondContact O-NH1 3.02Å; E426-R814 PolarHBondContact O-NH2 2.88Å
427	E	81.9	Confident	88.3	Confident	82 Å²	82	35.5 Å²	35.5	38%	0.383	19%	0.189	S	C	.	.	H	α-helix	trans	-76.6	-39.7	-178.9	-70.8	169.6	-159.5	0	0	113.4	Q388 S423 I424	Q388-E427 WeakPolarHBondContact CG-OE2 3.32Å; Q388-E427 PolarHBondContact NE2-OE1 3.13Å; S423-E427 WeakPolarHBondContact O-CB 3.4Å; S423-E427 VanDerWaalsContact O-CG 3.23Å; S423-E427 WeakPolarHBondContact O-CG 3.4Å; S423-E427 PolarHBondContact O-N 3.14Å; S423-E427 PolarHBondContact OG-OE1 2.91Å; I424-E427 PolarHBondContact O-N 3.04Å
428	N	80.8	Confident	88.3	Confident	24 Å²	24	36.7 Å²	36.7	13%	0.128	19%	0.194	C	C	.	.			trans	-118.9	109.9	-173.7	-174.2	-7	0	0	0	113	H394 I424 E430 S431	H394-N428 PolarHBondContact CD2-ND2 2.81Å; I424-N428 PolarHBondContact O-N 3.11Å; N428-E430 VanDerWaalsContact C-N 3.33Å; N428-E430 PolarHBondContact O-N 2.71Å; N428-E430 WeakPolarHBondContact OD1-CB 3.4Å; N428-E430 PolarHBondContact OD1-N 2.75Å; N428-S431 WeakPolarHBondContact O-CB 3.41Å; N428-S431 PolarHBondContact O-N 3.44Å; N428-S431 VanDerWaalsContact O-N 3.12Å; N428-S431 PolarHBondContact O-OG 3.12Å
429	P	80.9	Confident	88.4	Confident	85 Å²	85	36.7 Å²	36.7	55%	0.552	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-57.4	-36.7	177	-24.8	34.5	0	0	0	115.1	S431 K432	P429-S431 PolarHBondContact O-N 3.13Å; P429-K432 WeakPolarHBondContact O-CB 3.39Å; P429-K432 WeakPolarHBondContact O-CG 3.4Å; P429-K432 PolarHBondContact O-N 3.33Å
430	E	83.8	Confident	88.4	Confident	154 Å²	154	34.3 Å²	34.3	72%	0.72	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-67.5	-21.5	-179.3	-61.1	-175.7	163	0	0	112.1	N428	N428-E430 VanDerWaalsContact C-N 3.33Å; N428-E430 PolarHBondContact O-N 2.71Å; N428-E430 WeakPolarHBondContact OD1-CB 3.4Å; N428-E430 PolarHBondContact OD1-N 2.75Å
431	S	85.9	Confident	88.4	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-83.5	-14.9	-179.9	84.5	0	0	0	0	113.5	H394 I424 I425 N428 P429 E433 T434 G435	H394-S431 VanDerWaalsContact ND1-CB 3.34Å; H394-S431 WeakPolarHBondContact ND1-CB 3.43Å; I424-S431 PolarHBondContact O-OG 2.87Å; I424-S431 VanDerWaalsContact O-OG 3.07Å; I425-S431 WeakPolarHBondContact CA-OG 3.41Å; N428-S431 WeakPolarHBondContact O-CB 3.41Å; N428-S431 PolarHBondContact O-N 3.44Å; N428-S431 VanDerWaalsContact O-N 3.12Å; N428-S431 PolarHBondContact O-OG 3.12Å; P429-S431 PolarHBondContact O-N 3.13Å; S431-E433 PolarHBondContact O-N 3.49Å; S431-T434 PolarHBondContact O-N 2.92Å; S431-G435 PolarHBondContact O-N 3.06Å
432	K	87.6	Confident	88.4	Confident	43 Å²	43	39.3 Å²	39.3	19%	0.187	20%	0.204	C	C	.	.	H	α-helix	trans	-58.4	-52.8	-168.8	-71.8	-172.1	179	-162	0	113.3	I425 P429 T434 G435 L436 E462	I425-K432 HydrophobicContact CG2-CG 4.03Å; P429-K432 WeakPolarHBondContact O-CB 3.39Å; P429-K432 WeakPolarHBondContact O-CG 3.4Å; P429-K432 PolarHBondContact O-N 3.33Å; K432-T434 PolarHBondContact O-N 3.46Å; K432-G435 PolarHBondContact O-N 3.2Å; K432-L436 WeakPolarHBondContact O-CB 3.48Å; K432-L436 VanDerWaalsContact O-CG 3.23Å; K432-L436 WeakPolarHBondContact O-CG 3.47Å; K432-L436 PolarHBondContact O-N 3.46Å; K432-E462 IonicContact NZ-OE2 2.67Å; K432-E462 PolarHBondContact NZ-OE2 3.16Å
433	E	89.4	Confident	88.4	Confident	94 Å²	94	38.4 Å²	38.4	44%	0.439	20%	0.2	S	C	.	.	H	α-helix	trans	-62.2	-44.1	-177.1	-68.7	-165.6	147.8	0	0	111.9	S431 A437 P467	S431-E433 PolarHBondContact O-N 3.49Å; E433-A437 VanDerWaalsContact O-CB 3.26Å; E433-A437 WeakPolarHBondContact O-CB 3.41Å; E433-A437 PolarHBondContact O-N 3.14Å; E433-P467 VanDerWaalsContact OE1-CD 3.29Å; E433-P467 WeakPolarHBondContact OE1-CD 3.46Å; E433-P467 WeakPolarHBondContact OE1-CG 3.27Å
434	T	89.8	Confident	88.5	Confident	53 Å²	53	39.5 Å²	39.5	33%	0.325	20%	0.201	S	C	.	.	H	α-helix	trans	-65.8	-44.9	179	-55.2	0	0	0	0	111.4	S431 K432 A437 H438	S431-T434 PolarHBondContact O-N 2.92Å; K432-T434 PolarHBondContact O-N 3.46Å; T434-A437 PolarHBondContact O-N 3.49Å; T434-H438 PolarHBondContact O-CD2 3.46Å; T434-H438 PolarHBondContact O-N 3.46Å
435	G	91.1	Very high	88.4	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-46.4	178.8	0	0	0	0	0	113.3	S431 K432 A437 H438 L439	S431-G435 PolarHBondContact O-N 3.06Å; K432-G435 PolarHBondContact O-N 3.2Å; G435-A437 VanDerWaalsContact C-N 3.28Å; G435-A437 PolarHBondContact O-N 2.95Å; G435-H438 PolarHBondContact O-N 3.28Å; G435-L439 WeakPolarHBondContact O-CG 3.24Å; G435-L439 PolarHBondContact O-N 3.37Å
436	L	92.2	Very high	88.4	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-36.9	175.8	-66.7	177.3	0	0	0	111.2	I425 K432 L439 C440 L458 L459 E462 T466 Y472	I425-L436 HydrophobicContact CD1-CD2 4.22Å; I425-L436 HydrophobicContact CD1-CG 4.5Å; K432-L436 WeakPolarHBondContact O-CB 3.48Å; K432-L436 VanDerWaalsContact O-CG 3.23Å; K432-L436 WeakPolarHBondContact O-CG 3.47Å; K432-L436 PolarHBondContact O-N 3.46Å; L436-L439 PolarHBondContact O-N 2.67Å; L436-C440 WeakPolarHBondContact O-CB 3.39Å; L436-C440 PolarHBondContact O-N 2.85Å; L436-C440 PolarHBondContact O-SG 3.35Å; L436-L458 HydrophobicContact CD2-CD2 3.96Å; L436-L458 HydrophobicContact CD2-CG 4.3Å; L436-L459 HydrophobicContact CB-CD2 4.36Å; L436-L459 HydrophobicContact CD2-CD2 3.96Å; L436-E462 HydrophobicContact CD1-CB 4.32Å; L436-T466 HydrophobicContact CD1-CG2 3.74Å; L436-Y472 HydrophobicContact CB-CD1 4.49Å; L436-Y472 HydrophobicContact CB-CE1 3.66Å; L436-Y472 HydrophobicContact CD1-CE1 4.4Å
437	A	91.9	Very high	88.5	Confident	32 Å²	32	52.3 Å²	52.3	26%	0.264	27%	0.267	S	S	.	.	H	α-helix	trans	-63.1	-46.4	174.9	0	0	0	0	0	112.4	E433 T434 G435 L439 C440 E441	E433-A437 VanDerWaalsContact O-CB 3.26Å; E433-A437 WeakPolarHBondContact O-CB 3.41Å; E433-A437 PolarHBondContact O-N 3.14Å; T434-A437 PolarHBondContact O-N 3.49Å; G435-A437 VanDerWaalsContact C-N 3.28Å; G435-A437 PolarHBondContact O-N 2.95Å; A437-L439 PolarHBondContact O-N 3.43Å; A437-C440 WeakPolarHBondContact O-CB 3.47Å; A437-C440 PolarHBondContact O-N 3.03Å; A437-E441 PolarHBondContact O-N 3.12Å
438	H	93.2	Very high	88.9	Confident	26 Å²	26	50.7 Å²	50.7	12%	0.12	26%	0.259	C	S	.	.	H	α-helix	trans	-61.9	-41.9	176.9	-70.7	-44.5	0	0	0	112.4	N399 S402 T434 G435 E441 F442	N399-H438 PolarHBondContact OD1-NE2 3.24Å; S402-H438 VanDerWaalsContact CB-CG 3.5Å; S402-H438 WeakPolarHBondContact CB-ND1 3.47Å; S402-H438 PolarHBondContact OG-CE1 2.94Å; S402-H438 PolarHBondContact OG-ND1 2.88Å; T434-H438 PolarHBondContact O-CD2 3.46Å; T434-H438 PolarHBondContact O-N 3.46Å; G435-H438 PolarHBondContact O-N 3.28Å; H438-E441 PolarHBondContact O-N 2.86Å; H438-F442 PolarHBondContact O-N 3.39Å; H438-F442 VanDerWaalsContact O-N 3.07Å
439	L	93.8	Very high	89.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-35.6	176.2	-67.8	178.1	0	0	0	112.3	L405 V418 I421 I425 G435 L436 A437 E441 F442 I443 I455 L458	L405-L439 HydrophobicContact CD2-CD2 4.21Å; V418-L439 HydrophobicContact CG1-CD2 4.41Å; V418-L439 HydrophobicContact CG2-CD2 4.37Å; I421-L439 HydrophobicContact CB-CD2 4.4Å; I421-L439 HydrophobicContact CD1-CD2 4.23Å; I421-L439 HydrophobicContact CG2-CD1 3.94Å; I421-L439 HydrophobicContact CG2-CD2 4.06Å; I421-L439 HydrophobicContact CG2-CG 3.89Å; I425-L439 HydrophobicContact CD1-CD1 3.85Å; G435-L439 WeakPolarHBondContact O-CG 3.24Å; G435-L439 PolarHBondContact O-N 3.37Å; L436-L439 PolarHBondContact O-N 2.67Å; A437-L439 PolarHBondContact O-N 3.43Å; L439-E441 VanDerWaalsContact C-N 3.34Å; L439-F442 PolarHBondContact O-N 2.8Å; L439-I443 PolarHBondContact O-N 3.08Å; L439-I455 HydrophobicContact CB-CG2 3.82Å; L439-I455 HydrophobicContact CD2-CD1 4Å; L439-I455 HydrophobicContact CD2-CG1 4.23Å; L439-L458 HydrophobicContact CD1-CD2 3.53Å
440	C	92.8	Very high	89.9	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-62.8	-40.9	174.5	-76.6	0	0	0	0	112.2	L436 A437 I443 L459 F475	L436-C440 WeakPolarHBondContact O-CB 3.39Å; L436-C440 PolarHBondContact O-N 2.85Å; L436-C440 PolarHBondContact O-SG 3.35Å; A437-C440 WeakPolarHBondContact O-CB 3.47Å; A437-C440 PolarHBondContact O-N 3.03Å; C440-I443 WeakPolarHBondContact O-CG1 3.31Å; C440-L459 VanDerWaalsContact SG-CD2 3.51Å; C440-F475 HydrophobicContact CB-CB 4.24Å; C440-F475 HydrophobicContact CB-CD1 3.78Å; C440-F475 HydrophobicContact CB-CD2 4.04Å; C440-F475 HydrophobicContact CB-CE1 4.08Å; C440-F475 HydrophobicContact CB-CE2 4.33Å; C440-F475 HydrophobicContact CB-CG 3.76Å; C440-F475 HydrophobicContact CB-CZ 4.34Å
441	E	91.4	Very high	90.2	Very high	83 Å²	83	45.7 Å²	45.7	39%	0.388	24%	0.238	S	C	.	.	H	α-helix	trans	-66.8	-42	176	-168.8	172.2	170	0	0	111.1	R406 A437 H438 L439 I443 E444	R406-E441 VanDerWaalsContact CZ-CD 3.41Å; R406-E441 IonicContact CZ-OE1 2.74Å; R406-E441 IonicContact CZ-OE2 3.67Å; R406-E441 IonicContact NH1-OE1 3.2Å; R406-E441 PolarHBondContact NH1-OE1 2.84Å; R406-E441 IonicContact NH1-OE2 2.88Å; R406-E441 IonicContact NH2-OE1 2.75Å; R406-E441 PolarHBondContact NH2-OE1 2.91Å; R406-E441 IonicContact NH2-OE2 2.73Å; R406-E441 PolarHBondContact NH2-OE2 2.79Å; A437-E441 PolarHBondContact O-N 3.12Å; H438-E441 PolarHBondContact O-N 2.86Å; L439-E441 VanDerWaalsContact C-N 3.34Å; E441-I443 PolarHBondContact O-N 3.17Å; E441-E444 WeakPolarHBondContact O-CB 3.33Å; E441-E444 PolarHBondContact O-N 2.9Å; E441-E444 VanDerWaalsContact O-N 3.13Å
442	F	91.9	Very high	90.5	Very high	27 Å²	27	45.8 Å²	45.8	12%	0.118	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-40.5	177.7	175.8	-111.3	0	0	0	113.4	L405 K414 V418 H438 L439 E444 D445 C446 L451 I455	L405-F442 HydrophobicContact CD1-CD1 4.26Å; L405-F442 HydrophobicContact CD1-CD2 3.99Å; L405-F442 HydrophobicContact CD1-CE1 4.12Å; L405-F442 HydrophobicContact CD1-CE2 3.84Å; L405-F442 HydrophobicContact CD1-CG 4.19Å; L405-F442 HydrophobicContact CD1-CZ 3.89Å; L405-F442 HydrophobicContact CD2-CB 3.73Å; L405-F442 HydrophobicContact CD2-CD1 3.99Å; L405-F442 HydrophobicContact CD2-CD2 4.05Å; L405-F442 HydrophobicContact CD2-CG 3.64Å; L405-F442 HydrophobicContact CG-CB 4.18Å; L405-F442 HydrophobicContact CG-CD1 4.22Å; L405-F442 HydrophobicContact CG-CD2 3.56Å; L405-F442 HydrophobicContact CG-CE2 3.92Å; L405-F442 HydrophobicContact CG-CG 3.71Å; L405-F442 HydrophobicContact CG-CZ 4.39Å; L405-F442 WeakPolarHBondContact O-CD2 3.46Å; L405-F442 WeakPolarHBondContact O-CE2 3.41Å; K414-F442 HydrophobicContact CD-CE2 4.25Å; K414-F442 HydrophobicContact CD-CZ 4.34Å; V418-F442 HydrophobicContact CG2-CE1 4.24Å; H438-F442 PolarHBondContact O-N 3.39Å; H438-F442 VanDerWaalsContact O-N 3.07Å; L439-F442 PolarHBondContact O-N 2.8Å; F442-E444 PolarHBondContact O-N 2.79Å; F442-D445 PolarHBondContact O-N 3.13Å; F442-C446 HydrophobicContact CD1-CB 4.45Å; F442-C446 HydrophobicContact CE1-CB 4.16Å; F442-C446 WeakPolarHBondContact CE1-SG 3.44Å; F442-C446 HydrophobicContact CZ-CB 4.33Å; F442-C446 VanDerWaalsContact CZ-SG 3.59Å; F442-C446 WeakPolarHBondContact O-CB 3.44Å; F442-C446 PolarHBondContact O-N 2.86Å; F442-L451 HydrophobicContact CE1-CB 4.44Å; F442-L451 HydrophobicContact CE1-CD1 4.37Å; F442-L451 HydrophobicContact CZ-CD1 4.39Å; F442-I455 HydrophobicContact CD1-CD1 3.63Å; F442-I455 HydrophobicContact CE1-CD1 4.06Å
443	I	90.9	Very high	90.8	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-9.2	177.9	63.6	169.7	0	0	0	113.4	L439 C440 E441 D445 I455 L456 L459 R479	L439-I443 PolarHBondContact O-N 3.08Å; C440-I443 WeakPolarHBondContact O-CG1 3.31Å; E441-I443 PolarHBondContact O-N 3.17Å; I443-D445 VanDerWaalsContact C-N 3.32Å; I443-I455 HydrophobicContact CD1-CG2 4.48Å; I443-I455 HydrophobicContact CG2-CB 3.71Å; I443-I455 HydrophobicContact CG2-CD1 3.58Å; I443-I455 HydrophobicContact CG2-CG1 4.26Å; I443-I455 HydrophobicContact CG2-CG2 3.51Å; I443-L456 HydrophobicContact CD1-CD2 4.18Å; I443-L459 HydrophobicContact CD1-CD1 3.81Å; I443-R479 HydrophobicContact CD1-CG 4.46Å; I443-R479 VanDerWaalsContact O-CD 3.25Å; I443-R479 WeakPolarHBondContact O-CD 3.35Å; I443-R479 VanDerWaalsContact O-CZ 3.29Å; I443-R479 PolarHBondContact O-NE 3.09Å; I443-R479 PolarHBondContact O-NH1 3.26Å
444	E	88.9	Confident	90.9	Very high	56 Å²	56	44.9 Å²	44.9	26%	0.262	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-35.4	175	-70	-169.6	160.6	0	0	112.8	E441 F442 R474 F475 R479	E441-E444 WeakPolarHBondContact O-CB 3.33Å; E441-E444 PolarHBondContact O-N 2.9Å; E441-E444 VanDerWaalsContact O-N 3.13Å; F442-E444 PolarHBondContact O-N 2.79Å; E444-R474 IonicContact OE1-NH2 3.17Å; E444-F475 HydrophobicContact CG-CD1 4.05Å; E444-F475 HydrophobicContact CG-CE1 4.42Å; E444-F475 WeakPolarHBondContact OE1-CD1 3.27Å; E444-F475 WeakPolarHBondContact OE1-CE1 3.38Å; E444-R479 PolarHBondContact O-NH2 2.85Å
445	D	86.6	Confident	91.1	Very high	151 Å²	151	42.4 Å²	42.4	81%	0.807	22%	0.221	S	C	*	.	S	Bend	trans	-125.9	27.8	-177.1	-61.4	-44.4	0	0	0	112	F442 I443 E447	F442-D445 PolarHBondContact O-N 3.13Å; I443-D445 VanDerWaalsContact C-N 3.32Å; D445-E447 PolarHBondContact O-N 2.91Å
446	C	88.1	Confident	91.2	Very high	11 Å²	11	42.4 Å²	42.4	7%	0.074	22%	0.221	C	C	.	.			trans	-81	118.6	-176.1	-172.5	0	0	0	0	112.2	F442 H448	F442-C446 HydrophobicContact CD1-CB 4.45Å; F442-C446 HydrophobicContact CE1-CB 4.16Å; F442-C446 WeakPolarHBondContact CE1-SG 3.44Å; F442-C446 HydrophobicContact CZ-CB 4.33Å; F442-C446 VanDerWaalsContact CZ-SG 3.59Å; F442-C446 WeakPolarHBondContact O-CB 3.44Å; F442-C446 PolarHBondContact O-N 2.86Å; C446-H448 VanDerWaalsContact C-N 3.29Å; C446-H448 PolarHBondContact O-N 2.94Å; C446-H448 PolarHBondContact SG-N 2.63Å
447	E	86.8	Confident	91.1	Very high	177 Å²	177	47.7 Å²	47.7	83%	0.827	25%	0.246	S	C	*	.			trans	-80.2	-7.7	176.6	-56.8	-175.9	167.5	0	0	113.9	D445	D445-E447 PolarHBondContact O-N 2.91Å
448	H	90	Very high	91	Very high	48 Å²	48	46.6 Å²	46.6	22%	0.222	24%	0.235	C	C	.	.			trans	-106.1	101.4	-171.7	-62.5	-38	0	0	0	112.3	F411 C446 V450 L451 A452	F411-H448 HydrophobicContact CD2-CB 4.17Å; F411-H448 AromaticContact CD2-CG 3.93Å; C446-H448 VanDerWaalsContact C-N 3.29Å; C446-H448 PolarHBondContact O-N 2.94Å; C446-H448 PolarHBondContact SG-N 2.63Å; H448-V450 VanDerWaalsContact C-N 3.29Å; H448-V450 PolarHBondContact O-N 2.93Å; H448-V450 VanDerWaalsContact O-N 3.16Å; H448-L451 HydrophobicContact CB-CB 4.11Å; H448-L451 HydrophobicContact CB-CD1 3.94Å; H448-L451 HydrophobicContact CB-CG 3.95Å; H448-L451 PolarHBondContact O-N 3.11Å; H448-A452 PolarHBondContact O-N 3.1Å
449	T	90.2	Very high	91	Very high	65 Å²	65	45.3 Å²	45.3	40%	0.399	23%	0.23	S	C	.	.	H	α-helix	trans	-47.9	-46.1	179.1	-46.8	0	0	0	0	113.2	L451 A452 T453 A486 V487	T449-L451 VanDerWaalsContact C-N 3.34Å; T449-L451 PolarHBondContact O-N 2.78Å; T449-A452 PolarHBondContact O-N 2.99Å; T449-T453 WeakPolarHBondContact O-CG2 3.36Å; T449-T453 PolarHBondContact O-N 3.48Å; T449-T453 PolarHBondContact O-OG1 2.81Å; T449-A486 HydrophobicContact CG2-CB 4.04Å; T449-V487 HydrophobicContact CG2-CG2 3.79Å
450	V	91.1	Very high	90.8	Very high	91 Å²	91	45.4 Å²	45.4	55%	0.552	23%	0.231	S	C	*	.	H	α-helix	trans	-66	-34.7	-178	179.6	0	0	0	0	112.3	F411 H448 T453 K454	F411-V450 HydrophobicContact CE2-CB 4.08Å; F411-V450 HydrophobicContact CE2-CG1 4.48Å; F411-V450 HydrophobicContact CZ-CB 4.24Å; F411-V450 HydrophobicContact CZ-CG1 4.22Å; H448-V450 VanDerWaalsContact C-N 3.29Å; H448-V450 PolarHBondContact O-N 2.93Å; H448-V450 VanDerWaalsContact O-N 3.16Å; V450-T453 PolarHBondContact O-OG1 3.43Å; V450-K454 WeakPolarHBondContact O-CB 3.44Å; V450-K454 PolarHBondContact O-N 3.39Å
451	L	91.7	Very high	90.5	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.249	C	C	.	.	H	α-helix	trans	-76.1	-42	177.5	-61.4	-176.7	0	0	0	110.7	F411 K414 R415 F442 H448 T449 T453 K454 I455	F411-L451 HydrophobicContact CD2-CD1 4.37Å; F411-L451 HydrophobicContact CD2-CG 4.29Å; F411-L451 HydrophobicContact CE2-CD1 4.42Å; F411-L451 HydrophobicContact CE2-CD2 4.06Å; F411-L451 HydrophobicContact CE2-CG 3.88Å; K414-L451 HydrophobicContact CB-CD1 3.62Å; R415-L451 HydrophobicContact CB-CD2 3.87Å; R415-L451 HydrophobicContact CG-CD2 4.13Å; F442-L451 HydrophobicContact CE1-CB 4.44Å; F442-L451 HydrophobicContact CE1-CD1 4.37Å; F442-L451 HydrophobicContact CZ-CD1 4.39Å; H448-L451 HydrophobicContact CB-CB 4.11Å; H448-L451 HydrophobicContact CB-CD1 3.94Å; H448-L451 HydrophobicContact CB-CG 3.95Å; H448-L451 PolarHBondContact O-N 3.11Å; T449-L451 VanDerWaalsContact C-N 3.34Å; T449-L451 PolarHBondContact O-N 2.78Å; L451-T453 PolarHBondContact O-N 3.32Å; L451-K454 PolarHBondContact O-N 2.88Å; L451-I455 VanDerWaalsContact O-CG1 3.31Å; L451-I455 WeakPolarHBondContact O-CG1 3.42Å; L451-I455 PolarHBondContact O-N 2.99Å
452	A	92.3	Very high	90.3	Very high	2 Å²	2	46 Å²	46	2%	0.017	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-47.5	176.2	0	0	0	0	0	111.6	H448 T449 K454 I455 L456 V487	H448-A452 PolarHBondContact O-N 3.1Å; T449-A452 PolarHBondContact O-N 2.99Å; A452-K454 PolarHBondContact O-N 2.96Å; A452-I455 PolarHBondContact O-N 3.01Å; A452-L456 WeakPolarHBondContact O-CB 3.28Å; A452-L456 VanDerWaalsContact O-CG 3.25Å; A452-L456 WeakPolarHBondContact O-CG 3.25Å; A452-L456 PolarHBondContact O-N 3.14Å; A452-V487 HydrophobicContact CB-CG1 4.2Å; A452-V487 HydrophobicContact CB-CG2 4.01Å
453	T	92	Very high	90.2	Very high	37 Å²	37	44.7 Å²	44.7	23%	0.227	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-41.4	177.2	54.9	0	0	0	0	112.2	T449 V450 L451 L456 H457 A486 V487 A490	T449-T453 WeakPolarHBondContact O-CG2 3.36Å; T449-T453 PolarHBondContact O-N 3.48Å; T449-T453 PolarHBondContact O-OG1 2.81Å; V450-T453 PolarHBondContact O-OG1 3.43Å; L451-T453 PolarHBondContact O-N 3.32Å; T453-L456 PolarHBondContact O-N 3.5Å; T453-H457 WeakPolarHBondContact O-CB 3.46Å; T453-H457 PolarHBondContact O-N 3.03Å; T453-A486 WeakPolarHBondContact CG2-O 3.21Å; T453-V487 HydrophobicContact CG2-CG2 4.17Å; T453-A490 HydrophobicContact CG2-CB 3.98Å
454	K	92.6	Very high	90	Very high	82 Å²	82	45 Å²	45	36%	0.357	23%	0.228	S	C	.	.	H	α-helix	trans	-62.9	-44.4	177	-172.1	171.7	-174	173.2	0	112.3	D419 I422 V450 L451 A452 H457 L458	D419-K454 WeakPolarHBondContact OD1-CE 3.36Å; D419-K454 IonicContact OD1-NZ 2.66Å; D419-K454 PolarHBondContact OD1-NZ 2.92Å; D419-K454 IonicContact OD2-NZ 2.91Å; I422-K454 HydrophobicContact CD1-CD 4.32Å; I422-K454 HydrophobicContact CD1-CG 4.27Å; V450-K454 WeakPolarHBondContact O-CB 3.44Å; V450-K454 PolarHBondContact O-N 3.39Å; L451-K454 PolarHBondContact O-N 2.88Å; A452-K454 PolarHBondContact O-N 2.96Å; K454-H457 PolarHBondContact O-N 3.39Å; K454-L458 PolarHBondContact O-N 2.99Å; K454-L458 VanDerWaalsContact O-N 3.07Å
455	I	93.4	Very high	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67	-41.4	177.8	-67.4	166.9	0	0	0	110.8	V418 L439 F442 I443 L451 A452 H457 L458 L459	V418-I455 HydrophobicContact CG1-CD1 4.14Å; V418-I455 HydrophobicContact CG1-CG1 3.87Å; V418-I455 HydrophobicContact CG2-CD1 4.11Å; L439-I455 HydrophobicContact CB-CG2 3.82Å; L439-I455 HydrophobicContact CD2-CD1 4Å; L439-I455 HydrophobicContact CD2-CG1 4.23Å; F442-I455 HydrophobicContact CD1-CD1 3.63Å; F442-I455 HydrophobicContact CE1-CD1 4.06Å; I443-I455 HydrophobicContact CD1-CG2 4.48Å; I443-I455 HydrophobicContact CG2-CB 3.71Å; I443-I455 HydrophobicContact CG2-CD1 3.58Å; I443-I455 HydrophobicContact CG2-CG1 4.26Å; I443-I455 HydrophobicContact CG2-CG2 3.51Å; L451-I455 VanDerWaalsContact O-CG1 3.31Å; L451-I455 WeakPolarHBondContact O-CG1 3.42Å; L451-I455 PolarHBondContact O-N 2.99Å; A452-I455 PolarHBondContact O-N 3.01Å; I455-H457 VanDerWaalsContact C-N 3.31Å; I455-H457 PolarHBondContact O-N 3.23Å; I455-L458 WeakPolarHBondContact O-CB 3.37Å; I455-L458 PolarHBondContact O-N 3.42Å; I455-L459 HydrophobicContact CG2-CD1 4.02Å; I455-L459 HydrophobicContact CG2-CG 4.33Å; I455-L459 WeakPolarHBondContact O-CG 3.48Å; I455-L459 PolarHBondContact O-N 3.19Å
456	L	92.9	Very high	89.9	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.2	-40	174.9	-73.5	169.3	0	0	0	112	I443 A452 T453 L459 G460 I476 V487 A490 A491 A494	I443-L456 HydrophobicContact CD1-CD2 4.18Å; A452-L456 WeakPolarHBondContact O-CB 3.28Å; A452-L456 VanDerWaalsContact O-CG 3.25Å; A452-L456 WeakPolarHBondContact O-CG 3.25Å; A452-L456 PolarHBondContact O-N 3.14Å; T453-L456 PolarHBondContact O-N 3.5Å; L456-L459 HydrophobicContact CD2-CD1 4.44Å; L456-L459 PolarHBondContact O-N 2.94Å; L456-G460 PolarHBondContact O-N 3.01Å; L456-I476 HydrophobicContact CD2-CB 4.38Å; L456-I476 HydrophobicContact CD2-CG1 4.08Å; L456-I476 HydrophobicContact CD2-CG2 4.15Å; L456-V487 HydrophobicContact CD1-CG1 3.62Å; L456-V487 WeakPolarHBondContact CD1-O 3.35Å; L456-A490 HydrophobicContact CB-CB 4.26Å; L456-A490 HydrophobicContact CD1-CB 4.12Å; L456-A491 HydrophobicContact CD1-CB 4.06Å; L456-A491 HydrophobicContact CD2-CB 4.32Å; L456-A494 WeakPolarHBondContact O-CB 3.07Å
457	H	91.1	Very high	89.7	Confident	112 Å²	112	46.6 Å²	46.6	52%	0.519	23%	0.234	S	C	.	.	H	α-helix	trans	-61.3	-45.1	174.3	-174.7	91.8	0	0	0	111.9	T453 K454 I455 G460 K461	T453-H457 WeakPolarHBondContact O-CB 3.46Å; T453-H457 PolarHBondContact O-N 3.03Å; K454-H457 PolarHBondContact O-N 3.39Å; I455-H457 VanDerWaalsContact C-N 3.31Å; I455-H457 PolarHBondContact O-N 3.23Å; H457-G460 PolarHBondContact O-N 3.44Å; H457-K461 PolarHBondContact O-N 2.94Å; H457-K461 VanDerWaalsContact O-N 3.08Å
458	L	90.8	Very high	89.7	Confident	8 Å²	8	44.2 Å²	44.2	4%	0.042	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-45.6	174.5	-177.1	77.9	0	0	0	111.5	I422 I425 L436 L439 K454 I455 G460 K461 E462	I422-L458 HydrophobicContact CG1-CD1 4.45Å; I422-L458 HydrophobicContact CG1-CD2 3.77Å; I422-L458 HydrophobicContact CG2-CD1 4.16Å; I425-L458 HydrophobicContact CD1-CD2 4.08Å; L436-L458 HydrophobicContact CD2-CD2 3.96Å; L436-L458 HydrophobicContact CD2-CG 4.3Å; L439-L458 HydrophobicContact CD1-CD2 3.53Å; K454-L458 PolarHBondContact O-N 2.99Å; K454-L458 VanDerWaalsContact O-N 3.07Å; I455-L458 WeakPolarHBondContact O-CB 3.37Å; I455-L458 PolarHBondContact O-N 3.42Å; L458-G460 VanDerWaalsContact C-N 3.3Å; L458-G460 PolarHBondContact O-N 3.38Å; L458-K461 PolarHBondContact O-N 3.41Å; L458-E462 HydrophobicContact CD1-CG 4.23Å; L458-E462 PolarHBondContact O-N 3.33Å
459	L	92.2	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.4	-41.1	177.5	-75.2	169	0	0	0	111.5	L436 C440 I443 I455 L456 K461 G463 P464 Y472 I476 F498	L436-L459 HydrophobicContact CB-CD2 4.36Å; L436-L459 HydrophobicContact CD2-CD2 3.96Å; C440-L459 VanDerWaalsContact SG-CD2 3.51Å; I443-L459 HydrophobicContact CD1-CD1 3.81Å; I455-L459 HydrophobicContact CG2-CD1 4.02Å; I455-L459 HydrophobicContact CG2-CG 4.33Å; I455-L459 WeakPolarHBondContact O-CG 3.48Å; I455-L459 PolarHBondContact O-N 3.19Å; L456-L459 HydrophobicContact CD2-CD1 4.44Å; L456-L459 PolarHBondContact O-N 2.94Å; L459-K461 VanDerWaalsContact C-N 3.3Å; L459-K461 PolarHBondContact O-N 3.05Å; L459-G463 WeakPolarHBondContact O-CA 3.43Å; L459-G463 PolarHBondContact O-N 3.08Å; L459-P464 WeakPolarHBondContact O-CD 3.38Å; L459-Y472 HydrophobicContact CD2-CD1 3.97Å; L459-I476 HydrophobicContact CB-CD1 4.29Å; L459-I476 HydrophobicContact CD1-CG1 4.3Å; L459-F498 WeakPolarHBondContact O-CE2 3.18Å
460	G	89.6	Confident	89.5	Confident	2 Å²	2	43.2 Å²	43.2	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-29.3	174.2	0	0	0	0	0	113.8	L456 H457 L458 P464 K497	L456-G460 PolarHBondContact O-N 3.01Å; H457-G460 PolarHBondContact O-N 3.44Å; L458-G460 VanDerWaalsContact C-N 3.3Å; L458-G460 PolarHBondContact O-N 3.38Å; G460-P464 WeakPolarHBondContact O-CD 3.48Å; G460-P464 WeakPolarHBondContact O-CG 3.37Å; G460-K497 VanDerWaalsContact O-CB 3.24Å; G460-K497 WeakPolarHBondContact O-CB 3.49Å; G460-K497 VanDerWaalsContact O-CD 3.3Å; G460-K497 WeakPolarHBondContact O-CD 3.4Å
461	K	86.7	Confident	89.4	Confident	89 Å²	89	43.9 Å²	43.9	39%	0.387	22%	0.219	S	C	.	.	H	α-helix	trans	-80.5	-49.5	179.4	-178.9	-174.2	170.8	-170.2	0	112.4	E426 H457 L458 L459	E426-K461 IonicContact OE1-NZ 2.71Å; E426-K461 PolarHBondContact OE1-NZ 3.08Å; H457-K461 PolarHBondContact O-N 2.94Å; H457-K461 VanDerWaalsContact O-N 3.08Å; L458-K461 PolarHBondContact O-N 3.41Å; L459-K461 VanDerWaalsContact C-N 3.3Å; L459-K461 PolarHBondContact O-N 3.05Å
462	E	87.9	Confident	89.4	Confident	6 Å²	6	44 Å²	44	3%	0.028	22%	0.22	C	C	.	.	H	α-helix	trans	-101.7	-31.1	-171.6	-66	-61.5	137.4	0	0	113.3	K432 L436 L458 R465	K432-E462 IonicContact NZ-OE2 2.67Å; K432-E462 PolarHBondContact NZ-OE2 3.16Å; L436-E462 HydrophobicContact CD1-CB 4.32Å; L458-E462 HydrophobicContact CD1-CG 4.23Å; L458-E462 PolarHBondContact O-N 3.33Å; E462-R465 WeakPolarHBondContact O-CB 3.44Å; E462-R465 PolarHBondContact O-N 3.07Å; E462-R465 VanDerWaalsContact O-N 3.1Å
463	G	88.4	Confident	89.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-57.7	-42.8	-178.1	0	0	0	0	0	114.8	L459 R465 T466	L459-G463 WeakPolarHBondContact O-CA 3.43Å; L459-G463 PolarHBondContact O-N 3.08Å; G463-R465 PolarHBondContact O-N 2.73Å; G463-R465 VanDerWaalsContact O-N 3.16Å; G463-T466 WeakPolarHBondContact O-CB 3.44Å; G463-T466 PolarHBondContact O-N 3.27Å; G463-T466 PolarHBondContact O-OG1 3.4Å
464	P	87.8	Confident	89	Confident	6 Å²	6	50.2 Å²	50.2	4%	0.039	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-62	-22.1	177	-23.9	33.3	0	0	0	114.4	L459 G460 F498 Q501 N502	L459-P464 WeakPolarHBondContact O-CD 3.38Å; G460-P464 WeakPolarHBondContact O-CD 3.48Å; G460-P464 WeakPolarHBondContact O-CG 3.37Å; P464-F498 HydrophobicContact CB-CD1 4.41Å; P464-F498 HydrophobicContact CG-CB 4.49Å; P464-F498 HydrophobicContact CG-CD1 4.09Å; P464-F498 HydrophobicContact CG-CD2 3.75Å; P464-F498 HydrophobicContact CG-CE1 4.23Å; P464-F498 HydrophobicContact CG-CE2 3.91Å; P464-F498 HydrophobicContact CG-CG 3.85Å; P464-F498 HydrophobicContact CG-CZ 4.16Å; P464-Q501 HydrophobicContact CB-CB 3.83Å; P464-Q501 HydrophobicContact CB-CG 3.98Å; P464-N502 PolarHBondContact O-ND2 3.03Å
465	R	85.9	Confident	88.9	Confident	130 Å²	130	47.6 Å²	47.6	49%	0.491	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-91.2	-0.4	-177.3	-60.8	174.8	173.4	-179.2	-8.7	113.1	E462 G463 P769	E462-R465 WeakPolarHBondContact O-CB 3.44Å; E462-R465 PolarHBondContact O-N 3.07Å; E462-R465 VanDerWaalsContact O-N 3.1Å; G463-R465 PolarHBondContact O-N 2.73Å; G463-R465 VanDerWaalsContact O-N 3.16Å; R465-P769 PolarHBondContact NH2-O 3.1Å; R465-P769 VanDerWaalsContact NH2-O 3.12Å
466	T	86.4	Confident	88.7	Confident	13 Å²	13	47.6 Å²	47.6	8%	0.08	23%	0.228	C	C	.	.	S	Bend	trans	-78.9	158.6	178.3	61.8	0	0	0	0	111.6	L436 G463 Q468 P469 Y472	L436-T466 HydrophobicContact CD1-CG2 3.74Å; G463-T466 WeakPolarHBondContact O-CB 3.44Å; G463-T466 PolarHBondContact O-N 3.27Å; G463-T466 PolarHBondContact O-OG1 3.4Å; T466-Q468 PolarHBondContact O-N 2.92Å; T466-P469 VanDerWaalsContact O-CD 3.32Å; T466-P469 WeakPolarHBondContact O-CD 3.46Å; T466-P469 VanDerWaalsContact O-CG 3.29Å; T466-P469 WeakPolarHBondContact O-CG 3.36Å; T466-Y472 HydrophobicContact CG2-CE2 3.91Å; T466-Y472 VanDerWaalsContact OG1-CE2 3.22Å; T466-Y472 WeakPolarHBondContact OG1-CE2 3.35Å
467	P	84.5	Confident	88.4	Confident	109 Å²	109	49.6 Å²	49.6	71%	0.708	24%	0.237	S	C	*	.	S	Bend	trans	-58.5	-29.5	175.3	-25.7	33.9	0	0	0	114.7	E433	E433-P467 VanDerWaalsContact OE1-CD 3.29Å; E433-P467 WeakPolarHBondContact OE1-CD 3.46Å; E433-P467 WeakPolarHBondContact OE1-CG 3.27Å
468	Q	86.8	Confident	88.2	Confident	128 Å²	128	47 Å²	47	60%	0.598	23%	0.227	S	C	*	.			trans	-129.9	74.8	-179.8	-65.9	-174.3	-7.8	0	0	112.2	T466 S470 K471	T466-Q468 PolarHBondContact O-N 2.92Å; Q468-S470 VanDerWaalsContact C-N 3.29Å; Q468-S470 PolarHBondContact O-N 2.92Å; Q468-K471 PolarHBondContact O-N 3.46Å
469	P	87.8	Confident	88.1	Confident	19 Å²	19	47.2 Å²	47.2	12%	0.123	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-27.6	-174.4	-18.6	30.9	0	0	0	113.9	T466 K471 Y472 F498 L505	T466-P469 VanDerWaalsContact O-CD 3.32Å; T466-P469 WeakPolarHBondContact O-CD 3.46Å; T466-P469 VanDerWaalsContact O-CG 3.29Å; T466-P469 WeakPolarHBondContact O-CG 3.36Å; P469-K471 PolarHBondContact O-N 2.9Å; P469-Y472 PolarHBondContact O-N 3.19Å; P469-F498 HydrophobicContact CB-CD1 3.94Å; P469-F498 HydrophobicContact CB-CE1 3.74Å; P469-F498 VanDerWaalsContact O-CE1 3.28Å; P469-F498 WeakPolarHBondContact O-CE1 3.43Å; P469-L505 HydrophobicContact CB-CD1 3.75Å; P469-L505 HydrophobicContact CG-CD1 4.44Å
470	S	87.9	Confident	87.4	Confident	73 Å²	73	47.7 Å²	47.7	51%	0.51	23%	0.23	S	C	.	.	H	α-helix	trans	-59.5	-29.7	-178.3	57.9	0	0	0	0	113.8	Q468 Y472 I473	Q468-S470 VanDerWaalsContact C-N 3.29Å; Q468-S470 PolarHBondContact O-N 2.92Å; S470-Y472 VanDerWaalsContact C-N 3.27Å; S470-Y472 PolarHBondContact O-N 3.43Å; S470-I473 PolarHBondContact O-N 2.74Å
471	K	89.5	Confident	86.7	Confident	104 Å²	104	52.1 Å²	52.1	45%	0.452	26%	0.257	S	S	.	.	H	α-helix	trans	-58.9	-38.4	178.5	-178.1	-177.4	175.6	-172.5	0	112.1	Q468 P469 F475	Q468-K471 PolarHBondContact O-N 3.46Å; P469-K471 PolarHBondContact O-N 2.9Å; K471-F475 HydrophobicContact CG-CE2 4.31Å; K471-F475 VanDerWaalsContact O-CD2 3.28Å; K471-F475 WeakPolarHBondContact O-CD2 3.39Å; K471-F475 WeakPolarHBondContact O-CE2 3.46Å
472	Y	90.6	Very high	86.1	Confident	5 Å²	5	54.3 Å²	54.3	2%	0.02	27%	0.272	C	S	.	.	H	α-helix	trans	-77.8	-27.8	-174.3	-57.2	-75.8	0	0	0	112.9	L436 L459 T466 P469 S470 R474 F475 I476	L436-Y472 HydrophobicContact CB-CD1 4.49Å; L436-Y472 HydrophobicContact CB-CE1 3.66Å; L436-Y472 HydrophobicContact CD1-CE1 4.4Å; L459-Y472 HydrophobicContact CD2-CD1 3.97Å; T466-Y472 HydrophobicContact CG2-CE2 3.91Å; T466-Y472 VanDerWaalsContact OG1-CE2 3.22Å; T466-Y472 WeakPolarHBondContact OG1-CE2 3.35Å; P469-Y472 PolarHBondContact O-N 3.19Å; S470-Y472 VanDerWaalsContact C-N 3.27Å; S470-Y472 PolarHBondContact O-N 3.43Å; Y472-R474 PolarHBondContact O-N 3.11Å; Y472-F475 PolarHBondContact O-N 3.16Å; Y472-F475 VanDerWaalsContact O-N 3.1Å; Y472-I476 WeakPolarHBondContact O-CG1 3.48Å; Y472-I476 PolarHBondContact O-N 3.21Å; Y472-I476 VanDerWaalsContact O-N 3.12Å
473	I	88.7	Confident	85.9	Confident	18 Å²	18	56.4 Å²	56.4	9%	0.092	28%	0.282	C	S	.	.	H	α-helix	trans	-57	-38.2	179.9	-66.6	179.7	0	0	0	111.3	S470 F475 I476 F477 L495 F498 L505 V509 L512	S470-I473 PolarHBondContact O-N 2.74Å; I473-F475 PolarHBondContact O-N 3.49Å; I473-I476 PolarHBondContact O-N 3.19Å; I473-F477 VanDerWaalsContact O-CB 3.29Å; I473-F477 WeakPolarHBondContact O-CB 3.38Å; I473-F477 PolarHBondContact O-N 3.2Å; I473-L495 HydrophobicContact CG2-CD2 3.98Å; I473-F498 HydrophobicContact CD1-CD1 4.28Å; I473-F498 HydrophobicContact CG1-CD1 3.98Å; I473-F498 HydrophobicContact CG1-CE1 4.36Å; I473-F498 HydrophobicContact CG1-CG 4.32Å; I473-L505 HydrophobicContact CD1-CB 4.38Å; I473-L505 HydrophobicContact CD1-CD1 4.05Å; I473-L505 HydrophobicContact CD1-CD2 4.4Å; I473-V509 HydrophobicContact CD1-CG2 4.27Å; I473-L512 HydrophobicContact CG2-CD1 3.7Å
474	R	88.5	Confident	85.9	Confident	150 Å²	150	58.2 Å²	58.2	57%	0.566	29%	0.294	S	S	*	.	H	α-helix	trans	-59.2	-47	177.7	-169.8	-171.5	81.9	148.1	8.8	111.9	E444 Y472 F477 N478	E444-R474 IonicContact OE1-NH2 3.17Å; Y472-R474 PolarHBondContact O-N 3.11Å; R474-F477 PolarHBondContact O-N 3.42Å; R474-N478 VanDerWaalsContact O-CG 3.28Å; R474-N478 PolarHBondContact O-N 3.43Å; R474-N478 VanDerWaalsContact O-N 3.1Å; R474-N478 PolarHBondContact O-OD1 2.77Å
475	F	89.4	Confident	86	Confident	27 Å²	27	63 Å²	63	12%	0.118	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-40.9	-179.3	-63.8	-84.7	0	0	0	111.3	C440 E444 K471 Y472 I473 R479	C440-F475 HydrophobicContact CB-CB 4.24Å; C440-F475 HydrophobicContact CB-CD1 3.78Å; C440-F475 HydrophobicContact CB-CD2 4.04Å; C440-F475 HydrophobicContact CB-CE1 4.08Å; C440-F475 HydrophobicContact CB-CE2 4.33Å; C440-F475 HydrophobicContact CB-CG 3.76Å; C440-F475 HydrophobicContact CB-CZ 4.34Å; E444-F475 HydrophobicContact CG-CD1 4.05Å; E444-F475 HydrophobicContact CG-CE1 4.42Å; E444-F475 WeakPolarHBondContact OE1-CD1 3.27Å; E444-F475 WeakPolarHBondContact OE1-CE1 3.38Å; K471-F475 HydrophobicContact CG-CE2 4.31Å; K471-F475 VanDerWaalsContact O-CD2 3.28Å; K471-F475 WeakPolarHBondContact O-CD2 3.39Å; K471-F475 WeakPolarHBondContact O-CE2 3.46Å; Y472-F475 PolarHBondContact O-N 3.16Å; Y472-F475 VanDerWaalsContact O-N 3.1Å; I473-F475 PolarHBondContact O-N 3.49Å; F475-R479 WeakPolarHBondContact O-CG 3.26Å
476	I	90.2	Very high	86.2	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-66.5	-45.6	177.3	-61	167.1	0	0	0	110.7	L456 L459 Y472 I473 N478 R479 A491 A494 L495 F498	L456-I476 HydrophobicContact CD2-CB 4.38Å; L456-I476 HydrophobicContact CD2-CG1 4.08Å; L456-I476 HydrophobicContact CD2-CG2 4.15Å; L459-I476 HydrophobicContact CB-CD1 4.29Å; L459-I476 HydrophobicContact CD1-CG1 4.3Å; Y472-I476 WeakPolarHBondContact O-CG1 3.48Å; Y472-I476 PolarHBondContact O-N 3.21Å; Y472-I476 VanDerWaalsContact O-N 3.12Å; I473-I476 PolarHBondContact O-N 3.19Å; I476-N478 PolarHBondContact O-N 3.05Å; I476-R479 WeakPolarHBondContact O-CB 3.38Å; I476-R479 PolarHBondContact O-N 2.97Å; I476-A491 HydrophobicContact CG2-CB 3.8Å; I476-A491 WeakPolarHBondContact CG2-O 3.19Å; I476-A494 HydrophobicContact CD1-CB 4.2Å; I476-A494 HydrophobicContact CG2-CB 4.19Å; I476-L495 HydrophobicContact CB-CD2 4.29Å; I476-L495 HydrophobicContact CG2-CD1 4.39Å; I476-L495 HydrophobicContact CG2-CD2 3.91Å; I476-L495 HydrophobicContact CG2-CG 3.72Å; I476-F498 HydrophobicContact CD1-CD2 4.1Å; I476-F498 HydrophobicContact CD1-CE2 3.51Å; I476-F498 HydrophobicContact CD1-CZ 4.08Å
477	F	86.2	Confident	86.4	Confident	43 Å²	43	58.5 Å²	58.5	19%	0.189	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-38.1	-176.8	-179	-109.1	0	0	0	112.9	I473 R474 R479 V480 V481 L512	I473-F477 VanDerWaalsContact O-CB 3.29Å; I473-F477 WeakPolarHBondContact O-CB 3.38Å; I473-F477 PolarHBondContact O-N 3.2Å; R474-F477 PolarHBondContact O-N 3.42Å; F477-R479 PolarHBondContact O-N 3.38Å; F477-V480 HydrophobicContact CD2-CB 4.47Å; F477-V480 WeakPolarHBondContact O-CB 3.47Å; F477-V480 PolarHBondContact O-N 3.11Å; F477-V481 HydrophobicContact CE1-CG2 4.49Å; F477-V481 HydrophobicContact CZ-CG2 4.28Å; F477-L512 HydrophobicContact CB-CD1 4.41Å; F477-L512 HydrophobicContact CD1-CD2 4.47Å; F477-L512 HydrophobicContact CD2-CB 4.25Å; F477-L512 HydrophobicContact CD2-CD1 4.07Å; F477-L512 HydrophobicContact CD2-CD2 3.7Å; F477-L512 HydrophobicContact CD2-CG 4.2Å; F477-L512 HydrophobicContact CE1-CD2 4.41Å; F477-L512 HydrophobicContact CE2-CB 4.36Å; F477-L512 HydrophobicContact CE2-CD2 3.64Å; F477-L512 HydrophobicContact CE2-CG 4.44Å; F477-L512 HydrophobicContact CG-CD1 4.32Å; F477-L512 HydrophobicContact CG-CD2 4.14Å; F477-L512 HydrophobicContact CZ-CD2 4.01Å
478	N	86.9	Confident	86.8	Confident	57 Å²	57	54.8 Å²	54.8	31%	0.305	28%	0.28	S	S	.	.	H	α-helix	trans	-58.3	-31.6	176.7	-73.2	-7.8	0	0	0	112.3	R474 I476 V481	R474-N478 VanDerWaalsContact O-CG 3.28Å; R474-N478 PolarHBondContact O-N 3.43Å; R474-N478 VanDerWaalsContact O-N 3.1Å; R474-N478 PolarHBondContact O-OD1 2.77Å; I476-N478 PolarHBondContact O-N 3.05Å; N478-V481 PolarHBondContact O-N 3.29Å
479	R	87.8	Confident	87	Confident	13 Å²	13	48.8 Å²	48.8	5%	0.049	25%	0.252	C	S	.	.	H	α-helix	trans	-73.3	-27.2	176.8	-58	-72.5	80.4	78.4	-14.7	113.2	I443 E444 F475 I476 F477 V481 E483 V487 R488	I443-R479 HydrophobicContact CD1-CG 4.46Å; I443-R479 VanDerWaalsContact O-CD 3.25Å; I443-R479 WeakPolarHBondContact O-CD 3.35Å; I443-R479 VanDerWaalsContact O-CZ 3.29Å; I443-R479 PolarHBondContact O-NE 3.09Å; I443-R479 PolarHBondContact O-NH1 3.26Å; E444-R479 PolarHBondContact O-NH2 2.85Å; F475-R479 WeakPolarHBondContact O-CG 3.26Å; I476-R479 WeakPolarHBondContact O-CB 3.38Å; I476-R479 PolarHBondContact O-N 2.97Å; F477-R479 PolarHBondContact O-N 3.38Å; R479-V481 PolarHBondContact O-N 3.45Å; R479-E483 HydrophobicContact CB-CG 4.01Å; R479-E483 IonicContact CZ-OE1 2.81Å; R479-E483 IonicContact NE-OE1 3.61Å; R479-E483 PolarHBondContact NE-OE1 3.46Å; R479-E483 IonicContact NH2-OE1 2.91Å; R479-E483 VanDerWaalsContact O-CB 3.29Å; R479-E483 WeakPolarHBondContact O-CB 3.26Å; R479-E483 WeakPolarHBondContact O-CG 3.28Å; R479-V487 HydrophobicContact CB-CG1 4.16Å; R479-R488 WeakPolarHBondContact O-CG 3.28Å
480	V	78.6	Confident	87.2	Confident	10 Å²	10	48.7 Å²	48.7	6%	0.061	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-25.4	176	177.6	0	0	0	0	111.7	F477 R488 A491 L495 C516	F477-V480 HydrophobicContact CD2-CB 4.47Å; F477-V480 WeakPolarHBondContact O-CB 3.47Å; F477-V480 PolarHBondContact O-N 3.11Å; V480-R488 WeakPolarHBondContact O-CD 3.28Å; V480-R488 WeakPolarHBondContact O-CG 3.45Å; V480-A491 HydrophobicContact CG2-CB 3.57Å; V480-L495 HydrophobicContact CG2-CD1 4.32Å; V480-C516 VanDerWaalsContact CG1-SG 3.54Å
481	V	74	Confident	87.4	Confident	95 Å²	95	45.2 Å²	45.2	58%	0.576	23%	0.229	S	C	*	.	H	α-helix	trans	-97.1	-34.8	-174.1	-177.8	0	0	0	0	112.9	F477 N478 R479	F477-V481 HydrophobicContact CE1-CG2 4.49Å; F477-V481 HydrophobicContact CZ-CG2 4.28Å; N478-V481 PolarHBondContact O-N 3.29Å; R479-V481 PolarHBondContact O-N 3.45Å
482	L	74	Confident	87.6	Confident	134 Å²	134	40.3 Å²	40.3	70%	0.702	21%	0.208	S	C	*	.	H	α-helix	trans	-109.6	-3.6	-162.4	-62.9	173.5	0	0	0	114.6
483	E	84.1	Confident	87.7	Confident	50 Å²	50	41.1 Å²	41.1	23%	0.234	21%	0.214	C	C	.	.	S	Bend	trans	-116.7	169.8	-167	-60.5	-72	170.3	0	0	113.8	R479 V487 R488	R479-E483 HydrophobicContact CB-CG 4.01Å; R479-E483 IonicContact CZ-OE1 2.81Å; R479-E483 IonicContact NE-OE1 3.61Å; R479-E483 PolarHBondContact NE-OE1 3.46Å; R479-E483 IonicContact NH2-OE1 2.91Å; R479-E483 VanDerWaalsContact O-CB 3.29Å; R479-E483 WeakPolarHBondContact O-CB 3.26Å; R479-E483 WeakPolarHBondContact O-CG 3.28Å; E483-V487 HydrophobicContact CB-CB 3.77Å; E483-V487 HydrophobicContact CB-CG1 3.75Å; E483-V487 HydrophobicContact CB-CG2 4.48Å; E483-V487 HydrophobicContact CG-CB 4.4Å; E483-V487 HydrophobicContact CG-CG1 3.86Å; E483-R488 HydrophobicContact CB-CG 4.39Å; E483-R488 VanDerWaalsContact O-CD 3.25Å; E483-R488 WeakPolarHBondContact O-CD 3.47Å; E483-R488 WeakPolarHBondContact O-CG 3.44Å; E483-R488 PolarHBondContact O-NE 3.11Å
484	S	88.3	Confident	87.9	Confident	39 Å²	39	40.4 Å²	40.4	27%	0.273	21%	0.211	S	C	.	.			trans	-55.5	153	170.4	63.2	0	0	0	0	113.2	A486 V487 R488	S484-A486 VanDerWaalsContact C-N 3.28Å; S484-A486 PolarHBondContact O-N 2.96Å; S484-V487 PolarHBondContact O-N 3.4Å; S484-V487 WeakPolarHBondContact OG-CG2 3.44Å; S484-R488 WeakPolarHBondContact O-CG 3.34Å; S484-R488 PolarHBondContact O-N 2.86Å
485	E	90.1	Very high	88.1	Confident	105 Å²	105	33.2 Å²	33.2	49%	0.491	18%	0.184	S	C	.	.	H	α-helix	trans	-46.6	-45.6	177.7	56.6	-80	-177.3	0	0	113.3	V487 R488 A489 D521	E485-V487 VanDerWaalsContact C-N 3.33Å; E485-V487 PolarHBondContact O-N 3.14Å; E485-R488 PolarHBondContact O-N 3.14Å; E485-A489 WeakPolarHBondContact O-CB 3.36Å; E485-A489 PolarHBondContact O-N 3.36Å; E485-D521 HydrophobicContact CB-CB 4.15Å
486	A	89.9	Confident	88.2	Confident	49 Å²	49	32 Å²	32	41%	0.405	18%	0.178	S	C	.	.	H	α-helix	trans	-62.8	-35	179.6	0	0	0	0	0	113.6	T449 T453 S484 A490	T449-A486 HydrophobicContact CG2-CB 4.04Å; T453-A486 WeakPolarHBondContact CG2-O 3.21Å; S484-A486 VanDerWaalsContact C-N 3.28Å; S484-A486 PolarHBondContact O-N 2.96Å; A486-A490 PolarHBondContact O-N 2.87Å
487	V	91.3	Very high	88.2	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.006	18%	0.184	C	C	.	.	H	α-helix	trans	-76.4	-42.1	177.7	178.4	0	0	0	0	110.3	T449 A452 T453 L456 R479 E483 S484 E485 A489 A490 A491	T449-V487 HydrophobicContact CG2-CG2 3.79Å; A452-V487 HydrophobicContact CB-CG1 4.2Å; A452-V487 HydrophobicContact CB-CG2 4.01Å; T453-V487 HydrophobicContact CG2-CG2 4.17Å; L456-V487 HydrophobicContact CD1-CG1 3.62Å; L456-V487 WeakPolarHBondContact CD1-O 3.35Å; R479-V487 HydrophobicContact CB-CG1 4.16Å; E483-V487 HydrophobicContact CB-CB 3.77Å; E483-V487 HydrophobicContact CB-CG1 3.75Å; E483-V487 HydrophobicContact CB-CG2 4.48Å; E483-V487 HydrophobicContact CG-CB 4.4Å; E483-V487 HydrophobicContact CG-CG1 3.86Å; S484-V487 PolarHBondContact O-N 3.4Å; S484-V487 WeakPolarHBondContact OG-CG2 3.44Å; E485-V487 VanDerWaalsContact C-N 3.33Å; E485-V487 PolarHBondContact O-N 3.14Å; V487-A489 VanDerWaalsContact C-N 3.31Å; V487-A489 PolarHBondContact O-N 3.37Å; V487-A490 PolarHBondContact O-N 3.39Å; V487-A491 WeakPolarHBondContact O-CB 2.98Å; V487-A491 PolarHBondContact O-N 3.22Å
488	R	92.8	Very high	88.5	Confident	30 Å²	30	31.2 Å²	31.2	11%	0.113	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-44.5	175.9	-63.9	-170.5	-69.2	152.8	11.3	111.2	R479 V480 E483 S484 E485 A490 A491 V492 D519 V524	R479-R488 WeakPolarHBondContact O-CG 3.28Å; V480-R488 WeakPolarHBondContact O-CD 3.28Å; V480-R488 WeakPolarHBondContact O-CG 3.45Å; E483-R488 HydrophobicContact CB-CG 4.39Å; E483-R488 VanDerWaalsContact O-CD 3.25Å; E483-R488 WeakPolarHBondContact O-CD 3.47Å; E483-R488 WeakPolarHBondContact O-CG 3.44Å; E483-R488 PolarHBondContact O-NE 3.11Å; S484-R488 WeakPolarHBondContact O-CG 3.34Å; S484-R488 PolarHBondContact O-N 2.86Å; E485-R488 PolarHBondContact O-N 3.14Å; R488-A490 PolarHBondContact O-N 3.44Å; R488-A491 WeakPolarHBondContact O-CB 3.47Å; R488-A491 PolarHBondContact O-N 3Å; R488-V492 WeakPolarHBondContact O-CG2 3.46Å; R488-V492 PolarHBondContact O-N 3.03Å; R488-D519 IonicContact CZ-OD1 3.69Å; R488-D519 IonicContact CZ-OD2 2.61Å; R488-D519 IonicContact NH1-OD1 2.92Å; R488-D519 PolarHBondContact NH1-OD1 3.4Å; R488-D519 IonicContact NH1-OD2 2.83Å; R488-D519 PolarHBondContact NH1-OD2 3.28Å; R488-D519 IonicContact NH2-OD1 2.61Å; R488-D519 PolarHBondContact NH2-OD1 2.66Å; R488-V524 HydrophobicContact CB-CG1 4.33Å; R488-V524 HydrophobicContact CB-CG2 3.97Å
489	A	91.2	Very high	88.5	Confident	2 Å²	2	28.5 Å²	28.5	2%	0.017	16%	0.161	C	C	.	.	H	α-helix	trans	-55.6	-46.8	173.6	0	0	0	0	0	113.1	E485 V487 V492 S493 E523 V524 R527	E485-A489 WeakPolarHBondContact O-CB 3.36Å; E485-A489 PolarHBondContact O-N 3.36Å; V487-A489 VanDerWaalsContact C-N 3.31Å; V487-A489 PolarHBondContact O-N 3.37Å; A489-V492 PolarHBondContact O-N 3.26Å; A489-S493 PolarHBondContact O-N 3.22Å; A489-E523 WeakPolarHBondContact CB-OE1 3.47Å; A489-E523 WeakPolarHBondContact CB-OE2 3.05Å; A489-V524 HydrophobicContact CB-CG2 4.11Å; A489-R527 WeakPolarHBondContact O-CD 3.24Å; A489-R527 PolarHBondContact O-NH1 3.45Å
490	A	91.4	Very high	88.5	Confident	18 Å²	18	28.4 Å²	28.4	15%	0.149	16%	0.163	C	C	.	.	H	α-helix	trans	-67.2	-37.1	176	0	0	0	0	0	112.4	T453 L456 A486 V487 R488 S493 A494	T453-A490 HydrophobicContact CG2-CB 3.98Å; L456-A490 HydrophobicContact CB-CB 4.26Å; L456-A490 HydrophobicContact CD1-CB 4.12Å; A486-A490 PolarHBondContact O-N 2.87Å; V487-A490 PolarHBondContact O-N 3.39Å; R488-A490 PolarHBondContact O-N 3.44Å; A490-S493 PolarHBondContact O-N 3.47Å; A490-A494 PolarHBondContact O-N 3.31Å
491	A	92.7	Very high	88.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-64.9	-39.5	176.5	0	0	0	0	0	111.8	L456 I476 V480 V487 R488 A494 L495	L456-A491 HydrophobicContact CD1-CB 4.06Å; L456-A491 HydrophobicContact CD2-CB 4.32Å; I476-A491 HydrophobicContact CG2-CB 3.8Å; I476-A491 WeakPolarHBondContact CG2-O 3.19Å; V480-A491 HydrophobicContact CG2-CB 3.57Å; V487-A491 WeakPolarHBondContact O-CB 2.98Å; V487-A491 PolarHBondContact O-N 3.22Å; R488-A491 WeakPolarHBondContact O-CB 3.47Å; R488-A491 PolarHBondContact O-N 3Å; A491-A494 PolarHBondContact O-N 3.42Å; A491-L495 WeakPolarHBondContact O-CG 3.48Å; A491-L495 PolarHBondContact O-N 2.86Å
492	V	93.4	Very high	89.4	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-60.8	-46.6	173.5	171.9	0	0	0	0	111.1	R488 A489 A494 L495 A496 M513 C516 V524 R527 A528 Y531	R488-V492 WeakPolarHBondContact O-CG2 3.46Å; R488-V492 PolarHBondContact O-N 3.03Å; A489-V492 PolarHBondContact O-N 3.26Å; V492-A494 VanDerWaalsContact C-N 3.32Å; V492-A494 PolarHBondContact O-N 3.3Å; V492-L495 PolarHBondContact O-N 3.47Å; V492-A496 PolarHBondContact O-N 3.41Å; V492-M513 HydrophobicContact CG1-CE 3.79Å; V492-M513 WeakPolarHBondContact O-CE 3.49Å; V492-C516 HydrophobicContact CG2-CB 4.06Å; V492-V524 HydrophobicContact CG2-CG1 3.98Å; V492-R527 HydrophobicContact CG1-CB 4.47Å; V492-R527 HydrophobicContact CG1-CG 3.95Å; V492-A528 HydrophobicContact CG1-CB 3.97Å; V492-Y531 HydrophobicContact CG1-CD2 4.09Å
493	S	92.2	Very high	89.9	Confident	22 Å²	22	27.6 Å²	27.6	15%	0.154	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-39.2	173.6	-71.7	0	0	0	0	112.8	A489 A490 A496 K497 R527 Y531	A489-S493 PolarHBondContact O-N 3.22Å; A490-S493 PolarHBondContact O-N 3.47Å; S493-A496 WeakPolarHBondContact O-CB 3.18Å; S493-A496 PolarHBondContact O-N 2.89Å; S493-K497 PolarHBondContact O-N 2.97Å; S493-R527 WeakPolarHBondContact OG-CD 3.5Å; S493-Y531 WeakPolarHBondContact OG-CE2 3.45Å; S493-Y531 PolarHBondContact OG-OH 3.03Å
494	A	92.5	Very high	90	Very high	3 Å²	3	32.6 Å²	32.6	3%	0.025	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-48.2	176.6	0	0	0	0	0	111	L456 I476 A490 A491 V492 A496 K497 F498	L456-A494 WeakPolarHBondContact O-CB 3.07Å; I476-A494 HydrophobicContact CD1-CB 4.2Å; I476-A494 HydrophobicContact CG2-CB 4.19Å; A490-A494 PolarHBondContact O-N 3.31Å; A491-A494 PolarHBondContact O-N 3.42Å; V492-A494 VanDerWaalsContact C-N 3.32Å; V492-A494 PolarHBondContact O-N 3.3Å; A494-A496 VanDerWaalsContact C-N 3.28Å; A494-A496 PolarHBondContact O-N 3.12Å; A494-K497 WeakPolarHBondContact O-CB 3.5Å; A494-K497 PolarHBondContact O-N 3.49Å; A494-K497 VanDerWaalsContact O-N 3.13Å; A494-F498 WeakPolarHBondContact O-CD2 3.38Å; A494-F498 PolarHBondContact O-N 2.92Å
495	L	92.7	Very high	90	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-57.8	-39.5	175.9	-71.7	174.2	0	0	0	112.2	I473 I476 V480 A491 V492 K497 F498 G499 V509 L512 M513	I473-L495 HydrophobicContact CG2-CD2 3.98Å; I476-L495 HydrophobicContact CB-CD2 4.29Å; I476-L495 HydrophobicContact CG2-CD1 4.39Å; I476-L495 HydrophobicContact CG2-CD2 3.91Å; I476-L495 HydrophobicContact CG2-CG 3.72Å; V480-L495 HydrophobicContact CG2-CD1 4.32Å; A491-L495 WeakPolarHBondContact O-CG 3.48Å; A491-L495 PolarHBondContact O-N 2.86Å; V492-L495 PolarHBondContact O-N 3.47Å; L495-K497 VanDerWaalsContact C-N 3.29Å; L495-K497 PolarHBondContact O-N 3.35Å; L495-F498 WeakPolarHBondContact O-CB 3.4Å; L495-F498 PolarHBondContact O-N 3.08Å; L495-F498 VanDerWaalsContact O-N 3.14Å; L495-G499 PolarHBondContact O-N 3.2Å; L495-V509 HydrophobicContact CB-CG1 4.33Å; L495-V509 WeakPolarHBondContact O-CG1 3.41Å; L495-L512 HydrophobicContact CD1-CB 4.43Å; L495-L512 HydrophobicContact CD1-CD1 4.49Å; L495-L512 HydrophobicContact CD2-CD1 4.31Å; L495-M513 HydrophobicContact CB-CE 4.34Å
496	A	91.6	Very high	89.9	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-56.5	-44.4	176.7	0	0	0	0	0	111.7	V492 S493 A494 F498 G499 A500 M513 Y531 I547	V492-A496 PolarHBondContact O-N 3.41Å; S493-A496 WeakPolarHBondContact O-CB 3.18Å; S493-A496 PolarHBondContact O-N 2.89Å; A494-A496 VanDerWaalsContact C-N 3.28Å; A494-A496 PolarHBondContact O-N 3.12Å; A496-F498 PolarHBondContact O-N 3.16Å; A496-G499 PolarHBondContact O-N 3.41Å; A496-A500 VanDerWaalsContact O-CB 3.27Å; A496-A500 WeakPolarHBondContact O-CB 3.12Å; A496-A500 PolarHBondContact O-N 3.19Å; A496-M513 HydrophobicContact CB-CE 3.66Å; A496-Y531 HydrophobicContact CB-CD1 3.93Å; A496-Y531 HydrophobicContact CB-CD2 3.62Å; A496-Y531 HydrophobicContact CB-CE1 4.35Å; A496-Y531 HydrophobicContact CB-CE2 4.05Å; A496-Y531 HydrophobicContact CB-CG 3.54Å; A496-I547 HydrophobicContact CB-CG2 3.99Å
497	K	90.8	Very high	90	Very high	27 Å²	27	29.1 Å²	29.1	12%	0.117	16%	0.16	C	C	.	.	H	α-helix	trans	-64.1	-37.1	177.6	-66.8	177.2	-179.5	-174.9	0	112.6	G460 S493 A494 L495 A500 Q501 I547 F548	G460-K497 VanDerWaalsContact O-CB 3.24Å; G460-K497 WeakPolarHBondContact O-CB 3.49Å; G460-K497 VanDerWaalsContact O-CD 3.3Å; G460-K497 WeakPolarHBondContact O-CD 3.4Å; S493-K497 PolarHBondContact O-N 2.97Å; A494-K497 WeakPolarHBondContact O-CB 3.5Å; A494-K497 PolarHBondContact O-N 3.49Å; A494-K497 VanDerWaalsContact O-N 3.13Å; L495-K497 VanDerWaalsContact C-N 3.29Å; L495-K497 PolarHBondContact O-N 3.35Å; K497-A500 PolarHBondContact O-N 3.31Å; K497-Q501 WeakPolarHBondContact O-CB 3.16Å; K497-Q501 PolarHBondContact O-N 3.16Å; K497-Q501 VanDerWaalsContact O-N 3.12Å; K497-I547 HydrophobicContact CB-CG2 4.46Å; K497-I547 HydrophobicContact CG-CG2 3.8Å; K497-F548 HydrophobicContact CB-CE1 4.19Å; K497-F548 HydrophobicContact CG-CD1 4.39Å; K497-F548 HydrophobicContact CG-CE1 4.31Å
498	F	91.4	Very high	89.8	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.8	-45.5	173.4	-83.5	-100.1	0	0	0	111.9	L459 P464 P469 I473 I476 A494 L495 A496 A500 N502 V509	L459-F498 WeakPolarHBondContact O-CE2 3.18Å; P464-F498 HydrophobicContact CB-CD1 4.41Å; P464-F498 HydrophobicContact CG-CB 4.49Å; P464-F498 HydrophobicContact CG-CD1 4.09Å; P464-F498 HydrophobicContact CG-CD2 3.75Å; P464-F498 HydrophobicContact CG-CE1 4.23Å; P464-F498 HydrophobicContact CG-CE2 3.91Å; P464-F498 HydrophobicContact CG-CG 3.85Å; P464-F498 HydrophobicContact CG-CZ 4.16Å; P469-F498 HydrophobicContact CB-CD1 3.94Å; P469-F498 HydrophobicContact CB-CE1 3.74Å; P469-F498 VanDerWaalsContact O-CE1 3.28Å; P469-F498 WeakPolarHBondContact O-CE1 3.43Å; I473-F498 HydrophobicContact CD1-CD1 4.28Å; I473-F498 HydrophobicContact CG1-CD1 3.98Å; I473-F498 HydrophobicContact CG1-CE1 4.36Å; I473-F498 HydrophobicContact CG1-CG 4.32Å; I476-F498 HydrophobicContact CD1-CD2 4.1Å; I476-F498 HydrophobicContact CD1-CE2 3.51Å; I476-F498 HydrophobicContact CD1-CZ 4.08Å; A494-F498 WeakPolarHBondContact O-CD2 3.38Å; A494-F498 PolarHBondContact O-N 2.92Å; L495-F498 WeakPolarHBondContact O-CB 3.4Å; L495-F498 PolarHBondContact O-N 3.08Å; L495-F498 VanDerWaalsContact O-N 3.14Å; A496-F498 PolarHBondContact O-N 3.16Å; F498-A500 VanDerWaalsContact C-N 3.33Å; F498-N502 PolarHBondContact O-N 3.42Å; F498-N502 VanDerWaalsContact O-N 3.11Å; F498-V509 HydrophobicContact CB-CG2 4.41Å
499	G	88.7	Confident	89.8	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.01	18%	0.177	C	C	.	.	H	α-helix	trans	-67.6	-33	178.2	0	0	0	0	0	113.2	L495 A496	L495-G499 PolarHBondContact O-N 3.2Å; A496-G499 PolarHBondContact O-N 3.41Å
500	A	87.6	Confident	89.8	Confident	11 Å²	11	32.3 Å²	32.3	9%	0.091	19%	0.185	C	C	.	.	H	α-helix	trans	-74.7	-31.7	179.9	0	0	0	0	0	113.7	A496 K497 F498 L535 N543 I547 F548	A496-A500 VanDerWaalsContact O-CB 3.27Å; A496-A500 WeakPolarHBondContact O-CB 3.12Å; A496-A500 PolarHBondContact O-N 3.19Å; K497-A500 PolarHBondContact O-N 3.31Å; F498-A500 VanDerWaalsContact C-N 3.33Å; A500-L535 HydrophobicContact CB-CD2 3.83Å; A500-N543 HydrophobicContact CB-CB 4.04Å; A500-I547 HydrophobicContact CB-CB 4.43Å; A500-I547 HydrophobicContact CB-CD1 3.89Å; A500-I547 HydrophobicContact CB-CG2 4.03Å; A500-F548 HydrophobicContact CB-CE1 4.29Å; A500-F548 HydrophobicContact CB-CE2 3.66Å; A500-F548 HydrophobicContact CB-CZ 3.43Å; A500-F548 VanDerWaalsContact CB-CZ 3.43Å
501	Q	85.4	Confident	89.7	Confident	76 Å²	76	35 Å²	35	36%	0.355	20%	0.199	S	C	.	.	H	α-helix	trans	-91.2	-33.4	-176.7	-167.7	69.3	32.8	0	0	112.7	P464 K497 F548	P464-Q501 HydrophobicContact CB-CB 3.83Å; P464-Q501 HydrophobicContact CB-CG 3.98Å; K497-Q501 WeakPolarHBondContact O-CB 3.16Å; K497-Q501 PolarHBondContact O-N 3.16Å; K497-Q501 VanDerWaalsContact O-N 3.12Å; Q501-F548 HydrophobicContact CB-CE1 4.46Å; Q501-F548 HydrophobicContact CB-CZ 3.95Å; Q501-F548 VanDerWaalsContact OE1-CZ 3.29Å
502	N	85.1	Confident	89.5	Confident	40 Å²	40	36 Å²	36	21%	0.214	21%	0.205	C	C	.	.			trans	-119.9	102.6	-172	-66.9	-46.5	0	0	0	111.4	P464 F498 D504 L505 L506	P464-N502 PolarHBondContact O-ND2 3.03Å; F498-N502 PolarHBondContact O-N 3.42Å; F498-N502 VanDerWaalsContact O-N 3.11Å; N502-D504 VanDerWaalsContact C-N 3.26Å; N502-D504 PolarHBondContact O-N 3.33Å; N502-L505 HydrophobicContact CB-CB 4.17Å; N502-L505 HydrophobicContact CB-CD1 3.95Å; N502-L505 HydrophobicContact CB-CG 4.14Å; N502-L505 PolarHBondContact O-N 3.27Å; N502-L505 VanDerWaalsContact O-N 3.07Å; N502-L506 PolarHBondContact O-N 3.48Å
503	D	83.7	Confident	89.3	Confident	106 Å²	106	36 Å²	36	57%	0.567	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-33.2	-178.4	-70.5	-31.2	0	0	0	113	L505 L506	D503-L505 VanDerWaalsContact C-N 3.29Å; D503-L505 PolarHBondContact O-N 2.75Å; D503-L506 WeakPolarHBondContact O-CB 3.34Å; D503-L506 PolarHBondContact O-N 2.84Å
504	D	86.4	Confident	89.3	Confident	155 Å²	155	40.5 Å²	40.5	83%	0.829	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-29.6	178.1	-66.9	-30.1	0	0	0	112.9	N502	N502-D504 VanDerWaalsContact C-N 3.26Å; N502-D504 PolarHBondContact O-N 3.33Å
505	L	88.6	Confident	89	Confident	29 Å²	29	47.9 Å²	47.9	15%	0.152	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-16.8	-178.4	-61.6	176.7	0	0	0	112.4	P469 I473 N502 D503 S508 V509	P469-L505 HydrophobicContact CB-CD1 3.75Å; P469-L505 HydrophobicContact CG-CD1 4.44Å; I473-L505 HydrophobicContact CD1-CB 4.38Å; I473-L505 HydrophobicContact CD1-CD1 4.05Å; I473-L505 HydrophobicContact CD1-CD2 4.4Å; N502-L505 HydrophobicContact CB-CB 4.17Å; N502-L505 HydrophobicContact CB-CD1 3.95Å; N502-L505 HydrophobicContact CB-CG 4.14Å; N502-L505 PolarHBondContact O-N 3.27Å; N502-L505 VanDerWaalsContact O-N 3.07Å; D503-L505 VanDerWaalsContact C-N 3.29Å; D503-L505 PolarHBondContact O-N 2.75Å; L505-S508 WeakPolarHBondContact O-CB 3.38Å; L505-S508 PolarHBondContact O-N 3.22Å; L505-V509 PolarHBondContact O-N 3.44Å
506	L	89.1	Confident	88.9	Confident	11 Å²	11	48 Å²	48	6%	0.058	25%	0.251	C	S	.	.	H	α-helix	trans	-50.9	-47.3	-178.3	176.1	65.6	0	0	0	113.5	N502 D503 S508 V509 L510 L535 K538	N502-L506 PolarHBondContact O-N 3.48Å; D503-L506 WeakPolarHBondContact O-CB 3.34Å; D503-L506 PolarHBondContact O-N 2.84Å; L506-S508 VanDerWaalsContact C-N 3.28Å; L506-S508 PolarHBondContact O-N 2.98Å; L506-V509 PolarHBondContact O-N 3.1Å; L506-L510 HydrophobicContact CD1-CD1 4.09Å; L506-L510 HydrophobicContact CD1-CD2 4.41Å; L506-L510 HydrophobicContact CD1-CG 3.98Å; L506-L510 HydrophobicContact CG-CD1 4.08Å; L506-L510 HydrophobicContact CG-CG 4.39Å; L506-L510 WeakPolarHBondContact O-CG 3.41Å; L506-L510 PolarHBondContact O-N 2.84Å; L506-L535 HydrophobicContact CD1-CB 3.94Å; L506-L535 HydrophobicContact CD1-CD1 4.37Å; L506-L535 HydrophobicContact CD1-CD2 4.11Å; L506-L535 HydrophobicContact CD1-CG 4.38Å; L506-K538 HydrophobicContact CD2-CG 4.27Å
507	P	90.4	Very high	88.8	Confident	79 Å²	79	51 Å²	51	51%	0.513	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-38.5	178.9	-22.9	34.1	0	0	0	112.7	V511	P507-V511 WeakPolarHBondContact O-CG2 3.25Å; P507-V511 PolarHBondContact O-N 2.83Å
508	S	89.1	Confident	88.7	Confident	67 Å²	67	57.5 Å²	57.5	47%	0.469	30%	0.298	S	S	.	.	H	α-helix	trans	-68.8	-44.7	178.3	-60.5	0	0	0	0	110.9	L505 L506 L510 V511 L512	L505-S508 WeakPolarHBondContact O-CB 3.38Å; L505-S508 PolarHBondContact O-N 3.22Å; L506-S508 VanDerWaalsContact C-N 3.28Å; L506-S508 PolarHBondContact O-N 2.98Å; S508-L510 PolarHBondContact O-N 3.19Å; S508-V511 PolarHBondContact O-N 2.85Å; S508-L512 WeakPolarHBondContact O-CG 3.37Å; S508-L512 PolarHBondContact O-N 3.32Å
509	V	90.9	Very high	88.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61.8	-41.7	178	171.5	0	0	0	0	111.6	I473 L495 F498 L505 L506 V511 L512 M513 L535	I473-V509 HydrophobicContact CD1-CG2 4.27Å; L495-V509 HydrophobicContact CB-CG1 4.33Å; L495-V509 WeakPolarHBondContact O-CG1 3.41Å; F498-V509 HydrophobicContact CB-CG2 4.41Å; L505-V509 PolarHBondContact O-N 3.44Å; L506-V509 PolarHBondContact O-N 3.1Å; V509-V511 VanDerWaalsContact C-N 3.33Å; V509-V511 PolarHBondContact O-N 3.39Å; V509-L512 PolarHBondContact O-N 3.5Å; V509-L512 VanDerWaalsContact O-N 3.12Å; V509-M513 HydrophobicContact CG1-CG 4.24Å; V509-M513 WeakPolarHBondContact O-CG 3.39Å; V509-M513 PolarHBondContact O-N 2.82Å; V509-L535 HydrophobicContact CG1-CD1 4.3Å
510	L	91.4	Very high	88.8	Confident	33 Å²	33	63 Å²	63	17%	0.173	34%	0.335	C	S	.	.	H	α-helix	trans	-60.6	-40.2	177.7	-72.9	173.8	0	0	0	112.3	L506 S508 L512 M513 Q514 M532 L535 Q536	L506-L510 HydrophobicContact CD1-CD1 4.09Å; L506-L510 HydrophobicContact CD1-CD2 4.41Å; L506-L510 HydrophobicContact CD1-CG 3.98Å; L506-L510 HydrophobicContact CG-CD1 4.08Å; L506-L510 HydrophobicContact CG-CG 4.39Å; L506-L510 WeakPolarHBondContact O-CG 3.41Å; L506-L510 PolarHBondContact O-N 2.84Å; S508-L510 PolarHBondContact O-N 3.19Å; L510-L512 VanDerWaalsContact C-N 3.32Å; L510-L512 PolarHBondContact O-N 3.45Å; L510-M513 PolarHBondContact O-N 3.49Å; L510-Q514 WeakPolarHBondContact O-CB 3.33Å; L510-Q514 PolarHBondContact O-N 2.85Å; L510-M532 HydrophobicContact CD2-CG 4.16Å; L510-L535 HydrophobicContact CD2-CB 3.95Å; L510-Q536 HydrophobicContact CD2-CG 4.08Å
511	V	90.4	Very high	89.1	Confident	74 Å²	74	64.6 Å²	64.6	45%	0.448	34%	0.342	S	S	.	.	H	α-helix	trans	-63.9	-39.1	175.2	172.8	0	0	0	0	111.4	P507 S508 V509	P507-V511 WeakPolarHBondContact O-CG2 3.25Å; P507-V511 PolarHBondContact O-N 2.83Å; S508-V511 PolarHBondContact O-N 2.85Å; V509-V511 VanDerWaalsContact C-N 3.33Å; V509-V511 PolarHBondContact O-N 3.39Å
512	L	89.1	Confident	89.4	Confident	23 Å²	23	65.7 Å²	65.7	12%	0.12	35%	0.351	C	S	.	.	H	α-helix	trans	-68.2	-42.6	176.4	-59.5	179.4	0	0	0	111.3	I473 F477 L495 S508 V509 L510 Q514 R515 C516	I473-L512 HydrophobicContact CG2-CD1 3.7Å; F477-L512 HydrophobicContact CB-CD1 4.41Å; F477-L512 HydrophobicContact CD1-CD2 4.47Å; F477-L512 HydrophobicContact CD2-CB 4.25Å; F477-L512 HydrophobicContact CD2-CD1 4.07Å; F477-L512 HydrophobicContact CD2-CD2 3.7Å; F477-L512 HydrophobicContact CD2-CG 4.2Å; F477-L512 HydrophobicContact CE1-CD2 4.41Å; F477-L512 HydrophobicContact CE2-CB 4.36Å; F477-L512 HydrophobicContact CE2-CD2 3.64Å; F477-L512 HydrophobicContact CE2-CG 4.44Å; F477-L512 HydrophobicContact CG-CD1 4.32Å; F477-L512 HydrophobicContact CG-CD2 4.14Å; F477-L512 HydrophobicContact CZ-CD2 4.01Å; L495-L512 HydrophobicContact CD1-CB 4.43Å; L495-L512 HydrophobicContact CD1-CD1 4.49Å; L495-L512 HydrophobicContact CD2-CD1 4.31Å; S508-L512 WeakPolarHBondContact O-CG 3.37Å; S508-L512 PolarHBondContact O-N 3.32Å; V509-L512 PolarHBondContact O-N 3.5Å; V509-L512 VanDerWaalsContact O-N 3.12Å; L510-L512 VanDerWaalsContact C-N 3.32Å; L510-L512 PolarHBondContact O-N 3.45Å; L512-Q514 VanDerWaalsContact C-N 3.34Å; L512-Q514 PolarHBondContact O-N 2.93Å; L512-R515 WeakPolarHBondContact O-CB 3.22Å; L512-R515 PolarHBondContact O-N 3.24Å; L512-C516 PolarHBondContact O-N 2.73Å; L512-C516 PolarHBondContact O-SG 3.04Å
513	M	89.2	Confident	89.7	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-62.1	-39.8	176.9	-72.9	-139.5	152.3	0	0	112.5	V492 L495 A496 V509 L510 R515 C516 M517 Y531 M532 L535	V492-M513 HydrophobicContact CG1-CE 3.79Å; V492-M513 WeakPolarHBondContact O-CE 3.49Å; L495-M513 HydrophobicContact CB-CE 4.34Å; A496-M513 HydrophobicContact CB-CE 3.66Å; V509-M513 HydrophobicContact CG1-CG 4.24Å; V509-M513 WeakPolarHBondContact O-CG 3.39Å; V509-M513 PolarHBondContact O-N 2.82Å; L510-M513 PolarHBondContact O-N 3.49Å; M513-R515 PolarHBondContact O-N 2.98Å; M513-C516 CarbonylContact O-C 3.54Å; M513-C516 WeakPolarHBondContact O-CA 3.3Å; M513-C516 WeakPolarHBondContact O-CB 3.37Å; M513-C516 PolarHBondContact O-N 3.08Å; M513-M517 PolarHBondContact O-N 2.95Å; M513-Y531 HydrophobicContact CE-CD2 4.11Å; M513-Y531 HydrophobicContact CE-CG 4.33Å; M513-M532 HydrophobicContact CB-CB 4.35Å; M513-M532 HydrophobicContact CB-SD 4.37Å; M513-M532 HydrophobicContact SD-CB 4.42Å; M513-L535 HydrophobicContact SD-CD1 4.24Å
514	Q	90.4	Very high	90.1	Very high	116 Å²	116	62.3 Å²	62.3	54%	0.542	33%	0.33	S	S	.	.	H	α-helix	trans	-59.4	-31.5	177.1	-168.8	174.2	11.4	0	0	112.5	L510 L512 M532	L510-Q514 WeakPolarHBondContact O-CB 3.33Å; L510-Q514 PolarHBondContact O-N 2.85Å; L512-Q514 VanDerWaalsContact C-N 3.34Å; L512-Q514 PolarHBondContact O-N 2.93Å; Q514-M532 HydrophobicContact CB-CE 4.01Å; Q514-M532 HydrophobicContact CB-SD 4.12Å; Q514-M532 HydrophobicContact CG-CE 4.16Å
515	R	88.1	Confident	90.4	Very high	157 Å²	157	58.3 Å²	58.3	59%	0.592	30%	0.304	S	S	*	.	H	α-helix	trans	-71.7	-38.4	172.9	-63.5	177.6	-178.3	-177.1	-0.4	111.9	L512 M513 M517 M518	L512-R515 WeakPolarHBondContact O-CB 3.22Å; L512-R515 PolarHBondContact O-N 3.24Å; M513-R515 PolarHBondContact O-N 2.98Å; R515-M517 PolarHBondContact O-N 3.44Å; R515-M518 PolarHBondContact O-N 3.09Å; R515-M518 VanDerWaalsContact O-N 3.11Å
516	C	90.1	Very high	90.6	Very high	3 Å²	3	62.2 Å²	62.2	2%	0.02	33%	0.325	C	S	.	.	H	α-helix	trans	-67.4	-23	177.8	-52.7	0	0	0	0	112.6	V480 V492 L512 M513 M518 D519 A528	V480-C516 VanDerWaalsContact CG1-SG 3.54Å; V492-C516 HydrophobicContact CG2-CB 4.06Å; L512-C516 PolarHBondContact O-N 2.73Å; L512-C516 PolarHBondContact O-SG 3.04Å; M513-C516 CarbonylContact O-C 3.54Å; M513-C516 WeakPolarHBondContact O-CA 3.3Å; M513-C516 WeakPolarHBondContact O-CB 3.37Å; M513-C516 PolarHBondContact O-N 3.08Å; C516-M518 PolarHBondContact O-N 3.24Å; C516-D519 WeakPolarHBondContact O-CB 3.32Å; C516-D519 PolarHBondContact O-N 3.15Å; C516-D519 VanDerWaalsContact O-N 3.15Å; C516-A528 HydrophobicContact CB-CB 3.56Å
517	M	89.9	Confident	90.8	Very high	63 Å²	63	65.3 Å²	65.3	31%	0.31	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.3	172	-66.1	178.8	66.5	0	0	113.3	M513 R515 R525 A528 T529 M532	M513-M517 PolarHBondContact O-N 2.95Å; R515-M517 PolarHBondContact O-N 3.44Å; M517-R525 WeakPolarHBondContact O-CD 3.31Å; M517-R525 WeakPolarHBondContact O-CG 3.37Å; M517-A528 HydrophobicContact CG-CB 4.35Å; M517-T529 HydrophobicContact CE-CG2 4.08Å; M517-M532 HydrophobicContact CG-SD 4.4Å; M517-M532 HydrophobicContact SD-CE 4.28Å; M517-M532 HydrophobicContact SD-SD 3.36Å
518	M	88.7	Confident	90.9	Very high	163 Å²	163	61.6 Å²	61.6	80%	0.803	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	12.8	177.5	-57.5	-59.7	-61.5	0	0	112.3	R515 C516	R515-M518 PolarHBondContact O-N 3.09Å; R515-M518 VanDerWaalsContact O-N 3.11Å; C516-M518 PolarHBondContact O-N 3.24Å
519	D	91.7	Very high	91.1	Very high	18 Å²	18	60.5 Å²	60.5	10%	0.096	30%	0.302	C	S	.	.			trans	-61.1	151.7	178.4	-157.8	-69.3	0	0	0	111.5	R488 C516 D521 V524 R525	R488-D519 IonicContact CZ-OD1 3.69Å; R488-D519 IonicContact CZ-OD2 2.61Å; R488-D519 IonicContact NH1-OD1 2.92Å; R488-D519 PolarHBondContact NH1-OD1 3.4Å; R488-D519 IonicContact NH1-OD2 2.83Å; R488-D519 PolarHBondContact NH1-OD2 3.28Å; R488-D519 IonicContact NH2-OD1 2.61Å; R488-D519 PolarHBondContact NH2-OD1 2.66Å; C516-D519 WeakPolarHBondContact O-CB 3.32Å; C516-D519 PolarHBondContact O-N 3.15Å; C516-D519 VanDerWaalsContact O-N 3.15Å; D519-D521 VanDerWaalsContact C-N 3.3Å; D519-D521 PolarHBondContact OD1-N 3.15Å; D519-V524 HydrophobicContact CB-CB 4.15Å; D519-V524 HydrophobicContact CB-CG1 3.92Å; D519-R525 HydrophobicContact CB-CG 3.82Å; D519-R525 WeakPolarHBondContact O-CD 3.19Å; D519-R525 WeakPolarHBondContact O-CG 3.33Å; D519-R525 PolarHBondContact O-NH1 3.13Å
520	S	89.8	Confident	91.1	Very high	99 Å²	99	64.9 Å²	64.9	69%	0.692	32%	0.321	S	S	*	.	S	Bend	trans	-71.9	-26.1	176.1	58.6	0	0	0	0	113	R525	S520-R525 PolarHBondContact O-NH1 3.12Å
521	D	92.8	Very high	91.2	Very high	44 Å²	44	64.7 Å²	64.7	24%	0.235	32%	0.318	C	S	.	.	S	Bend	trans	-88.6	135.7	-178	-175.6	-97.7	0	0	0	112.4	E485 D519 E523 V524 R525	E485-D521 HydrophobicContact CB-CB 4.15Å; D519-D521 VanDerWaalsContact C-N 3.3Å; D519-D521 PolarHBondContact OD1-N 3.15Å; D521-E523 VanDerWaalsContact OD1-CB 3.3Å; D521-E523 WeakPolarHBondContact OD1-CB 3.38Å; D521-E523 PolarHBondContact OD1-N 3.1Å; D521-V524 HydrophobicContact CB-CB 4.38Å; D521-V524 HydrophobicContact CB-CG2 4.08Å; D521-V524 PolarHBondContact OD1-N 2.92Å; D521-R525 WeakPolarHBondContact O-CG 3.17Å; D521-R525 PolarHBondContact O-N 3.27Å; D521-R525 VanDerWaalsContact O-N 3.16Å
522	D	91.9	Very high	91.2	Very high	100 Å²	100	62.1 Å²	62.1	54%	0.535	30%	0.301	S	S	.	.	H	α-helix	trans	-66.6	-41	-175.2	-64.6	8.4	0	0	0	111.6	R525 D526	D522-R525 PolarHBondContact O-N 2.87Å; D522-R525 IonicContact OD1-CZ 2.94Å; D522-R525 IonicContact OD1-NH1 2.62Å; D522-R525 IonicContact OD1-NH2 2.59Å; D522-R525 PolarHBondContact OD1-NH2 3.32Å; D522-D526 WeakPolarHBondContact O-CB 3.27Å; D522-D526 VanDerWaalsContact O-CG 3.24Å; D522-D526 PolarHBondContact O-N 3.39Å
523	E	91.8	Very high	91.3	Very high	75 Å²	75	65 Å²	65	35%	0.35	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-46.1	-177.7	-167	-94.1	-147.7	0	0	111	A489 D521 R525 D526 R527	A489-E523 WeakPolarHBondContact CB-OE1 3.47Å; A489-E523 WeakPolarHBondContact CB-OE2 3.05Å; D521-E523 VanDerWaalsContact OD1-CB 3.3Å; D521-E523 WeakPolarHBondContact OD1-CB 3.38Å; D521-E523 PolarHBondContact OD1-N 3.1Å; E523-R525 PolarHBondContact O-N 3.21Å; E523-D526 PolarHBondContact O-N 3.01Å; E523-R527 VanDerWaalsContact CD-CZ 3.49Å; E523-R527 WeakPolarHBondContact O-CB 3.37Å; E523-R527 PolarHBondContact O-N 3.21Å; E523-R527 IonicContact OE1-CZ 2.73Å; E523-R527 IonicContact OE1-NE 3.38Å; E523-R527 IonicContact OE1-NH1 2.68Å; E523-R527 PolarHBondContact OE1-NH1 3.15Å; E523-R527 IonicContact OE1-NH2 3.37Å; E523-R527 PolarHBondContact OE1-NH2 2.92Å; E523-R527 IonicContact OE2-CZ 3.65Å; E523-R527 IonicContact OE2-NH1 3.43Å; E523-R527 PolarHBondContact OE2-NH1 3.28Å; E523-R527 IonicContact OE2-NH2 3.44Å
524	V	91.6	Very high	91.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-44.5	179.6	-177.9	0	0	0	0	110.5	R488 A489 V492 D519 D521 A528	R488-V524 HydrophobicContact CB-CG1 4.33Å; R488-V524 HydrophobicContact CB-CG2 3.97Å; A489-V524 HydrophobicContact CB-CG2 4.11Å; V492-V524 HydrophobicContact CG2-CG1 3.98Å; D519-V524 HydrophobicContact CB-CB 4.15Å; D519-V524 HydrophobicContact CB-CG1 3.92Å; D521-V524 HydrophobicContact CB-CB 4.38Å; D521-V524 HydrophobicContact CB-CG2 4.08Å; D521-V524 PolarHBondContact OD1-N 2.92Å; V524-A528 VanDerWaalsContact O-CB 3.25Å; V524-A528 WeakPolarHBondContact O-CB 3.39Å; V524-A528 PolarHBondContact O-N 3.22Å
525	R	93.4	Very high	91.3	Very high	70 Å²	70	60 Å²	60	26%	0.264	30%	0.295	S	S	.	.	H	α-helix	trans	-62.9	-48.1	177.7	-77.2	-160.1	-56.8	-88.5	0.8	112.2	M517 D519 S520 D521 D522 E523 A528 T529	M517-R525 WeakPolarHBondContact O-CD 3.31Å; M517-R525 WeakPolarHBondContact O-CG 3.37Å; D519-R525 HydrophobicContact CB-CG 3.82Å; D519-R525 WeakPolarHBondContact O-CD 3.19Å; D519-R525 WeakPolarHBondContact O-CG 3.33Å; D519-R525 PolarHBondContact O-NH1 3.13Å; S520-R525 PolarHBondContact O-NH1 3.12Å; D521-R525 WeakPolarHBondContact O-CG 3.17Å; D521-R525 PolarHBondContact O-N 3.27Å; D521-R525 VanDerWaalsContact O-N 3.16Å; D522-R525 PolarHBondContact O-N 2.87Å; D522-R525 IonicContact OD1-CZ 2.94Å; D522-R525 IonicContact OD1-NH1 2.62Å; D522-R525 IonicContact OD1-NH2 2.59Å; D522-R525 PolarHBondContact OD1-NH2 3.32Å; E523-R525 PolarHBondContact O-N 3.21Å; R525-A528 PolarHBondContact O-N 3.35Å; R525-T529 WeakPolarHBondContact O-CB 3.38Å; R525-T529 PolarHBondContact O-N 3.37Å; R525-T529 PolarHBondContact O-OG1 3.2Å
526	D	92.6	Very high	91.3	Very high	111 Å²	111	57.5 Å²	57.5	59%	0.594	29%	0.289	S	S	*	.	H	α-helix	trans	-65.8	-42.7	-176.8	-74.2	-7.1	0	0	0	110.4	D522 E523 T529 F530	D522-D526 WeakPolarHBondContact O-CB 3.27Å; D522-D526 VanDerWaalsContact O-CG 3.24Å; D522-D526 PolarHBondContact O-N 3.39Å; E523-D526 PolarHBondContact O-N 3.01Å; D526-T529 PolarHBondContact O-N 3.38Å; D526-F530 VanDerWaalsContact O-CB 3.28Å; D526-F530 WeakPolarHBondContact O-CB 3.45Å; D526-F530 PolarHBondContact O-N 3.43Å
527	R	92.8	Very high	91.2	Very high	77 Å²	77	62.2 Å²	62.2	29%	0.291	31%	0.311	S	S	.	.	H	α-helix	trans	-63.6	-43.1	175.2	-177	170.5	-78.6	153.3	17.6	112.5	A489 V492 S493 E523 F530 Y531	A489-R527 WeakPolarHBondContact O-CD 3.24Å; A489-R527 PolarHBondContact O-NH1 3.45Å; V492-R527 HydrophobicContact CG1-CB 4.47Å; V492-R527 HydrophobicContact CG1-CG 3.95Å; S493-R527 WeakPolarHBondContact OG-CD 3.5Å; E523-R527 VanDerWaalsContact CD-CZ 3.49Å; E523-R527 WeakPolarHBondContact O-CB 3.37Å; E523-R527 PolarHBondContact O-N 3.21Å; E523-R527 IonicContact OE1-CZ 2.73Å; E523-R527 IonicContact OE1-NE 3.38Å; E523-R527 IonicContact OE1-NH1 2.68Å; E523-R527 PolarHBondContact OE1-NH1 3.15Å; E523-R527 IonicContact OE1-NH2 3.37Å; E523-R527 PolarHBondContact OE1-NH2 2.92Å; E523-R527 IonicContact OE2-CZ 3.65Å; E523-R527 IonicContact OE2-NH1 3.43Å; E523-R527 PolarHBondContact OE2-NH1 3.28Å; E523-R527 IonicContact OE2-NH2 3.44Å; R527-F530 PolarHBondContact O-N 2.82Å; R527-Y531 HydrophobicContact CG-CD2 3.67Å; R527-Y531 HydrophobicContact CG-CE2 3.32Å; R527-Y531 WeakPolarHBondContact O-CD2 3.48Å; R527-Y531 PolarHBondContact O-N 3.16Å
528	A	93.1	Very high	90.9	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-43.7	176.2	0	0	0	0	0	111.7	V492 C516 M517 V524 R525 M532	V492-A528 HydrophobicContact CG1-CB 3.97Å; C516-A528 HydrophobicContact CB-CB 3.56Å; M517-A528 HydrophobicContact CG-CB 4.35Å; V524-A528 VanDerWaalsContact O-CB 3.25Å; V524-A528 WeakPolarHBondContact O-CB 3.39Å; V524-A528 PolarHBondContact O-N 3.22Å; R525-A528 PolarHBondContact O-N 3.35Å; A528-M532 WeakPolarHBondContact O-CB 3.4Å; A528-M532 PolarHBondContact O-N 3.33Å
529	T	92.8	Very high	90.6	Very high	44 Å²	44	63.9 Å²	63.9	27%	0.27	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-45.9	177.6	-56.4	0	0	0	0	111.1	M517 R525 D526 M532 N533	M517-T529 HydrophobicContact CE-CG2 4.08Å; R525-T529 WeakPolarHBondContact O-CB 3.38Å; R525-T529 PolarHBondContact O-N 3.37Å; R525-T529 PolarHBondContact O-OG1 3.2Å; D526-T529 PolarHBondContact O-N 3.38Å; T529-M532 PolarHBondContact O-N 3.43Å; T529-N533 PolarHBondContact O-N 3.44Å; T529-N533 PolarHBondContact O-ND2 2.89Å
530	F	92.3	Very high	90	Very high	93 Å²	93	70 Å²	70	41%	0.408	34%	0.339	S	S	.	.	H	α-helix	trans	-58.2	-54.6	177.3	177.2	-100.9	0	0	0	111.6	D526 R527 M532 N533 V534 Y546	D526-F530 VanDerWaalsContact O-CB 3.28Å; D526-F530 WeakPolarHBondContact O-CB 3.45Å; D526-F530 PolarHBondContact O-N 3.43Å; R527-F530 PolarHBondContact O-N 2.82Å; F530-M532 PolarHBondContact O-N 3.46Å; F530-N533 PolarHBondContact O-N 2.73Å; F530-V534 HydrophobicContact CE1-CG2 4.28Å; F530-V534 HydrophobicContact CE2-CG2 4.45Å; F530-V534 HydrophobicContact CZ-CG2 4.19Å; F530-V534 WeakPolarHBondContact O-CG2 3.32Å; F530-V534 PolarHBondContact O-N 3.33Å; F530-V534 VanDerWaalsContact O-N 3.1Å; F530-Y546 AromaticContact CZ-CD1 3.75Å; F530-Y546 HydrophobicContact CZ-CD1 3.75Å; F530-Y546 AromaticContact CZ-CG 3.95Å; F530-Y546 HydrophobicContact CZ-CG 3.95Å
531	Y	92.4	Very high	89.2	Confident	29 Å²	29	67.2 Å²	67.2	11%	0.114	32%	0.323	C	S	.	.	H	α-helix	trans	-66.7	-35.1	-179.3	-69.2	-44.2	0	0	0	113.1	V492 S493 A496 M513 R527 N533 V534 L535 I547	V492-Y531 HydrophobicContact CG1-CD2 4.09Å; S493-Y531 WeakPolarHBondContact OG-CE2 3.45Å; S493-Y531 PolarHBondContact OG-OH 3.03Å; A496-Y531 HydrophobicContact CB-CD1 3.93Å; A496-Y531 HydrophobicContact CB-CD2 3.62Å; A496-Y531 HydrophobicContact CB-CE1 4.35Å; A496-Y531 HydrophobicContact CB-CE2 4.05Å; A496-Y531 HydrophobicContact CB-CG 3.54Å; M513-Y531 HydrophobicContact CE-CD2 4.11Å; M513-Y531 HydrophobicContact CE-CG 4.33Å; R527-Y531 HydrophobicContact CG-CD2 3.67Å; R527-Y531 HydrophobicContact CG-CE2 3.32Å; R527-Y531 WeakPolarHBondContact O-CD2 3.48Å; R527-Y531 PolarHBondContact O-N 3.16Å; Y531-N533 VanDerWaalsContact C-N 3.35Å; Y531-N533 PolarHBondContact O-N 3.35Å; Y531-V534 PolarHBondContact O-N 2.7Å; Y531-L535 VanDerWaalsContact O-CB 3.3Å; Y531-L535 WeakPolarHBondContact O-CB 3.31Å; Y531-L535 VanDerWaalsContact O-CG 3.22Å; Y531-L535 WeakPolarHBondContact O-CG 3.25Å; Y531-L535 PolarHBondContact O-N 3.29Å; Y531-I547 HydrophobicContact CD1-CD1 4.33Å; Y531-I547 HydrophobicContact CD1-CG1 3.81Å; Y531-I547 HydrophobicContact CE1-CG1 4.02Å
532	M	91.3	Very high	88.6	Confident	19 Å²	19	66.9 Å²	66.9	9%	0.094	32%	0.321	C	S	.	.	H	α-helix	trans	-61.7	-43.6	175.2	-177.2	161.6	172.1	0	0	111.4	L510 M513 Q514 M517 A528 T529 F530 L535 Q536	L510-M532 HydrophobicContact CD2-CG 4.16Å; M513-M532 HydrophobicContact CB-CB 4.35Å; M513-M532 HydrophobicContact CB-SD 4.37Å; M513-M532 HydrophobicContact SD-CB 4.42Å; Q514-M532 HydrophobicContact CB-CE 4.01Å; Q514-M532 HydrophobicContact CB-SD 4.12Å; Q514-M532 HydrophobicContact CG-CE 4.16Å; M517-M532 HydrophobicContact CG-SD 4.4Å; M517-M532 HydrophobicContact SD-CE 4.28Å; M517-M532 HydrophobicContact SD-SD 3.36Å; A528-M532 WeakPolarHBondContact O-CB 3.4Å; A528-M532 PolarHBondContact O-N 3.33Å; T529-M532 PolarHBondContact O-N 3.43Å; F530-M532 PolarHBondContact O-N 3.46Å; M532-L535 PolarHBondContact O-N 2.86Å; M532-Q536 HydrophobicContact CG-CG 4.47Å; M532-Q536 WeakPolarHBondContact O-CB 3.43Å; M532-Q536 VanDerWaalsContact O-CG 3.23Å; M532-Q536 WeakPolarHBondContact O-CG 3.16Å; M532-Q536 PolarHBondContact O-N 3.46Å
533	N	91.1	Very high	88.2	Confident	85 Å²	85	62.6 Å²	62.6	46%	0.455	30%	0.298	S	S	.	.	H	α-helix	trans	-64.9	-38	176.8	-75.5	-25.6	0	0	0	112.7	T529 F530 Y531 Q537	T529-N533 PolarHBondContact O-N 3.44Å; T529-N533 PolarHBondContact O-ND2 2.89Å; F530-N533 PolarHBondContact O-N 2.73Å; Y531-N533 VanDerWaalsContact C-N 3.35Å; Y531-N533 PolarHBondContact O-N 3.35Å; N533-Q537 WeakPolarHBondContact O-CG 3.21Å; N533-Q537 PolarHBondContact O-NE2 3.13Å; N533-Q537 VanDerWaalsContact O-NE2 3.1Å
534	V	89.3	Confident	87.3	Confident	9 Å²	9	59.1 Å²	59.1	6%	0.055	28%	0.282	C	S	.	.	H	α-helix	trans	-67.1	-49.4	176	174.4	0	0	0	0	110.4	F530 Y531 Q536 Q537 L542 I547	F530-V534 HydrophobicContact CE1-CG2 4.28Å; F530-V534 HydrophobicContact CE2-CG2 4.45Å; F530-V534 HydrophobicContact CZ-CG2 4.19Å; F530-V534 WeakPolarHBondContact O-CG2 3.32Å; F530-V534 PolarHBondContact O-N 3.33Å; F530-V534 VanDerWaalsContact O-N 3.1Å; Y531-V534 PolarHBondContact O-N 2.7Å; V534-Q536 VanDerWaalsContact C-N 3.35Å; V534-Q536 PolarHBondContact O-N 3.36Å; V534-Q537 WeakPolarHBondContact O-CB 3.44Å; V534-Q537 PolarHBondContact O-N 3.45Å; V534-L542 HydrophobicContact CG1-CB 4.07Å; V534-I547 HydrophobicContact CB-CD1 4.41Å; V534-I547 HydrophobicContact CG1-CD1 3.82Å; V534-I547 HydrophobicContact CG1-CG1 4.15Å
535	L	89.3	Confident	86.6	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	30%	0.297	C	S	.	.	H	α-helix	trans	-65.3	-34.4	-177.5	-73	176.1	0	0	0	113.3	A500 L506 V509 L510 M513 Y531 M532 Q537 K538 I547	A500-L535 HydrophobicContact CB-CD2 3.83Å; L506-L535 HydrophobicContact CD1-CB 3.94Å; L506-L535 HydrophobicContact CD1-CD1 4.37Å; L506-L535 HydrophobicContact CD1-CD2 4.11Å; L506-L535 HydrophobicContact CD1-CG 4.38Å; V509-L535 HydrophobicContact CG1-CD1 4.3Å; L510-L535 HydrophobicContact CD2-CB 3.95Å; M513-L535 HydrophobicContact SD-CD1 4.24Å; Y531-L535 VanDerWaalsContact O-CB 3.3Å; Y531-L535 WeakPolarHBondContact O-CB 3.31Å; Y531-L535 VanDerWaalsContact O-CG 3.22Å; Y531-L535 WeakPolarHBondContact O-CG 3.25Å; Y531-L535 PolarHBondContact O-N 3.29Å; M532-L535 PolarHBondContact O-N 2.86Å; L535-Q537 PolarHBondContact O-N 3.07Å; L535-K538 PolarHBondContact O-N 3.49Å; L535-I547 HydrophobicContact CD2-CD1 3.64Å; L535-I547 HydrophobicContact CG-CD1 3.94Å
536	Q	89.8	Confident	85.9	Confident	103 Å²	103	63.7 Å²	63.7	48%	0.481	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-26.9	177	-80.5	179.6	-3.2	0	0	113.5	L510 M532 V534 K538	L510-Q536 HydrophobicContact CD2-CG 4.08Å; M532-Q536 HydrophobicContact CG-CG 4.47Å; M532-Q536 WeakPolarHBondContact O-CB 3.43Å; M532-Q536 VanDerWaalsContact O-CG 3.23Å; M532-Q536 WeakPolarHBondContact O-CG 3.16Å; M532-Q536 PolarHBondContact O-N 3.46Å; V534-Q536 VanDerWaalsContact C-N 3.35Å; V534-Q536 PolarHBondContact O-N 3.36Å; Q536-K538 PolarHBondContact O-N 3.04Å
537	Q	87.3	Confident	85.4	Confident	102 Å²	102	58.8 Å²	58.8	48%	0.477	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-18.3	178.1	-67.9	175.6	58	0	0	112.3	N533 V534 L535 Q539 L542	N533-Q537 WeakPolarHBondContact O-CG 3.21Å; N533-Q537 PolarHBondContact O-NE2 3.13Å; N533-Q537 VanDerWaalsContact O-NE2 3.1Å; V534-Q537 WeakPolarHBondContact O-CB 3.44Å; V534-Q537 PolarHBondContact O-N 3.45Å; L535-Q537 PolarHBondContact O-N 3.07Å; Q537-Q539 HydrophobicContact CB-CG 4.36Å; Q537-Q539 PolarHBondContact O-N 3.47Å; Q537-Q539 VanDerWaalsContact O-N 3.08Å; Q537-L542 HydrophobicContact CB-CD1 4.13Å; Q537-L542 HydrophobicContact CG-CD1 4.48Å
538	K	83.7	Confident	84.7	Confident	161 Å²	161	57.1 Å²	57.1	70%	0.7	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	25.1	-179.7	-58.4	-176.1	179	-175.2	0	114	L506 L535 Q536	L506-K538 HydrophobicContact CD2-CG 4.27Å; L535-K538 PolarHBondContact O-N 3.49Å; Q536-K538 PolarHBondContact O-N 3.04Å
539	Q	82.8	Confident	83.5	Confident	100 Å²	100	59.2 Å²	59.2	47%	0.467	29%	0.288	S	S	.	.			trans	-94.4	117	178.5	-67.2	179.7	8.9	0	0	109.7	Q537 A541 L542 N543	Q537-Q539 HydrophobicContact CB-CG 4.36Å; Q537-Q539 PolarHBondContact O-N 3.47Å; Q537-Q539 VanDerWaalsContact O-N 3.08Å; Q539-A541 VanDerWaalsContact C-N 3.26Å; Q539-A541 PolarHBondContact O-N 3.44Å; Q539-L542 HydrophobicContact CB-CB 4.24Å; Q539-L542 HydrophobicContact CB-CD1 3.99Å; Q539-L542 HydrophobicContact CB-CG 3.99Å; Q539-L542 HydrophobicContact CG-CD1 4.41Å; Q539-L542 PolarHBondContact O-N 3.34Å; Q539-N543 PolarHBondContact O-N 3.14Å; Q539-N543 VanDerWaalsContact O-N 3.14Å
540	K	78	Confident	82	Confident	146 Å²	146	60.3 Å²	60.3	64%	0.635	31%	0.308	S	S	*	.	H	α-helix	trans	-62	-33.3	-179.1	-67.2	-174.2	178.1	-179	0	112.8	N543 A544	K540-N543 PolarHBondContact O-N 3.33Å; K540-A544 PolarHBondContact O-N 2.82Å
541	A	73.6	Confident	80.6	Confident	42 Å²	42	61.5 Å²	61.5	35%	0.347	32%	0.318	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.4	0	0	0	0	0	112.1	Q539 N543 A544 A545	Q539-A541 VanDerWaalsContact C-N 3.26Å; Q539-A541 PolarHBondContact O-N 3.44Å; A541-N543 VanDerWaalsContact C-N 3.35Å; A541-N543 PolarHBondContact O-N 3.27Å; A541-A544 WeakPolarHBondContact O-CB 3.35Å; A541-A544 PolarHBondContact O-N 3.27Å; A541-A545 PolarHBondContact O-N 3.12Å
542	L	81.1	Confident	79	Confident	36 Å²	36	63.5 Å²	63.5	19%	0.188	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-38.6	176.8	-64.2	179.7	0	0	0	112.1	V534 Q537 Q539 A544 A545 Y546	V534-L542 HydrophobicContact CG1-CB 4.07Å; Q537-L542 HydrophobicContact CB-CD1 4.13Å; Q537-L542 HydrophobicContact CG-CD1 4.48Å; Q539-L542 HydrophobicContact CB-CB 4.24Å; Q539-L542 HydrophobicContact CB-CD1 3.99Å; Q539-L542 HydrophobicContact CB-CG 3.99Å; Q539-L542 HydrophobicContact CG-CD1 4.41Å; Q539-L542 PolarHBondContact O-N 3.34Å; L542-A544 VanDerWaalsContact C-N 3.32Å; L542-A544 PolarHBondContact O-N 3.27Å; L542-A545 PolarHBondContact O-N 3.49Å; L542-Y546 HydrophobicContact CB-CD2 4.35Å; L542-Y546 HydrophobicContact CD2-CD2 4.13Å; L542-Y546 HydrophobicContact CD2-CE2 3.74Å; L542-Y546 WeakPolarHBondContact O-CB 3.49Å; L542-Y546 WeakPolarHBondContact O-CD2 3.24Å; L542-Y546 PolarHBondContact O-N 3.17Å
543	N	83.4	Confident	77.8	Confident	11 Å²	11	63 Å²	63	6%	0.059	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-43	173.8	-70.7	-8.1	0	0	0	111.3	A500 Q539 K540 A541 I547 F548	A500-N543 HydrophobicContact CB-CB 4.04Å; Q539-N543 PolarHBondContact O-N 3.14Å; Q539-N543 VanDerWaalsContact O-N 3.14Å; K540-N543 PolarHBondContact O-N 3.33Å; A541-N543 VanDerWaalsContact C-N 3.35Å; A541-N543 PolarHBondContact O-N 3.27Å; N543-I547 HydrophobicContact CB-CD1 4.46Å; N543-I547 WeakPolarHBondContact O-CA 3.44Å; N543-I547 VanDerWaalsContact O-CB 3.23Å; N543-I547 WeakPolarHBondContact O-CB 3.41Å; N543-I547 PolarHBondContact O-N 3.04Å; N543-F548 HydrophobicContact CB-CD2 4.49Å; N543-F548 HydrophobicContact CB-CE2 4.21Å; N543-F548 WeakPolarHBondContact O-CD2 3.48Å; N543-F548 PolarHBondContact O-N 3.44Å; N543-F548 VanDerWaalsContact O-N 3.12Å
544	A	73	Confident	76.7	Confident	2 Å²	2	59.5 Å²	59.5	2%	0.017	32%	0.316	C	S	.	.	I	π-helix	trans	-62	-52.1	175.9	0	0	0	0	0	111.8	K540 A541 L542 Y546 N549 A773	K540-A544 PolarHBondContact O-N 2.82Å; A541-A544 WeakPolarHBondContact O-CB 3.35Å; A541-A544 PolarHBondContact O-N 3.27Å; L542-A544 VanDerWaalsContact C-N 3.32Å; L542-A544 PolarHBondContact O-N 3.27Å; A544-Y546 PolarHBondContact O-N 3.22Å; A544-N549 VanDerWaalsContact O-CB 3.22Å; A544-N549 WeakPolarHBondContact O-CB 3.34Å; A544-N549 PolarHBondContact O-N 2.79Å; A544-N549 PolarHBondContact O-ND2 2.97Å; A544-A773 HydrophobicContact CB-CB 3.67Å
545	A	75.1	Confident	75.9	Confident	37 Å²	37	64.4 Å²	64.4	31%	0.306	34%	0.341	S	S	.	.	I	π-helix	trans	-62.7	-42.5	-177	0	0	0	0	0	113.5	A541 L542	A541-A545 PolarHBondContact O-N 3.12Å; L542-A545 PolarHBondContact O-N 3.49Å
546	Y	79.9	Confident	75	Confident	129 Å²	129	66.3 Å²	66.3	51%	0.506	35%	0.353	S	S	.	.	I	π-helix	trans	-109.9	-16.7	-167.2	-64.1	-68.3	0	0	0	115.3	F530 L542 A544	F530-Y546 AromaticContact CZ-CD1 3.75Å; F530-Y546 HydrophobicContact CZ-CD1 3.75Å; F530-Y546 AromaticContact CZ-CG 3.95Å; F530-Y546 HydrophobicContact CZ-CG 3.95Å; L542-Y546 HydrophobicContact CB-CD2 4.35Å; L542-Y546 HydrophobicContact CD2-CD2 4.13Å; L542-Y546 HydrophobicContact CD2-CE2 3.74Å; L542-Y546 WeakPolarHBondContact O-CB 3.49Å; L542-Y546 WeakPolarHBondContact O-CD2 3.24Å; L542-Y546 PolarHBondContact O-N 3.17Å; A544-Y546 PolarHBondContact O-N 3.22Å
547	I	82.7	Confident	74.1	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.041	33%	0.332	C	S	.	.	I	π-helix	trans	-113.1	-42.6	-177.1	-55.3	178.4	0	0	0	111.6	A496 K497 A500 Y531 V534 L535 N543	A496-I547 HydrophobicContact CB-CG2 3.99Å; K497-I547 HydrophobicContact CB-CG2 4.46Å; K497-I547 HydrophobicContact CG-CG2 3.8Å; A500-I547 HydrophobicContact CB-CB 4.43Å; A500-I547 HydrophobicContact CB-CD1 3.89Å; A500-I547 HydrophobicContact CB-CG2 4.03Å; Y531-I547 HydrophobicContact CD1-CD1 4.33Å; Y531-I547 HydrophobicContact CD1-CG1 3.81Å; Y531-I547 HydrophobicContact CE1-CG1 4.02Å; V534-I547 HydrophobicContact CB-CD1 4.41Å; V534-I547 HydrophobicContact CG1-CD1 3.82Å; V534-I547 HydrophobicContact CG1-CG1 4.15Å; L535-I547 HydrophobicContact CD2-CD1 3.64Å; L535-I547 HydrophobicContact CG-CD1 3.94Å; N543-I547 HydrophobicContact CB-CD1 4.46Å; N543-I547 WeakPolarHBondContact O-CA 3.44Å; N543-I547 VanDerWaalsContact O-CB 3.23Å; N543-I547 WeakPolarHBondContact O-CB 3.41Å; N543-I547 PolarHBondContact O-N 3.04Å
548	F	76.4	Confident	73.6	Confident	41 Å²	41	57.9 Å²	57.9	18%	0.18	32%	0.316	C	S	.	.	I	π-helix	trans	-93.5	-41.3	-175.8	-63.7	-59.1	0	0	0	113.8	K497 A500 Q501 N543	K497-F548 HydrophobicContact CB-CE1 4.19Å; K497-F548 HydrophobicContact CG-CD1 4.39Å; K497-F548 HydrophobicContact CG-CE1 4.31Å; A500-F548 HydrophobicContact CB-CE1 4.29Å; A500-F548 HydrophobicContact CB-CE2 3.66Å; A500-F548 HydrophobicContact CB-CZ 3.43Å; A500-F548 VanDerWaalsContact CB-CZ 3.43Å; Q501-F548 HydrophobicContact CB-CE1 4.46Å; Q501-F548 HydrophobicContact CB-CZ 3.95Å; Q501-F548 VanDerWaalsContact OE1-CZ 3.29Å; N543-F548 HydrophobicContact CB-CD2 4.49Å; N543-F548 HydrophobicContact CB-CE2 4.21Å; N543-F548 WeakPolarHBondContact O-CD2 3.48Å; N543-F548 PolarHBondContact O-N 3.44Å; N543-F548 VanDerWaalsContact O-N 3.12Å
549	N	67.9	Low	73.3	Confident	45 Å²	45	56.8 Å²	56.8	24%	0.241	31%	0.313	C	S	.	.			trans	-85.8	130	-177.8	-63	-19.4	0	0	0	110.4	A544 P769	A544-N549 VanDerWaalsContact O-CB 3.22Å; A544-N549 WeakPolarHBondContact O-CB 3.34Å; A544-N549 PolarHBondContact O-N 2.79Å; A544-N549 PolarHBondContact O-ND2 2.97Å; N549-P769 WeakPolarHBondContact OD1-CD 3.41Å
550	G	62.8	Low	72.9	Confident	66 Å²	66	56.8 Å²	56.8	68%	0.68	31%	0.312	S	S	*	.			trans	-85.5	-178.5	167.3	0	0	0	0	0	111.2	S552	G550-S552 PolarHBondContact O-N 2.79Å; G550-S552 VanDerWaalsContact O-N 3.12Å
551	L	62.4	Low	72.8	Confident	119 Å²	119	50.9 Å²	50.9	62%	0.623	29%	0.289	S	S	*	.			trans	-56.2	119.5	168	-102	82.7	0	0	0	109.3	V553 L558	L551-V553 VanDerWaalsContact C-N 3.27Å; L551-V553 HydrophobicContact CB-CG2 4.43Å; L551-V553 HydrophobicContact CD2-CG2 3.75Å; L551-V553 HydrophobicContact CG-CG2 4.24Å; L551-L558 HydrophobicContact CD2-CD2 3.65Å
552	S	58.9	Low	73.1	Confident	71 Å²	71	52.5 Å²	52.5	50%	0.497	29%	0.291	S	S	.	.			trans	-82.7	-5.5	176.4	53.6	0	0	0	0	113.2	G550 L581 A582	G550-S552 PolarHBondContact O-N 2.79Å; G550-S552 VanDerWaalsContact O-N 3.12Å; S552-L581 CarbonylContact O-C 3.6Å; S552-L581 WeakPolarHBondContact O-CA 3.3Å; S552-L581 VanDerWaalsContact O-CD2 3.29Å; S552-L581 WeakPolarHBondContact O-CD2 3.25Å; S552-A582 PolarHBondContact O-N 2.99Å
553	V	65	Low	73	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.042	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-97.8	150.1	-175.9	-61	0	0	0	0	112.2	L551 I555 L558 M576 V579 L581	L551-V553 VanDerWaalsContact C-N 3.27Å; L551-V553 HydrophobicContact CB-CG2 4.43Å; L551-V553 HydrophobicContact CD2-CG2 3.75Å; L551-V553 HydrophobicContact CG-CG2 4.24Å; V553-I555 PolarHBondContact O-N 2.97Å; V553-L558 HydrophobicContact CG2-CB 4.36Å; V553-L558 HydrophobicContact CG2-CD2 4.19Å; V553-M576 HydrophobicContact CG1-CG 4.03Å; V553-M576 HydrophobicContact CG1-SD 4.41Å; V553-M576 HydrophobicContact CG2-CG 4.48Å; V553-M576 HydrophobicContact CG2-SD 3.88Å; V553-V579 HydrophobicContact CB-CB 4.07Å; V553-V579 HydrophobicContact CB-CG1 3.76Å; V553-V579 HydrophobicContact CG1-CB 3.98Å; V553-V579 HydrophobicContact CG1-CG1 4.24Å; V553-V579 HydrophobicContact CG2-CG1 4.31Å; V553-L581 HydrophobicContact CG1-CD2 4.49Å
554	S	68.3	Low	72.7	Confident	12 Å²	12	61.3 Å²	61.3	8%	0.084	33%	0.331	C	S	.	.			trans	-61.4	125.1	173.2	174.9	0	0	0	0	109.7	P556 G557 L558 P580	S554-P556 WeakPolarHBondContact OG-CD 3.44Å; S554-G557 PolarHBondContact O-N 3.19Å; S554-G557 PolarHBondContact OG-N 2.9Å; S554-L558 VanDerWaalsContact O-CB 3.31Å; S554-L558 WeakPolarHBondContact O-CB 3.31Å; S554-L558 PolarHBondContact O-N 3.05Å; S554-P580 WeakPolarHBondContact CB-O 3.35Å; S554-P580 PolarHBondContact N-O 3.42Å
555	I	71.8	Confident	72.9	Confident	113 Å²	113	64.8 Å²	64.8	58%	0.579	34%	0.344	S	S	*	.	H	α-helix	trans	-62.9	-46.1	178	-60.5	173.8	0	0	0	111.1	V553 G557 L558 E559	V553-I555 PolarHBondContact O-N 2.97Å; I555-G557 VanDerWaalsContact C-N 3.32Å; I555-G557 PolarHBondContact O-N 2.8Å; I555-L558 PolarHBondContact O-N 2.73Å; I555-E559 PolarHBondContact O-N 2.87Å
556	P	72.3	Confident	73.3	Confident	41 Å²	41	67.7 Å²	67.7	27%	0.266	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-39.4	171.7	-24.6	33.9	0	0	0	113.4	S554 E559 K560	S554-P556 WeakPolarHBondContact OG-CD 3.44Å; P556-E559 PolarHBondContact O-N 2.95Å; P556-K560 PolarHBondContact O-N 2.88Å; P556-K560 VanDerWaalsContact O-N 3.12Å
557	G	69.1	Low	73.3	Confident	4 Å²	4	67.2 Å²	67.2	4%	0.041	36%	0.364	C	S	.	.	H	α-helix	trans	-62.4	-44.5	175.4	0	0	0	0	0	111.8	S554 I555 K560 S561	S554-G557 PolarHBondContact O-N 3.19Å; S554-G557 PolarHBondContact OG-N 2.9Å; I555-G557 VanDerWaalsContact C-N 3.32Å; I555-G557 PolarHBondContact O-N 2.8Å; G557-K560 PolarHBondContact O-N 2.93Å; G557-S561 WeakPolarHBondContact O-CB 3.46Å; G557-S561 PolarHBondContact O-N 3.17Å; G557-S561 PolarHBondContact O-OG 3.38Å; G557-S561 VanDerWaalsContact O-OG 3.1Å
558	L	78	Confident	72.9	Confident	25 Å²	25	73.4 Å²	73.4	13%	0.131	39%	0.392	C	S	.	.	H	α-helix	trans	-62.1	-45.1	177.9	179.1	60.2	0	0	0	111.3	L551 V553 S554 I555 K560 S561 L562 F574 M576 V579	L551-L558 HydrophobicContact CD2-CD2 3.65Å; V553-L558 HydrophobicContact CG2-CB 4.36Å; V553-L558 HydrophobicContact CG2-CD2 4.19Å; S554-L558 VanDerWaalsContact O-CB 3.31Å; S554-L558 WeakPolarHBondContact O-CB 3.31Å; S554-L558 PolarHBondContact O-N 3.05Å; I555-L558 PolarHBondContact O-N 2.73Å; L558-K560 VanDerWaalsContact C-N 3.34Å; L558-K560 PolarHBondContact O-N 3.02Å; L558-S561 PolarHBondContact O-N 3.16Å; L558-L562 HydrophobicContact CD1-CD1 3.78Å; L558-L562 HydrophobicContact CD1-CG 3.95Å; L558-L562 HydrophobicContact CG-CD1 3.81Å; L558-L562 HydrophobicContact CG-CG 4.38Å; L558-L562 VanDerWaalsContact O-CB 3.27Å; L558-L562 WeakPolarHBondContact O-CB 3.33Å; L558-L562 WeakPolarHBondContact O-CG 3.5Å; L558-L562 PolarHBondContact O-N 3.44Å; L558-F574 HydrophobicContact CD1-CE1 3.86Å; L558-F574 HydrophobicContact CD1-CZ 4.06Å; L558-M576 HydrophobicContact CD1-CE 4.37Å; L558-M576 HydrophobicContact CD1-SD 3.57Å; L558-M576 VanDerWaalsContact CD1-SD 3.57Å; L558-M576 HydrophobicContact CD2-SD 4.37Å; L558-V579 HydrophobicContact CB-CG1 3.96Å; L558-V579 HydrophobicContact CD1-CG2 3.88Å; L558-V579 VanDerWaalsContact N-CG1 3.33Å
559	E	78	Confident	72.2	Confident	138 Å²	138	76.7 Å²	76.7	65%	0.645	42%	0.418	S	S	*	.	H	α-helix	trans	-58.5	-46.2	176.8	-175	179.1	-174.1	0	0	111.3	I555 P556 H563	I555-E559 PolarHBondContact O-N 2.87Å; P556-E559 PolarHBondContact O-N 2.95Å; E559-H563 VanDerWaalsContact O-CB 3.29Å; E559-H563 WeakPolarHBondContact O-CB 3.49Å; E559-H563 PolarHBondContact O-N 2.9Å
560	K	72.9	Confident	72.3	Confident	100 Å²	100	77.6 Å²	77.6	44%	0.435	43%	0.427	S	S	.	.	H	α-helix	trans	-65.3	-48.4	177.8	-75.2	179.3	176.8	179.2	0	112.5	P556 G557 L558 L562 H563 Q564 E615	P556-K560 PolarHBondContact O-N 2.88Å; P556-K560 VanDerWaalsContact O-N 3.12Å; G557-K560 PolarHBondContact O-N 2.93Å; L558-K560 VanDerWaalsContact C-N 3.34Å; L558-K560 PolarHBondContact O-N 3.02Å; K560-L562 VanDerWaalsContact C-N 3.31Å; K560-L562 PolarHBondContact O-N 3.27Å; K560-H563 PolarHBondContact O-N 3.14Å; K560-H563 VanDerWaalsContact O-N 3.17Å; K560-Q564 WeakPolarHBondContact O-CB 3.18Å; K560-Q564 PolarHBondContact O-N 3.02Å; K560-E615 IonicContact NZ-OE1 2.71Å; K560-E615 PolarHBondContact NZ-OE1 3.48Å
561	S	75.8	Confident	72.8	Confident	22 Å²	22	84.2 Å²	84.2	15%	0.154	44%	0.441	C	S	.	.	H	α-helix	trans	-61.8	-39.8	179.2	-63	0	0	0	0	111.5	G557 L558 Y565	G557-S561 WeakPolarHBondContact O-CB 3.46Å; G557-S561 PolarHBondContact O-N 3.17Å; G557-S561 PolarHBondContact O-OG 3.38Å; G557-S561 VanDerWaalsContact O-OG 3.1Å; L558-S561 PolarHBondContact O-N 3.16Å; S561-Y565 WeakPolarHBondContact O-CB 3.45Å; S561-Y565 PolarHBondContact O-N 3.07Å
562	L	80.4	Confident	73.3	Confident	75 Å²	75	86.3 Å²	86.3	39%	0.393	45%	0.445	S	S	.	.	H	α-helix	trans	-66.8	-41.9	173.4	-72.9	171.8	0	0	0	111.7	L558 K560 Y565 T566 F574	L558-L562 HydrophobicContact CD1-CD1 3.78Å; L558-L562 HydrophobicContact CD1-CG 3.95Å; L558-L562 HydrophobicContact CG-CD1 3.81Å; L558-L562 HydrophobicContact CG-CG 4.38Å; L558-L562 VanDerWaalsContact O-CB 3.27Å; L558-L562 WeakPolarHBondContact O-CB 3.33Å; L558-L562 WeakPolarHBondContact O-CG 3.5Å; L558-L562 PolarHBondContact O-N 3.44Å; K560-L562 VanDerWaalsContact C-N 3.31Å; K560-L562 PolarHBondContact O-N 3.27Å; L562-Y565 PolarHBondContact O-N 3.44Å; L562-T566 WeakPolarHBondContact O-CG2 3.29Å; L562-T566 PolarHBondContact O-N 3.23Å; L562-T566 PolarHBondContact O-OG1 3.44Å; L562-F574 HydrophobicContact CD2-CD1 3.67Å; L562-F574 HydrophobicContact CD2-CD2 4.06Å; L562-F574 HydrophobicContact CD2-CE1 3.62Å; L562-F574 HydrophobicContact CD2-CE2 4.01Å; L562-F574 HydrophobicContact CD2-CG 3.88Å; L562-F574 HydrophobicContact CD2-CZ 3.78Å; L562-F574 HydrophobicContact CG-CE1 4.12Å; L562-F574 HydrophobicContact CG-CE2 4.36Å; L562-F574 HydrophobicContact CG-CZ 3.96Å
563	H	78.8	Confident	74.2	Confident	112 Å²	112	88.2 Å²	88.2	52%	0.519	46%	0.456	S	S	.	.	H	α-helix	trans	-62.7	-44.2	176.9	-169.4	53.7	0	0	0	111.5	E559 K560 Y565 T566 L567	E559-H563 VanDerWaalsContact O-CB 3.29Å; E559-H563 WeakPolarHBondContact O-CB 3.49Å; E559-H563 PolarHBondContact O-N 2.9Å; K560-H563 PolarHBondContact O-N 3.14Å; K560-H563 VanDerWaalsContact O-N 3.17Å; H563-Y565 PolarHBondContact O-N 2.63Å; H563-T566 WeakPolarHBondContact CA-OG1 3.36Å; H563-T566 PolarHBondContact O-N 3.43Å; H563-T566 VanDerWaalsContact O-N 3.15Å; H563-T566 PolarHBondContact O-OG1 3.32Å; H563-L567 WeakPolarHBondContact O-CG 3.28Å; H563-L567 PolarHBondContact O-N 3.02Å
564	Q	76.3	Confident	74.8	Confident	121 Å²	121	90.4 Å²	90.4	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-61.4	-43.9	174.4	-173.4	175.4	3.6	0	0	111.5	K560 T566 L567 E568	K560-Q564 WeakPolarHBondContact O-CB 3.18Å; K560-Q564 PolarHBondContact O-N 3.02Å; Q564-T566 VanDerWaalsContact C-N 3.26Å; Q564-T566 PolarHBondContact O-N 2.9Å; Q564-L567 PolarHBondContact O-N 3.45Å; Q564-E568 PolarHBondContact O-N 3.12Å
565	Y	79.3	Confident	75.1	Confident	75 Å²	75	94.1 Å²	94.1	29%	0.294	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-33.6	175.1	-174.1	-99.2	0	0	0	112.7	S561 L562 H563 E568 P569 S570 K572 F574	S561-Y565 WeakPolarHBondContact O-CB 3.45Å; S561-Y565 PolarHBondContact O-N 3.07Å; L562-Y565 PolarHBondContact O-N 3.44Å; H563-Y565 PolarHBondContact O-N 2.63Å; Y565-E568 CarbonylContact O-C 3.56Å; Y565-P569 WeakPolarHBondContact O-CA 3.46Å; Y565-S570 PolarHBondContact OH-O 3.47Å; Y565-K572 WeakPolarHBondContact CE2-O 3.23Å; Y565-K572 PolarHBondContact OH-O 2.67Å; Y565-F574 HydrophobicContact CD1-CB 4.12Å; Y565-F574 HydrophobicContact CD1-CD2 4.4Å; Y565-F574 HydrophobicContact CD2-CB 4.26Å; Y565-F574 HydrophobicContact CD2-CD2 4.05Å; Y565-F574 HydrophobicContact CE1-CB 4.07Å; Y565-F574 HydrophobicContact CE2-CB 4.2Å; Y565-F574 HydrophobicContact CG-CB 4.22Å; Y565-F574 AromaticContact CG-CD2 3.84Å; Y565-F574 HydrophobicContact CG-CD2 3.84Å; Y565-F574 HydrophobicContact CG-CG 4.49Å; Y565-F574 PolarHBondContact OH-N 3.12Å
566	T	81.5	Confident	75	Confident	98 Å²	98	93.1 Å²	93.1	60%	0.601	48%	0.477	S	S	*	.	H	α-helix	trans	-72.9	-27.6	173.1	56.5	0	0	0	0	113.7	L562 H563 Q564	L562-T566 WeakPolarHBondContact O-CG2 3.29Å; L562-T566 PolarHBondContact O-N 3.23Å; L562-T566 PolarHBondContact O-OG1 3.44Å; H563-T566 WeakPolarHBondContact CA-OG1 3.36Å; H563-T566 PolarHBondContact O-N 3.43Å; H563-T566 VanDerWaalsContact O-N 3.15Å; H563-T566 PolarHBondContact O-OG1 3.32Å; Q564-T566 VanDerWaalsContact C-N 3.26Å; Q564-T566 PolarHBondContact O-N 2.9Å
567	L	80.4	Confident	74.8	Confident	119 Å²	119	98.8 Å²	98.8	62%	0.623	50%	0.498	S	S	*	.	H	α-helix	trans	-80.5	-34	177.2	-68.5	170.5	0	0	0	112	H563 Q564 P569	H563-L567 WeakPolarHBondContact O-CG 3.28Å; H563-L567 PolarHBondContact O-N 3.02Å; Q564-L567 PolarHBondContact O-N 3.45Å; L567-P569 WeakPolarHBondContact O-CD 3.48Å
568	E	74.7	Confident	74.6	Confident	138 Å²	138	101.3 Å²	101.3	65%	0.645	52%	0.515	S	S	*	.	S	Bend	trans	-123.3	76.2	177.4	-68.8	179.7	-178.9	0	0	110.6	Q564 Y565 S570	Q564-E568 PolarHBondContact O-N 3.12Å; Y565-E568 CarbonylContact O-C 3.56Å; E568-S570 PolarHBondContact O-N 3.04Å
569	P	62.5	Low	74.1	Confident	110 Å²	110	100.5 Å²	100.5	71%	0.714	51%	0.511	S	S	*	.			trans	-64.1	112.8	-177.6	22.9	-31.7	0	0	0	111.1	Y565 L567	Y565-P569 WeakPolarHBondContact O-CA 3.46Å; L567-P569 WeakPolarHBondContact O-CD 3.48Å
570	S	68.9	Low	73.4	Confident	63 Å²	63	95.5 Å²	95.5	44%	0.441	49%	0.491	S	S	.	.			trans	-88	148.8	173.9	171.2	0	0	0	0	110.8	Y565 E568 K572	Y565-S570 PolarHBondContact OH-O 3.47Å; E568-S570 PolarHBondContact O-N 3.04Å; S570-K572 PolarHBondContact O-N 3.12Å; S570-K572 PolarHBondContact OG-N 3.11Å; S570-K572 VanDerWaalsContact OG-N 3.1Å
571	E	72.9	Confident	73	Confident	206 Å²	206	92.3 Å²	92.3	96%	0.963	48%	0.478	S	S	*	.	S	Bend	trans	-65.9	-17.1	169.9	-69.8	-164.7	161.8	0	0	112.7
572	K	73.3	Confident	72	Confident	162 Å²	162	93.8 Å²	93.8	70%	0.704	49%	0.491	S	S	*	.	S	Bend	trans	-85.1	137.2	175.1	-65.3	-176	179.5	179.7	0	110.4	Y565 S570	Y565-K572 WeakPolarHBondContact CE2-O 3.23Å; Y565-K572 PolarHBondContact OH-O 2.67Å; S570-K572 PolarHBondContact O-N 3.12Å; S570-K572 PolarHBondContact OG-N 3.11Å; S570-K572 VanDerWaalsContact OG-N 3.1Å
573	P	78.7	Confident	70.4	Confident	112 Å²	112	93.5 Å²	93.5	73%	0.727	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-56.5	148.1	173.4	-22.2	32.1	0	0	0	112	D575	P573-D575 PolarHBondContact O-N 3.1Å
574	F	77.6	Confident	68.5	Low	52 Å²	52	92.5 Å²	92.5	23%	0.228	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-59	124.8	173.3	-179.4	-98	0	0	0	110.7	L558 L562 Y565 M576 V579	L558-F574 HydrophobicContact CD1-CE1 3.86Å; L558-F574 HydrophobicContact CD1-CZ 4.06Å; L562-F574 HydrophobicContact CD2-CD1 3.67Å; L562-F574 HydrophobicContact CD2-CD2 4.06Å; L562-F574 HydrophobicContact CD2-CE1 3.62Å; L562-F574 HydrophobicContact CD2-CE2 4.01Å; L562-F574 HydrophobicContact CD2-CG 3.88Å; L562-F574 HydrophobicContact CD2-CZ 3.78Å; L562-F574 HydrophobicContact CG-CE1 4.12Å; L562-F574 HydrophobicContact CG-CE2 4.36Å; L562-F574 HydrophobicContact CG-CZ 3.96Å; Y565-F574 HydrophobicContact CD1-CB 4.12Å; Y565-F574 HydrophobicContact CD1-CD2 4.4Å; Y565-F574 HydrophobicContact CD2-CB 4.26Å; Y565-F574 HydrophobicContact CD2-CD2 4.05Å; Y565-F574 HydrophobicContact CE1-CB 4.07Å; Y565-F574 HydrophobicContact CE2-CB 4.2Å; Y565-F574 HydrophobicContact CG-CB 4.22Å; Y565-F574 AromaticContact CG-CD2 3.84Å; Y565-F574 HydrophobicContact CG-CD2 3.84Å; Y565-F574 HydrophobicContact CG-CG 4.49Å; Y565-F574 PolarHBondContact OH-N 3.12Å; F574-M576 HydrophobicContact CE1-SD 4.48Å; F574-V579 HydrophobicContact CE1-CG2 4.05Å; F574-V579 HydrophobicContact CZ-CG2 3.56Å
575	D	73.2	Confident	66.2	Low	90 Å²	90	92.5 Å²	92.5	48%	0.481	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-100.9	119.8	178.6	-171.2	-6.8	0	0	0	110.5	P573 K577 S578	P573-D575 PolarHBondContact O-N 3.1Å; D575-K577 PolarHBondContact O-N 3.32Å; D575-K577 VanDerWaalsContact O-N 3.16Å; D575-K577 WeakPolarHBondContact OD1-CB 3.45Å; D575-K577 WeakPolarHBondContact OD1-CG 3.5Å; D575-K577 PolarHBondContact OD1-N 3.44Å; D575-S578 WeakPolarHBondContact O-CB 3.41Å; D575-S578 PolarHBondContact O-N 3.35Å; D575-S578 PolarHBondContact O-OG 3.33Å
576	M	70.3	Confident	63.7	Low	92 Å²	92	94.6 Å²	94.6	45%	0.453	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-59.9	-23.7	177.2	-163.4	71.3	76.6	0	0	112.3	V553 L558 F574 S578 V579	V553-M576 HydrophobicContact CG1-CG 4.03Å; V553-M576 HydrophobicContact CG1-SD 4.41Å; V553-M576 HydrophobicContact CG2-CG 4.48Å; V553-M576 HydrophobicContact CG2-SD 3.88Å; L558-M576 HydrophobicContact CD1-CE 4.37Å; L558-M576 HydrophobicContact CD1-SD 3.57Å; L558-M576 VanDerWaalsContact CD1-SD 3.57Å; L558-M576 HydrophobicContact CD2-SD 4.37Å; F574-M576 HydrophobicContact CE1-SD 4.48Å; M576-S578 PolarHBondContact O-N 3.33Å; M576-V579 WeakPolarHBondContact O-CB 3.2Å; M576-V579 PolarHBondContact O-N 3.28Å
577	K	67.5	Low	61.2	Low	161 Å²	161	96.8 Å²	96.8	70%	0.7	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-67.7	-17.2	175.6	-63.2	-177.4	177.7	-169.8	0	113.8	D575 V579	D575-K577 PolarHBondContact O-N 3.32Å; D575-K577 VanDerWaalsContact O-N 3.16Å; D575-K577 WeakPolarHBondContact OD1-CB 3.45Å; D575-K577 WeakPolarHBondContact OD1-CG 3.5Å; D575-K577 PolarHBondContact OD1-N 3.44Å; K577-V579 VanDerWaalsContact C-N 3.26Å
578	S	65.5	Low	58.5	Low	57 Å²	57	98.5 Å²	98.5	40%	0.399	54%	0.539	S	S	.	.	G	3₁₀ helix	trans	-78.6	-10.3	175.9	69.2	0	0	0	0	113.6	D575 M576	D575-S578 WeakPolarHBondContact O-CB 3.41Å; D575-S578 PolarHBondContact O-N 3.35Å; D575-S578 PolarHBondContact O-OG 3.33Å; M576-S578 PolarHBondContact O-N 3.33Å
579	V	67.9	Low	56.1	Low	7 Å²	7	100.7 Å²	100.7	4%	0.042	55%	0.549	C	S	.	.	S	Bend	trans	-90.2	134.7	-177.2	-173.4	0	0	0	0	110.1	V553 L558 F574 M576 K577 L581	V553-V579 HydrophobicContact CB-CB 4.07Å; V553-V579 HydrophobicContact CB-CG1 3.76Å; V553-V579 HydrophobicContact CG1-CB 3.98Å; V553-V579 HydrophobicContact CG1-CG1 4.24Å; V553-V579 HydrophobicContact CG2-CG1 4.31Å; L558-V579 HydrophobicContact CB-CG1 3.96Å; L558-V579 HydrophobicContact CD1-CG2 3.88Å; L558-V579 VanDerWaalsContact N-CG1 3.33Å; F574-V579 HydrophobicContact CE1-CG2 4.05Å; F574-V579 HydrophobicContact CZ-CG2 3.56Å; M576-V579 WeakPolarHBondContact O-CB 3.2Å; M576-V579 PolarHBondContact O-N 3.28Å; K577-V579 VanDerWaalsContact C-N 3.26Å; V579-L581 PolarHBondContact O-N 2.82Å
580	P	63.8	Low	54.5	Low	34 Å²	34	105.3 Å²	105.3	22%	0.221	56%	0.558	C	S	.	*	P	Polyproline II helix	trans	-54.7	134.9	174.7	-23.9	32.7	0	0	0	111.8	S554	S554-P580 WeakPolarHBondContact CB-O 3.35Å; S554-P580 PolarHBondContact N-O 3.42Å
581	L	62.9	Low	52.4	Low	32 Å²	32	110 Å²	110	17%	0.168	58%	0.577	C	S	.	*	B	Isolated β-bridge	trans	-65.1	142.8	174.8	-68.2	169.7	0	0	0	110.4	S552 V553 V579 T583 V766 V832	S552-L581 CarbonylContact O-C 3.6Å; S552-L581 WeakPolarHBondContact O-CA 3.3Å; S552-L581 VanDerWaalsContact O-CD2 3.29Å; S552-L581 WeakPolarHBondContact O-CD2 3.25Å; V553-L581 HydrophobicContact CG1-CD2 4.49Å; V579-L581 PolarHBondContact O-N 2.82Å; L581-T583 PolarHBondContact O-N 3.31Å; L581-T583 VanDerWaalsContact O-N 3.11Å; L581-V766 HydrophobicContact CD1-CG2 3.81Å; L581-V832 HydrophobicContact CD1-CB 4.2Å; L581-V832 HydrophobicContact CD1-CG2 3.98Å
582	A	55.8	Low	50.1	Low	53 Å²	53	109.1 Å²	109.1	44%	0.438	57%	0.573	S	S	.	*			trans	-66.3	112.1	175.2	0	0	0	0	0	109	S552 T584	S552-A582 PolarHBondContact O-N 2.99Å; A582-T584 PolarHBondContact O-N 3.43Å
583	T	47.5	Very low	47.9	Very low	69 Å²	69	108.7 Å²	108.7	42%	0.423	58%	0.577	S	S	.	*			trans	-66	118.4	166.7	27.3	0	0	0	0	108.1	L581 Q610	L581-T583 PolarHBondContact O-N 3.31Å; L581-T583 VanDerWaalsContact O-N 3.11Å; T583-Q610 PolarHBondContact OG1-OE1 3.01Å
584	T	38	Very low	45.4	Very low	92 Å²	92	107.2 Å²	107.2	56%	0.564	57%	0.574	S	S	*	*			trans	-58.4	129	164.1	44.1	0	0	0	0	107.2	A582 I586	A582-T584 PolarHBondContact O-N 3.43Å; T584-I586 PolarHBondContact O-N 3.22Å
585	P	27.3	Very low	43.2	Very low	120 Å²	120	111 Å²	111	78%	0.779	60%	0.603	S	S	*	*			trans	-57.5	111.2	169.5	22.5	-29.3	0	0	0	106.9	T587	P585-T587 PolarHBondContact O-N 3.13Å
586	I	27.2	Very low	41	Very low	119 Å²	119	113.7 Å²	113.7	61%	0.61	62%	0.623	S	S	*	*			trans	-59	122.9	167.3	-63.6	171	0	0	0	104.6	T584 E588	T584-I586 PolarHBondContact O-N 3.22Å; I586-E588 HydrophobicContact CG2-CG 4.41Å; I586-E588 PolarHBondContact O-N 3.29Å
587	T	28.6	Very low	39	Very low	144 Å²	144	113.3 Å²	113.3	88%	0.883	63%	0.634	S	S	*	*	S	Bend	trans	-67.3	71.5	178	-44.9	0	0	0	0	109.7	P585	P585-T587 PolarHBondContact O-N 3.13Å
588	E	24.9	Very low	37.1	Very low	156 Å²	156	112.5 Å²	112.5	73%	0.729	64%	0.643	S	S	*	*			trans	-141.6	95.2	168	-75	-162.4	165	0	0	110	I586	I586-E588 HydrophobicContact CG2-CG 4.41Å; I586-E588 PolarHBondContact O-N 3.29Å
589	Q	24.3	Very low	35.4	Very low	184 Å²	184	115.3 Å²	115.3	86%	0.86	66%	0.663	S	S	*	*				-161.3	121.9	126.4	-104.1	170.8	14	0	0	107.8	L591	Q589-L591 PolarHBondContact O-N 3.19Å
590	K	27.4	Very low	33.7	Very low	207 Å²	207	124 Å²	124	90%	0.9	70%	0.7	S	S	*	*			trans	-46.6	108.1	162.2	-90.3	171.7	171.1	168.4	0	107.9	E592	K590-E592 PolarHBondContact O-N 3.25Å
591	L	25.1	Very low	32	Very low	162 Å²	162	129.8 Å²	129.8	85%	0.848	73%	0.728	S	S	*	*			trans	-68.7	103.1	167.8	-76.5	164	0	0	0	107.9	Q589 I593	Q589-L591 PolarHBondContact O-N 3.19Å; L591-I593 PolarHBondContact O-N 3.02Å
592	E	25	Very low	30.5	Very low	187 Å²	187	133.8 Å²	133.8	87%	0.874	76%	0.756	S	S	*	*			trans	-59.8	121.8	157.2	-73.3	-165.1	148.5	0	0	108.5	K590 A594	K590-E592 PolarHBondContact O-N 3.25Å; E592-A594 PolarHBondContact O-N 3.44Å; E592-A594 VanDerWaalsContact O-N 3.08Å
593	I	28	Very low	29.2	Very low	153 Å²	153	140.4 Å²	140.4	79%	0.785	78%	0.778	S	S	*	*			trans	-73.9	99.3	-179	-58.5	169.5	0	0	0	108.5	M316 L591	M316-I593 HydrophobicContact CE-CD1 4.29Å; L591-I593 PolarHBondContact O-N 3.02Å
594	A	25.9	Very low	28.4	Very low	81 Å²	81	146.6 Å²	146.6	67%	0.669	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-94.6	148.8	163.3	0	0	0	0	0	110.8	E592	E592-A594 PolarHBondContact O-N 3.44Å; E592-A594 VanDerWaalsContact O-N 3.08Å
595	P	30.6	Very low	28.3	Very low	130 Å²	130	149 Å²	149	84%	0.844	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.2	146.3	-168.6	31	-34	0	0	0	113.8
596	V	27.8	Very low	28.9	Very low	148 Å²	148	147.5 Å²	147.5	90%	0.897	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-71	126.4	-178.7	-179.7	0	0	0	0	112.1
597	A	28	Very low	30	Very low	83 Å²	83	145.6 Å²	145.6	69%	0.686	80%	0.8	S	S	*	*			trans	-169.1	104.1	142.9	0	0	0	0	0	110.9
598	T	28	Very low	31.8	Very low	144 Å²	144	140.4 Å²	140.4	88%	0.883	77%	0.77	S	S	*	*				164.7	151.4	127.8	38.2	0	0	0	0	111.4
599	S	29.4	Very low	34	Very low	116 Å²	116	138.9 Å²	138.9	81%	0.811	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-59.6	138.3	-165	46.9	0	0	0	0	116.5
600	K	32.5	Very low	36.3	Very low	190 Å²	190	131.2 Å²	131.2	83%	0.826	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-62.2	133.7	176.3	-66.5	178	176.5	176.7	0	113.6
601	L	28.1	Very low	38.5	Very low	155 Å²	155	122 Å²	122	81%	0.812	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-95.4	158	147.4	-86	157.3	0	0	0	108.2	E603	L601-E603 PolarHBondContact O-N 3.03Å
602	P	30.7	Very low	41.2	Very low	117 Å²	117	118.3 Å²	118.3	76%	0.76	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-61.4	125.3	-177.1	23.5	-30.8	0	0	0	110.8	K604	P602-K604 PolarHBondContact O-N 3.21Å
603	E	29.5	Very low	44.1	Very low	192 Å²	192	110.7 Å²	110.7	90%	0.897	63%	0.626	S	S	*	*			trans	-57.9	105.9	178	-80.4	172.8	149.2	0	0	110.1	L601	L601-E603 PolarHBondContact O-N 3.03Å
604	K	30.1	Very low	46.7	Very low	199 Å²	199	105.9 Å²	105.9	87%	0.865	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-65.9	128.5	149.8	-83.5	-175.9	172.3	-175.1	0	106.6	P602 A606	P602-K604 PolarHBondContact O-N 3.21Å; K604-A606 PolarHBondContact O-N 3.38Å; K604-A606 VanDerWaalsContact O-N 3.09Å
605	L	36.7	Very low	49.4	Very low	143 Å²	143	107.2 Å²	107.2	75%	0.749	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-47.7	118.1	170.7	-79.4	150.7	0	0	0	108.5
606	A	39.7	Very low	52.1	Low	87 Å²	87	103.9 Å²	103.9	72%	0.719	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-60.9	134.8	178.1	0	0	0	0	0	109.3	K604	K604-A606 PolarHBondContact O-N 3.38Å; K604-A606 VanDerWaalsContact O-N 3.09Å
607	P	49	Very low	54.9	Low	79 Å²	79	97 Å²	97	51%	0.513	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-60.9	140.5	178.7	24.9	-32.4	0	0	0	110.2	D611 I612	P607-D611 HydrophobicContact CB-CB 4.23Å; P607-I612 HydrophobicContact CG-CG1 4.46Å
608	S	66.6	Low	57.5	Low	35 Å²	35	95.2 Å²	95.2	25%	0.245	51%	0.51	C	S	.	.	P	Polyproline II helix	trans	-68.6	157.5	177.7	74.6	0	0	0	0	110.4	Q610 D611 I612	S608-Q610 PolarHBondContact O-N 3.08Å; S608-D611 WeakPolarHBondContact CB-OD2 3.27Å; S608-D611 PolarHBondContact N-OD2 3.49Å; S608-D611 WeakPolarHBondContact O-CB 3.49Å; S608-D611 PolarHBondContact O-N 2.7Å; S608-D611 PolarHBondContact OG-N 3.19Å; S608-D611 PolarHBondContact OG-OD2 3.47Å; S608-I612 PolarHBondContact O-N 3.48Å
609	R	71.6	Confident	60.2	Low	124 Å²	124	92.5 Å²	92.5	47%	0.468	50%	0.496	S	S	.	.	H	α-helix	trans	-56	-34.6	178.2	-174.9	178.8	178.1	-177	-2.9	112.6	I612 Y613	R609-I612 PolarHBondContact O-N 2.77Å; R609-Y613 HydrophobicContact CG-CD2 4.08Å; R609-Y613 HydrophobicContact CG-CE2 3.51Å; R609-Y613 PolarHBondContact NE-OH 2.96Å; R609-Y613 PolarHBondContact NH2-OH 3.36Å; R609-Y613 WeakPolarHBondContact O-CD2 3.27Å; R609-Y613 PolarHBondContact O-N 3.28Å
610	Q	72.3	Confident	62.9	Low	23 Å²	23	88 Å²	88	11%	0.107	46%	0.463	C	S	.	.	H	α-helix	trans	-66.7	-38.2	174.2	-87.4	-179.7	-49.3	0	0	112.7	T583 S608 I612 Y613 Q614 F630	T583-Q610 PolarHBondContact OG1-OE1 3.01Å; S608-Q610 PolarHBondContact O-N 3.08Å; Q610-I612 VanDerWaalsContact C-N 3.28Å; Q610-I612 PolarHBondContact O-N 3.38Å; Q610-Y613 PolarHBondContact O-N 3.14Å; Q610-Q614 WeakPolarHBondContact O-CB 3.49Å; Q610-Q614 PolarHBondContact O-N 3.41Å; Q610-F630 PolarHBondContact NE2-O 3.3Å
611	D	74.3	Confident	65.4	Low	13 Å²	13	83.3 Å²	83.3	7%	0.07	45%	0.452	C	S	.	.	H	α-helix	trans	-63.5	-37.5	178.4	-60.6	-48.8	0	0	0	111.2	P607 S608 Q614 E615	P607-D611 HydrophobicContact CB-CB 4.23Å; S608-D611 WeakPolarHBondContact CB-OD2 3.27Å; S608-D611 PolarHBondContact N-OD2 3.49Å; S608-D611 WeakPolarHBondContact O-CB 3.49Å; S608-D611 PolarHBondContact O-N 2.7Å; S608-D611 PolarHBondContact OG-N 3.19Å; S608-D611 PolarHBondContact OG-OD2 3.47Å; D611-Q614 PolarHBondContact O-N 3.15Å; D611-E615 WeakPolarHBondContact O-CG 3.46Å; D611-E615 PolarHBondContact O-N 2.98Å; D611-E615 VanDerWaalsContact O-N 3.08Å
612	I	82.3	Confident	68	Low	86 Å²	86	81.3 Å²	81.3	44%	0.441	44%	0.438	S	S	.	.	H	α-helix	trans	-64.1	-47.5	176	-59.8	171.8	0	0	0	110.4	P607 S608 R609 Q610 Q614 E615 Q616	P607-I612 HydrophobicContact CG-CG1 4.46Å; S608-I612 PolarHBondContact O-N 3.48Å; R609-I612 PolarHBondContact O-N 2.77Å; Q610-I612 VanDerWaalsContact C-N 3.28Å; Q610-I612 PolarHBondContact O-N 3.38Å; I612-Q614 PolarHBondContact O-N 3.26Å; I612-E615 PolarHBondContact O-N 3.06Å; I612-Q616 WeakPolarHBondContact O-CB 3.48Å; I612-Q616 PolarHBondContact O-N 2.82Å
613	Y	85.6	Confident	70.8	Confident	26 Å²	26	76 Å²	76	10%	0.102	40%	0.404	C	S	.	.	H	α-helix	trans	-65.7	-37.9	177.9	-68.6	-47.4	0	0	0	112.6	R609 Q610 E615 Q616 L617 S632 I650 H652	R609-Y613 HydrophobicContact CG-CD2 4.08Å; R609-Y613 HydrophobicContact CG-CE2 3.51Å; R609-Y613 PolarHBondContact NE-OH 2.96Å; R609-Y613 PolarHBondContact NH2-OH 3.36Å; R609-Y613 WeakPolarHBondContact O-CD2 3.27Å; R609-Y613 PolarHBondContact O-N 3.28Å; Q610-Y613 PolarHBondContact O-N 3.14Å; Y613-E615 VanDerWaalsContact C-N 3.33Å; Y613-E615 PolarHBondContact O-N 3.37Å; Y613-Q616 PolarHBondContact O-N 3.4Å; Y613-L617 WeakPolarHBondContact O-CB 3.5Å; Y613-L617 VanDerWaalsContact O-CG 3.25Å; Y613-L617 WeakPolarHBondContact O-CG 3.42Å; Y613-L617 PolarHBondContact O-N 3.42Å; Y613-S632 WeakPolarHBondContact CD2-OG 3.49Å; Y613-I650 HydrophobicContact CE1-CD1 4.26Å; Y613-I650 WeakPolarHBondContact OH-CD1 3.34Å; Y613-H652 AromaticContact CD1-CE1 3.84Å; Y613-H652 AromaticContact CG-CE1 3.71Å
614	Q	82.9	Confident	73.1	Confident	53 Å²	53	73.5 Å²	73.5	25%	0.248	39%	0.392	C	S	.	.	H	α-helix	trans	-58.6	-45.7	174.3	178.3	69.5	50.7	0	0	111.1	Q610 D611 I612 A618	Q610-Q614 WeakPolarHBondContact O-CB 3.49Å; Q610-Q614 PolarHBondContact O-N 3.41Å; D611-Q614 PolarHBondContact O-N 3.15Å; I612-Q614 PolarHBondContact O-N 3.26Å; Q614-A618 WeakPolarHBondContact O-CB 3.33Å; Q614-A618 PolarHBondContact O-N 2.87Å
615	E	82.7	Confident	75.5	Confident	109 Å²	109	68.9 Å²	68.9	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-64.9	-44	177.8	-74.7	178.2	-174.8	0	0	111.9	K560 D611 I612 Y613 A618 S619	K560-E615 IonicContact NZ-OE1 2.71Å; K560-E615 PolarHBondContact NZ-OE1 3.48Å; D611-E615 WeakPolarHBondContact O-CG 3.46Å; D611-E615 PolarHBondContact O-N 2.98Å; D611-E615 VanDerWaalsContact O-N 3.08Å; I612-E615 PolarHBondContact O-N 3.06Å; Y613-E615 VanDerWaalsContact C-N 3.33Å; Y613-E615 PolarHBondContact O-N 3.37Å; E615-A618 PolarHBondContact O-N 3.44Å; E615-S619 PolarHBondContact O-N 3.02Å; E615-S619 VanDerWaalsContact O-N 3.13Å
616	Q	85.4	Confident	77.7	Confident	60 Å²	60	63.1 Å²	63.1	28%	0.28	36%	0.361	S	S	.	.	H	α-helix	trans	-60.2	-49.8	177.4	-178.6	176.5	-0.9	0	0	111.5	I612 Y613 S619 Y706	I612-Q616 WeakPolarHBondContact O-CB 3.48Å; I612-Q616 PolarHBondContact O-N 2.82Å; Y613-Q616 PolarHBondContact O-N 3.4Å; Q616-S619 WeakPolarHBondContact O-CB 3.3Å; Q616-S619 PolarHBondContact O-N 3.25Å; Q616-S619 PolarHBondContact O-OG 2.81Å; Q616-Y706 PolarHBondContact NE2-OH 2.94Å
617	L	86.4	Confident	79.7	Confident	3 Å²	3	60.7 Å²	60.7	2%	0.016	34%	0.344	C	S	.	.	H	α-helix	trans	-68.5	-36.1	-179.3	-65.8	172.2	0	0	0	112	Y613 S619 I620 F623 L629 H652 F654 V659 Y706	Y613-L617 WeakPolarHBondContact O-CB 3.5Å; Y613-L617 VanDerWaalsContact O-CG 3.25Å; Y613-L617 WeakPolarHBondContact O-CG 3.42Å; Y613-L617 PolarHBondContact O-N 3.42Å; L617-S619 PolarHBondContact O-N 3.41Å; L617-I620 WeakPolarHBondContact O-CB 3.16Å; L617-I620 PolarHBondContact O-N 3.46Å; L617-F623 HydrophobicContact CD2-CD2 3.94Å; L617-F623 HydrophobicContact CD2-CE2 4.09Å; L617-L629 HydrophobicContact CD1-CD1 4.18Å; L617-L629 HydrophobicContact CD1-CD2 4.43Å; L617-H652 HydrophobicContact CD1-CB 3.95Å; L617-F654 HydrophobicContact CD1-CE2 4.29Å; L617-F654 HydrophobicContact CD1-CZ 3.98Å; L617-V659 HydrophobicContact CD2-CG1 4.11Å; L617-Y706 HydrophobicContact CD2-CD1 4.22Å; L617-Y706 HydrophobicContact CD2-CE1 3.9Å
618	A	83.8	Confident	81.2	Confident	46 Å²	46	60.6 Å²	60.6	38%	0.38	34%	0.343	S	S	.	.	H	α-helix	trans	-67.9	-23.4	176.6	0	0	0	0	0	113.4	Q614 E615 I620	Q614-A618 WeakPolarHBondContact O-CB 3.33Å; Q614-A618 PolarHBondContact O-N 2.87Å; E615-A618 PolarHBondContact O-N 3.44Å; A618-I620 PolarHBondContact O-N 3.47Å
619	S	84.8	Confident	82.1	Confident	87 Å²	87	59.3 Å²	59.3	61%	0.608	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-18.7	174.7	79.1	0	0	0	0	113.3	E615 Q616 L617 P621	E615-S619 PolarHBondContact O-N 3.02Å; E615-S619 VanDerWaalsContact O-N 3.13Å; Q616-S619 WeakPolarHBondContact O-CB 3.3Å; Q616-S619 PolarHBondContact O-N 3.25Å; Q616-S619 PolarHBondContact O-OG 2.81Å; L617-S619 PolarHBondContact O-N 3.41Å; S619-P621 WeakPolarHBondContact O-CD 3.36Å
620	I	86.3	Confident	82.8	Confident	21 Å²	21	54.8 Å²	54.8	11%	0.108	32%	0.318	C	S	.	.	S	Bend	trans	-86.5	115.7	179.3	-60.1	173.9	0	0	0	108.6	L617 A618 E622 F623 I692 Y706	L617-I620 WeakPolarHBondContact O-CB 3.16Å; L617-I620 PolarHBondContact O-N 3.46Å; A618-I620 PolarHBondContact O-N 3.47Å; I620-E622 VanDerWaalsContact C-N 3.25Å; I620-E622 HydrophobicContact CG2-CB 4.3Å; I620-E622 VanDerWaalsContact CG2-OE2 3.26Å; I620-E622 WeakPolarHBondContact CG2-OE2 3.21Å; I620-E622 PolarHBondContact O-N 3.08Å; I620-F623 HydrophobicContact CB-CB 4.4Å; I620-F623 HydrophobicContact CB-CD2 3.74Å; I620-F623 HydrophobicContact CB-CE2 4.32Å; I620-F623 HydrophobicContact CB-CG 4.26Å; I620-F623 HydrophobicContact CD1-CD2 3.73Å; I620-F623 HydrophobicContact CD1-CE2 3.65Å; I620-F623 HydrophobicContact CG1-CD2 4.3Å; I620-F623 HydrophobicContact CG2-CD2 3.7Å; I620-F623 HydrophobicContact CG2-CE2 3.97Å; I620-F623 HydrophobicContact CG2-CG 4.04Å; I620-F623 PolarHBondContact O-N 3.11Å; I620-I692 HydrophobicContact CG2-CD1 3.48Å; I620-I692 VanDerWaalsContact CG2-CD1 3.48Å; I620-Y706 HydrophobicContact CD1-CD2 3.92Å; I620-Y706 HydrophobicContact CD1-CE1 4.29Å; I620-Y706 HydrophobicContact CD1-CE2 3.65Å; I620-Y706 HydrophobicContact CD1-CG 4.38Å
621	P	84.7	Confident	83.5	Confident	92 Å²	92	55.5 Å²	55.5	60%	0.597	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-54.9	-38.2	-175.7	-27.3	35.5	0	0	0	114.1	S619 F623 Q624	S619-P621 WeakPolarHBondContact O-CD 3.36Å; P621-F623 PolarHBondContact O-N 3.13Å; P621-Q624 PolarHBondContact O-N 3.14Å
622	E	83.4	Confident	84.2	Confident	112 Å²	112	55.9 Å²	55.9	52%	0.523	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-65	-20.8	-179.1	-64.3	81.5	177.4	0	0	112.9	I620 I692	I620-E622 VanDerWaalsContact C-N 3.25Å; I620-E622 HydrophobicContact CG2-CB 4.3Å; I620-E622 VanDerWaalsContact CG2-OE2 3.26Å; I620-E622 WeakPolarHBondContact CG2-OE2 3.21Å; I620-E622 PolarHBondContact O-N 3.08Å; E622-I692 HydrophobicContact CB-CD1 4.15Å; E622-I692 HydrophobicContact CG-CD1 4.41Å
623	F	87.8	Confident	84.6	Confident	7 Å²	7	52.6 Å²	52.6	3%	0.031	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-103.5	-5.2	-176.1	-61.5	-20.1	0	0	0	114.1	L617 I620 P621 A625 L626 V659 I692 Y706 L708	L617-F623 HydrophobicContact CD2-CD2 3.94Å; L617-F623 HydrophobicContact CD2-CE2 4.09Å; I620-F623 HydrophobicContact CB-CB 4.4Å; I620-F623 HydrophobicContact CB-CD2 3.74Å; I620-F623 HydrophobicContact CB-CE2 4.32Å; I620-F623 HydrophobicContact CB-CG 4.26Å; I620-F623 HydrophobicContact CD1-CD2 3.73Å; I620-F623 HydrophobicContact CD1-CE2 3.65Å; I620-F623 HydrophobicContact CG1-CD2 4.3Å; I620-F623 HydrophobicContact CG2-CD2 3.7Å; I620-F623 HydrophobicContact CG2-CE2 3.97Å; I620-F623 HydrophobicContact CG2-CG 4.04Å; I620-F623 PolarHBondContact O-N 3.11Å; P621-F623 PolarHBondContact O-N 3.13Å; F623-A625 PolarHBondContact O-N 3.11Å; F623-A625 VanDerWaalsContact O-N 3.15Å; F623-L626 HydrophobicContact CB-CD1 3.8Å; F623-L626 HydrophobicContact CB-CG 4.42Å; F623-L626 HydrophobicContact CD1-CD1 3.78Å; F623-L626 HydrophobicContact CG-CD1 3.95Å; F623-L626 WeakPolarHBondContact O-CB 3.45Å; F623-L626 WeakPolarHBondContact O-CG 3.45Å; F623-L626 PolarHBondContact O-N 3Å; F623-L626 VanDerWaalsContact O-N 3.09Å; F623-V659 HydrophobicContact CD1-CG2 4.34Å; F623-V659 HydrophobicContact CD2-CG1 4.48Å; F623-V659 HydrophobicContact CE1-CG2 4.17Å; F623-V659 HydrophobicContact CE2-CG1 3.73Å; F623-V659 HydrophobicContact CE2-CG2 4.35Å; F623-V659 HydrophobicContact CZ-CG1 3.78Å; F623-V659 HydrophobicContact CZ-CG2 4.17Å; F623-I692 HydrophobicContact CE1-CD1 3.71Å; F623-I692 HydrophobicContact CE2-CD1 3.82Å; F623-I692 HydrophobicContact CZ-CD1 3.32Å; F623-I692 HydrophobicContact CZ-CG1 4.22Å; F623-Y706 HydrophobicContact CE2-CD1 4.11Å; F623-Y706 HydrophobicContact CE2-CG 4Å; F623-Y706 HydrophobicContact CZ-CG 4.31Å; F623-L708 HydrophobicContact CE1-CB 4.02Å; F623-L708 HydrophobicContact CE1-CD1 4.43Å; F623-L708 HydrophobicContact CE1-CD2 4.34Å; F623-L708 HydrophobicContact CE1-CG 4.5Å
624	Q	78.6	Confident	84.7	Confident	138 Å²	138	57.6 Å²	57.6	65%	0.645	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-60.5	-28.8	-177.6	-70	-175.3	-7	0	0	113.6	P621 L626	P621-Q624 PolarHBondContact O-N 3.14Å; Q624-L626 VanDerWaalsContact C-N 3.34Å
625	A	81.4	Confident	85	Confident	102 Å²	102	57.9 Å²	57.9	84%	0.843	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-82.8	-4.8	-179.5	0	0	0	0	0	114.4	F623 G627	F623-A625 PolarHBondContact O-N 3.11Å; F623-A625 VanDerWaalsContact O-N 3.15Å; A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.37Å
626	L	81.6	Confident	85.5	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.12	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-76.7	-17.9	-174.7	-60.7	178.5	0	0	0	113.7	F623 Q624 F654 H657 V659 L708	F623-L626 HydrophobicContact CB-CD1 3.8Å; F623-L626 HydrophobicContact CB-CG 4.42Å; F623-L626 HydrophobicContact CD1-CD1 3.78Å; F623-L626 HydrophobicContact CG-CD1 3.95Å; F623-L626 WeakPolarHBondContact O-CB 3.45Å; F623-L626 WeakPolarHBondContact O-CG 3.45Å; F623-L626 PolarHBondContact O-N 3Å; F623-L626 VanDerWaalsContact O-N 3.09Å; Q624-L626 VanDerWaalsContact C-N 3.34Å; L626-F654 HydrophobicContact CB-CD1 3.79Å; L626-F654 HydrophobicContact CB-CE1 3.92Å; L626-F654 HydrophobicContact CB-CG 4.14Å; L626-F654 HydrophobicContact CB-CZ 4.37Å; L626-F654 HydrophobicContact CD1-CD2 4.31Å; L626-F654 HydrophobicContact CD1-CE2 4.08Å; L626-F654 HydrophobicContact CD1-CZ 4.24Å; L626-H657 HydrophobicContact CD2-CB 3.91Å; L626-V659 HydrophobicContact CD1-CG2 3.74Å; L626-L708 HydrophobicContact CD1-CD1 3.87Å; L626-L708 HydrophobicContact CD2-CD1 4.04Å
627	G	81.3	Confident	85.7	Confident	36 Å²	36	56.4 Å²	56.4	37%	0.371	34%	0.336	S	S	.	.			trans	84.5	-163.4	-176.5	0	0	0	0	0	113.4	A625 F654	A625-G627 VanDerWaalsContact C-N 3.33Å; A625-G627 PolarHBondContact O-N 3.37Å; G627-F654 WeakPolarHBondContact O-CE1 3.49Å
628	P	81.9	Confident	86	Confident	77 Å²	77	56.3 Å²	56.3	50%	0.5	34%	0.336	S	S	.	.	S	Bend	trans	-69.6	138.7	179.5	28.7	-33.5	0	0	0	111.4	F630 F654	P628-F630 PolarHBondContact O-N 3.36Å; P628-F654 WeakPolarHBondContact O-CD1 3.4Å
629	L	84.8	Confident	86.4	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.042	32%	0.32	C	S	.	.			trans	-63.7	126	172.5	179.1	66.2	0	0	0	109.1	L617 H652 F654	L617-L629 HydrophobicContact CD1-CD1 4.18Å; L617-L629 HydrophobicContact CD1-CD2 4.43Å; L629-H652 HydrophobicContact CD1-CB 3.71Å; L629-F654 HydrophobicContact CB-CE1 4.09Å; L629-F654 HydrophobicContact CB-CZ 4.31Å; L629-F654 HydrophobicContact CD1-CD2 4.42Å; L629-F654 HydrophobicContact CD1-CE1 4.29Å; L629-F654 HydrophobicContact CD1-CE2 3.9Å; L629-F654 HydrophobicContact CD1-CZ 3.83Å
630	F	86.3	Confident	86.4	Confident	29 Å²	29	56.9 Å²	56.9	13%	0.127	32%	0.321	C	S	.	.			trans	-83.8	-51.4	179.2	177.9	-106.9	0	0	0	111.1	Q610 P628 T653 H762 Q764 V832 R834	Q610-F630 PolarHBondContact NE2-O 3.3Å; P628-F630 PolarHBondContact O-N 3.36Å; F630-T653 WeakPolarHBondContact CA-O 3.36Å; F630-T653 VanDerWaalsContact CB-O 3.24Å; F630-T653 WeakPolarHBondContact CB-O 3.44Å; F630-T653 HydrophobicContact CD1-CG2 4.31Å; F630-T653 PolarHBondContact N-O 3.16Å; F630-H762 WeakPolarHBondContact CE1-O 3.4Å; F630-Q764 HydrophobicContact CE1-CB 4.11Å; F630-Q764 HydrophobicContact CE2-CB 4.41Å; F630-Q764 HydrophobicContact CZ-CB 3.78Å; F630-Q764 PolarHBondContact O-OE1 2.88Å; F630-V832 HydrophobicContact CE2-CG1 4.12Å; F630-V832 HydrophobicContact CZ-CG1 4.32Å; F630-V832 WeakPolarHBondContact CZ-O 3.33Å; F630-R834 HydrophobicContact CD1-CB 3.93Å; F630-R834 HydrophobicContact CE1-CB 4Å; F630-R834 HydrophobicContact CG-CB 4.31Å; F630-R834 HydrophobicContact CZ-CB 4.43Å
631	K	87.3	Confident	85.9	Confident	38 Å²	38	59.3 Å²	59.3	17%	0.165	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	147.5	-176.1	-175.7	177.8	174.7	-177	0	111.4	H652 T653 A760 I763	K631-H652 CarbonylContact O-C 3.48Å; K631-H652 WeakPolarHBondContact O-CA 3.17Å; K631-T653 PolarHBondContact N-O 2.62Å; K631-T653 PolarHBondContact O-N 3.38Å; K631-A760 PolarHBondContact NZ-O 3.29Å; K631-I763 WeakPolarHBondContact CD-O 3.36Å; K631-I763 PolarHBondContact NZ-O 3.26Å
632	S	89.9	Confident	85.5	Confident	20 Å²	20	64 Å²	64	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	139.9	162.9	-57.6	0	0	0	0	109.8	Y613 K651 H652	Y613-S632 WeakPolarHBondContact CD2-OG 3.49Å; S632-K651 CarbonylContact C-O 3.49Å; S632-K651 VanDerWaalsContact CA-O 3.28Å; S632-K651 WeakPolarHBondContact CA-O 3.46Å; S632-H652 PolarHBondContact OG-CE1 3.18Å; S632-H652 PolarHBondContact OG-ND1 3.2Å
633	S	90.1	Very high	85.7	Confident	17 Å²	17	60.1 Å²	60.1	12%	0.119	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-77.1	171.6	173.2	75.7	0	0	0	0	112.2	K651	S633-K651 PolarHBondContact N-O 3.01Å; S633-K651 WeakPolarHBondContact OG-CB 3.35Å; S633-K651 PolarHBondContact OG-N 3.36Å
634	E	87.6	Confident	85.6	Confident	131 Å²	131	64 Å²	64	61%	0.612	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-70.4	155.2	160.5	-65.2	-171.1	167.7	0	0	110.5	V636	E634-V636 PolarHBondContact O-N 2.99Å
635	P	89.8	Confident	86.2	Confident	59 Å²	59	57.9 Å²	57.9	38%	0.383	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-66.1	121.8	177.8	-16.5	31.3	0	0	0	110.4	R648 C649 I650	P635-R648 HydrophobicContact CB-CB 4.43Å; P635-C649 CarbonylContact C-O 3.55Å; P635-C649 WeakPolarHBondContact CA-O 3.46Å; P635-I650 HydrophobicContact CB-CG1 4Å; P635-I650 HydrophobicContact CG-CD1 4.26Å; P635-I650 HydrophobicContact CG-CG1 4.07Å
636	V	91.9	Very high	86.7	Confident	56 Å²	56	54 Å²	54	34%	0.339	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.1	172.6	-177.4	0	0	0	0	107.9	E634 L638 R648 C649 L755	E634-V636 PolarHBondContact O-N 2.99Å; V636-L638 HydrophobicContact CG1-CD2 4.18Å; V636-R648 CarbonylContact O-C 3.6Å; V636-R648 VanDerWaalsContact O-CA 3.31Å; V636-R648 WeakPolarHBondContact O-CA 3.13Å; V636-C649 PolarHBondContact N-O 3.41Å; V636-C649 PolarHBondContact O-N 2.95Å; V636-L755 HydrophobicContact CB-CD1 4.19Å; V636-L755 HydrophobicContact CG1-CD1 4.15Å; V636-L755 HydrophobicContact CG2-CD1 4.41Å
637	Q	91.2	Very high	87.3	Confident	82 Å²	82	52.9 Å²	52.9	38%	0.383	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	127.1	177.5	-177	160.8	6.6	0	0	109.1	T639	Q637-T639 VanDerWaalsContact CD-O 3.28Å; Q637-T639 WeakPolarHBondContact CG-O 3.4Å; Q637-T639 PolarHBondContact NE2-O 3.42Å
638	L	91.7	Very high	87.9	Confident	2 Å²	2	57 Å²	57	1%	0.01	30%	0.296	C	S	.	.			trans	-108.1	-2.6	-177.7	-61.6	-178.3	0	0	0	113.3	V636 V647 C649 F662 L752 E753 L755	V636-L638 HydrophobicContact CG1-CD2 4.18Å; L638-V647 PolarHBondContact N-O 3.46Å; L638-C649 HydrophobicContact CD1-CB 3.75Å; L638-C649 HydrophobicContact CG-CB 4.2Å; L638-F662 HydrophobicContact CD1-CD1 3.99Å; L638-F662 HydrophobicContact CD1-CE1 3.61Å; L638-L752 HydrophobicContact CB-CB 4.26Å; L638-L752 HydrophobicContact CD1-CD1 4.35Å; L638-E753 HydrophobicContact CD2-CB 4.47Å; L638-E753 WeakPolarHBondContact O-CG 3.46Å; L638-E753 PolarHBondContact O-N 2.99Å; L638-E753 VanDerWaalsContact O-N 3.1Å; L638-L755 HydrophobicContact CD2-CB 4.33Å; L638-L755 HydrophobicContact CD2-CD1 4.13Å
639	T	91.6	Very high	88.5	Confident	8 Å²	8	53.3 Å²	53.3	5%	0.049	27%	0.272	C	S	.	.	S	Bend	trans	-144.8	147.6	173.5	61.3	0	0	0	0	110.5	Q637 Y645 V646 V647 Y750 L752	Q637-T639 VanDerWaalsContact CD-O 3.28Å; Q637-T639 WeakPolarHBondContact CG-O 3.4Å; Q637-T639 PolarHBondContact NE2-O 3.42Å; T639-Y645 VanDerWaalsContact CB-O 3.28Å; T639-Y645 WeakPolarHBondContact CB-O 3.39Å; T639-Y645 PolarHBondContact OG1-O 3.47Å; T639-V646 WeakPolarHBondContact OG1-CA 3.43Å; T639-V647 HydrophobicContact CG2-CB 4.22Å; T639-V647 HydrophobicContact CG2-CG2 4.26Å; T639-V647 PolarHBondContact OG1-N 3.22Å; T639-Y750 HydrophobicContact CG2-CE1 3.89Å; T639-L752 HydrophobicContact CG2-CD2 3.42Å; T639-L752 VanDerWaalsContact CG2-CD2 3.42Å
640	E	84.8	Confident	89	Confident	136 Å²	136	53 Å²	53	64%	0.636	27%	0.271	S	S	*	.			trans	-66	151.7	176.8	-60.1	-177.7	170.5	0	0	111.8	E642 T643	E640-E642 PolarHBondContact O-N 2.86Å; E640-E642 VanDerWaalsContact O-N 3.08Å; E640-T643 HydrophobicContact CB-CG2 4.03Å; E640-T643 PolarHBondContact O-N 3.02Å; E640-T643 PolarHBondContact O-OG1 3.34Å
641	A	76.1	Confident	89.4	Confident	72 Å²	72	52.4 Å²	52.4	60%	0.595	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.2	-172.5	0	0	0	0	0	115
642	E	77.6	Confident	89.7	Confident	191 Å²	191	50.6 Å²	50.6	89%	0.893	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	8.4	-177.6	-60.5	-175.3	178	0	0	113.4	E640	E640-E642 PolarHBondContact O-N 2.86Å; E640-E642 VanDerWaalsContact O-N 3.08Å
643	T	87.2	Confident	89.7	Confident	31 Å²	31	49.7 Å²	49.7	19%	0.19	25%	0.254	C	S	.	.	S	Bend	trans	-85.5	172.7	-180	57.1	0	0	0	0	113	E640 Y645 T667	E640-T643 HydrophobicContact CB-CG2 4.03Å; E640-T643 PolarHBondContact O-N 3.02Å; E640-T643 PolarHBondContact O-OG1 3.34Å; T643-Y645 PolarHBondContact O-N 3.5Å; T643-Y645 PolarHBondContact OG1-O 3.15Å; T643-Y645 VanDerWaalsContact OG1-O 3.11Å; T643-T667 PolarHBondContact O-OG1 3.39Å
644	E	86.2	Confident	89.7	Confident	89 Å²	89	49.1 Å²	49.1	42%	0.416	25%	0.249	S	C	.	.	S	Bend	trans	-59.7	-30.3	-179.8	-56.8	98.8	160.7	0	0	112.8	T667 L668 Y750	E644-T667 VanDerWaalsContact C-OG1 3.22Å; E644-T667 WeakPolarHBondContact CA-OG1 3.42Å; E644-T667 PolarHBondContact O-N 3.33Å; E644-T667 PolarHBondContact O-OG1 2.95Å; E644-L668 HydrophobicContact CB-CD1 4Å; E644-L668 HydrophobicContact CB-CD2 4.36Å; E644-L668 HydrophobicContact CB-CG 4.14Å; E644-L668 HydrophobicContact CG-CD1 4.22Å; E644-L668 HydrophobicContact CG-CD2 4.34Å; E644-Y750 VanDerWaalsContact OE2-CE2 3.31Å; E644-Y750 WeakPolarHBondContact OE2-CE2 2.97Å; E644-Y750 PolarHBondContact OE2-OH 3.28Å
645	Y	90.9	Very high	89.6	Confident	9 Å²	9	45.3 Å²	45.3	4%	0.035	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	126.4	-178.5	-49.8	-60.2	0	0	0	110.7	T639 T643 T665 N666 L668 Q671 L673 M727 Y729 Y750	T639-Y645 VanDerWaalsContact CB-O 3.28Å; T639-Y645 WeakPolarHBondContact CB-O 3.39Å; T639-Y645 PolarHBondContact OG1-O 3.47Å; T643-Y645 PolarHBondContact O-N 3.5Å; T643-Y645 PolarHBondContact OG1-O 3.15Å; T643-Y645 VanDerWaalsContact OG1-O 3.11Å; Y645-T665 WeakPolarHBondContact CA-O 3.49Å; Y645-N666 HydrophobicContact CD1-CB 4.45Å; Y645-L668 HydrophobicContact CE1-CD1 4.43Å; Y645-Q671 PolarHBondContact OH-OE1 3.18Å; Y645-L673 HydrophobicContact CD1-CD1 3.85Å; Y645-L673 HydrophobicContact CE1-CD1 3.55Å; Y645-L673 HydrophobicContact CE1-CD2 4.07Å; Y645-L673 HydrophobicContact CE1-CG 4.27Å; Y645-M727 HydrophobicContact CD1-CE 4.27Å; Y645-M727 HydrophobicContact CD2-CE 3.58Å; Y645-M727 HydrophobicContact CE2-CE 4.12Å; Y645-M727 HydrophobicContact CG-CE 3.65Å; Y645-Y729 HydrophobicContact CE2-CE1 4.34Å; Y645-Y729 AromaticContact CE2-CZ 3.8Å; Y645-Y729 VanDerWaalsContact CE2-OH 3.24Å; Y645-Y729 WeakPolarHBondContact CE2-OH 3.36Å; Y645-Y729 AromaticContact CZ-CZ 3.98Å; Y645-Y729 PolarHBondContact OH-OH 3.31Å; Y645-Y750 HydrophobicContact CD2-CD1 4.24Å; Y645-Y750 AromaticContact CD2-CD2 3.71Å; Y645-Y750 HydrophobicContact CD2-CD2 3.71Å; Y645-Y750 HydrophobicContact CD2-CE1 4.5Å; Y645-Y750 AromaticContact CD2-CE2 3.99Å; Y645-Y750 HydrophobicContact CD2-CE2 3.99Å; Y645-Y750 AromaticContact CD2-CG 3.82Å; Y645-Y750 HydrophobicContact CD2-CG 3.82Å; Y645-Y750 AromaticContact CE2-CD2 3.83Å; Y645-Y750 HydrophobicContact CE2-CD2 3.83Å; Y645-Y750 HydrophobicContact CE2-CE2 4.31Å; Y645-Y750 HydrophobicContact CE2-CG 4.2Å
646	V	91.3	Very high	89.4	Confident	20 Å²	20	50.9 Å²	50.9	12%	0.121	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	113.2	173.7	-179.4	0	0	0	0	108.8	T639 C664 T665 T667	T639-V646 WeakPolarHBondContact OG1-CA 3.43Å; V646-C664 CarbonylContact O-C 3.58Å; V646-C664 WeakPolarHBondContact O-CA 3.49Å; V646-T665 PolarHBondContact N-O 2.86Å; V646-T665 PolarHBondContact O-N 2.72Å; V646-T667 HydrophobicContact CG2-CG2 3.91Å
647	V	93.9	Very high	89.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.9	-178.6	-175.4	0	0	0	0	110.3	L638 T639 F662 D663 C664 M727 L752	L638-V647 PolarHBondContact N-O 3.46Å; T639-V647 HydrophobicContact CG2-CB 4.22Å; T639-V647 HydrophobicContact CG2-CG2 4.26Å; T639-V647 PolarHBondContact OG1-N 3.22Å; V647-F662 HydrophobicContact CG1-CB 4.44Å; V647-F662 HydrophobicContact CG1-CD1 4.13Å; V647-D663 WeakPolarHBondContact CA-O 3.39Å; V647-C664 HydrophobicContact CG2-CB 4.39Å; V647-M727 HydrophobicContact CG2-SD 3.97Å; V647-L752 HydrophobicContact CB-CD2 4.08Å; V647-L752 HydrophobicContact CG1-CD1 4Å; V647-L752 HydrophobicContact CG1-CD2 4.45Å; V647-L752 HydrophobicContact CG2-CD2 3.82Å
648	R	94.3	Very high	89.4	Confident	122 Å²	122	46.7 Å²	46.7	46%	0.46	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134	174.9	-63.5	176.3	179.6	157.6	0.8	110	P635 V636 F662 D663	P635-R648 HydrophobicContact CB-CB 4.43Å; V636-R648 CarbonylContact O-C 3.6Å; V636-R648 VanDerWaalsContact O-CA 3.31Å; V636-R648 WeakPolarHBondContact O-CA 3.13Å; R648-F662 CarbonylContact O-C 3.52Å; R648-F662 WeakPolarHBondContact O-CA 3.28Å; R648-D663 PolarHBondContact N-O 2.98Å; R648-D663 PolarHBondContact O-N 2.99Å
649	C	95	Very high	89.6	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	133.4	178.4	-176.9	0	0	0	0	111.6	P635 V636 L638 Q661 F662 L755	P635-C649 CarbonylContact C-O 3.55Å; P635-C649 WeakPolarHBondContact CA-O 3.46Å; V636-C649 PolarHBondContact N-O 3.41Å; V636-C649 PolarHBondContact O-N 2.95Å; L638-C649 HydrophobicContact CD1-CB 3.75Å; L638-C649 HydrophobicContact CG-CB 4.2Å; C649-Q661 CarbonylContact C-O 3.56Å; C649-Q661 VanDerWaalsContact CA-O 3.26Å; C649-Q661 WeakPolarHBondContact CA-O 3.38Å; C649-F662 HydrophobicContact CB-CD1 3.9Å; C649-F662 HydrophobicContact CB-CE1 3.82Å; C649-L755 HydrophobicContact CB-CD1 4.28Å; C649-L755 HydrophobicContact CB-CD2 4.39Å; C649-L755 VanDerWaalsContact SG-CD2 3.53Å
650	I	94.8	Very high	89.8	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.01	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.5	169.7	-56.4	168.1	0	0	0	108	Y613 P635 H652 Q661	Y613-I650 HydrophobicContact CE1-CD1 4.26Å; Y613-I650 WeakPolarHBondContact OH-CD1 3.34Å; P635-I650 HydrophobicContact CB-CG1 4Å; P635-I650 HydrophobicContact CG-CD1 4.26Å; P635-I650 HydrophobicContact CG-CG1 4.07Å; I650-H652 VanDerWaalsContact CG2-CE1 3.49Å; I650-H652 WeakPolarHBondContact CG2-CE1 3.41Å; I650-Q661 HydrophobicContact CB-CB 4.35Å; I650-Q661 PolarHBondContact N-O 3.27Å; I650-Q661 PolarHBondContact O-N 3Å
651	K	94.2	Very high	90.3	Very high	15 Å²	15	40 Å²	40	7%	0.065	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.9	-179.8	-58.4	179	-95.2	176.8	0	109.2	S632 S633 M658 F660 E756 V757 D761	S632-K651 CarbonylContact C-O 3.49Å; S632-K651 VanDerWaalsContact CA-O 3.28Å; S632-K651 WeakPolarHBondContact CA-O 3.46Å; S633-K651 PolarHBondContact N-O 3.01Å; S633-K651 WeakPolarHBondContact OG-CB 3.35Å; S633-K651 PolarHBondContact OG-N 3.36Å; K651-M658 HydrophobicContact CB-CE 4.07Å; K651-F660 HydrophobicContact CB-CE1 4.49Å; K651-F660 HydrophobicContact CD-CE1 4.03Å; K651-F660 HydrophobicContact CG-CD1 3.84Å; K651-F660 HydrophobicContact CG-CE1 3.75Å; K651-E756 PolarHBondContact NZ-O 3.14Å; K651-V757 HydrophobicContact CD-CG2 4.19Å; K651-D761 WeakPolarHBondContact CE-OD1 3.32Å; K651-D761 VanDerWaalsContact NZ-CG 3.33Å; K651-D761 IonicContact NZ-OD1 2.89Å; K651-D761 PolarHBondContact NZ-OD1 3.09Å; K651-D761 IonicContact NZ-OD2 3.14Å; K651-D761 PolarHBondContact NZ-OD2 3.47Å
652	H	93.1	Very high	91.2	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	108.4	178	-59.7	-71.4	0	0	0	109.9	Y613 L617 L629 K631 S632 I650 F654 M658 V659 Q661	Y613-H652 AromaticContact CD1-CE1 3.84Å; Y613-H652 AromaticContact CG-CE1 3.71Å; L617-H652 HydrophobicContact CD1-CB 3.95Å; L629-H652 HydrophobicContact CD1-CB 3.71Å; K631-H652 CarbonylContact O-C 3.48Å; K631-H652 WeakPolarHBondContact O-CA 3.17Å; S632-H652 PolarHBondContact OG-CE1 3.18Å; S632-H652 PolarHBondContact OG-ND1 3.2Å; I650-H652 VanDerWaalsContact CG2-CE1 3.49Å; I650-H652 WeakPolarHBondContact CG2-CE1 3.41Å; H652-F654 HydrophobicContact CB-CE2 4.25Å; H652-M658 CarbonylContact O-C 3.56Å; H652-M658 VanDerWaalsContact O-CA 3.31Å; H652-M658 WeakPolarHBondContact O-CA 3.4Å; H652-V659 HydrophobicContact CB-CB 4.11Å; H652-V659 WeakPolarHBondContact CB-O 3.38Å; H652-V659 PolarHBondContact N-O 3.1Å; H652-V659 PolarHBondContact O-N 3.15Å; H652-Q661 PolarHBondContact NE2-OE1 3.34Å
653	T	91.3	Very high	92	Very high	2 Å²	2	29.4 Å²	29.4	1%	0.012	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	131.9	-177.1	-48.7	0	0	0	0	110.5	F630 K631 M658 D761	F630-T653 WeakPolarHBondContact CA-O 3.36Å; F630-T653 VanDerWaalsContact CB-O 3.24Å; F630-T653 WeakPolarHBondContact CB-O 3.44Å; F630-T653 HydrophobicContact CD1-CG2 4.31Å; F630-T653 PolarHBondContact N-O 3.16Å; K631-T653 PolarHBondContact N-O 2.62Å; K631-T653 PolarHBondContact O-N 3.38Å; T653-M658 HydrophobicContact CG2-CG 4.2Å; T653-D761 PolarHBondContact OG1-O 2.85Å
654	F	90.3	Very high	92.3	Very high	4 Å²	4	28 Å²	28	2%	0.018	13%	0.13	C	C	.	.			trans	-116.9	-179.5	169.1	-64.8	-97.7	0	0	0	109.6	L617 L626 G627 P628 L629 H652 R656 H657 V659	L617-F654 HydrophobicContact CD1-CE2 4.29Å; L617-F654 HydrophobicContact CD1-CZ 3.98Å; L626-F654 HydrophobicContact CB-CD1 3.79Å; L626-F654 HydrophobicContact CB-CE1 3.92Å; L626-F654 HydrophobicContact CB-CG 4.14Å; L626-F654 HydrophobicContact CB-CZ 4.37Å; L626-F654 HydrophobicContact CD1-CD2 4.31Å; L626-F654 HydrophobicContact CD1-CE2 4.08Å; L626-F654 HydrophobicContact CD1-CZ 4.24Å; G627-F654 WeakPolarHBondContact O-CE1 3.49Å; P628-F654 WeakPolarHBondContact O-CD1 3.4Å; L629-F654 HydrophobicContact CB-CE1 4.09Å; L629-F654 HydrophobicContact CB-CZ 4.31Å; L629-F654 HydrophobicContact CD1-CD2 4.42Å; L629-F654 HydrophobicContact CD1-CE1 4.29Å; L629-F654 HydrophobicContact CD1-CE2 3.9Å; L629-F654 HydrophobicContact CD1-CZ 3.83Å; H652-F654 HydrophobicContact CB-CE2 4.25Å; F654-R656 VanDerWaalsContact C-N 3.34Å; F654-R656 PolarHBondContact O-N 3.29Å; F654-H657 WeakPolarHBondContact CA-O 3.43Å; F654-H657 WeakPolarHBondContact CB-O 3.34Å; F654-H657 PolarHBondContact N-O 3.43Å; F654-V659 HydrophobicContact CD2-CG2 4.35Å; F654-V659 HydrophobicContact CE2-CB 4.3Å; F654-V659 HydrophobicContact CE2-CG2 3.84Å
655	A	84.9	Confident	92.6	Very high	52 Å²	52	25.4 Å²	25.4	43%	0.43	12%	0.12	S	C	.	.	S	Bend	trans	-59.4	-41.1	-178.5	0	0	0	0	0	113.5	R834	A655-R834 PolarHBondContact O-NH1 3.44Å
656	R	86.2	Confident	92.6	Very high	175 Å²	175	25 Å²	25	66%	0.66	12%	0.118	S	C	*	.	S	Bend	trans	-127.3	-1.9	-176.1	-65.1	-172.2	177.2	175.7	-3.1	114.9	F654 L711	F654-R656 VanDerWaalsContact C-N 3.34Å; F654-R656 PolarHBondContact O-N 3.29Å; R656-L711 WeakPolarHBondContact O-CB 3.46Å; R656-L711 PolarHBondContact O-N 3.39Å; R656-L711 VanDerWaalsContact O-N 3.1Å
657	H	90.6	Very high	92.5	Very high	50 Å²	50	26.7 Å²	26.7	23%	0.231	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	158	-174.6	-59.5	89.8	0	0	0	110.1	L626 F654 L708 V709	L626-H657 HydrophobicContact CD2-CB 3.91Å; F654-H657 WeakPolarHBondContact CA-O 3.43Å; F654-H657 WeakPolarHBondContact CB-O 3.34Å; F654-H657 PolarHBondContact N-O 3.43Å; H657-L708 HydrophobicContact CB-CD1 3.95Å; H657-V709 CarbonylContact C-O 3.55Å; H657-V709 WeakPolarHBondContact CA-O 3.39Å
658	M	92.1	Very high	92.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134.5	166.5	-73.5	-177.1	72	0	0	109.4	K651 H652 T653 F660 V709 L711 V757 D761	K651-M658 HydrophobicContact CB-CE 4.07Å; H652-M658 CarbonylContact O-C 3.56Å; H652-M658 VanDerWaalsContact O-CA 3.31Å; H652-M658 WeakPolarHBondContact O-CA 3.4Å; T653-M658 HydrophobicContact CG2-CG 4.2Å; M658-F660 HydrophobicContact CB-CE2 4.05Å; M658-F660 HydrophobicContact CB-CZ 4.4Å; M658-F660 HydrophobicContact CE-CZ 4.31Å; M658-V709 PolarHBondContact N-O 3.24Å; M658-V709 PolarHBondContact O-N 3.01Å; M658-L711 HydrophobicContact CG-CD1 4.41Å; M658-L711 HydrophobicContact CG-CD2 3.82Å; M658-L711 HydrophobicContact CG-CG 4.43Å; M658-L711 HydrophobicContact SD-CD2 3.84Å; M658-V757 HydrophobicContact CE-CG1 4.06Å; M658-V757 HydrophobicContact CE-CG2 4.17Å; M658-V757 HydrophobicContact SD-CG1 3.97Å; M658-D761 HydrophobicContact CE-CB 4.27Å
659	V	94.8	Very high	91.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125	172.5	176.2	0	0	0	0	108.2	L617 F623 L626 H652 F654 Y706 L708	L617-V659 HydrophobicContact CD2-CG1 4.11Å; F623-V659 HydrophobicContact CD1-CG2 4.34Å; F623-V659 HydrophobicContact CD2-CG1 4.48Å; F623-V659 HydrophobicContact CE1-CG2 4.17Å; F623-V659 HydrophobicContact CE2-CG1 3.73Å; F623-V659 HydrophobicContact CE2-CG2 4.35Å; F623-V659 HydrophobicContact CZ-CG1 3.78Å; F623-V659 HydrophobicContact CZ-CG2 4.17Å; L626-V659 HydrophobicContact CD1-CG2 3.74Å; H652-V659 HydrophobicContact CB-CB 4.11Å; H652-V659 WeakPolarHBondContact CB-O 3.38Å; H652-V659 PolarHBondContact N-O 3.1Å; H652-V659 PolarHBondContact O-N 3.15Å; F654-V659 HydrophobicContact CD2-CG2 4.35Å; F654-V659 HydrophobicContact CE2-CB 4.3Å; F654-V659 HydrophobicContact CE2-CG2 3.84Å; V659-Y706 HydrophobicContact CG1-CD1 3.89Å; V659-L708 HydrophobicContact CG2-CD1 3.62Å
660	F	95.6	Very high	91.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	113.7	174	-62.9	-91	0	0	0	108.6	K651 M658 F662 M680 Y706 T707 V709 F723 L755 V757	K651-F660 HydrophobicContact CB-CE1 4.49Å; K651-F660 HydrophobicContact CD-CE1 4.03Å; K651-F660 HydrophobicContact CG-CD1 3.84Å; K651-F660 HydrophobicContact CG-CE1 3.75Å; M658-F660 HydrophobicContact CB-CE2 4.05Å; M658-F660 HydrophobicContact CB-CZ 4.4Å; M658-F660 HydrophobicContact CE-CZ 4.31Å; F660-F662 HydrophobicContact CB-CD2 4.38Å; F660-F662 HydrophobicContact CB-CE2 3.6Å; F660-F662 HydrophobicContact CB-CZ 3.96Å; F660-M680 HydrophobicContact CB-CE 4.42Å; F660-M680 HydrophobicContact CB-SD 3.9Å; F660-M680 HydrophobicContact CD1-CE 3.79Å; F660-M680 HydrophobicContact CD1-SD 4.35Å; F660-M680 HydrophobicContact CD2-CE 3.95Å; F660-M680 HydrophobicContact CD2-SD 3.77Å; F660-M680 HydrophobicContact CE1-CE 3.92Å; F660-M680 HydrophobicContact CE2-CE 4.09Å; F660-M680 HydrophobicContact CE2-SD 4.38Å; F660-M680 HydrophobicContact CG-CE 3.79Å; F660-M680 HydrophobicContact CG-SD 3.75Å; F660-M680 HydrophobicContact CZ-CE 4.06Å; F660-Y706 CarbonylContact O-C 3.49Å; F660-Y706 VanDerWaalsContact O-CA 3.28Å; F660-Y706 WeakPolarHBondContact O-CA 3.48Å; F660-T707 PolarHBondContact N-O 2.92Å; F660-T707 PolarHBondContact O-N 3.33Å; F660-V709 HydrophobicContact CD2-CB 4.39Å; F660-V709 HydrophobicContact CD2-CG2 3.71Å; F660-V709 HydrophobicContact CE2-CB 3.87Å; F660-V709 HydrophobicContact CE2-CG2 3.51Å; F660-F723 HydrophobicContact CE2-CZ 4.47Å; F660-F723 HydrophobicContact CZ-CE2 4.04Å; F660-F723 HydrophobicContact CZ-CZ 4.21Å; F660-L755 HydrophobicContact CD1-CD2 3.36Å; F660-L755 HydrophobicContact CE1-CD2 3.43Å; F660-L755 VanDerWaalsContact CE1-CD2 3.43Å; F660-L755 HydrophobicContact CG-CD2 4.46Å; F660-V757 HydrophobicContact CE1-CG2 3.84Å; F660-V757 HydrophobicContact CZ-CG2 3.69Å
661	Q	95.2	Very high	91	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.023	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	118.6	174	174.4	179.2	-30.8	0	0	109	C649 I650 H652 D663 Y706	C649-Q661 CarbonylContact C-O 3.56Å; C649-Q661 VanDerWaalsContact CA-O 3.26Å; C649-Q661 WeakPolarHBondContact CA-O 3.38Å; I650-Q661 HydrophobicContact CB-CB 4.35Å; I650-Q661 PolarHBondContact N-O 3.27Å; I650-Q661 PolarHBondContact O-N 3Å; H652-Q661 PolarHBondContact NE2-OE1 3.34Å; Q661-D663 PolarHBondContact NE2-OD1 3.5Å; Q661-D663 PolarHBondContact NE2-OD2 2.88Å; Q661-Y706 HydrophobicContact CB-CD1 3.76Å; Q661-Y706 HydrophobicContact CB-CE1 3.59Å; Q661-Y706 HydrophobicContact CG-CD1 4.06Å; Q661-Y706 HydrophobicContact CG-CE1 3.48Å; Q661-Y706 VanDerWaalsContact CG-CE1 3.48Å
662	F	96	Very high	90.8	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	107.7	175.3	-62.8	-86.1	0	0	0	109.7	L638 V647 R648 C649 F660 C664 V678 M680 S704 S705	L638-F662 HydrophobicContact CD1-CD1 3.99Å; L638-F662 HydrophobicContact CD1-CE1 3.61Å; V647-F662 HydrophobicContact CG1-CB 4.44Å; V647-F662 HydrophobicContact CG1-CD1 4.13Å; R648-F662 CarbonylContact O-C 3.52Å; R648-F662 WeakPolarHBondContact O-CA 3.28Å; C649-F662 HydrophobicContact CB-CD1 3.9Å; C649-F662 HydrophobicContact CB-CE1 3.82Å; F660-F662 HydrophobicContact CB-CD2 4.38Å; F660-F662 HydrophobicContact CB-CE2 3.6Å; F660-F662 HydrophobicContact CB-CZ 3.96Å; F662-C664 PolarHBondContact O-N 3.34Å; F662-V678 HydrophobicContact CB-CG2 3.85Å; F662-V678 HydrophobicContact CD1-CB 4.07Å; F662-V678 HydrophobicContact CD1-CG1 3.97Å; F662-V678 HydrophobicContact CD1-CG2 3.88Å; F662-V678 HydrophobicContact CD2-CB 3.72Å; F662-V678 HydrophobicContact CD2-CG1 4.25Å; F662-V678 HydrophobicContact CD2-CG2 3.99Å; F662-V678 HydrophobicContact CE1-CB 4.16Å; F662-V678 HydrophobicContact CE1-CG1 3.66Å; F662-V678 HydrophobicContact CE1-CG2 4.42Å; F662-V678 HydrophobicContact CE2-CB 3.82Å; F662-V678 HydrophobicContact CE2-CG1 3.95Å; F662-V678 HydrophobicContact CG-CB 3.84Å; F662-V678 HydrophobicContact CG-CG1 4.25Å; F662-V678 HydrophobicContact CG-CG2 3.63Å; F662-V678 HydrophobicContact CZ-CB 4.04Å; F662-V678 HydrophobicContact CZ-CG1 3.64Å; F662-M680 HydrophobicContact CE2-CG 4.32Å; F662-M680 HydrophobicContact CE2-SD 3.75Å; F662-M680 HydrophobicContact CZ-CE 4.09Å; F662-M680 HydrophobicContact CZ-CG 3.98Å; F662-M680 HydrophobicContact CZ-SD 3.54Å; F662-M680 VanDerWaalsContact CZ-SD 3.54Å; F662-S704 CarbonylContact O-C 3.55Å; F662-S704 VanDerWaalsContact O-CA 3.29Å; F662-S704 WeakPolarHBondContact O-CA 3.25Å; F662-S705 PolarHBondContact N-O 2.87Å; F662-S705 PolarHBondContact O-N 3.12Å
663	D	94	Very high	90.7	Very high	42 Å²	42	32 Å²	32	23%	0.225	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	104.8	171.7	-66.4	-24.1	0	0	0	108.5	V647 R648 Q661 S704	V647-D663 WeakPolarHBondContact CA-O 3.39Å; R648-D663 PolarHBondContact N-O 2.98Å; R648-D663 PolarHBondContact O-N 2.99Å; Q661-D663 PolarHBondContact NE2-OD1 3.5Å; Q661-D663 PolarHBondContact NE2-OD2 2.88Å; D663-S704 WeakPolarHBondContact OD1-CB 3.23Å; D663-S704 PolarHBondContact OD1-OG 3.45Å
664	C	93.8	Very high	90.7	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.014	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.6	-175.6	-58.3	0	0	0	0	110.2	V646 V647 F662 L697 P702 G703 M727	V646-C664 CarbonylContact O-C 3.58Å; V646-C664 WeakPolarHBondContact O-CA 3.49Å; V647-C664 HydrophobicContact CG2-CB 4.39Å; F662-C664 PolarHBondContact O-N 3.34Å; C664-L697 HydrophobicContact CB-CD1 3.48Å; C664-L697 VanDerWaalsContact CB-CD1 3.48Å; C664-P702 WeakPolarHBondContact O-CA 3.48Å; C664-G703 PolarHBondContact N-O 2.99Å; C664-G703 PolarHBondContact O-N 3.24Å; C664-M727 HydrophobicContact CB-SD 4.47Å
665	T	92.4	Very high	90.7	Very high	34 Å²	34	41 Å²	41	21%	0.209	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	125.1	174.7	-52.2	0	0	0	0	110	Y645 V646	Y645-T665 WeakPolarHBondContact CA-O 3.49Å; V646-T665 PolarHBondContact N-O 2.86Å; V646-T665 PolarHBondContact O-N 2.72Å
666	N	91.3	Very high	91.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	121.9	173.5	178.9	14.6	0	0	0	110.9	Y645 L668 Q671 L673 L697 S700	Y645-N666 HydrophobicContact CD1-CB 4.45Å; N666-L668 PolarHBondContact ND2-O 3.23Å; N666-L668 WeakPolarHBondContact OD1-CB 3.43Å; N666-L668 PolarHBondContact OD1-N 3.46Å; N666-L668 PolarHBondContact OD1-O 3.26Å; N666-Q671 PolarHBondContact ND2-O 3.37Å; N666-L673 HydrophobicContact CB-CD1 4.24Å; N666-L673 HydrophobicContact CB-CG 4.43Å; N666-L697 HydrophobicContact CB-CB 4.42Å; N666-S700 PolarHBondContact O-N 3.47Å
667	T	89.6	Confident	91.6	Very high	55 Å²	55	31.4 Å²	31.4	34%	0.337	16%	0.16	S	C	.	.			trans	-99.7	0.3	178.4	74	0	0	0	0	113.1	T643 E644 V646 Y699	T643-T667 PolarHBondContact O-OG1 3.39Å; E644-T667 VanDerWaalsContact C-OG1 3.22Å; E644-T667 WeakPolarHBondContact CA-OG1 3.42Å; E644-T667 PolarHBondContact O-N 3.33Å; E644-T667 PolarHBondContact O-OG1 2.95Å; V646-T667 HydrophobicContact CG2-CG2 3.91Å; T667-Y699 VanDerWaalsContact O-CE2 3.25Å; T667-Y699 WeakPolarHBondContact O-CE2 3.23Å
668	L	87	Confident	91.8	Very high	44 Å²	44	29 Å²	29	23%	0.23	15%	0.149	C	C	.	.			trans	-93.5	127.3	175.4	-57.9	-178.3	0	0	0	110.6	E644 Y645 N666 Q671 Y699	E644-L668 HydrophobicContact CB-CD1 4Å; E644-L668 HydrophobicContact CB-CD2 4.36Å; E644-L668 HydrophobicContact CB-CG 4.14Å; E644-L668 HydrophobicContact CG-CD1 4.22Å; E644-L668 HydrophobicContact CG-CD2 4.34Å; Y645-L668 HydrophobicContact CE1-CD1 4.43Å; N666-L668 PolarHBondContact ND2-O 3.23Å; N666-L668 WeakPolarHBondContact OD1-CB 3.43Å; N666-L668 PolarHBondContact OD1-N 3.46Å; N666-L668 PolarHBondContact OD1-O 3.26Å; L668-Q671 HydrophobicContact CB-CB 4.44Å; L668-Y699 VanDerWaalsContact C-CD2 3.48Å; L668-Y699 WeakPolarHBondContact O-CD2 3.38Å
669	N	86.3	Confident	91.9	Very high	79 Å²	79	32 Å²	32	42%	0.422	16%	0.163	S	C	.	.	S	Bend	trans	-91.1	-7.6	-176.3	68.9	-28.1	0	0	0	114.1	Y699	N669-Y699 HydrophobicContact CB-CD1 3.89Å; N669-Y699 HydrophobicContact CB-CD2 3.69Å; N669-Y699 HydrophobicContact CB-CE1 4.02Å; N669-Y699 HydrophobicContact CB-CE2 3.83Å; N669-Y699 HydrophobicContact CB-CG 3.71Å
670	D	85.4	Confident	91.8	Very high	68 Å²	68	32.1 Å²	32.1	36%	0.364	16%	0.164	S	C	.	.	S	Bend	trans	-99.8	4.9	177.8	60.3	-21.8	0	0	0	112.9	D733 C734 P736	D670-D733 CarbonylContact O-C 3.51Å; D670-D733 WeakPolarHBondContact O-CA 3.35Å; D670-C734 WeakPolarHBondContact CA-O 3.45Å; D670-C734 PolarHBondContact O-N 3.01Å; D670-P736 HydrophobicContact CB-CG 4.06Å
671	Q	86.9	Confident	91.6	Very high	33 Å²	33	38.6 Å²	38.6	15%	0.154	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	143.9	-177.9	-63.1	-178.7	4.9	0	0	112.1	Y645 N666 L668 V731 R732	Y645-Q671 PolarHBondContact OH-OE1 3.18Å; N666-Q671 PolarHBondContact ND2-O 3.37Å; L668-Q671 HydrophobicContact CB-CB 4.44Å; Q671-V731 HydrophobicContact CB-CG1 4.3Å; Q671-V731 HydrophobicContact CG-CG1 4.1Å; Q671-R732 WeakPolarHBondContact CA-O 3.34Å
672	L	89.2	Confident	91.4	Very high	25 Å²	25	40.4 Å²	40.4	13%	0.131	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	121.8	167.1	173.2	68.1	0	0	0	108.7	Q674 P698 R732 C734 P741	L672-Q674 HydrophobicContact CD2-CG 4.42Å; L672-Q674 HydrophobicContact CG-CG 4.33Å; L672-P698 HydrophobicContact CD1-CB 4.17Å; L672-P698 HydrophobicContact CD1-CG 4.01Å; L672-R732 PolarHBondContact N-O 3.4Å; L672-R732 PolarHBondContact O-N 3.35Å; L672-C734 WeakPolarHBondContact CB-SG 3.38Å; L672-C734 PolarHBondContact N-SG 3.3Å; L672-P741 HydrophobicContact CD2-CB 3.93Å; L672-P741 HydrophobicContact CD2-CG 4Å
673	L	91.4	Very high	90.8	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.9	175.5	-40.6	179.7	0	0	0	109.8	Y645 N666 V676 S696 L697 M727 Y729 V731	Y645-L673 HydrophobicContact CD1-CD1 3.85Å; Y645-L673 HydrophobicContact CE1-CD1 3.55Å; Y645-L673 HydrophobicContact CE1-CD2 4.07Å; Y645-L673 HydrophobicContact CE1-CG 4.27Å; N666-L673 HydrophobicContact CB-CD1 4.24Å; N666-L673 HydrophobicContact CB-CG 4.43Å; L673-V676 HydrophobicContact CB-CG2 3.6Å; L673-V676 HydrophobicContact CD1-CG2 4.39Å; L673-S696 CarbonylContact O-C 3.54Å; L673-S696 VanDerWaalsContact O-CA 3.27Å; L673-S696 WeakPolarHBondContact O-CA 3.18Å; L673-L697 HydrophobicContact CB-CB 4.17Å; L673-L697 HydrophobicContact CD1-CB 4.47Å; L673-L697 HydrophobicContact CD1-CD1 4.34Å; L673-L697 PolarHBondContact N-O 3.06Å; L673-L697 PolarHBondContact O-N 2.74Å; L673-M727 HydrophobicContact CD1-CE 4.46Å; L673-Y729 HydrophobicContact CB-CD2 4.42Å; L673-Y729 HydrophobicContact CD1-CD2 4.38Å; L673-Y729 HydrophobicContact CD1-CG 4.42Å; L673-Y729 HydrophobicContact CD2-CD2 3.65Å; L673-Y729 HydrophobicContact CD2-CE2 3.83Å; L673-Y729 HydrophobicContact CD2-CG 4.42Å; L673-Y729 HydrophobicContact CG-CD2 4.36Å; L673-V731 HydrophobicContact CD2-CG2 4.22Å
674	Q	91.3	Very high	89.9	Confident	52 Å²	52	47.4 Å²	47.4	24%	0.243	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	150.6	175.2	-66.9	-175.3	-19.3	0	0	110.9	L672 V676 L730	L672-Q674 HydrophobicContact CD2-CG 4.42Å; L672-Q674 HydrophobicContact CG-CG 4.33Å; Q674-V676 VanDerWaalsContact C-N 3.3Å; Q674-V676 PolarHBondContact O-N 3.01Å; Q674-L730 HydrophobicContact CB-CD2 4.42Å; Q674-L730 PolarHBondContact N-O 3.39Å; Q674-L730 PolarHBondContact O-N 3.08Å
675	K	91.1	Very high	89	Confident	145 Å²	145	50.6 Å²	50.6	63%	0.63	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	52.5	45.9	178.8	-57.5	178.3	179.6	174.4	0	113.1	V677 A694 P695	K675-V677 PolarHBondContact O-N 2.96Å; K675-A694 WeakPolarHBondContact CA-O 3.46Å; K675-A694 PolarHBondContact N-O 3.31Å; K675-P695 PolarHBondContact N-O 2.99Å; K675-P695 VanDerWaalsContact N-O 3.09Å
676	V	93.8	Very high	88.6	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	121.5	-176	-173.3	0	0	0	0	109.6	L673 Q674 P693 A694 L697 S705 M727 K728	L673-V676 HydrophobicContact CB-CG2 3.6Å; L673-V676 HydrophobicContact CD1-CG2 4.39Å; Q674-V676 VanDerWaalsContact C-N 3.3Å; Q674-V676 PolarHBondContact O-N 3.01Å; V676-P693 CarbonylContact O-C 3.59Å; V676-P693 VanDerWaalsContact O-CA 3.28Å; V676-P693 WeakPolarHBondContact O-CA 3.48Å; V676-A694 HydrophobicContact CB-CB 4.28Å; V676-A694 PolarHBondContact N-O 3.34Å; V676-A694 PolarHBondContact O-N 3.48Å; V676-L697 HydrophobicContact CB-CD1 3.92Å; V676-L697 HydrophobicContact CB-CG 4.49Å; V676-L697 HydrophobicContact CG1-CD1 3.95Å; V676-L697 HydrophobicContact CG2-CD1 3.58Å; V676-L697 HydrophobicContact CG2-CG 3.91Å; V676-S705 PolarHBondContact O-OG 3.17Å; V676-M727 HydrophobicContact CG1-CG 3.6Å; V676-M727 HydrophobicContact CG1-SD 3.71Å; V676-K728 WeakPolarHBondContact CA-O 3.3Å
677	V	95.3	Very high	88.4	Confident	24 Å²	24	55 Å²	55	15%	0.145	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	136.2	178.4	174.6	0	0	0	0	108.9	K675 Q679 Y691 P693 M727 K728	K675-V677 PolarHBondContact O-N 2.96Å; V677-Q679 HydrophobicContact CG1-CG 4.35Å; V677-Y691 HydrophobicContact CG1-CD1 3.71Å; V677-Y691 HydrophobicContact CG1-CG 3.79Å; V677-P693 HydrophobicContact CG2-CB 3.55Å; V677-P693 HydrophobicContact CG2-CG 4.47Å; V677-M727 CarbonylContact O-C 3.57Å; V677-M727 WeakPolarHBondContact O-CA 3.3Å; V677-K728 PolarHBondContact N-O 2.78Å; V677-K728 PolarHBondContact O-N 3.41Å
678	V	95.3	Very high	88.4	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	106.9	168.1	-176.9	0	0	0	0	109.2	F662 M680 Y691 T707 C725 M727 L752	F662-V678 HydrophobicContact CB-CG2 3.85Å; F662-V678 HydrophobicContact CD1-CB 4.07Å; F662-V678 HydrophobicContact CD1-CG1 3.97Å; F662-V678 HydrophobicContact CD1-CG2 3.88Å; F662-V678 HydrophobicContact CD2-CB 3.72Å; F662-V678 HydrophobicContact CD2-CG1 4.25Å; F662-V678 HydrophobicContact CD2-CG2 3.99Å; F662-V678 HydrophobicContact CE1-CB 4.16Å; F662-V678 HydrophobicContact CE1-CG1 3.66Å; F662-V678 HydrophobicContact CE1-CG2 4.42Å; F662-V678 HydrophobicContact CE2-CB 3.82Å; F662-V678 HydrophobicContact CE2-CG1 3.95Å; F662-V678 HydrophobicContact CG-CB 3.84Å; F662-V678 HydrophobicContact CG-CG1 4.25Å; F662-V678 HydrophobicContact CG-CG2 3.63Å; F662-V678 HydrophobicContact CZ-CB 4.04Å; F662-V678 HydrophobicContact CZ-CG1 3.64Å; V678-M680 HydrophobicContact CG1-CG 4.49Å; V678-Y691 WeakPolarHBondContact O-CE1 3.34Å; V678-T707 PolarHBondContact O-OG1 2.98Å; V678-C725 HydrophobicContact CG1-CB 4.11Å; V678-M727 HydrophobicContact CG2-CB 4.33Å; V678-M727 HydrophobicContact CG2-CG 4.13Å; V678-L752 HydrophobicContact CG1-CD1 3.78Å; V678-L752 HydrophobicContact CG2-CD1 4.16Å
679	Q	93.7	Very high	88.5	Confident	63 Å²	63	54 Å²	54	29%	0.294	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	131.4	171.1	-69.1	-167.6	-19.5	0	0	109.3	V677 Y691 C725 T726 K728	V677-Q679 HydrophobicContact CG1-CG 4.35Å; Q679-Y691 HydrophobicContact CG-CE1 4.48Å; Q679-C725 CarbonylContact O-C 3.56Å; Q679-C725 WeakPolarHBondContact O-CA 3.28Å; Q679-T726 PolarHBondContact N-O 3.09Å; Q679-T726 PolarHBondContact O-N 3.33Å; Q679-K728 HydrophobicContact CG-CD 4.24Å
680	M	93.6	Very high	88.6	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	130.3	179.2	-59.3	-180	75.1	0	0	108.5	F660 F662 V678 T707 F723 S724 L755	F660-M680 HydrophobicContact CB-CE 4.42Å; F660-M680 HydrophobicContact CB-SD 3.9Å; F660-M680 HydrophobicContact CD1-CE 3.79Å; F660-M680 HydrophobicContact CD1-SD 4.35Å; F660-M680 HydrophobicContact CD2-CE 3.95Å; F660-M680 HydrophobicContact CD2-SD 3.77Å; F660-M680 HydrophobicContact CE1-CE 3.92Å; F660-M680 HydrophobicContact CE2-CE 4.09Å; F660-M680 HydrophobicContact CE2-SD 4.38Å; F660-M680 HydrophobicContact CG-CE 3.79Å; F660-M680 HydrophobicContact CG-SD 3.75Å; F660-M680 HydrophobicContact CZ-CE 4.06Å; F662-M680 HydrophobicContact CE2-CG 4.32Å; F662-M680 HydrophobicContact CE2-SD 3.75Å; F662-M680 HydrophobicContact CZ-CE 4.09Å; F662-M680 HydrophobicContact CZ-CG 3.98Å; F662-M680 HydrophobicContact CZ-SD 3.54Å; F662-M680 VanDerWaalsContact CZ-SD 3.54Å; V678-M680 HydrophobicContact CG1-CG 4.49Å; M680-T707 HydrophobicContact CB-CG2 4.48Å; M680-T707 HydrophobicContact CG-CG2 4.13Å; M680-T707 HydrophobicContact SD-CG2 3.71Å; M680-F723 HydrophobicContact CB-CD1 4.01Å; M680-F723 HydrophobicContact CE-CB 3.64Å; M680-F723 HydrophobicContact CE-CD1 3.75Å; M680-F723 HydrophobicContact CE-CD2 4.17Å; M680-F723 HydrophobicContact CE-CE1 4.38Å; M680-F723 HydrophobicContact CE-CG 3.6Å; M680-S724 WeakPolarHBondContact CA-O 3.47Å; M680-L755 HydrophobicContact CE-CD2 3.71Å
681	E	92	Very high	88.9	Confident	136 Å²	136	56.8 Å²	56.8	64%	0.636	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.2	173.9	-67.2	-173	175.4	0	0	108.9	F723 S724	E681-F723 WeakPolarHBondContact O-CA 3.42Å; E681-S724 PolarHBondContact N-O 2.88Å; E681-S724 PolarHBondContact O-N 3.09Å
682	P	90.4	Very high	89.2	Confident	43 Å²	43	56.8 Å²	56.8	28%	0.279	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	143.4	-179.9	25.4	-27.4	0	0	0	112.1	Y686 F723	P682-Y686 WeakPolarHBondContact CG-O 3.4Å; P682-F723 HydrophobicContact CB-CD1 3.8Å; P682-F723 HydrophobicContact CB-CE1 3.54Å; P682-F723 HydrophobicContact CB-CZ 4.21Å; P682-F723 HydrophobicContact CG-CE1 4.26Å
683	S	84.3	Confident	89.4	Confident	78 Å²	78	58.4 Å²	58.4	55%	0.545	31%	0.308	S	S	.	.	S	Bend	trans	-74.4	-27	171.4	64.7	0	0	0	0	113.4	T722	S683-T722 WeakPolarHBondContact CB-O 3.26Å; S683-T722 PolarHBondContact N-O 2.86Å; S683-T722 PolarHBondContact OG-N 2.98Å; S683-T722 VanDerWaalsContact OG-N 3.14Å; S683-T722 PolarHBondContact OG-O 3.22Å
684	E	74.2	Confident	89.4	Confident	110 Å²	110	58.4 Å²	58.4	51%	0.514	31%	0.308	S	S	.	.	S	Bend	trans	-117.2	-178.1	-176.1	-69.2	-66	162.7	0	0	111.2	Y686 C721	E684-Y686 HydrophobicContact CB-CD2 4.44Å; E684-Y686 PolarHBondContact O-N 3.3Å; E684-C721 HydrophobicContact CB-CB 4.28Å
685	A	75.1	Confident	89.3	Confident	70 Å²	70	61 Å²	61	58%	0.579	33%	0.33	S	S	*	.	S	Bend	trans	-68.1	28.6	-173.8	0	0	0	0	0	116.6	P712	A685-P712 HydrophobicContact CB-CB 4.48Å
686	Y	83.8	Confident	89.3	Confident	11 Å²	11	56.9 Å²	56.9	4%	0.043	32%	0.319	C	S	.	.			trans	-73.7	137.6	170.8	-80.2	-112.9	0	0	0	109.9	P682 E684 V709 L711 P712 A718 V719 C721 F723 H762	P682-Y686 WeakPolarHBondContact CG-O 3.4Å; E684-Y686 HydrophobicContact CB-CD2 4.44Å; E684-Y686 PolarHBondContact O-N 3.3Å; Y686-V709 HydrophobicContact CD1-CG1 3.74Å; Y686-V709 HydrophobicContact CG-CG1 4.31Å; Y686-L711 HydrophobicContact CD1-CD2 4.03Å; Y686-L711 HydrophobicContact CE1-CD2 3.3Å; Y686-P712 HydrophobicContact CD2-CG 3.72Å; Y686-P712 HydrophobicContact CE2-CG 3.76Å; Y686-P712 HydrophobicContact CG-CG 4.27Å; Y686-A718 WeakPolarHBondContact CE2-O 3.31Å; Y686-V719 PolarHBondContact OH-O 3.44Å; Y686-C721 HydrophobicContact CD2-CB 3.58Å; Y686-C721 HydrophobicContact CE2-CB 3.48Å; Y686-C721 VanDerWaalsContact CE2-CB 3.48Å; Y686-C721 HydrophobicContact CG-CB 4.3Å; Y686-F723 HydrophobicContact CD1-CE2 4.5Å; Y686-F723 AromaticContact CD1-CZ 3.73Å; Y686-F723 HydrophobicContact CD1-CZ 3.73Å; Y686-F723 HydrophobicContact CE1-CZ 4.38Å; Y686-F723 AromaticContact CG-CZ 3.86Å; Y686-F723 HydrophobicContact CG-CZ 3.86Å; Y686-H762 PolarHBondContact OH-NE2 3.34Å
687	E	86.5	Confident	89.1	Confident	114 Å²	114	57 Å²	57	53%	0.533	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117.5	-179.5	-175.3	-173.5	-172.1	0	0	110.1	A689 V709 R710	E687-A689 PolarHBondContact O-N 2.94Å; E687-V709 CarbonylContact O-C 3.59Å; E687-V709 WeakPolarHBondContact O-CA 3.33Å; E687-V709 WeakPolarHBondContact O-CG1 3.45Å; E687-R710 HydrophobicContact CB-CB 4.36Å; E687-R710 PolarHBondContact N-O 3.33Å; E687-R710 PolarHBondContact O-N 2.9Å
688	V	90.8	Very high	88.9	Confident	36 Å²	36	57.6 Å²	57.6	22%	0.218	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	113.7	174.2	-172.2	0	0	0	0	109.4	Y691 T707 V709	V688-Y691 HydrophobicContact CG1-CE1 3.71Å; V688-Y691 HydrophobicContact CG1-CE2 4.06Å; V688-Y691 VanDerWaalsContact CG1-CZ 3.45Å; V688-Y691 WeakPolarHBondContact CG1-OH 3.45Å; V688-T707 HydrophobicContact CG1-CG2 3.58Å; V688-V709 HydrophobicContact CG1-CG2 4.41Å; V688-V709 HydrophobicContact CG2-CG2 4.14Å
689	A	87.9	Confident	88.5	Confident	42 Å²	42	63.6 Å²	63.6	35%	0.347	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-50.3	-172.5	0	0	0	0	0	112.3	E687 L708	E687-A689 PolarHBondContact O-N 2.94Å; A689-L708 HydrophobicContact CB-CD2 4.24Å; A689-L708 HydrophobicContact CB-CG 4.23Å; A689-L708 PolarHBondContact N-O 3.23Å
690	H	88.3	Confident	88.2	Confident	117 Å²	117	64.5 Å²	64.5	54%	0.542	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	151.1	-172.3	-67.1	78.5	0	0	0	112.2	L708	H690-L708 HydrophobicContact CB-CB 4.31Å; H690-L708 PolarHBondContact N-O 2.86Å; H690-L708 PolarHBondContact O-N 3.45Å
691	Y	92.4	Very high	87.8	Confident	90 Å²	90	69.9 Å²	69.9	35%	0.353	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	135.5	171.3	-57.4	-80.9	0	0	0	110.1	V677 V678 Q679 V688 T707	V677-Y691 HydrophobicContact CG1-CD1 3.71Å; V677-Y691 HydrophobicContact CG1-CG 3.79Å; V678-Y691 WeakPolarHBondContact O-CE1 3.34Å; Q679-Y691 HydrophobicContact CG-CE1 4.48Å; V688-Y691 HydrophobicContact CG1-CE1 3.71Å; V688-Y691 HydrophobicContact CG1-CE2 4.06Å; V688-Y691 VanDerWaalsContact CG1-CZ 3.45Å; V688-Y691 WeakPolarHBondContact CG1-OH 3.45Å; Y691-T707 HydrophobicContact CD1-CG2 3.69Å; Y691-T707 WeakPolarHBondContact CD1-OG1 3Å; Y691-T707 HydrophobicContact CE1-CG2 3.51Å
692	I	92.6	Very high	87.7	Confident	32 Å²	32	68.2 Å²	68.2	16%	0.164	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	106.7	174.9	-52.9	-174.6	0	0	0	107.8	I620 E622 F623 S705 Y706	I620-I692 HydrophobicContact CG2-CD1 3.48Å; I620-I692 VanDerWaalsContact CG2-CD1 3.48Å; E622-I692 HydrophobicContact CB-CD1 4.15Å; E622-I692 HydrophobicContact CG-CD1 4.41Å; F623-I692 HydrophobicContact CE1-CD1 3.71Å; F623-I692 HydrophobicContact CE2-CD1 3.82Å; F623-I692 HydrophobicContact CZ-CD1 3.32Å; F623-I692 HydrophobicContact CZ-CG1 4.22Å; I692-S705 WeakPolarHBondContact O-CA 3.44Å; I692-S705 PolarHBondContact O-OG 3.36Å; I692-S705 VanDerWaalsContact O-OG 3.06Å; I692-Y706 HydrophobicContact CB-CD2 4.37Å; I692-Y706 HydrophobicContact CG2-CD2 4.41Å; I692-Y706 PolarHBondContact N-O 3.49Å; I692-Y706 PolarHBondContact O-N 2.85Å
693	P	93.3	Very high	87.7	Confident	59 Å²	59	67 Å²	67	38%	0.383	38%	0.382	S	S	.	.			trans	-70.8	146.2	-176.4	26.1	-32.8	0	0	0	112.5	V676 V677 P695	V676-P693 CarbonylContact O-C 3.59Å; V676-P693 VanDerWaalsContact O-CA 3.28Å; V676-P693 WeakPolarHBondContact O-CA 3.48Å; V677-P693 HydrophobicContact CG2-CB 3.55Å; V677-P693 HydrophobicContact CG2-CG 4.47Å; P693-P695 WeakPolarHBondContact O-CD 3.45Å
694	A	91.9	Very high	88.1	Confident	1 Å²	1	65.1 Å²	65.1	1%	0.008	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	124.2	159.8	0	0	0	0	0	108.9	K675 V676 S696 L697	K675-A694 WeakPolarHBondContact CA-O 3.46Å; K675-A694 PolarHBondContact N-O 3.31Å; V676-A694 HydrophobicContact CB-CB 4.28Å; V676-A694 PolarHBondContact N-O 3.34Å; V676-A694 PolarHBondContact O-N 3.48Å; A694-S696 PolarHBondContact O-N 2.65Å; A694-L697 HydrophobicContact CB-CD2 4.25Å; A694-L697 HydrophobicContact CB-CG 4.44Å
695	P	89.9	Confident	89.1	Confident	108 Å²	108	59.9 Å²	59.9	70%	0.701	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.8	-44.4	-173.1	-25.8	33.8	0	0	0	113.5	K675 P693	K675-P695 PolarHBondContact N-O 2.99Å; K675-P695 VanDerWaalsContact N-O 3.09Å; P693-P695 WeakPolarHBondContact O-CD 3.45Å
696	S	90.9	Very high	90.1	Very high	58 Å²	58	57.4 Å²	57.4	41%	0.406	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	141.8	-179.7	59.3	0	0	0	0	111.2	L673 A694	L673-S696 CarbonylContact O-C 3.54Å; L673-S696 VanDerWaalsContact O-CA 3.27Å; L673-S696 WeakPolarHBondContact O-CA 3.18Å; A694-S696 PolarHBondContact O-N 2.65Å
697	L	90.1	Very high	90.6	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	90.4	173.4	-60.7	178.6	0	0	0	110.5	C664 N666 L673 V676 A694 G703	C664-L697 HydrophobicContact CB-CD1 3.48Å; C664-L697 VanDerWaalsContact CB-CD1 3.48Å; N666-L697 HydrophobicContact CB-CB 4.42Å; L673-L697 HydrophobicContact CB-CB 4.17Å; L673-L697 HydrophobicContact CD1-CB 4.47Å; L673-L697 HydrophobicContact CD1-CD1 4.34Å; L673-L697 PolarHBondContact N-O 3.06Å; L673-L697 PolarHBondContact O-N 2.74Å; V676-L697 HydrophobicContact CB-CD1 3.92Å; V676-L697 HydrophobicContact CB-CG 4.49Å; V676-L697 HydrophobicContact CG1-CD1 3.95Å; V676-L697 HydrophobicContact CG2-CD1 3.58Å; V676-L697 HydrophobicContact CG2-CG 3.91Å; A694-L697 HydrophobicContact CB-CD2 4.25Å; A694-L697 HydrophobicContact CB-CG 4.44Å; L697-G703 VanDerWaalsContact CD2-N 3.3Å
698	P	89.6	Confident	90.9	Very high	37 Å²	37	52 Å²	52	24%	0.24	30%	0.296	C	S	.	.			trans	-68	165.3	171.3	-17	30.9	0	0	0	112.7	L672 S700 Q701	L672-P698 HydrophobicContact CD1-CB 4.17Å; L672-P698 HydrophobicContact CD1-CG 4.01Å; P698-S700 PolarHBondContact O-N 3.04Å; P698-Q701 HydrophobicContact CB-CB 4.35Å; P698-Q701 HydrophobicContact CB-CG 4.46Å; P698-Q701 HydrophobicContact CG-CB 4.47Å; P698-Q701 PolarHBondContact O-N 2.86Å; P698-Q701 VanDerWaalsContact O-N 3.17Å
699	Y	88.1	Confident	91	Very high	127 Å²	127	50.3 Å²	50.3	50%	0.498	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-51.7	125.7	175.6	175.7	-118.7	0	0	0	112.6	T667 L668 N669 Q701	T667-Y699 VanDerWaalsContact O-CE2 3.25Å; T667-Y699 WeakPolarHBondContact O-CE2 3.23Å; L668-Y699 VanDerWaalsContact C-CD2 3.48Å; L668-Y699 WeakPolarHBondContact O-CD2 3.38Å; N669-Y699 HydrophobicContact CB-CD1 3.89Å; N669-Y699 HydrophobicContact CB-CD2 3.69Å; N669-Y699 HydrophobicContact CB-CE1 4.02Å; N669-Y699 HydrophobicContact CB-CE2 3.83Å; N669-Y699 HydrophobicContact CB-CG 3.71Å; Y699-Q701 PolarHBondContact O-N 2.79Å; Y699-Q701 VanDerWaalsContact O-N 3.13Å
700	S	86	Confident	91.1	Very high	82 Å²	82	53.2 Å²	53.2	57%	0.573	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	19.9	177	-151.5	0	0	0	0	115	N666 P698	N666-S700 PolarHBondContact O-N 3.47Å; P698-S700 PolarHBondContact O-N 3.04Å
701	Q	86.5	Confident	91	Very high	116 Å²	116	47.9 Å²	47.9	54%	0.542	26%	0.263	S	S	.	.			trans	-112.6	117.6	173.9	-67.4	-175.1	27.1	0	0	110.1	P698 Y699	P698-Q701 HydrophobicContact CB-CB 4.35Å; P698-Q701 HydrophobicContact CB-CG 4.46Å; P698-Q701 HydrophobicContact CG-CB 4.47Å; P698-Q701 PolarHBondContact O-N 2.86Å; P698-Q701 VanDerWaalsContact O-N 3.17Å; Y699-Q701 PolarHBondContact O-N 2.79Å; Y699-Q701 VanDerWaalsContact O-N 3.13Å
702	P	88.4	Confident	90.5	Very high	101 Å²	101	44.4 Å²	44.4	66%	0.656	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	144.4	178.1	29.1	-33.4	0	0	0	110.9	C664	C664-P702 WeakPolarHBondContact O-CA 3.48Å
703	G	91.3	Very high	89.4	Confident	17 Å²	17	47.2 Å²	47.2	18%	0.175	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	156.1	168.1	0	0	0	0	0	111.2	C664 L697	C664-G703 PolarHBondContact N-O 2.99Å; C664-G703 PolarHBondContact O-N 3.24Å; L697-G703 VanDerWaalsContact CD2-N 3.3Å
704	S	93.1	Very high	88.2	Confident	39 Å²	39	52.3 Å²	52.3	27%	0.273	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	129.7	-173.3	-53	0	0	0	0	111.3	F662 D663	F662-S704 CarbonylContact O-C 3.55Å; F662-S704 VanDerWaalsContact O-CA 3.29Å; F662-S704 WeakPolarHBondContact O-CA 3.25Å; D663-S704 WeakPolarHBondContact OD1-CB 3.23Å; D663-S704 PolarHBondContact OD1-OG 3.45Å
705	S	94.4	Very high	87.2	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	151.2	166.7	178.3	0	0	0	0	108.9	F662 V676 I692	F662-S705 PolarHBondContact N-O 2.87Å; F662-S705 PolarHBondContact O-N 3.12Å; V676-S705 PolarHBondContact O-OG 3.17Å; I692-S705 WeakPolarHBondContact O-CA 3.44Å; I692-S705 PolarHBondContact O-OG 3.36Å; I692-S705 VanDerWaalsContact O-OG 3.06Å
706	Y	95.7	Very high	86.2	Confident	18 Å²	18	53.9 Å²	53.9	7%	0.071	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143	178.1	-55.5	-93.4	0	0	0	112.5	Q616 L617 I620 F623 V659 F660 Q661 I692	Q616-Y706 PolarHBondContact NE2-OH 2.94Å; L617-Y706 HydrophobicContact CD2-CD1 4.22Å; L617-Y706 HydrophobicContact CD2-CE1 3.9Å; I620-Y706 HydrophobicContact CD1-CD2 3.92Å; I620-Y706 HydrophobicContact CD1-CE1 4.29Å; I620-Y706 HydrophobicContact CD1-CE2 3.65Å; I620-Y706 HydrophobicContact CD1-CG 4.38Å; F623-Y706 HydrophobicContact CE2-CD1 4.11Å; F623-Y706 HydrophobicContact CE2-CG 4Å; F623-Y706 HydrophobicContact CZ-CG 4.31Å; V659-Y706 HydrophobicContact CG1-CD1 3.89Å; F660-Y706 CarbonylContact O-C 3.49Å; F660-Y706 VanDerWaalsContact O-CA 3.28Å; F660-Y706 WeakPolarHBondContact O-CA 3.48Å; Q661-Y706 HydrophobicContact CB-CD1 3.76Å; Q661-Y706 HydrophobicContact CB-CE1 3.59Å; Q661-Y706 HydrophobicContact CG-CD1 4.06Å; Q661-Y706 HydrophobicContact CG-CE1 3.48Å; Q661-Y706 VanDerWaalsContact CG-CE1 3.48Å; I692-Y706 HydrophobicContact CB-CD2 4.37Å; I692-Y706 HydrophobicContact CG2-CD2 4.41Å; I692-Y706 PolarHBondContact N-O 3.49Å; I692-Y706 PolarHBondContact O-N 2.85Å
707	T	94.6	Very high	85.4	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	121.6	171.8	-57.9	0	0	0	0	109.2	F660 V678 M680 V688 Y691 V709	F660-T707 PolarHBondContact N-O 2.92Å; F660-T707 PolarHBondContact O-N 3.33Å; V678-T707 PolarHBondContact O-OG1 2.98Å; M680-T707 HydrophobicContact CB-CG2 4.48Å; M680-T707 HydrophobicContact CG-CG2 4.13Å; M680-T707 HydrophobicContact SD-CG2 3.71Å; V688-T707 HydrophobicContact CG1-CG2 3.58Å; Y691-T707 HydrophobicContact CD1-CG2 3.69Å; Y691-T707 WeakPolarHBondContact CD1-OG1 3Å; Y691-T707 HydrophobicContact CE1-CG2 3.51Å; T707-V709 HydrophobicContact CG2-CG2 4.12Å
708	L	93.9	Very high	84.6	Confident	11 Å²	11	54.7 Å²	54.7	6%	0.058	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	123.6	177.4	177.2	66.2	0	0	0	109.5	F623 L626 H657 V659 A689 H690	F623-L708 HydrophobicContact CE1-CB 4.02Å; F623-L708 HydrophobicContact CE1-CD1 4.43Å; F623-L708 HydrophobicContact CE1-CD2 4.34Å; F623-L708 HydrophobicContact CE1-CG 4.5Å; L626-L708 HydrophobicContact CD1-CD1 3.87Å; L626-L708 HydrophobicContact CD2-CD1 4.04Å; H657-L708 HydrophobicContact CB-CD1 3.95Å; V659-L708 HydrophobicContact CG2-CD1 3.62Å; A689-L708 HydrophobicContact CB-CD2 4.24Å; A689-L708 HydrophobicContact CB-CG 4.23Å; A689-L708 PolarHBondContact N-O 3.23Å; H690-L708 HydrophobicContact CB-CB 4.31Å; H690-L708 PolarHBondContact N-O 2.86Å; H690-L708 PolarHBondContact O-N 3.45Å
709	V	92.6	Very high	84.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	133.9	178.9	-174.1	0	0	0	0	109.3	H657 M658 F660 Y686 E687 V688 T707 F723	H657-V709 CarbonylContact C-O 3.55Å; H657-V709 WeakPolarHBondContact CA-O 3.39Å; M658-V709 PolarHBondContact N-O 3.24Å; M658-V709 PolarHBondContact O-N 3.01Å; F660-V709 HydrophobicContact CD2-CB 4.39Å; F660-V709 HydrophobicContact CD2-CG2 3.71Å; F660-V709 HydrophobicContact CE2-CB 3.87Å; F660-V709 HydrophobicContact CE2-CG2 3.51Å; Y686-V709 HydrophobicContact CD1-CG1 3.74Å; Y686-V709 HydrophobicContact CG-CG1 4.31Å; E687-V709 CarbonylContact O-C 3.59Å; E687-V709 WeakPolarHBondContact O-CA 3.33Å; E687-V709 WeakPolarHBondContact O-CG1 3.45Å; V688-V709 HydrophobicContact CG1-CG2 4.41Å; V688-V709 HydrophobicContact CG2-CG2 4.14Å; T707-V709 HydrophobicContact CG2-CG2 4.12Å; V709-F723 HydrophobicContact CG1-CE1 4.25Å; V709-F723 HydrophobicContact CG1-CZ 4.27Å; V709-F723 HydrophobicContact CG2-CE1 4.44Å
710	R	89.5	Confident	84	Confident	104 Å²	104	49.4 Å²	49.4	39%	0.392	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	135.6	173.2	-174.8	-179.9	178.2	173.7	-0.2	109.4	E687 D713	E687-R710 HydrophobicContact CB-CB 4.36Å; E687-R710 PolarHBondContact N-O 3.33Å; E687-R710 PolarHBondContact O-N 2.9Å; R710-D713 IonicContact CZ-OD2 3.94Å; R710-D713 IonicContact NE-OD2 3.93Å; R710-D713 PolarHBondContact NE-OD2 3.28Å; R710-D713 IonicContact NH2-OD2 3.59Å; R710-D713 PolarHBondContact NH2-OD2 2.69Å
711	L	86.9	Confident	84.2	Confident	4 Å²	4	45.7 Å²	45.7	2%	0.021	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-74.1	147	178.6	-61	175.3	0	0	0	110.1	R656 M658 Y686 D713 R834	R656-L711 WeakPolarHBondContact O-CB 3.46Å; R656-L711 PolarHBondContact O-N 3.39Å; R656-L711 VanDerWaalsContact O-N 3.1Å; M658-L711 HydrophobicContact CG-CD1 4.41Å; M658-L711 HydrophobicContact CG-CD2 3.82Å; M658-L711 HydrophobicContact CG-CG 4.43Å; M658-L711 HydrophobicContact SD-CD2 3.84Å; Y686-L711 HydrophobicContact CD1-CD2 4.03Å; Y686-L711 HydrophobicContact CE1-CD2 3.3Å; L711-D713 PolarHBondContact O-N 2.82Å; L711-R834 VanDerWaalsContact CD1-NH1 3.29Å
712	P	80.9	Confident	84.4	Confident	17 Å²	17	42.4 Å²	42.4	11%	0.11	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-59.8	131.5	-178.8	-18.9	29	0	0	0	111.7	A685 Y686	A685-P712 HydrophobicContact CB-CB 4.48Å; Y686-P712 HydrophobicContact CD2-CG 3.72Å; Y686-P712 HydrophobicContact CE2-CG 3.76Å; Y686-P712 HydrophobicContact CG-CG 4.27Å
713	D	70.3	Confident	84.6	Confident	92 Å²	92	37.6 Å²	37.6	49%	0.492	22%	0.215	S	C	.	.	S	Bend	trans	-95.7	-22.8	174.1	-73.7	-36.7	0	0	0	112.1	R710 L711	R710-D713 IonicContact CZ-OD2 3.94Å; R710-D713 IonicContact NE-OD2 3.93Å; R710-D713 PolarHBondContact NE-OD2 3.28Å; R710-D713 IonicContact NH2-OD2 3.59Å; R710-D713 PolarHBondContact NH2-OD2 2.69Å; L711-D713 PolarHBondContact O-N 2.82Å
714	D	67.6	Low	84.7	Confident	165 Å²	165	39.5 Å²	39.5	88%	0.882	23%	0.225	S	C	*	.	S	Bend	trans	-83.9	-32.5	-171.5	-66.8	-31	0	0	0	113.8
715	D	71.9	Confident	84.8	Confident	78 Å²	78	37.7 Å²	37.7	42%	0.417	21%	0.213	S	C	.	.			trans	-129.2	100.3	172.2	-172.8	-10	0	0	0	110.1	T717 A718	D715-T717 PolarHBondContact O-N 2.93Å; D715-T717 VanDerWaalsContact O-N 3.16Å; D715-T717 WeakPolarHBondContact OD1-CB 3.38Å; D715-T717 PolarHBondContact OD1-N 3.47Å; D715-T717 PolarHBondContact OD1-OG1 2.86Å; D715-A718 HydrophobicContact CB-CB 4.22Å; D715-A718 PolarHBondContact O-N 3.5Å
716	P	67.9	Low	84.9	Confident	65 Å²	65	39.2 Å²	39.2	42%	0.422	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.5	179.8	-20.5	31.8	0	0	0	114	V867	P716-V867 WeakPolarHBondContact O-CG2 3.46Å
717	T	73.3	Confident	84.8	Confident	52 Å²	52	38.4 Å²	38.4	32%	0.319	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-17	-176.8	67.8	0	0	0	0	113.5	D715 V719 D866	D715-T717 PolarHBondContact O-N 2.93Å; D715-T717 VanDerWaalsContact O-N 3.16Å; D715-T717 WeakPolarHBondContact OD1-CB 3.38Å; D715-T717 PolarHBondContact OD1-N 3.47Å; D715-T717 PolarHBondContact OD1-OG1 2.86Å; T717-V719 PolarHBondContact O-N 3.39Å; T717-D866 HydrophobicContact CG2-CB 4.22Å
718	A	74.4	Confident	84.9	Confident	23 Å²	23	42 Å²	42	19%	0.19	24%	0.235	C	C	.	.			trans	-77.2	63.2	177.6	0	0	0	0	0	112.4	Y686 D715	Y686-A718 WeakPolarHBondContact CE2-O 3.31Å; D715-A718 HydrophobicContact CB-CB 4.22Å; D715-A718 PolarHBondContact O-N 3.5Å
719	V	80.1	Confident	84.9	Confident	1 Å²	1	41.9 Å²	41.9	1%	0.006	23%	0.233	C	C	.	.			trans	-89.3	-16.2	-177.1	-64.1	0	0	0	0	114.3	Y686 T717 V759 H762 F833 V867	Y686-V719 PolarHBondContact OH-O 3.44Å; T717-V719 PolarHBondContact O-N 3.39Å; V719-V759 HydrophobicContact CG2-CG2 3.82Å; V719-H762 PolarHBondContact O-NE2 3.04Å; V719-F833 HydrophobicContact CG1-CZ 4.45Å; V719-V867 HydrophobicContact CB-CG1 4.28Å; V719-V867 HydrophobicContact CG1-CG1 3.68Å; V719-V867 HydrophobicContact CG1-CG2 4.11Å; V719-V867 HydrophobicContact CG2-CG1 3.66Å
720	S	85.4	Confident	84.9	Confident	52 Å²	52	43.5 Å²	43.5	36%	0.364	24%	0.242	S	C	.	.			trans	-98.6	137.6	176.8	-60.4	0	0	0	0	110.4	V757	S720-V757 CarbonylContact C-O 3.56Å; S720-V757 VanDerWaalsContact CA-O 3.24Å; S720-V757 WeakPolarHBondContact CA-O 3.49Å
721	C	88.8	Confident	85	Confident	4 Å²	4	38.5 Å²	38.5	3%	0.027	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	141.4	179.9	-178	0	0	0	0	110	E684 Y686 F723 V757	E684-C721 HydrophobicContact CB-CB 4.28Å; Y686-C721 HydrophobicContact CD2-CB 3.58Å; Y686-C721 HydrophobicContact CE2-CB 3.48Å; Y686-C721 VanDerWaalsContact CE2-CB 3.48Å; Y686-C721 HydrophobicContact CG-CB 4.3Å; C721-F723 HydrophobicContact CB-CE2 3.85Å; C721-F723 HydrophobicContact CB-CZ 4.33Å; C721-V757 PolarHBondContact N-O 3.37Å; C721-V757 PolarHBondContact O-N 3.35Å
722	T	91.8	Very high	85.1	Confident	48 Å²	48	41.3 Å²	41.3	29%	0.294	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	136.6	170.5	-55.7	0	0	0	0	108.6	S683 D754 E756	S683-T722 WeakPolarHBondContact CB-O 3.26Å; S683-T722 PolarHBondContact N-O 2.86Å; S683-T722 PolarHBondContact OG-N 2.98Å; S683-T722 VanDerWaalsContact OG-N 3.14Å; S683-T722 PolarHBondContact OG-O 3.22Å; T722-D754 HydrophobicContact CG2-CB 3.84Å; T722-E756 HydrophobicContact CG2-CG 4.29Å
723	F	92.9	Very high	85.3	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	120	179.9	-67.9	-96.3	0	0	0	110	F660 M680 E681 P682 Y686 V709 C721 C725 D754 L755 V757	F660-F723 HydrophobicContact CE2-CZ 4.47Å; F660-F723 HydrophobicContact CZ-CE2 4.04Å; F660-F723 HydrophobicContact CZ-CZ 4.21Å; M680-F723 HydrophobicContact CB-CD1 4.01Å; M680-F723 HydrophobicContact CE-CB 3.64Å; M680-F723 HydrophobicContact CE-CD1 3.75Å; M680-F723 HydrophobicContact CE-CD2 4.17Å; M680-F723 HydrophobicContact CE-CE1 4.38Å; M680-F723 HydrophobicContact CE-CG 3.6Å; E681-F723 WeakPolarHBondContact O-CA 3.42Å; P682-F723 HydrophobicContact CB-CD1 3.8Å; P682-F723 HydrophobicContact CB-CE1 3.54Å; P682-F723 HydrophobicContact CB-CZ 4.21Å; P682-F723 HydrophobicContact CG-CE1 4.26Å; Y686-F723 HydrophobicContact CD1-CE2 4.5Å; Y686-F723 AromaticContact CD1-CZ 3.73Å; Y686-F723 HydrophobicContact CD1-CZ 3.73Å; Y686-F723 HydrophobicContact CE1-CZ 4.38Å; Y686-F723 AromaticContact CG-CZ 3.86Å; Y686-F723 HydrophobicContact CG-CZ 3.86Å; V709-F723 HydrophobicContact CG1-CE1 4.25Å; V709-F723 HydrophobicContact CG1-CZ 4.27Å; V709-F723 HydrophobicContact CG2-CE1 4.44Å; C721-F723 HydrophobicContact CB-CE2 3.85Å; C721-F723 HydrophobicContact CB-CZ 4.33Å; F723-C725 PolarHBondContact O-N 2.79Å; F723-C725 PolarHBondContact O-SG 3.15Å; F723-C725 VanDerWaalsContact O-SG 3.42Å; F723-D754 WeakPolarHBondContact O-CA 3.46Å; F723-L755 HydrophobicContact CB-CB 4.4Å; F723-L755 PolarHBondContact N-O 3.34Å; F723-L755 PolarHBondContact O-N 3.43Å; F723-V757 HydrophobicContact CD2-CG2 4.12Å; F723-V757 HydrophobicContact CE2-CB 4.28Å; F723-V757 HydrophobicContact CE2-CG2 3.62Å
724	S	93.8	Very high	85.8	Confident	56 Å²	56	40.4 Å²	40.4	39%	0.392	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.7	167.5	-65.9	0	0	0	0	109.6	M680 E681 D754	M680-S724 WeakPolarHBondContact CA-O 3.47Å; E681-S724 PolarHBondContact N-O 2.88Å; E681-S724 PolarHBondContact O-N 3.09Å; S724-D754 VanDerWaalsContact CA-OD1 3.24Å; S724-D754 WeakPolarHBondContact CA-OD1 3.48Å; S724-D754 WeakPolarHBondContact CB-OD1 3.34Å; S724-D754 PolarHBondContact OG-OD1 2.63Å
725	C	94.9	Very high	86.2	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.014	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	124.6	-169.8	-66.1	0	0	0	0	110.4	V678 Q679 F723 L752	V678-C725 HydrophobicContact CG1-CB 4.11Å; Q679-C725 CarbonylContact O-C 3.56Å; Q679-C725 WeakPolarHBondContact O-CA 3.28Å; F723-C725 PolarHBondContact O-N 2.79Å; F723-C725 PolarHBondContact O-SG 3.15Å; F723-C725 VanDerWaalsContact O-SG 3.42Å; C725-L752 HydrophobicContact CB-CB 3.91Å; C725-L752 HydrophobicContact CB-CD1 4.13Å; C725-L752 WeakPolarHBondContact O-CB 3.16Å; C725-L752 PolarHBondContact O-N 3.19Å
726	T	95.6	Very high	86.1	Confident	32 Å²	32	35.4 Å²	35.4	20%	0.196	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	118.3	175.9	-57.8	0	0	0	0	109.7	Q679 K728 E749	Q679-T726 PolarHBondContact N-O 3.09Å; Q679-T726 PolarHBondContact O-N 3.33Å; T726-K728 HydrophobicContact CG2-CG 4.37Å; T726-E749 HydrophobicContact CG2-CB 3.99Å
727	M	94.8	Very high	86.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	118.9	176	-167.5	177.7	72.9	0	0	109.5	Y645 V647 C664 L673 V676 V677 V678 Y729 E749 Y750 L752	Y645-M727 HydrophobicContact CD1-CE 4.27Å; Y645-M727 HydrophobicContact CD2-CE 3.58Å; Y645-M727 HydrophobicContact CE2-CE 4.12Å; Y645-M727 HydrophobicContact CG-CE 3.65Å; V647-M727 HydrophobicContact CG2-SD 3.97Å; C664-M727 HydrophobicContact CB-SD 4.47Å; L673-M727 HydrophobicContact CD1-CE 4.46Å; V676-M727 HydrophobicContact CG1-CG 3.6Å; V676-M727 HydrophobicContact CG1-SD 3.71Å; V677-M727 CarbonylContact O-C 3.57Å; V677-M727 WeakPolarHBondContact O-CA 3.3Å; V678-M727 HydrophobicContact CG2-CB 4.33Å; V678-M727 HydrophobicContact CG2-CG 4.13Å; M727-Y729 HydrophobicContact CB-CD1 4.47Å; M727-Y729 HydrophobicContact CB-CE1 4.47Å; M727-Y729 HydrophobicContact CE-CD1 3.59Å; M727-Y729 HydrophobicContact CE-CE1 3.3Å; M727-Y729 HydrophobicContact CG-CD1 3.9Å; M727-Y729 HydrophobicContact CG-CE1 4.25Å; M727-Y729 HydrophobicContact SD-CD1 4.43Å; M727-E749 CarbonylContact O-C 3.5Å; M727-E749 VanDerWaalsContact O-CA 3.28Å; M727-E749 WeakPolarHBondContact O-CA 2.82Å; M727-Y750 PolarHBondContact N-O 3.32Å; M727-Y750 PolarHBondContact O-N 3.08Å; M727-L752 HydrophobicContact CB-CD1 4.17Å; M727-L752 HydrophobicContact CB-CD2 4.46Å; M727-L752 HydrophobicContact CB-CG 4.31Å
728	K	95.1	Very high	86.1	Confident	75 Å²	75	41.1 Å²	41.1	33%	0.326	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	134.8	176.3	-63.1	-166.6	176.2	174.1	0	110.3	V676 V677 Q679 T726 E749	V676-K728 WeakPolarHBondContact CA-O 3.3Å; V677-K728 PolarHBondContact N-O 2.78Å; V677-K728 PolarHBondContact O-N 3.41Å; Q679-K728 HydrophobicContact CG-CD 4.24Å; T726-K728 HydrophobicContact CG2-CG 4.37Å; K728-E749 WeakPolarHBondContact CE-OE2 3.42Å; K728-E749 HydrophobicContact CG-CB 4.09Å; K728-E749 IonicContact NZ-OE2 2.85Å
729	Y	94.4	Very high	85.7	Confident	8 Å²	8	42.5 Å²	42.5	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160	-174.9	47.9	-88.8	0	0	0	111	Y645 L673 M727 V731 D748	Y645-Y729 HydrophobicContact CE2-CE1 4.34Å; Y645-Y729 AromaticContact CE2-CZ 3.8Å; Y645-Y729 VanDerWaalsContact CE2-OH 3.24Å; Y645-Y729 WeakPolarHBondContact CE2-OH 3.36Å; Y645-Y729 AromaticContact CZ-CZ 3.98Å; Y645-Y729 PolarHBondContact OH-OH 3.31Å; L673-Y729 HydrophobicContact CB-CD2 4.42Å; L673-Y729 HydrophobicContact CD1-CD2 4.38Å; L673-Y729 HydrophobicContact CD1-CG 4.42Å; L673-Y729 HydrophobicContact CD2-CD2 3.65Å; L673-Y729 HydrophobicContact CD2-CE2 3.83Å; L673-Y729 HydrophobicContact CD2-CG 4.42Å; L673-Y729 HydrophobicContact CG-CD2 4.36Å; M727-Y729 HydrophobicContact CB-CD1 4.47Å; M727-Y729 HydrophobicContact CB-CE1 4.47Å; M727-Y729 HydrophobicContact CE-CD1 3.59Å; M727-Y729 HydrophobicContact CE-CE1 3.3Å; M727-Y729 HydrophobicContact CG-CD1 3.9Å; M727-Y729 HydrophobicContact CG-CE1 4.25Å; M727-Y729 HydrophobicContact SD-CD1 4.43Å; Y729-V731 HydrophobicContact CD2-CG2 3.49Å; Y729-V731 VanDerWaalsContact CD2-CG2 3.49Å; Y729-V731 HydrophobicContact CE2-CG2 3.33Å; Y729-D748 HydrophobicContact CD2-CB 4.34Å; Y729-D748 HydrophobicContact CE2-CB 3.8Å; Y729-D748 PolarHBondContact N-O 3.32Å; Y729-D748 VanDerWaalsContact N-O 3.08Å; Y729-D748 PolarHBondContact O-N 3.36Å; Y729-D748 PolarHBondContact OH-OD2 3.01Å
730	L	92.3	Very high	85.5	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.178	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	120.8	170.3	-175.9	149	0	0	0	108.6	Q674 R732	Q674-L730 HydrophobicContact CB-CD2 4.42Å; Q674-L730 PolarHBondContact N-O 3.39Å; Q674-L730 PolarHBondContact O-N 3.08Å; L730-R732 HydrophobicContact CD2-CG 3.78Å
731	V	91.5	Very high	85.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	134	177.7	-175.7	0	0	0	0	109.6	Q671 L673 Y729 G745 Y746 D748	Q671-V731 HydrophobicContact CB-CG1 4.3Å; Q671-V731 HydrophobicContact CG-CG1 4.1Å; L673-V731 HydrophobicContact CD2-CG2 4.22Å; Y729-V731 HydrophobicContact CD2-CG2 3.49Å; Y729-V731 VanDerWaalsContact CD2-CG2 3.49Å; Y729-V731 HydrophobicContact CE2-CG2 3.33Å; V731-G745 CarbonylContact O-C 3.59Å; V731-G745 WeakPolarHBondContact O-CA 3.19Å; V731-Y746 HydrophobicContact CB-CE1 4.39Å; V731-Y746 HydrophobicContact CB-CE2 4.24Å; V731-Y746 HydrophobicContact CG1-CE1 4.45Å; V731-Y746 HydrophobicContact CG2-CE2 4.35Å; V731-Y746 PolarHBondContact N-O 2.89Å; V731-Y746 PolarHBondContact O-N 2.9Å; V731-Y746 VanDerWaalsContact O-N 3.1Å; V731-D748 HydrophobicContact CG2-CB 3.8Å
732	R	88.9	Confident	84.5	Confident	63 Å²	63	54 Å²	54	24%	0.238	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	127.2	163.1	-66.3	-178.1	179	-118.3	-5.6	109.2	Q671 L672 L730 P741 D742 D743	Q671-R732 WeakPolarHBondContact CA-O 3.34Å; L672-R732 PolarHBondContact N-O 3.4Å; L672-R732 PolarHBondContact O-N 3.35Å; L730-R732 HydrophobicContact CD2-CG 3.78Å; R732-P741 HydrophobicContact CB-CB 4.13Å; R732-D742 PolarHBondContact NH1-O 3.11Å; R732-D742 VanDerWaalsContact NH1-O 3.12Å; R732-D743 PolarHBondContact NH1-O 2.84Å
733	D	85.6	Confident	83.7	Confident	74 Å²	74	59 Å²	59	40%	0.396	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	141.8	172.7	-65.3	-30.5	0	0	0	109.5	D670 P741 D742	D670-D733 CarbonylContact O-C 3.51Å; D670-D733 WeakPolarHBondContact O-CA 3.35Å; D733-P741 CarbonylContact O-C 3.6Å; D733-P741 WeakPolarHBondContact O-CA 3.4Å; D733-D742 PolarHBondContact O-N 3.37Å
734	C	81.3	Confident	82.9	Confident	16 Å²	16	65.9 Å²	65.9	11%	0.108	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	144	-178.5	-64.3	0	0	0	0	110.2	D670 L672 P736 E740	D670-C734 WeakPolarHBondContact CA-O 3.45Å; D670-C734 PolarHBondContact O-N 3.01Å; L672-C734 WeakPolarHBondContact CB-SG 3.38Å; L672-C734 PolarHBondContact N-SG 3.3Å; C734-P736 VanDerWaalsContact O-CD 3.27Å; C734-P736 WeakPolarHBondContact O-CD 3.27Å; C734-E740 WeakPolarHBondContact CA-O 3.37Å
735	D	75.2	Confident	82.3	Confident	67 Å²	67	65.1 Å²	65.1	36%	0.358	37%	0.369	S	S	.	.			trans	-68	119.5	170.6	170.8	0.5	0	0	0	110	N737 T738 G739 E740	D735-N737 PolarHBondContact O-N 3.41Å; D735-N737 PolarHBondContact OD1-N 3.07Å; D735-N737 PolarHBondContact OD1-ND2 3.45Å; D735-T738 VanDerWaalsContact CB-OG1 3.27Å; D735-T738 WeakPolarHBondContact CB-OG1 3.49Å; D735-T738 VanDerWaalsContact CG-OG1 3.29Å; D735-T738 PolarHBondContact O-N 3.31Å; D735-T738 WeakPolarHBondContact OD2-CG2 3.38Å; D735-T738 PolarHBondContact OD2-OG1 2.84Å; D735-G739 WeakPolarHBondContact O-CA 3.49Å; D735-G739 PolarHBondContact O-N 2.87Å; D735-E740 PolarHBondContact N-O 3.25Å
736	P	71.1	Confident	82.1	Confident	70 Å²	70	70.7 Å²	70.7	46%	0.455	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-17.8	-175.7	-25.5	34.6	0	0	0	115.5	D670 C734	D670-P736 HydrophobicContact CB-CG 4.06Å; C734-P736 VanDerWaalsContact O-CD 3.27Å; C734-P736 WeakPolarHBondContact O-CD 3.27Å
737	N	70.6	Confident	81.9	Confident	152 Å²	152	75.7 Å²	75.7	81%	0.813	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-28	-178.7	-58.2	-67	0	0	0	113.7	D735	D735-N737 PolarHBondContact O-N 3.41Å; D735-N737 PolarHBondContact OD1-N 3.07Å; D735-N737 PolarHBondContact OD1-ND2 3.45Å
738	T	69.9	Low	81.8	Confident	86 Å²	86	78.8 Å²	78.8	53%	0.528	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-24.8	-174.6	60	0	0	0	0	112.6	D735 E740	D735-T738 VanDerWaalsContact CB-OG1 3.27Å; D735-T738 WeakPolarHBondContact CB-OG1 3.49Å; D735-T738 VanDerWaalsContact CG-OG1 3.29Å; D735-T738 PolarHBondContact O-N 3.31Å; D735-T738 WeakPolarHBondContact OD2-CG2 3.38Å; D735-T738 PolarHBondContact OD2-OG1 2.84Å; T738-E740 PolarHBondContact O-N 2.77Å
739	G	65.7	Low	81.7	Confident	52 Å²	52	80.7 Å²	80.7	54%	0.536	44%	0.442	S	S	.	.			trans	71.2	13.5	-177.6	0	0	0	0	0	113.9	D735	D735-G739 WeakPolarHBondContact O-CA 3.49Å; D735-G739 PolarHBondContact O-N 2.87Å
740	E	75.4	Confident	81.7	Confident	143 Å²	143	82.6 Å²	82.6	67%	0.668	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-80.3	126.2	175.9	-69.6	-170.1	162.2	0	0	110.2	C734 D735 T738	C734-E740 WeakPolarHBondContact CA-O 3.37Å; D735-E740 PolarHBondContact N-O 3.25Å; T738-E740 PolarHBondContact O-N 2.77Å
741	P	76.9	Confident	81.8	Confident	56 Å²	56	86.1 Å²	86.1	36%	0.364	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	144.6	178.2	31.6	-33.5	0	0	0	111.8	L672 R732 D733	L672-P741 HydrophobicContact CD2-CB 3.93Å; L672-P741 HydrophobicContact CD2-CG 4Å; R732-P741 HydrophobicContact CB-CB 4.13Å; D733-P741 CarbonylContact O-C 3.6Å; D733-P741 WeakPolarHBondContact O-CA 3.4Å
742	D	77.9	Confident	81.9	Confident	100 Å²	100	86.5 Å²	86.5	54%	0.535	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	156.5	170.6	-81.1	-20.8	0	0	0	111.8	R732 D733 D744	R732-D742 PolarHBondContact NH1-O 3.11Å; R732-D742 VanDerWaalsContact NH1-O 3.12Å; D733-D742 PolarHBondContact O-N 3.37Å; D742-D744 VanDerWaalsContact C-N 3.3Å; D742-D744 PolarHBondContact O-N 2.92Å
743	D	73.4	Confident	82.1	Confident	152 Å²	152	88.6 Å²	88.6	81%	0.813	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	-28.6	-178.2	-83	-30.7	0	0	0	112.4	R732	R732-D743 PolarHBondContact NH1-O 2.84Å
744	D	75.8	Confident	82.4	Confident	144 Å²	144	89.6 Å²	89.6	77%	0.77	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	136.8	-180	-67.8	-35.1	0	0	0	111.1	D742	D742-D744 VanDerWaalsContact C-N 3.3Å; D742-D744 PolarHBondContact O-N 2.92Å
745	G	82.8	Confident	82.9	Confident	40 Å²	40	89 Å²	89	41%	0.412	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	158.1	175.3	0	0	0	0	0	111.7	V731	V731-G745 CarbonylContact O-C 3.59Å; V731-G745 WeakPolarHBondContact O-CA 3.19Å
746	Y	89.3	Confident	83.7	Confident	120 Å²	120	91.5 Å²	91.5	47%	0.471	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	153.5	-179.5	62.1	-91.1	0	0	0	111.4	V731 D748	V731-Y746 HydrophobicContact CB-CE1 4.39Å; V731-Y746 HydrophobicContact CB-CE2 4.24Å; V731-Y746 HydrophobicContact CG1-CE1 4.45Å; V731-Y746 HydrophobicContact CG2-CE2 4.35Å; V731-Y746 PolarHBondContact N-O 2.89Å; V731-Y746 PolarHBondContact O-N 2.9Å; V731-Y746 VanDerWaalsContact O-N 3.1Å; Y746-D748 HydrophobicContact CD2-CB 4.39Å; Y746-D748 HydrophobicContact CE2-CB 4.13Å
747	D	91.4	Very high	84.6	Confident	137 Å²	137	88.2 Å²	88.2	73%	0.733	48%	0.476	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	135.2	176.2	-63.5	-56.1	0	0	0	110.1
748	D	93.6	Very high	85.6	Confident	65 Å²	65	83.1 Å²	83.1	35%	0.348	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	162.2	178.5	-163.3	17.5	0	0	0	111	Y729 V731 Y746	Y729-D748 HydrophobicContact CD2-CB 4.34Å; Y729-D748 HydrophobicContact CE2-CB 3.8Å; Y729-D748 PolarHBondContact N-O 3.32Å; Y729-D748 VanDerWaalsContact N-O 3.08Å; Y729-D748 PolarHBondContact O-N 3.36Å; Y729-D748 PolarHBondContact OH-OD2 3.01Å; V731-D748 HydrophobicContact CG2-CB 3.8Å; Y746-D748 HydrophobicContact CD2-CB 4.39Å; Y746-D748 HydrophobicContact CE2-CB 4.13Å
749	E	93.5	Very high	86.5	Confident	115 Å²	115	79 Å²	79	54%	0.537	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.2	-179	66.5	-174.4	-178.7	0	0	112.8	T726 M727 K728	T726-E749 HydrophobicContact CG2-CB 3.99Å; M727-E749 CarbonylContact O-C 3.5Å; M727-E749 VanDerWaalsContact O-CA 3.28Å; M727-E749 WeakPolarHBondContact O-CA 2.82Å; K728-E749 WeakPolarHBondContact CE-OE2 3.42Å; K728-E749 HydrophobicContact CG-CB 4.09Å; K728-E749 IonicContact NZ-OE2 2.85Å
750	Y	93.3	Very high	87.7	Confident	49 Å²	49	77.1 Å²	77.1	19%	0.192	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	121.4	179.8	-167.7	-90.5	0	0	0	110.1	T639 E644 Y645 M727 L752	T639-Y750 HydrophobicContact CG2-CE1 3.89Å; E644-Y750 VanDerWaalsContact OE2-CE2 3.31Å; E644-Y750 WeakPolarHBondContact OE2-CE2 2.97Å; E644-Y750 PolarHBondContact OE2-OH 3.28Å; Y645-Y750 HydrophobicContact CD2-CD1 4.24Å; Y645-Y750 AromaticContact CD2-CD2 3.71Å; Y645-Y750 HydrophobicContact CD2-CD2 3.71Å; Y645-Y750 HydrophobicContact CD2-CE1 4.5Å; Y645-Y750 AromaticContact CD2-CE2 3.99Å; Y645-Y750 HydrophobicContact CD2-CE2 3.99Å; Y645-Y750 AromaticContact CD2-CG 3.82Å; Y645-Y750 HydrophobicContact CD2-CG 3.82Å; Y645-Y750 AromaticContact CE2-CD2 3.83Å; Y645-Y750 HydrophobicContact CE2-CD2 3.83Å; Y645-Y750 HydrophobicContact CE2-CE2 4.31Å; Y645-Y750 HydrophobicContact CE2-CG 4.2Å; M727-Y750 PolarHBondContact N-O 3.32Å; M727-Y750 PolarHBondContact O-N 3.08Å; Y750-L752 HydrophobicContact CD1-CD2 3.79Å; Y750-L752 HydrophobicContact CE1-CD2 4.18Å
751	V	94.3	Very high	88.4	Confident	107 Å²	107	70.9 Å²	70.9	65%	0.648	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	127.8	179.8	-177.7	0	0	0	0	109.2
752	L	94	Very high	89	Confident	9 Å²	9	68.2 Å²	68.2	5%	0.047	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-100.6	167.2	178	-56.1	174.6	0	0	0	110.1	L638 T639 V647 V678 C725 M727 Y750	L638-L752 HydrophobicContact CB-CB 4.26Å; L638-L752 HydrophobicContact CD1-CD1 4.35Å; T639-L752 HydrophobicContact CG2-CD2 3.42Å; T639-L752 VanDerWaalsContact CG2-CD2 3.42Å; V647-L752 HydrophobicContact CB-CD2 4.08Å; V647-L752 HydrophobicContact CG1-CD1 4Å; V647-L752 HydrophobicContact CG1-CD2 4.45Å; V647-L752 HydrophobicContact CG2-CD2 3.82Å; V678-L752 HydrophobicContact CG1-CD1 3.78Å; V678-L752 HydrophobicContact CG2-CD1 4.16Å; C725-L752 HydrophobicContact CB-CB 3.91Å; C725-L752 HydrophobicContact CB-CD1 4.13Å; C725-L752 WeakPolarHBondContact O-CB 3.16Å; C725-L752 PolarHBondContact O-N 3.19Å; M727-L752 HydrophobicContact CB-CD1 4.17Å; M727-L752 HydrophobicContact CB-CD2 4.46Å; M727-L752 HydrophobicContact CB-CG 4.31Å; Y750-L752 HydrophobicContact CD1-CD2 3.79Å; Y750-L752 HydrophobicContact CE1-CD2 4.18Å
753	E	92.9	Very high	89.6	Confident	107 Å²	107	63.5 Å²	63.5	50%	0.5	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-62	149.1	169	-67.8	-178.8	-174.9	0	0	111.6	L638	L638-E753 HydrophobicContact CD2-CB 4.47Å; L638-E753 WeakPolarHBondContact O-CG 3.46Å; L638-E753 PolarHBondContact O-N 2.99Å; L638-E753 VanDerWaalsContact O-N 3.1Å
754	D	92	Very high	90.3	Very high	95 Å²	95	56.9 Å²	56.9	51%	0.508	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-64.2	138	177.3	-70.8	-32.3	0	0	0	110.5	T722 F723 S724	T722-D754 HydrophobicContact CG2-CB 3.84Å; F723-D754 WeakPolarHBondContact O-CA 3.46Å; S724-D754 VanDerWaalsContact CA-OD1 3.24Å; S724-D754 WeakPolarHBondContact CA-OD1 3.48Å; S724-D754 WeakPolarHBondContact CB-OD1 3.34Å; S724-D754 PolarHBondContact OG-OD1 2.63Å
755	L	92.8	Very high	90.7	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	124.1	178.6	-179.3	72.9	0	0	0	110.6	V636 L638 C649 F660 M680 F723	V636-L755 HydrophobicContact CB-CD1 4.19Å; V636-L755 HydrophobicContact CG1-CD1 4.15Å; V636-L755 HydrophobicContact CG2-CD1 4.41Å; L638-L755 HydrophobicContact CD2-CB 4.33Å; L638-L755 HydrophobicContact CD2-CD1 4.13Å; C649-L755 HydrophobicContact CB-CD1 4.28Å; C649-L755 HydrophobicContact CB-CD2 4.39Å; C649-L755 VanDerWaalsContact SG-CD2 3.53Å; F660-L755 HydrophobicContact CD1-CD2 3.36Å; F660-L755 HydrophobicContact CE1-CD2 3.43Å; F660-L755 VanDerWaalsContact CE1-CD2 3.43Å; F660-L755 HydrophobicContact CG-CD2 4.46Å; M680-L755 HydrophobicContact CE-CD2 3.71Å; F723-L755 HydrophobicContact CB-CB 4.4Å; F723-L755 PolarHBondContact N-O 3.34Å; F723-L755 PolarHBondContact O-N 3.43Å
756	E	91.4	Very high	90.6	Very high	120 Å²	120	53.9 Å²	53.9	56%	0.561	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97	133.3	177.1	-62.9	-176.2	170.2	0	0	112	K651 T722	K651-E756 PolarHBondContact NZ-O 3.14Å; T722-E756 HydrophobicContact CG2-CG 4.29Å
757	V	90.9	Very high	89.9	Confident	2 Å²	2	53.1 Å²	53.1	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	130.9	163.8	176.1	0	0	0	0	108	K651 M658 F660 S720 C721 F723 D761	K651-V757 HydrophobicContact CD-CG2 4.19Å; M658-V757 HydrophobicContact CE-CG1 4.06Å; M658-V757 HydrophobicContact CE-CG2 4.17Å; M658-V757 HydrophobicContact SD-CG1 3.97Å; F660-V757 HydrophobicContact CE1-CG2 3.84Å; F660-V757 HydrophobicContact CZ-CG2 3.69Å; S720-V757 CarbonylContact C-O 3.56Å; S720-V757 VanDerWaalsContact CA-O 3.24Å; S720-V757 WeakPolarHBondContact CA-O 3.49Å; C721-V757 PolarHBondContact N-O 3.37Å; C721-V757 PolarHBondContact O-N 3.35Å; F723-V757 HydrophobicContact CD2-CG2 4.12Å; F723-V757 HydrophobicContact CE2-CB 4.28Å; F723-V757 HydrophobicContact CE2-CG2 3.62Å; V757-D761 WeakPolarHBondContact CA-OD2 3.45Å; V757-D761 HydrophobicContact CG1-CB 4.25Å
758	T	90.2	Very high	89.2	Confident	44 Å²	44	48 Å²	48	27%	0.27	24%	0.243	S	C	.	.			trans	-124.4	169.4	-176.5	63.6	0	0	0	0	110.8	A760 D761 H762	T758-A760 PolarHBondContact O-N 3.01Å; T758-D761 PolarHBondContact N-OD2 3.05Å; T758-D761 WeakPolarHBondContact O-CB 3.33Å; T758-D761 PolarHBondContact O-N 3.04Å; T758-D761 PolarHBondContact OG1-OD2 3.14Å; T758-H762 PolarHBondContact O-CD2 3.24Å
759	V	90	Very high	87.8	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-50.9	-39.9	173	-174.3	0	0	0	0	112.5	V719 D761 H762 I763 I868 S871	V719-V759 HydrophobicContact CG2-CG2 3.82Å; V759-D761 PolarHBondContact O-N 3.45Å; V759-D761 VanDerWaalsContact O-N 3.16Å; V759-H762 PolarHBondContact O-N 3.46Å; V759-I763 HydrophobicContact CG1-CD1 3.65Å; V759-I763 HydrophobicContact CG1-CG1 4.44Å; V759-I763 PolarHBondContact O-N 3.02Å; V759-I868 HydrophobicContact CG1-CD1 4.04Å; V759-S871 WeakPolarHBondContact CG2-OG 3.3Å
760	A	90.1	Very high	86.9	Confident	13 Å²	13	43.5 Å²	43.5	11%	0.107	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-58	-29.6	179.4	0	0	0	0	0	112.5	K631 T758 H762 I763	K631-A760 PolarHBondContact NZ-O 3.29Å; T758-A760 PolarHBondContact O-N 3.01Å; A760-H762 PolarHBondContact O-N 3.15Å; A760-I763 PolarHBondContact O-N 3.44Å; A760-I763 VanDerWaalsContact O-O 3.1Å
761	D	90.4	Very high	86.4	Confident	12 Å²	12	41.4 Å²	41.4	6%	0.064	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-70.2	-21.3	178.2	-64.7	-57.7	0	0	0	112.7	K651 T653 M658 V757 T758 V759	K651-D761 WeakPolarHBondContact CE-OD1 3.32Å; K651-D761 VanDerWaalsContact NZ-CG 3.33Å; K651-D761 IonicContact NZ-OD1 2.89Å; K651-D761 PolarHBondContact NZ-OD1 3.09Å; K651-D761 IonicContact NZ-OD2 3.14Å; K651-D761 PolarHBondContact NZ-OD2 3.47Å; T653-D761 PolarHBondContact OG1-O 2.85Å; M658-D761 HydrophobicContact CE-CB 4.27Å; V757-D761 WeakPolarHBondContact CA-OD2 3.45Å; V757-D761 HydrophobicContact CG1-CB 4.25Å; T758-D761 PolarHBondContact N-OD2 3.05Å; T758-D761 WeakPolarHBondContact O-CB 3.33Å; T758-D761 PolarHBondContact O-N 3.04Å; T758-D761 PolarHBondContact OG1-OD2 3.14Å; V759-D761 PolarHBondContact O-N 3.45Å; V759-D761 VanDerWaalsContact O-N 3.16Å
762	H	89.9	Confident	85.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-94.1	-4.1	178.2	-59.2	-81.6	0	0	0	113.7	F630 Y686 V719 T758 V759 A760 F833 R834	F630-H762 WeakPolarHBondContact CE1-O 3.4Å; Y686-H762 PolarHBondContact OH-NE2 3.34Å; V719-H762 PolarHBondContact O-NE2 3.04Å; T758-H762 PolarHBondContact O-CD2 3.24Å; V759-H762 PolarHBondContact O-N 3.46Å; A760-H762 PolarHBondContact O-N 3.15Å; H762-F833 HydrophobicContact CB-CD2 4.2Å; H762-F833 HydrophobicContact CB-CE2 3.62Å; H762-F833 HydrophobicContact CB-CZ 4.14Å; H762-R834 HydrophobicContact CB-CG 4.45Å; H762-R834 WeakPolarHBondContact ND1-CD 3.36Å; H762-R834 PolarHBondContact ND1-NE 2.75Å; H762-R834 VanDerWaalsContact ND1-NE 3.1Å; H762-R834 PolarHBondContact O-N 3.01Å
763	I	90.1	Very high	84.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	131.6	-175	-59.9	175.5	0	0	0	111.4	K631 V759 A760 M809 V832 F833 I868	K631-I763 WeakPolarHBondContact CD-O 3.36Å; K631-I763 PolarHBondContact NZ-O 3.26Å; V759-I763 HydrophobicContact CG1-CD1 3.65Å; V759-I763 HydrophobicContact CG1-CG1 4.44Å; V759-I763 PolarHBondContact O-N 3.02Å; A760-I763 PolarHBondContact O-N 3.44Å; A760-I763 VanDerWaalsContact O-O 3.1Å; I763-M809 HydrophobicContact CD1-CG 4.42Å; I763-M809 HydrophobicContact CG2-CG 3.81Å; I763-V832 WeakPolarHBondContact CA-O 3.41Å; I763-F833 HydrophobicContact CG1-CD2 3.88Å; I763-I868 HydrophobicContact CD1-CD1 3.44Å; I763-I868 VanDerWaalsContact CD1-CD1 3.44Å
764	Q	86.8	Confident	84.1	Confident	14 Å²	14	33.2 Å²	33.2	7%	0.065	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	132.4	170.9	-168.1	172.1	10.1	0	0	110.7	F630 V766 G831 V832	F630-Q764 HydrophobicContact CE1-CB 4.11Å; F630-Q764 HydrophobicContact CE2-CB 4.41Å; F630-Q764 HydrophobicContact CZ-CB 3.78Å; F630-Q764 PolarHBondContact O-OE1 2.88Å; Q764-V766 PolarHBondContact O-N 3.45Å; Q764-G831 CarbonylContact O-C 3.56Å; Q764-G831 WeakPolarHBondContact O-CA 3.31Å; Q764-V832 PolarHBondContact N-O 3.25Å; Q764-V832 PolarHBondContact O-N 3.32Å
765	K	85.9	Confident	83.7	Confident	100 Å²	100	29.2 Å²	29.2	44%	0.435	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	128.7	176.2	-70	-175.8	179.7	175.9	0	110.4	G808 Q810	K765-G808 WeakPolarHBondContact CE-O 3.43Å; K765-G808 WeakPolarHBondContact CG-O 3.31Å; K765-Q810 HydrophobicContact CB-CB 4.04Å
766	V	80.8	Confident	83.3	Confident	21 Å²	21	35.6 Å²	35.6	13%	0.127	19%	0.192	C	C	.	.			trans	-132.7	124.4	175.9	175.9	0	0	0	0	110.4	L581 Q764 K768 Q810 A830 V832	L581-V766 HydrophobicContact CD1-CG2 3.81Å; Q764-V766 PolarHBondContact O-N 3.45Å; V766-K768 HydrophobicContact CG1-CD 4.42Å; V766-K768 PolarHBondContact O-N 3.43Å; V766-Q810 WeakPolarHBondContact O-CB 3.4Å; V766-A830 WeakPolarHBondContact O-CB 3.42Å; V766-V832 HydrophobicContact CB-CG2 4.5Å; V766-V832 HydrophobicContact CG2-CB 4.35Å; V766-V832 HydrophobicContact CG2-CG2 3.64Å
767	L	74.3	Confident	82.8	Confident	103 Å²	103	34.7 Å²	34.7	54%	0.539	19%	0.187	S	C	.	.			trans	-77	118.4	175.3	-176.4	69.5	0	0	0	110.2	Q810	L767-Q810 HydrophobicContact CB-CG 4.28Å; L767-Q810 HydrophobicContact CD1-CG 4.12Å
768	K	76.1	Confident	82.4	Confident	30 Å²	30	36 Å²	36	13%	0.13	20%	0.195	C	C	.	.			trans	-108.1	106.8	167.9	-61.3	-75.9	-172.8	163	0	108.5	V766 N770 A774 A830 D838	V766-K768 HydrophobicContact CG1-CD 4.42Å; V766-K768 PolarHBondContact O-N 3.43Å; K768-N770 PolarHBondContact O-N 3.44Å; K768-A774 HydrophobicContact CB-CB 4.38Å; K768-A774 HydrophobicContact CD-CB 4.19Å; K768-A774 HydrophobicContact CG-CB 4.3Å; K768-A830 HydrophobicContact CB-CB 4.2Å; K768-A830 HydrophobicContact CG-CB 3.69Å; K768-D838 IonicContact NZ-OD2 3.94Å; K768-D838 PolarHBondContact NZ-OD2 2.89Å
769	P	63.8	Low	82	Confident	47 Å²	47	35 Å²	35	31%	0.305	19%	0.193	S	C	.	.	S	Bend	trans	-62.3	-22.3	-176.1	-25.3	34.2	0	0	0	115.5	R465 N549	R465-P769 PolarHBondContact NH2-O 3.1Å; R465-P769 VanDerWaalsContact NH2-O 3.12Å; N549-P769 WeakPolarHBondContact OD1-CD 3.41Å
770	N	74.4	Confident	81.8	Confident	38 Å²	38	40.4 Å²	40.4	20%	0.203	22%	0.223	C	C	.	.			trans	-132.6	98.6	175.7	-176.7	-25.4	0	0	0	107.8	K768 G772 A773 A774	K768-N770 PolarHBondContact O-N 3.44Å; N770-G772 PolarHBondContact OD1-N 3.25Å; N770-A773 HydrophobicContact CB-CB 4.33Å; N770-A773 PolarHBondContact OD1-N 3.25Å; N770-A774 PolarHBondContact O-N 2.69Å
771	F	83	Confident	81.5	Confident	5 Å²	5	48.2 Å²	48.2	2%	0.022	26%	0.257	C	S	.	.	H	α-helix	trans	-68.6	-40.9	-175.8	-180	-91.8	0	0	0	110.9	A773 A774 W775 C812 E813 F828 L829 L840 R842	F771-A773 VanDerWaalsContact C-N 3.32Å; F771-A773 PolarHBondContact O-N 3.49Å; F771-A774 PolarHBondContact O-N 3.01Å; F771-W775 HydrophobicContact CD1-CB 4.4Å; F771-W775 HydrophobicContact CE1-CB 4.22Å; F771-W775 AromaticContact CE1-CD2 3.91Å; F771-W775 HydrophobicContact CE1-CD2 3.91Å; F771-W775 AromaticContact CE1-CE3 3.44Å; F771-W775 HydrophobicContact CE1-CE3 3.44Å; F771-W775 VanDerWaalsContact CE1-CE3 3.44Å; F771-W775 HydrophobicContact CE1-CG 4.27Å; F771-W775 HydrophobicContact CE1-CZ3 4.12Å; F771-W775 HydrophobicContact CE2-CE3 4.3Å; F771-W775 HydrophobicContact CZ-CD2 4.22Å; F771-W775 AromaticContact CZ-CE3 3.28Å; F771-W775 HydrophobicContact CZ-CE3 3.28Å; F771-W775 AromaticContact CZ-CZ3 3.68Å; F771-W775 HydrophobicContact CZ-CZ3 3.68Å; F771-W775 VanDerWaalsContact O-CB 3.3Å; F771-W775 WeakPolarHBondContact O-CB 3.44Å; F771-W775 PolarHBondContact O-N 3.08Å; F771-C812 HydrophobicContact CB-CB 4.08Å; F771-C812 HydrophobicContact CD2-CB 4.16Å; F771-E813 HydrophobicContact CB-CG 4.38Å; F771-E813 PolarHBondContact N-OE1 3.39Å; F771-F828 HydrophobicContact CB-CB 4.34Å; F771-F828 HydrophobicContact CB-CG 4.5Å; F771-F828 HydrophobicContact CD1-CB 4.06Å; F771-F828 AromaticContact CD1-CD1 3.42Å; F771-F828 HydrophobicContact CD1-CD1 3.42Å; F771-F828 VanDerWaalsContact CD1-CD1 3.42Å; F771-F828 AromaticContact CD1-CE1 3.98Å; F771-F828 HydrophobicContact CD1-CE1 3.98Å; F771-F828 AromaticContact CD1-CG 3.83Å; F771-F828 HydrophobicContact CD1-CG 3.83Å; F771-F828 HydrophobicContact CD2-CB 3.78Å; F771-F828 HydrophobicContact CD2-CG 4.45Å; F771-F828 HydrophobicContact CE1-CB 4.29Å; F771-F828 AromaticContact CE1-CD1 3.35Å; F771-F828 HydrophobicContact CE1-CD1 3.35Å; F771-F828 AromaticContact CE1-CE1 3.96Å; F771-F828 HydrophobicContact CE1-CE1 3.96Å; F771-F828 HydrophobicContact CE1-CG 4.11Å; F771-F828 HydrophobicContact CE2-CB 4.01Å; F771-F828 HydrophobicContact CE2-CD1 4.5Å; F771-F828 HydrophobicContact CG-CB 3.79Å; F771-F828 HydrophobicContact CG-CD1 4.06Å; F771-F828 HydrophobicContact CG-CG 4.01Å; F771-F828 HydrophobicContact CZ-CB 4.24Å; F771-F828 AromaticContact CZ-CD1 3.91Å; F771-F828 HydrophobicContact CZ-CD1 3.91Å; F771-L829 WeakPolarHBondContact CE2-O 3.33Å; F771-L840 HydrophobicContact CD2-CD2 4.43Å; F771-L840 HydrophobicContact CE2-CB 3.97Å; F771-L840 HydrophobicContact CE2-CD2 4.05Å; F771-L840 HydrophobicContact CE2-CG 4.44Å; F771-L840 HydrophobicContact CZ-CB 4.1Å; F771-R842 HydrophobicContact CE1-CB 4.44Å; F771-R842 HydrophobicContact CZ-CB 4.41Å
772	G	78.8	Confident	81.3	Confident	38 Å²	38	49.4 Å²	49.4	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-59	-40.9	-179.8	0	0	0	0	0	113	N770 W775 E776	N770-G772 PolarHBondContact OD1-N 3.25Å; G772-W775 WeakPolarHBondContact O-CB 3.37Å; G772-W775 PolarHBondContact O-N 3.32Å; G772-E776 WeakPolarHBondContact O-CG 3.23Å; G772-E776 PolarHBondContact O-N 3.02Å
773	A	74.8	Confident	81.4	Confident	9 Å²	9	53 Å²	53	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-68.5	-41	176.8	0	0	0	0	0	112.6	A544 N770 F771 W775 E776 E777	A544-A773 HydrophobicContact CB-CB 3.67Å; N770-A773 HydrophobicContact CB-CB 4.33Å; N770-A773 PolarHBondContact OD1-N 3.25Å; F771-A773 VanDerWaalsContact C-N 3.32Å; F771-A773 PolarHBondContact O-N 3.49Å; A773-W775 VanDerWaalsContact C-N 3.31Å; A773-W775 PolarHBondContact O-N 3.14Å; A773-E776 PolarHBondContact O-N 3.13Å; A773-E777 WeakPolarHBondContact O-CB 3.46Å; A773-E777 PolarHBondContact O-N 3.37Å
774	A	78.9	Confident	81.5	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.033	29%	0.293	C	S	.	.	H	α-helix	trans	-65.2	-36	175.3	0	0	0	0	0	111.9	K768 N770 F771 E776 E777 V778 L840	K768-A774 HydrophobicContact CB-CB 4.38Å; K768-A774 HydrophobicContact CD-CB 4.19Å; K768-A774 HydrophobicContact CG-CB 4.3Å; N770-A774 PolarHBondContact O-N 2.69Å; F771-A774 PolarHBondContact O-N 3.01Å; A774-E776 VanDerWaalsContact C-N 3.33Å; A774-E776 PolarHBondContact O-N 3.13Å; A774-E777 PolarHBondContact O-N 3.15Å; A774-V778 WeakPolarHBondContact O-CG2 3.25Å; A774-V778 PolarHBondContact O-N 3.03Å; A774-V778 VanDerWaalsContact O-N 3.11Å; A774-L840 VanDerWaalsContact C-CD1 3.47Å; A774-L840 HydrophobicContact CB-CD1 3.99Å; A774-L840 WeakPolarHBondContact O-CD1 3.14Å
775	W	84.8	Confident	81.8	Confident	11 Å²	11	59.7 Å²	59.7	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-62.8	-38	176.7	-171.6	-93.7	0	0	0	112.7	F771 G772 A773 L840 R842 T856 R858	F771-W775 HydrophobicContact CD1-CB 4.4Å; F771-W775 HydrophobicContact CE1-CB 4.22Å; F771-W775 AromaticContact CE1-CD2 3.91Å; F771-W775 HydrophobicContact CE1-CD2 3.91Å; F771-W775 AromaticContact CE1-CE3 3.44Å; F771-W775 HydrophobicContact CE1-CE3 3.44Å; F771-W775 VanDerWaalsContact CE1-CE3 3.44Å; F771-W775 HydrophobicContact CE1-CG 4.27Å; F771-W775 HydrophobicContact CE1-CZ3 4.12Å; F771-W775 HydrophobicContact CE2-CE3 4.3Å; F771-W775 HydrophobicContact CZ-CD2 4.22Å; F771-W775 AromaticContact CZ-CE3 3.28Å; F771-W775 HydrophobicContact CZ-CE3 3.28Å; F771-W775 AromaticContact CZ-CZ3 3.68Å; F771-W775 HydrophobicContact CZ-CZ3 3.68Å; F771-W775 VanDerWaalsContact O-CB 3.3Å; F771-W775 WeakPolarHBondContact O-CB 3.44Å; F771-W775 PolarHBondContact O-N 3.08Å; G772-W775 WeakPolarHBondContact O-CB 3.37Å; G772-W775 PolarHBondContact O-N 3.32Å; A773-W775 VanDerWaalsContact C-N 3.31Å; A773-W775 PolarHBondContact O-N 3.14Å; W775-L840 HydrophobicContact CB-CD1 4.39Å; W775-L840 HydrophobicContact CE3-CB 3.67Å; W775-L840 HydrophobicContact CE3-CD1 4.18Å; W775-L840 HydrophobicContact CZ3-CB 3.75Å; W775-R842 HydrophobicContact CH2-CB 4Å; W775-R842 HydrophobicContact CZ3-CB 4.13Å; W775-T856 HydrophobicContact CH2-CG2 3.91Å; W775-T856 HydrophobicContact CZ2-CG2 3.81Å; W775-R858 HydrophobicContact CE3-CB 4.44Å; W775-R858 HydrophobicContact CE3-CG 4.5Å; W775-R858 HydrophobicContact CH2-CB 4.08Å; W775-R858 HydrophobicContact CH2-CG 3.69Å; W775-R858 HydrophobicContact CZ2-CB 4.48Å; W775-R858 VanDerWaalsContact CZ2-CD 3.45Å; W775-R858 HydrophobicContact CZ2-CG 3.66Å; W775-R858 HydrophobicContact CZ3-CB 4.07Å; W775-R858 HydrophobicContact CZ3-CG 4.13Å; W775-R858 VanDerWaalsContact NE1-NE 3.18Å; W775-R858 PolarHBondContact O-NH1 2.82Å
776	E	84.4	Confident	82.1	Confident	137 Å²	137	59.1 Å²	59.1	64%	0.64	31%	0.309	S	S	*	.	H	α-helix	trans	-76.1	-34	173.7	-64.2	-59.5	139.5	0	0	112.5	G772 A773 A774 G779	G772-E776 WeakPolarHBondContact O-CG 3.23Å; G772-E776 PolarHBondContact O-N 3.02Å; A773-E776 PolarHBondContact O-N 3.13Å; A774-E776 VanDerWaalsContact C-N 3.33Å; A774-E776 PolarHBondContact O-N 3.13Å; E776-G779 PolarHBondContact O-N 3.23Å
777	E	79.8	Confident	82.6	Confident	100 Å²	100	62.2 Å²	62.2	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-40.5	178.6	-176.5	-177.7	177.1	0	0	112.6	A773 A774 G779	A773-E777 WeakPolarHBondContact O-CB 3.46Å; A773-E777 PolarHBondContact O-N 3.37Å; A774-E777 PolarHBondContact O-N 3.15Å; E777-G779 PolarHBondContact O-N 3.22Å
778	V	83.3	Confident	83.3	Confident	29 Å²	29	58.5 Å²	58.5	18%	0.176	31%	0.308	C	S	.	.	H	α-helix	trans	-65.7	-27.4	175.7	174.8	0	0	0	0	111.7	A774 D838 L840 R858	A774-V778 WeakPolarHBondContact O-CG2 3.25Å; A774-V778 PolarHBondContact O-N 3.03Å; A774-V778 VanDerWaalsContact O-N 3.11Å; V778-D838 HydrophobicContact CG2-CB 4.45Å; V778-L840 HydrophobicContact CG2-CD1 3.82Å; V778-L840 HydrophobicContact CG2-CG 4.39Å; V778-R858 HydrophobicContact CG1-CB 4.11Å
779	G	81.4	Confident	83.8	Confident	23 Å²	23	61 Å²	61	24%	0.237	33%	0.333	C	S	.	.			trans	77.5	177.5	-175.8	0	0	0	0	0	113.4	E776 E777 R858	E776-G779 PolarHBondContact O-N 3.23Å; E777-G779 PolarHBondContact O-N 3.22Å; G779-R858 VanDerWaalsContact O-CD 3.27Å; G779-R858 WeakPolarHBondContact O-CD 3.33Å
780	D	85.7	Confident	84.7	Confident	115 Å²	115	61 Å²	61	62%	0.615	33%	0.331	S	S	*	.	S	Bend	trans	-105.1	7.2	-178.1	61.6	-15.1	0	0	0	113.8	N782	D780-N782 VanDerWaalsContact C-N 3.32Å; D780-N782 PolarHBondContact O-N 2.93Å
781	E	83.1	Confident	84.8	Confident	177 Å²	177	63.6 Å²	63.6	83%	0.827	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-41.6	-178.3	-66.8	-171.2	163.1	0	0	112.7
782	N	87.6	Confident	84.5	Confident	37 Å²	37	68.2 Å²	68.2	20%	0.198	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	69.8	175.9	-53.3	-53	0	0	0	110.1	D780 S859 T860 V865	D780-N782 VanDerWaalsContact C-N 3.32Å; D780-N782 PolarHBondContact O-N 2.93Å; N782-S859 WeakPolarHBondContact CB-O 3.49Å; N782-S859 PolarHBondContact ND2-O 3Å; N782-S859 PolarHBondContact O-N 3.42Å; N782-T860 PolarHBondContact ND2-O 3.16Å; N782-V865 HydrophobicContact CB-CG2 4.17Å; N782-V865 WeakPolarHBondContact O-CG2 3.45Å
783	E	92.4	Very high	84.8	Confident	76 Å²	76	66.7 Å²	66.7	36%	0.355	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.1	170.9	-178	176.3	107.3	0	0	110.6	T856 V857 R858	E783-T856 HydrophobicContact CG-CG2 3.69Å; E783-V857 WeakPolarHBondContact CA-O 3.44Å; E783-R858 HydrophobicContact CB-CG 4.03Å; E783-R858 HydrophobicContact CG-CG 4.11Å; E783-R858 IonicContact OE2-CZ 2.69Å; E783-R858 IonicContact OE2-NE 2.98Å; E783-R858 PolarHBondContact OE2-NE 3.16Å; E783-R858 IonicContact OE2-NH2 3.14Å; E783-R858 PolarHBondContact OE2-NH2 2.98Å
784	K	91.6	Very high	85.2	Confident	60 Å²	60	76.4 Å²	76.4	26%	0.261	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	148.4	167.3	-62.3	179.5	-176.5	179.1	0	110.1	T856 V857 E862 V865 D866 L869	K784-T856 WeakPolarHBondContact O-CA 3.17Å; K784-V857 PolarHBondContact N-O 3.18Å; K784-V857 PolarHBondContact O-N 3.33Å; K784-E862 WeakPolarHBondContact CE-OE1 3.4Å; K784-E862 IonicContact NZ-OE1 3.24Å; K784-E862 PolarHBondContact NZ-OE1 2.66Å; K784-V865 HydrophobicContact CB-CG1 3.55Å; K784-V865 HydrophobicContact CD-CG1 3.88Å; K784-V865 HydrophobicContact CG-CG1 3.72Å; K784-D866 VanDerWaalsContact CD-OD1 3.22Å; K784-D866 WeakPolarHBondContact CD-OD1 3.44Å; K784-D866 WeakPolarHBondContact CE-OD1 3.04Å; K784-D866 IonicContact NZ-OD1 3.53Å; K784-D866 PolarHBondContact NZ-OD1 3.32Å; K784-D866 IonicContact NZ-OD2 2.87Å; K784-D866 PolarHBondContact NZ-OD2 3.03Å; K784-L869 HydrophobicContact CB-CD1 3.36Å; K784-L869 HydrophobicContact CD-CD1 4.48Å; K784-L869 HydrophobicContact CG-CD1 4.5Å
785	E	92.3	Very high	85.6	Confident	93 Å²	93	79.3 Å²	79.3	44%	0.435	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	131.3	-178	-177.2	170	106.3	0	0	110.6	Q854 V855 T856	E785-Q854 HydrophobicContact CG-CG 3.84Å; E785-Q854 VanDerWaalsContact OE1-CD 3.28Å; E785-Q854 PolarHBondContact OE1-NE2 3.07Å; E785-V855 WeakPolarHBondContact CA-O 3.42Å; E785-T856 HydrophobicContact CB-CG2 4.38Å; E785-T856 PolarHBondContact OE2-OG1 3.27Å
786	E	92.6	Very high	85.7	Confident	89 Å²	89	79.1 Å²	79.1	42%	0.416	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	155.1	178.9	-163.2	164.4	-164	0	0	111.2	F788 Q854 V855 L869	E786-F788 HydrophobicContact CB-CE2 3.77Å; E786-F788 HydrophobicContact CB-CZ 3.72Å; E786-F788 HydrophobicContact CG-CE1 3.98Å; E786-F788 HydrophobicContact CG-CE2 4.02Å; E786-F788 HydrophobicContact CG-CZ 3.58Å; E786-F788 WeakPolarHBondContact OE2-CZ 3.36Å; E786-Q854 CarbonylContact O-C 3.6Å; E786-Q854 WeakPolarHBondContact O-CA 3.43Å; E786-V855 PolarHBondContact N-O 3.05Å; E786-V855 PolarHBondContact O-N 2.87Å; E786-L869 HydrophobicContact CB-CD2 4.04Å
787	T	90.5	Very high	85.9	Confident	85 Å²	85	77.2 Å²	77.2	52%	0.521	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	124.6	-177.1	-55.7	0	0	0	0	110.7	T852 M853	T787-T852 HydrophobicContact CG2-CG2 3.85Å; T787-M853 CarbonylContact C-O 3.58Å; T787-M853 WeakPolarHBondContact CA-O 3.49Å
788	F	89	Confident	86.3	Confident	26 Å²	26	76.6 Å²	76.6	11%	0.114	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	152.9	-177.1	-54.6	-80.3	0	0	0	110.9	E786 M853 V855 L869 V872	E786-F788 HydrophobicContact CB-CE2 3.77Å; E786-F788 HydrophobicContact CB-CZ 3.72Å; E786-F788 HydrophobicContact CG-CE1 3.98Å; E786-F788 HydrophobicContact CG-CE2 4.02Å; E786-F788 HydrophobicContact CG-CZ 3.58Å; E786-F788 WeakPolarHBondContact OE2-CZ 3.36Å; F788-M853 HydrophobicContact CB-CE 4.36Å; F788-M853 HydrophobicContact CD2-CE 4.19Å; F788-M853 PolarHBondContact N-O 2.91Å; F788-M853 PolarHBondContact O-N 2.98Å; F788-V855 HydrophobicContact CD2-CB 4.45Å; F788-V855 HydrophobicContact CD2-CG2 3.9Å; F788-V855 HydrophobicContact CE2-CB 4.19Å; F788-V855 HydrophobicContact CE2-CG2 4.05Å; F788-L869 HydrophobicContact CE2-CD2 4.33Å; F788-V872 HydrophobicContact CD1-CG1 4.27Å; F788-V872 HydrophobicContact CD2-CG1 3.5Å; F788-V872 HydrophobicContact CE1-CG1 4.31Å; F788-V872 HydrophobicContact CE2-CB 4.07Å; F788-V872 HydrophobicContact CE2-CG1 3.52Å; F788-V872 HydrophobicContact CG-CG1 3.87Å; F788-V872 HydrophobicContact CZ-CB 4.12Å; F788-V872 HydrophobicContact CZ-CG1 3.94Å
789	A	86.6	Confident	86.5	Confident	81 Å²	81	75.2 Å²	75.2	67%	0.669	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	111.1	176.4	0	0	0	0	0	110.4	A791	A789-A791 PolarHBondContact O-N 3.46Å
790	L	84.1	Confident	86.9	Confident	49 Å²	49	74.2 Å²	74.2	26%	0.257	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	81.6	177.2	-60	169.2	0	0	0	109.1	S792 V793 A799 V851	L790-S792 VanDerWaalsContact C-N 3.29Å; L790-S792 PolarHBondContact O-N 2.8Å; L790-V793 HydrophobicContact CB-CB 4.22Å; L790-V793 HydrophobicContact CB-CG2 4.23Å; L790-V793 PolarHBondContact O-N 3.44Å; L790-A799 HydrophobicContact CD1-CB 4.23Å; L790-V851 HydrophobicContact CB-CB 4.28Å; L790-V851 WeakPolarHBondContact CB-O 3.28Å; L790-V851 HydrophobicContact CD1-CB 4.48Å; L790-V851 HydrophobicContact CD1-CG1 4.33Å; L790-V851 PolarHBondContact N-O 3.27Å; L790-V851 PolarHBondContact O-N 3.31Å
791	A	75.4	Confident	87.1	Confident	91 Å²	91	70.5 Å²	70.5	75%	0.752	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.6	-174.7	0	0	0	0	0	114.2	A789	A789-A791 PolarHBondContact O-N 3.46Å
792	S	77.6	Confident	87.3	Confident	103 Å²	103	66.2 Å²	66.2	72%	0.72	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-19.2	-179.7	52.1	0	0	0	0	113.8	L790	L790-S792 VanDerWaalsContact C-N 3.29Å; L790-S792 PolarHBondContact O-N 2.8Å
793	V	84	Confident	87.4	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.036	36%	0.363	C	S	.	.			trans	-96.8	125.8	-172.8	-178.4	0	0	0	0	110.4	L790 T795 E798 A799 V851	L790-V793 HydrophobicContact CB-CB 4.22Å; L790-V793 HydrophobicContact CB-CG2 4.23Å; L790-V793 PolarHBondContact O-N 3.44Å; V793-T795 VanDerWaalsContact CG1-O 3.29Å; V793-T795 WeakPolarHBondContact CG1-O 3.46Å; V793-E798 HydrophobicContact CG1-CB 3.89Å; V793-E798 HydrophobicContact CG1-CG 3.89Å; V793-A799 HydrophobicContact CG1-CB 3.77Å; V793-V851 HydrophobicContact CG1-CG2 4.2Å
794	R	83.4	Confident	87.3	Confident	213 Å²	213	62.8 Å²	62.8	80%	0.804	35%	0.353	S	S	*	.			trans	-103.8	-9.3	-173.1	-64.6	-172.8	179.7	179.3	1.3	114.3	L847	R794-L847 WeakPolarHBondContact O-CD1 3.24Å
795	T	87.9	Confident	87.1	Confident	64 Å²	64	64.4 Å²	64.4	39%	0.393	37%	0.372	S	S	.	.	S	Bend	trans	-133.8	149.9	-178.6	68.7	0	0	0	0	111.2	V793 D797 E798 A799	V793-T795 VanDerWaalsContact CG1-O 3.29Å; V793-T795 WeakPolarHBondContact CG1-O 3.46Å; T795-D797 VanDerWaalsContact C-N 3.32Å; T795-E798 WeakPolarHBondContact OG1-CB 3.24Å; T795-E798 PolarHBondContact OG1-N 3.4Å; T795-A799 PolarHBondContact O-N 3.49Å; T795-A799 VanDerWaalsContact O-N 3.14Å
796	L	87.4	Confident	87	Confident	8 Å²	8	64.1 Å²	64.1	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-66.7	-35.3	176	-69	174.8	0	0	0	111.7	A799 V800 V818 K822 H825 L845 L847 V851	L796-A799 PolarHBondContact O-N 3.08Å; L796-V800 WeakPolarHBondContact O-CB 3.3Å; L796-V800 VanDerWaalsContact O-CG2 3.28Å; L796-V800 WeakPolarHBondContact O-CG2 3.38Å; L796-V800 PolarHBondContact O-N 2.9Å; L796-V818 HydrophobicContact CB-CG1 3.9Å; L796-V818 HydrophobicContact CB-CG2 4.09Å; L796-V818 HydrophobicContact CD1-CG1 4.15Å; L796-K822 WeakPolarHBondContact CD1-O 3.25Å; L796-H825 HydrophobicContact CD1-CB 4.2Å; L796-L845 HydrophobicContact CD2-CB 3.72Å; L796-L847 HydrophobicContact CD1-CB 4.27Å; L796-L847 HydrophobicContact CD2-CB 4.05Å; L796-L847 HydrophobicContact CG-CB 3.99Å; L796-L847 HydrophobicContact CG-CD2 4.49Å; L796-V851 HydrophobicContact CD2-CG1 4.09Å; L796-V851 HydrophobicContact CD2-CG2 4.27Å
797	D	87.3	Confident	86.8	Confident	96 Å²	96	60 Å²	60	51%	0.513	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-45	177.6	-72.5	-62.9	0	0	0	112.1	T795 A799 V800 G801 V818	T795-D797 VanDerWaalsContact C-N 3.32Å; D797-A799 VanDerWaalsContact C-N 3.35Å; D797-V800 PolarHBondContact O-N 3.4Å; D797-G801 PolarHBondContact O-N 3.39Å; D797-V818 WeakPolarHBondContact OD1-CB 3.48Å; D797-V818 VanDerWaalsContact OD1-CG2 3.28Å; D797-V818 WeakPolarHBondContact OD1-CG2 3.28Å
798	E	88.4	Confident	86.7	Confident	88 Å²	88	56.1 Å²	56.1	41%	0.411	33%	0.327	S	S	.	.	H	α-helix	trans	-63.4	-41.4	175.2	-176.6	-176.2	-170.1	0	0	111.3	V793 T795 G801 N802	V793-E798 HydrophobicContact CG1-CB 3.89Å; V793-E798 HydrophobicContact CG1-CG 3.89Å; T795-E798 WeakPolarHBondContact OG1-CB 3.24Å; T795-E798 PolarHBondContact OG1-N 3.4Å; E798-G801 PolarHBondContact O-N 3.14Å; E798-N802 WeakPolarHBondContact O-CB 3.38Å; E798-N802 PolarHBondContact O-N 3.4Å; E798-N802 PolarHBondContact O-ND2 3.4Å
799	A	88.5	Confident	86.8	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-48.2	176.3	0	0	0	0	0	111.3	L790 V793 T795 L796 D797 G801 N802 I803 L845 V851	L790-A799 HydrophobicContact CD1-CB 4.23Å; V793-A799 HydrophobicContact CG1-CB 3.77Å; T795-A799 PolarHBondContact O-N 3.49Å; T795-A799 VanDerWaalsContact O-N 3.14Å; L796-A799 PolarHBondContact O-N 3.08Å; D797-A799 VanDerWaalsContact C-N 3.35Å; A799-G801 PolarHBondContact O-N 3.39Å; A799-N802 PolarHBondContact O-N 2.92Å; A799-I803 WeakPolarHBondContact O-CD1 3.47Å; A799-I803 WeakPolarHBondContact O-CG1 3.36Å; A799-I803 PolarHBondContact O-N 2.88Å; A799-L845 HydrophobicContact CB-CD2 4.49Å; A799-V851 HydrophobicContact CB-CB 4.32Å; A799-V851 HydrophobicContact CB-CG1 3.93Å; A799-V851 HydrophobicContact CB-CG2 4.19Å
800	V	90.2	Very high	86.8	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-46.5	178.5	168.6	0	0	0	0	111.1	L796 D797 N802 I803 I804 V818 L827 L845	L796-V800 WeakPolarHBondContact O-CB 3.3Å; L796-V800 VanDerWaalsContact O-CG2 3.28Å; L796-V800 WeakPolarHBondContact O-CG2 3.38Å; L796-V800 PolarHBondContact O-N 2.9Å; D797-V800 PolarHBondContact O-N 3.4Å; V800-N802 PolarHBondContact O-N 2.94Å; V800-I803 PolarHBondContact O-N 2.91Å; V800-I804 HydrophobicContact CG1-CD1 3.66Å; V800-I804 HydrophobicContact CG1-CG1 4.48Å; V800-I804 WeakPolarHBondContact O-CD1 3.25Å; V800-I804 VanDerWaalsContact O-CG1 3.25Å; V800-I804 WeakPolarHBondContact O-CG1 3.28Å; V800-I804 PolarHBondContact O-N 3.19Å; V800-V818 HydrophobicContact CB-CG2 4.5Å; V800-V818 HydrophobicContact CG2-CG2 3.91Å; V800-L827 HydrophobicContact CG1-CD1 3.97Å; V800-L827 HydrophobicContact CG1-CD2 4.25Å; V800-L827 HydrophobicContact CG2-CD2 4.46Å; V800-L845 HydrophobicContact CG2-CD1 3.53Å
801	G	88.8	Confident	87	Confident	37 Å²	37	51.9 Å²	51.9	38%	0.381	29%	0.294	S	S	.	.	H	α-helix	trans	-59.2	-46.6	176.7	0	0	0	0	0	112.7	D797 E798 A799 I804 S805	D797-G801 PolarHBondContact O-N 3.39Å; E798-G801 PolarHBondContact O-N 3.14Å; A799-G801 PolarHBondContact O-N 3.39Å; G801-I804 PolarHBondContact O-N 3.06Å; G801-S805 WeakPolarHBondContact O-CB 3.42Å; G801-S805 PolarHBondContact O-N 3.06Å
802	N	88.2	Confident	87.4	Confident	86 Å²	86	47.6 Å²	47.6	46%	0.46	26%	0.258	S	S	.	.	H	α-helix	trans	-63.7	-44.1	179.1	-70.1	-10.8	0	0	0	111.9	E798 A799 V800 S805 F806	E798-N802 WeakPolarHBondContact O-CB 3.38Å; E798-N802 PolarHBondContact O-N 3.4Å; E798-N802 PolarHBondContact O-ND2 3.4Å; A799-N802 PolarHBondContact O-N 2.92Å; V800-N802 PolarHBondContact O-N 2.94Å; N802-S805 PolarHBondContact O-N 2.88Å; N802-F806 WeakPolarHBondContact O-CB 3.48Å; N802-F806 PolarHBondContact O-N 3.48Å
803	I	89.7	Confident	87.6	Confident	15 Å²	15	47.5 Å²	47.5	8%	0.077	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-43.7	179	-62.5	155.3	0	0	0	110.9	A799 V800 S805 F806 L807 L827 L829 L845 M853	A799-I803 WeakPolarHBondContact O-CD1 3.47Å; A799-I803 WeakPolarHBondContact O-CG1 3.36Å; A799-I803 PolarHBondContact O-N 2.88Å; V800-I803 PolarHBondContact O-N 2.91Å; I803-S805 VanDerWaalsContact C-N 3.34Å; I803-S805 PolarHBondContact O-N 3.18Å; I803-F806 PolarHBondContact O-N 3.35Å; I803-L807 HydrophobicContact CG2-CD1 3.85Å; I803-L807 HydrophobicContact CG2-CG 4.42Å; I803-L807 WeakPolarHBondContact O-CB 3.36Å; I803-L807 PolarHBondContact O-N 3.22Å; I803-L827 HydrophobicContact CB-CD2 3.97Å; I803-L827 HydrophobicContact CD1-CD2 4.19Å; I803-L827 HydrophobicContact CG2-CD2 3.81Å; I803-L829 HydrophobicContact CG2-CD1 3.87Å; I803-L845 HydrophobicContact CD1-CD1 4.2Å; I803-L845 HydrophobicContact CD1-CD2 3.77Å; I803-M853 HydrophobicContact CD1-SD 3.31Å; I803-M853 WeakPolarHBondContact CD1-SD 3.49Å; I803-M853 HydrophobicContact CG1-SD 3.84Å
804	I	89.8	Confident	87.2	Confident	27 Å²	27	52.4 Å²	52.4	14%	0.138	27%	0.265	C	S	.	.	H	α-helix	trans	-61.5	-44.7	177.8	-69.8	165.3	0	0	0	110.6	V800 G801 G808 P811 D816 L827 L829	V800-I804 HydrophobicContact CG1-CD1 3.66Å; V800-I804 HydrophobicContact CG1-CG1 4.48Å; V800-I804 WeakPolarHBondContact O-CD1 3.25Å; V800-I804 VanDerWaalsContact O-CG1 3.25Å; V800-I804 WeakPolarHBondContact O-CG1 3.28Å; V800-I804 PolarHBondContact O-N 3.19Å; G801-I804 PolarHBondContact O-N 3.06Å; I804-G808 WeakPolarHBondContact O-CA 3.47Å; I804-G808 PolarHBondContact O-N 3.43Å; I804-P811 HydrophobicContact CD1-CB 4.14Å; I804-P811 HydrophobicContact CD1-CG 4.16Å; I804-D816 HydrophobicContact CD1-CB 3.89Å; I804-L827 HydrophobicContact CD1-CD1 4.24Å; I804-L827 HydrophobicContact CG1-CD1 4.32Å; I804-L827 HydrophobicContact CG1-CD2 4.3Å; I804-L829 HydrophobicContact CG1-CD2 3.8Å
805	S	87.4	Confident	87.3	Confident	93 Å²	93	42.6 Å²	42.6	65%	0.65	23%	0.229	S	C	*	.	H	α-helix	trans	-66	-43.9	178.7	-167.7	0	0	0	0	111.7	G801 N802 I803 G808	G801-S805 WeakPolarHBondContact O-CB 3.42Å; G801-S805 PolarHBondContact O-N 3.06Å; N802-S805 PolarHBondContact O-N 2.88Å; I803-S805 VanDerWaalsContact C-N 3.34Å; I803-S805 PolarHBondContact O-N 3.18Å; S805-G808 PolarHBondContact O-N 3.25Å
806	F	89	Confident	87.2	Confident	87 Å²	87	42.7 Å²	42.7	38%	0.382	23%	0.227	S	C	.	.	H	α-helix	trans	-66.8	-49.2	-176.5	-178.2	-100	0	0	0	112.8	N802 I803 G808 S871 V872	N802-F806 WeakPolarHBondContact O-CB 3.48Å; N802-F806 PolarHBondContact O-N 3.48Å; I803-F806 PolarHBondContact O-N 3.35Å; F806-G808 VanDerWaalsContact C-N 3.33Å; F806-S871 VanDerWaalsContact CE1-O 3.29Å; F806-S871 WeakPolarHBondContact CE1-O 3.4Å; F806-S871 WeakPolarHBondContact CZ-O 3.44Å; F806-V872 HydrophobicContact CE1-CG2 4.24Å
807	L	89.7	Confident	87	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-78.7	-20.1	178.9	-65.3	177.8	0	0	0	112.4	I803 M809 L829 V841 I868 V872	I803-L807 HydrophobicContact CG2-CD1 3.85Å; I803-L807 HydrophobicContact CG2-CG 4.42Å; I803-L807 WeakPolarHBondContact O-CB 3.36Å; I803-L807 PolarHBondContact O-N 3.22Å; L807-M809 HydrophobicContact CB-CB 4.48Å; L807-M809 HydrophobicContact CB-CG 3.98Å; L807-M809 HydrophobicContact CB-SD 4.11Å; L807-M809 HydrophobicContact CD1-SD 4.31Å; L807-M809 PolarHBondContact O-N 3.15Å; L807-L829 HydrophobicContact CD1-CD1 3.71Å; L807-V841 HydrophobicContact CD1-CG1 4.35Å; L807-V841 HydrophobicContact CD1-CG2 4.47Å; L807-I868 HydrophobicContact CD2-CD1 4.4Å; L807-I868 HydrophobicContact CD2-CG2 4.08Å; L807-V872 HydrophobicContact CD2-CG2 3.98Å
808	G	87.4	Confident	86.8	Confident	5 Å²	5	45.1 Å²	45.1	5%	0.052	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	25.7	-178.5	0	0	0	0	0	113.9	K765 I804 S805 F806	K765-G808 WeakPolarHBondContact CE-O 3.43Å; K765-G808 WeakPolarHBondContact CG-O 3.31Å; I804-G808 WeakPolarHBondContact O-CA 3.47Å; I804-G808 PolarHBondContact O-N 3.43Å; S805-G808 PolarHBondContact O-N 3.25Å; F806-G808 VanDerWaalsContact C-N 3.33Å
809	M	91.3	Very high	86.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-98.6	163.7	-176.2	-65.7	179.8	81.4	0	0	112.7	I763 L807 L829 G831 V839 V841	I763-M809 HydrophobicContact CD1-CG 4.42Å; I763-M809 HydrophobicContact CG2-CG 3.81Å; L807-M809 HydrophobicContact CB-CB 4.48Å; L807-M809 HydrophobicContact CB-CG 3.98Å; L807-M809 HydrophobicContact CB-SD 4.11Å; L807-M809 HydrophobicContact CD1-SD 4.31Å; L807-M809 PolarHBondContact O-N 3.15Å; M809-L829 HydrophobicContact CB-CB 3.74Å; M809-L829 HydrophobicContact CB-CD1 4.36Å; M809-L829 HydrophobicContact CB-CD2 4.47Å; M809-L829 HydrophobicContact CB-CG 4.41Å; M809-L829 HydrophobicContact CE-CB 4.19Å; M809-L829 HydrophobicContact SD-CB 4.04Å; M809-G831 VanDerWaalsContact CE-N 3.29Å; M809-V839 HydrophobicContact CE-CB 4.5Å; M809-V839 HydrophobicContact CE-CG1 3.87Å; M809-V839 HydrophobicContact CE-CG2 4.33Å; M809-V839 WeakPolarHBondContact CE-O 3.28Å; M809-V841 HydrophobicContact CE-CG2 3.94Å; M809-V841 HydrophobicContact SD-CB 4.35Å; M809-V841 HydrophobicContact SD-CG2 3.65Å
810	Q	88.1	Confident	85.9	Confident	49 Å²	49	52.1 Å²	52.1	23%	0.229	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.3	179.3	-175.6	58.6	40.7	0	0	110.8	K765 V766 L767 C812 L829 A830	K765-Q810 HydrophobicContact CB-CB 4.04Å; V766-Q810 WeakPolarHBondContact O-CB 3.4Å; L767-Q810 HydrophobicContact CB-CG 4.28Å; L767-Q810 HydrophobicContact CD1-CG 4.12Å; Q810-C812 PolarHBondContact O-N 3.47Å; Q810-L829 WeakPolarHBondContact O-CA 3.32Å; Q810-A830 PolarHBondContact N-O 3.23Å; Q810-A830 PolarHBondContact O-N 2.86Å
811	P	87.7	Confident	85.2	Confident	18 Å²	18	59.9 Å²	59.9	12%	0.117	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	131.5	169.5	26.7	-34.1	0	0	0	111.1	I804 D816 F828 L829	I804-P811 HydrophobicContact CD1-CB 4.14Å; I804-P811 HydrophobicContact CD1-CG 4.16Å; P811-D816 HydrophobicContact CB-CB 3.8Å; P811-D816 HydrophobicContact CG-CB 3.9Å; P811-F828 WeakPolarHBondContact CA-O 3.26Å; P811-L829 HydrophobicContact CB-CD2 4.27Å
812	C	83.8	Confident	84.9	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-101.8	155.3	178.4	-65.1	0	0	0	0	110.5	F771 Q810 R814 S815 F828 A830	F771-C812 HydrophobicContact CB-CB 4.08Å; F771-C812 HydrophobicContact CD2-CB 4.16Å; Q810-C812 PolarHBondContact O-N 3.47Å; C812-R814 PolarHBondContact O-N 2.63Å; C812-S815 WeakPolarHBondContact O-CB 3.38Å; C812-S815 PolarHBondContact O-N 3.38Å; C812-S815 PolarHBondContact O-OG 3.4Å; C812-F828 HydrophobicContact CB-CB 4.16Å; C812-F828 PolarHBondContact N-O 3.48Å; C812-A830 VanDerWaalsContact SG-CB 3.53Å
813	E	81.2	Confident	84.7	Confident	101 Å²	101	65.1 Å²	65.1	47%	0.472	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	24	172.8	-56	-174.8	179	0	0	115.7	F771 S815	F771-E813 HydrophobicContact CB-CG 4.38Å; F771-E813 PolarHBondContact N-OE1 3.39Å; E813-S815 PolarHBondContact O-N 3.03Å
814	R	76.4	Confident	84.7	Confident	109 Å²	109	68 Å²	68	41%	0.411	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	27.9	-174.6	-56.5	-175.6	177.6	-164.1	-5	114.3	E426 C812 D816 K817	E426-R814 VanDerWaalsContact O-CZ 3.23Å; E426-R814 PolarHBondContact O-NH1 3.02Å; E426-R814 PolarHBondContact O-NH2 2.88Å; C812-R814 PolarHBondContact O-N 2.63Å; R814-D816 WeakPolarHBondContact CA-OD1 3.45Å; R814-D816 PolarHBondContact O-N 3.48Å; R814-D816 VanDerWaalsContact O-N 3.14Å; R814-K817 PolarHBondContact O-N 2.9Å
815	S	85.1	Confident	84.9	Confident	8 Å²	8	67.9 Å²	67.9	6%	0.056	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.3	176.4	65.4	0	0	0	0	113.6	C812 E813 K817 H825 V826 L827 F828	C812-S815 WeakPolarHBondContact O-CB 3.38Å; C812-S815 PolarHBondContact O-N 3.38Å; C812-S815 PolarHBondContact O-OG 3.4Å; E813-S815 PolarHBondContact O-N 3.03Å; S815-K817 VanDerWaalsContact C-N 3.3Å; S815-H825 PolarHBondContact O-NE2 3.16Å; S815-V826 WeakPolarHBondContact CB-O 3.43Å; S815-L827 WeakPolarHBondContact O-CD1 3.28Å; S815-L827 WeakPolarHBondContact OG-CD1 3.45Å; S815-F828 PolarHBondContact OG-N 2.95Å; S815-F828 PolarHBondContact OG-O 3.04Å
816	D	85.3	Confident	85.1	Confident	65 Å²	65	66 Å²	66	35%	0.348	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-21.9	169.7	58.3	-55.7	0	0	0	113.3	I804 P811 R814	I804-D816 HydrophobicContact CD1-CB 3.89Å; P811-D816 HydrophobicContact CB-CB 3.8Å; P811-D816 HydrophobicContact CG-CB 3.9Å; R814-D816 WeakPolarHBondContact CA-OD1 3.45Å; R814-D816 PolarHBondContact O-N 3.48Å; R814-D816 VanDerWaalsContact O-N 3.14Å
817	K	83.8	Confident	85.3	Confident	135 Å²	135	61.9 Å²	61.9	59%	0.587	31%	0.314	S	S	*	.	S	Bend	trans	-98.1	116.6	178.9	-65.1	-168.6	178	-171.3	0	111.2	R814 S815 P819	R814-K817 PolarHBondContact O-N 2.9Å; S815-K817 VanDerWaalsContact C-N 3.3Å; K817-P819 WeakPolarHBondContact O-CD 3.19Å
818	V	84.1	Confident	85.5	Confident	20 Å²	20	64 Å²	64	12%	0.121	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-83	127.2	174.3	-169.7	0	0	0	0	109.6	L796 D797 V800 H825	L796-V818 HydrophobicContact CB-CG1 3.9Å; L796-V818 HydrophobicContact CB-CG2 4.09Å; L796-V818 HydrophobicContact CD1-CG1 4.15Å; D797-V818 WeakPolarHBondContact OD1-CB 3.48Å; D797-V818 VanDerWaalsContact OD1-CG2 3.28Å; D797-V818 WeakPolarHBondContact OD1-CG2 3.28Å; V800-V818 HydrophobicContact CB-CG2 4.5Å; V800-V818 HydrophobicContact CG2-CG2 3.91Å; V818-H825 HydrophobicContact CG1-CB 4.32Å
819	P	80.1	Confident	85.7	Confident	59 Å²	59	63.8 Å²	63.8	38%	0.383	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-65.7	140.2	172.9	-20.7	33.1	0	0	0	112	K817 K822	K817-P819 WeakPolarHBondContact O-CD 3.19Å; P819-K822 HydrophobicContact CB-CD 3.96Å; P819-K822 HydrophobicContact CB-CG 4.28Å; P819-K822 HydrophobicContact CG-CD 4.02Å
820	E	77.3	Confident	85.6	Confident	177 Å²	177	63.8 Å²	63.8	83%	0.827	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	141.5	177.7	-64.4	-177.9	178.8	0	0	112	K822	E820-K822 PolarHBondContact O-N 3.36Å
821	N	75.8	Confident	85.7	Confident	164 Å²	164	61.6 Å²	61.6	88%	0.877	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	25.1	177.1	-57.7	-41.7	0	0	0	116.9
822	K	81.3	Confident	85.7	Confident	115 Å²	115	61.1 Å²	61.1	50%	0.5	31%	0.308	S	S	.	.			trans	-98.9	139	170.3	-70.2	-165.7	177.4	-176.9	0	112.3	L796 P819 E820	L796-K822 WeakPolarHBondContact CD1-O 3.25Å; P819-K822 HydrophobicContact CB-CD 3.96Å; P819-K822 HydrophobicContact CB-CG 4.28Å; P819-K822 HydrophobicContact CG-CD 4.02Å; E820-K822 PolarHBondContact O-N 3.36Å
823	N	84.9	Confident	86	Confident	118 Å²	118	61.8 Å²	61.8	63%	0.631	31%	0.311	S	S	*	.	S	Bend	trans	-94.3	-1.4	173.7	-64.1	-7.8	0	0	0	112.8	A846 L847	N823-A846 WeakPolarHBondContact O-CA 3.41Å; N823-L847 PolarHBondContact O-N 2.77Å
824	S	90	Very high	86.2	Confident	77 Å²	77	58.9 Å²	58.9	54%	0.538	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	148.3	174.7	62.5	0	0	0	0	111.4	L845	S824-L845 CarbonylContact C-O 3.54Å; S824-L845 WeakPolarHBondContact CA-O 3.16Å; S824-L845 WeakPolarHBondContact CB-O 3.4Å
825	H	92.8	Very high	86.4	Confident	24 Å²	24	56.1 Å²	56.1	11%	0.111	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	155.2	-179.1	-172.3	61.7	0	0	0	110.4	L796 S815 V818 L845	L796-H825 HydrophobicContact CD1-CB 4.2Å; S815-H825 PolarHBondContact O-NE2 3.16Å; V818-H825 HydrophobicContact CG1-CB 4.32Å; H825-L845 PolarHBondContact N-O 3.2Å; H825-L845 PolarHBondContact O-N 3.24Å
826	V	92.6	Very high	86.1	Confident	53 Å²	53	56.9 Å²	56.9	32%	0.321	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.2	175.1	-172.3	0	0	0	0	108.3	S815 F828 R842 A843 R844	S815-V826 WeakPolarHBondContact CB-O 3.43Å; V826-F828 HydrophobicContact CB-CZ 4.37Å; V826-F828 HydrophobicContact CG1-CD1 4.27Å; V826-F828 HydrophobicContact CG1-CE1 3.65Å; V826-F828 HydrophobicContact CG1-CE2 4.33Å; V826-F828 HydrophobicContact CG1-CZ 3.67Å; V826-R842 HydrophobicContact CG1-CG 3.97Å; V826-A843 CarbonylContact C-O 3.59Å; V826-A843 WeakPolarHBondContact CA-O 3.33Å; V826-R844 HydrophobicContact CG1-CG 4.17Å; V826-R844 HydrophobicContact CG2-CG 4.12Å
827	L	92.6	Very high	86.2	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.6	178.3	176.2	62.5	0	0	0	109.3	V800 I803 I804 S815 L829 R842 A843 L845	V800-L827 HydrophobicContact CG1-CD1 3.97Å; V800-L827 HydrophobicContact CG1-CD2 4.25Å; V800-L827 HydrophobicContact CG2-CD2 4.46Å; I803-L827 HydrophobicContact CB-CD2 3.97Å; I803-L827 HydrophobicContact CD1-CD2 4.19Å; I803-L827 HydrophobicContact CG2-CD2 3.81Å; I804-L827 HydrophobicContact CD1-CD1 4.24Å; I804-L827 HydrophobicContact CG1-CD1 4.32Å; I804-L827 HydrophobicContact CG1-CD2 4.3Å; S815-L827 WeakPolarHBondContact O-CD1 3.28Å; S815-L827 WeakPolarHBondContact OG-CD1 3.45Å; L827-L829 HydrophobicContact CD1-CD2 3.83Å; L827-L829 HydrophobicContact CD1-CG 4.35Å; L827-L829 HydrophobicContact CD2-CD1 4.08Å; L827-L829 HydrophobicContact CD2-CD2 4.19Å; L827-L829 HydrophobicContact CD2-CG 4.22Å; L827-L829 HydrophobicContact CG-CD1 4.32Å; L827-L829 HydrophobicContact CG-CD2 3.95Å; L827-L829 HydrophobicContact CG-CG 3.94Å; L827-R842 WeakPolarHBondContact O-CA 3.48Å; L827-A843 HydrophobicContact CB-CB 4.22Å; L827-A843 PolarHBondContact N-O 3.13Å; L827-A843 PolarHBondContact O-N 3.17Å; L827-L845 HydrophobicContact CB-CD1 4.49Å
828	F	93	Very high	86.3	Confident	47 Å²	47	52 Å²	52	21%	0.206	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.5	176	-59.5	-60.9	0	0	0	109.4	F771 P811 C812 S815 V826 R842	F771-F828 HydrophobicContact CB-CB 4.34Å; F771-F828 HydrophobicContact CB-CG 4.5Å; F771-F828 HydrophobicContact CD1-CB 4.06Å; F771-F828 AromaticContact CD1-CD1 3.42Å; F771-F828 HydrophobicContact CD1-CD1 3.42Å; F771-F828 VanDerWaalsContact CD1-CD1 3.42Å; F771-F828 AromaticContact CD1-CE1 3.98Å; F771-F828 HydrophobicContact CD1-CE1 3.98Å; F771-F828 AromaticContact CD1-CG 3.83Å; F771-F828 HydrophobicContact CD1-CG 3.83Å; F771-F828 HydrophobicContact CD2-CB 3.78Å; F771-F828 HydrophobicContact CD2-CG 4.45Å; F771-F828 HydrophobicContact CE1-CB 4.29Å; F771-F828 AromaticContact CE1-CD1 3.35Å; F771-F828 HydrophobicContact CE1-CD1 3.35Å; F771-F828 AromaticContact CE1-CE1 3.96Å; F771-F828 HydrophobicContact CE1-CE1 3.96Å; F771-F828 HydrophobicContact CE1-CG 4.11Å; F771-F828 HydrophobicContact CE2-CB 4.01Å; F771-F828 HydrophobicContact CE2-CD1 4.5Å; F771-F828 HydrophobicContact CG-CB 3.79Å; F771-F828 HydrophobicContact CG-CD1 4.06Å; F771-F828 HydrophobicContact CG-CG 4.01Å; F771-F828 HydrophobicContact CZ-CB 4.24Å; F771-F828 AromaticContact CZ-CD1 3.91Å; F771-F828 HydrophobicContact CZ-CD1 3.91Å; P811-F828 WeakPolarHBondContact CA-O 3.26Å; C812-F828 HydrophobicContact CB-CB 4.16Å; C812-F828 PolarHBondContact N-O 3.48Å; S815-F828 PolarHBondContact OG-N 2.95Å; S815-F828 PolarHBondContact OG-O 3.04Å; V826-F828 HydrophobicContact CB-CZ 4.37Å; V826-F828 HydrophobicContact CG1-CD1 4.27Å; V826-F828 HydrophobicContact CG1-CE1 3.65Å; V826-F828 HydrophobicContact CG1-CE2 4.33Å; V826-F828 HydrophobicContact CG1-CZ 3.67Å; F828-R842 HydrophobicContact CD1-CB 4.34Å; F828-R842 HydrophobicContact CD1-CG 3.99Å; F828-R842 HydrophobicContact CE1-CG 3.74Å
829	L	92.1	Very high	86.6	Confident	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	137.1	-178.7	-57.1	172.8	0	0	0	110.4	F771 I803 I804 L807 M809 Q810 P811 L827 L840 V841	F771-L829 WeakPolarHBondContact CE2-O 3.33Å; I803-L829 HydrophobicContact CG2-CD1 3.87Å; I804-L829 HydrophobicContact CG1-CD2 3.8Å; L807-L829 HydrophobicContact CD1-CD1 3.71Å; M809-L829 HydrophobicContact CB-CB 3.74Å; M809-L829 HydrophobicContact CB-CD1 4.36Å; M809-L829 HydrophobicContact CB-CD2 4.47Å; M809-L829 HydrophobicContact CB-CG 4.41Å; M809-L829 HydrophobicContact CE-CB 4.19Å; M809-L829 HydrophobicContact SD-CB 4.04Å; Q810-L829 WeakPolarHBondContact O-CA 3.32Å; P811-L829 HydrophobicContact CB-CD2 4.27Å; L827-L829 HydrophobicContact CD1-CD2 3.83Å; L827-L829 HydrophobicContact CD1-CG 4.35Å; L827-L829 HydrophobicContact CD2-CD1 4.08Å; L827-L829 HydrophobicContact CD2-CD2 4.19Å; L827-L829 HydrophobicContact CD2-CG 4.22Å; L827-L829 HydrophobicContact CG-CD1 4.32Å; L827-L829 HydrophobicContact CG-CD2 3.95Å; L827-L829 HydrophobicContact CG-CG 3.94Å; L829-L840 WeakPolarHBondContact O-CA 3.39Å; L829-V841 HydrophobicContact CB-CB 4.17Å; L829-V841 PolarHBondContact N-O 3.16Å; L829-V841 PolarHBondContact O-N 2.98Å
830	A	89.8	Confident	87.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.6	174.1	0	0	0	0	0	111.1	V766 K768 Q810 C812 L840	V766-A830 WeakPolarHBondContact O-CB 3.42Å; K768-A830 HydrophobicContact CB-CB 4.2Å; K768-A830 HydrophobicContact CG-CB 3.69Å; Q810-A830 PolarHBondContact N-O 3.23Å; Q810-A830 PolarHBondContact O-N 2.86Å; C812-A830 VanDerWaalsContact SG-CB 3.53Å; A830-L840 HydrophobicContact CB-CD2 3.57Å
831	G	90.1	Very high	88.1	Confident	3 Å²	3	39.9 Å²	39.9	3%	0.031	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161	174.2	177.3	0	0	0	0	0	111.1	Q764 M809 V839	Q764-G831 CarbonylContact O-C 3.56Å; Q764-G831 WeakPolarHBondContact O-CA 3.31Å; M809-G831 VanDerWaalsContact CE-N 3.29Å; G831-V839 PolarHBondContact N-O 2.85Å; G831-V839 WeakPolarHBondContact O-CG1 3.15Å; G831-V839 PolarHBondContact O-N 2.99Å
832	V	88.6	Confident	89	Confident	9 Å²	9	34.3 Å²	34.3	6%	0.055	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	130.5	171.7	175.7	0	0	0	0	106.5	L581 F630 I763 Q764 V766 H837 D838	L581-V832 HydrophobicContact CD1-CB 4.2Å; L581-V832 HydrophobicContact CD1-CG2 3.98Å; F630-V832 HydrophobicContact CE2-CG1 4.12Å; F630-V832 HydrophobicContact CZ-CG1 4.32Å; F630-V832 WeakPolarHBondContact CZ-O 3.33Å; I763-V832 WeakPolarHBondContact CA-O 3.41Å; Q764-V832 PolarHBondContact N-O 3.25Å; Q764-V832 PolarHBondContact O-N 3.32Å; V766-V832 HydrophobicContact CB-CG2 4.5Å; V766-V832 HydrophobicContact CG2-CB 4.35Å; V766-V832 HydrophobicContact CG2-CG2 3.64Å; V832-H837 CarbonylContact C-O 3.39Å; V832-H837 WeakPolarHBondContact CA-O 3.4Å; V832-D838 WeakPolarHBondContact CG2-OD1 3.4Å
833	F	90.1	Very high	89.6	Confident	14 Å²	14	28.8 Å²	28.8	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	149.7	172.9	-170.1	-98.5	0	0	0	109.8	V719 H762 I763 G835 G836 H837 V839 V864 V867	V719-F833 HydrophobicContact CG1-CZ 4.45Å; H762-F833 HydrophobicContact CB-CD2 4.2Å; H762-F833 HydrophobicContact CB-CE2 3.62Å; H762-F833 HydrophobicContact CB-CZ 4.14Å; I763-F833 HydrophobicContact CG1-CD2 3.88Å; F833-G835 PolarHBondContact O-N 3.36Å; F833-G836 PolarHBondContact O-N 3.23Å; F833-H837 PolarHBondContact N-O 3.26Å; F833-H837 PolarHBondContact O-N 2.69Å; F833-V839 HydrophobicContact CB-CG1 4.42Å; F833-V864 HydrophobicContact CB-CG1 3.71Å; F833-V864 HydrophobicContact CB-CG2 4.17Å; F833-V864 HydrophobicContact CD1-CG1 4.4Å; F833-V864 HydrophobicContact CD1-CG2 3.73Å; F833-V864 HydrophobicContact CD2-CG1 4.21Å; F833-V864 HydrophobicContact CE1-CG2 4.35Å; F833-V864 HydrophobicContact CG-CG1 3.87Å; F833-V864 HydrophobicContact CG-CG2 4.04Å; F833-V867 HydrophobicContact CE2-CG1 4.03Å; F833-V867 HydrophobicContact CZ-CG1 4.37Å
834	R	85.4	Confident	90	Very high	40 Å²	40	28.3 Å²	28.3	15%	0.151	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	136.6	177.1	62.1	174.9	175.5	99.7	-0.7	110.9	F630 A655 L711 H762	F630-R834 HydrophobicContact CD1-CB 3.93Å; F630-R834 HydrophobicContact CE1-CB 4Å; F630-R834 HydrophobicContact CG-CB 4.31Å; F630-R834 HydrophobicContact CZ-CB 4.43Å; A655-R834 PolarHBondContact O-NH1 3.44Å; L711-R834 VanDerWaalsContact CD1-NH1 3.29Å; H762-R834 HydrophobicContact CB-CG 4.45Å; H762-R834 WeakPolarHBondContact ND1-CD 3.36Å; H762-R834 PolarHBondContact ND1-NE 2.75Å; H762-R834 VanDerWaalsContact ND1-NE 3.1Å; H762-R834 PolarHBondContact O-N 3.01Å
835	G	78.8	Confident	90.1	Very high	50 Å²	50	24.9 Å²	24.9	52%	0.515	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	97	-8.6	-168.7	0	0	0	0	0	114.3	F833	F833-G835 PolarHBondContact O-N 3.36Å
836	G	80.3	Confident	90	Very high	25 Å²	25	26 Å²	26	26%	0.258	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	26.7	173.6	0	0	0	0	0	113.7	F833	F833-G836 PolarHBondContact O-N 3.23Å
837	H	86.4	Confident	89.7	Confident	52 Å²	52	26 Å²	26	24%	0.241	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	118.3	179.6	-56.7	-78.3	0	0	0	109.8	V832 F833 V839 E861 V864	V832-H837 CarbonylContact C-O 3.39Å; V832-H837 WeakPolarHBondContact CA-O 3.4Å; F833-H837 PolarHBondContact N-O 3.26Å; F833-H837 PolarHBondContact O-N 2.69Å; H837-V839 PolarHBondContact O-N 3.5Å; H837-E861 IonicContact CD2-OE2 3.59Å; H837-E861 IonicContact CE1-OE2 2.64Å; H837-E861 PolarHBondContact CE1-OE2 3.16Å; H837-E861 IonicContact CG-OE2 2.68Å; H837-E861 IonicContact ND1-OE2 3.03Å; H837-E861 PolarHBondContact ND1-OE2 3.15Å; H837-E861 IonicContact NE2-OE2 2.83Å; H837-E861 PolarHBondContact NE2-OE2 3.45Å; H837-V864 HydrophobicContact CB-CG2 4.08Å
838	D	86	Confident	89.3	Confident	44 Å²	44	29.8 Å²	29.8	24%	0.235	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	133.7	175.8	-86.3	22.1	0	0	0	109	K768 V778 V832 S859 T860	K768-D838 IonicContact NZ-OD2 3.94Å; K768-D838 PolarHBondContact NZ-OD2 2.89Å; V778-D838 HydrophobicContact CG2-CB 4.45Å; V832-D838 WeakPolarHBondContact CG2-OD1 3.4Å; D838-S859 VanDerWaalsContact O-CA 3.24Å; D838-S859 WeakPolarHBondContact O-CA 3.33Å; D838-S859 WeakPolarHBondContact O-CB 3.5Å; D838-S859 PolarHBondContact O-OG 3.29Å; D838-T860 PolarHBondContact O-N 3.29Å
839	V	91.6	Very high	88.5	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	127.7	176.3	57	0	0	0	0	109.7	M809 G831 F833 H837 V857 R858 V864 I868	M809-V839 HydrophobicContact CE-CB 4.5Å; M809-V839 HydrophobicContact CE-CG1 3.87Å; M809-V839 HydrophobicContact CE-CG2 4.33Å; M809-V839 WeakPolarHBondContact CE-O 3.28Å; G831-V839 PolarHBondContact N-O 2.85Å; G831-V839 WeakPolarHBondContact O-CG1 3.15Å; G831-V839 PolarHBondContact O-N 2.99Å; F833-V839 HydrophobicContact CB-CG1 4.42Å; H837-V839 PolarHBondContact O-N 3.5Å; V839-V857 HydrophobicContact CG2-CG1 3.95Å; V839-R858 WeakPolarHBondContact CA-O 3.41Å; V839-V864 HydrophobicContact CB-CG1 3.96Å; V839-V864 HydrophobicContact CG1-CG1 4.49Å; V839-V864 HydrophobicContact CG2-CG1 4.04Å; V839-I868 HydrophobicContact CG2-CD1 4.45Å; V839-I868 HydrophobicContact CG2-CG1 4.03Å
840	L	93	Very high	88	Confident	2 Å²	2	36.9 Å²	36.9	1%	0.01	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	134.1	-179.8	-59.4	177.7	0	0	0	108.8	F771 A774 W775 V778 L829 A830 V857 R858	F771-L840 HydrophobicContact CD2-CD2 4.43Å; F771-L840 HydrophobicContact CE2-CB 3.97Å; F771-L840 HydrophobicContact CE2-CD2 4.05Å; F771-L840 HydrophobicContact CE2-CG 4.44Å; F771-L840 HydrophobicContact CZ-CB 4.1Å; A774-L840 VanDerWaalsContact C-CD1 3.47Å; A774-L840 HydrophobicContact CB-CD1 3.99Å; A774-L840 WeakPolarHBondContact O-CD1 3.14Å; W775-L840 HydrophobicContact CB-CD1 4.39Å; W775-L840 HydrophobicContact CE3-CB 3.67Å; W775-L840 HydrophobicContact CE3-CD1 4.18Å; W775-L840 HydrophobicContact CZ3-CB 3.75Å; V778-L840 HydrophobicContact CG2-CD1 3.82Å; V778-L840 HydrophobicContact CG2-CG 4.39Å; L829-L840 WeakPolarHBondContact O-CA 3.39Å; A830-L840 HydrophobicContact CB-CD2 3.57Å; L840-V857 WeakPolarHBondContact O-CA 3.45Å; L840-R858 PolarHBondContact N-O 2.94Å; L840-R858 PolarHBondContact O-N 3.43Å
841	V	94.4	Very high	87.9	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.9	179.3	-179	0	0	0	0	109.5	L807 M809 L829 V855 T856 V857 I868	L807-V841 HydrophobicContact CD1-CG1 4.35Å; L807-V841 HydrophobicContact CD1-CG2 4.47Å; M809-V841 HydrophobicContact CE-CG2 3.94Å; M809-V841 HydrophobicContact SD-CB 4.35Å; M809-V841 HydrophobicContact SD-CG2 3.65Å; L829-V841 HydrophobicContact CB-CB 4.17Å; L829-V841 PolarHBondContact N-O 3.16Å; L829-V841 PolarHBondContact O-N 2.98Å; V841-V855 HydrophobicContact CG1-CG1 3.55Å; V841-T856 WeakPolarHBondContact CA-O 3.32Å; V841-V857 HydrophobicContact CG1-CG2 4.38Å; V841-V857 HydrophobicContact CG2-CG1 4.19Å; V841-V857 HydrophobicContact CG2-CG2 4.1Å; V841-I868 HydrophobicContact CG2-CG2 4.15Å
842	R	94.8	Very high	87.9	Confident	47 Å²	47	39.9 Å²	39.9	18%	0.177	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	105.8	171.3	179.5	-179	70.6	-163.4	-2.5	108.5	F771 W775 V826 L827 F828 T856	F771-R842 HydrophobicContact CE1-CB 4.44Å; F771-R842 HydrophobicContact CZ-CB 4.41Å; W775-R842 HydrophobicContact CH2-CB 4Å; W775-R842 HydrophobicContact CZ3-CB 4.13Å; V826-R842 HydrophobicContact CG1-CG 3.97Å; L827-R842 WeakPolarHBondContact O-CA 3.48Å; F828-R842 HydrophobicContact CD1-CB 4.34Å; F828-R842 HydrophobicContact CD1-CG 3.99Å; F828-R842 HydrophobicContact CE1-CG 3.74Å; R842-T856 PolarHBondContact N-O 3.43Å; R842-T856 PolarHBondContact NH2-OG1 2.94Å; R842-T856 VanDerWaalsContact NH2-OG1 3.11Å; R842-T856 PolarHBondContact O-N 2.95Å
843	A	93.4	Very high	88	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	113.9	178	0	0	0	0	0	110.7	V826 L827 M853 Q854 V855	V826-A843 CarbonylContact C-O 3.59Å; V826-A843 WeakPolarHBondContact CA-O 3.33Å; L827-A843 HydrophobicContact CB-CB 4.22Å; L827-A843 PolarHBondContact N-O 3.13Å; L827-A843 PolarHBondContact O-N 3.17Å; A843-M853 HydrophobicContact CB-CG 4.11Å; A843-M853 HydrophobicContact CB-SD 3.95Å; A843-Q854 CarbonylContact C-O 3.35Å; A843-Q854 WeakPolarHBondContact CA-O 3.15Å; A843-V855 HydrophobicContact CB-CG2 4.43Å
844	R	93.4	Very high	88.2	Confident	108 Å²	108	41.4 Å²	41.4	41%	0.408	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	116.5	173.2	-64.8	178.7	177.4	153.7	-1.1	109.3	V826 M853 Q854	V826-R844 HydrophobicContact CG1-CG 4.17Å; V826-R844 HydrophobicContact CG2-CG 4.12Å; R844-M853 CarbonylContact O-C 3.56Å; R844-M853 WeakPolarHBondContact O-CA 3.12Å; R844-Q854 HydrophobicContact CB-CB 4.34Å; R844-Q854 PolarHBondContact N-O 3.3Å; R844-Q854 PolarHBondContact O-N 3.17Å
845	L	92.5	Very high	88.6	Confident	4 Å²	4	39.6 Å²	39.6	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	137	-175.8	-59.8	162.8	0	0	0	109.8	L796 A799 V800 I803 S824 H825 L827 V851 T852 M853	L796-L845 HydrophobicContact CD2-CB 3.72Å; A799-L845 HydrophobicContact CB-CD2 4.49Å; V800-L845 HydrophobicContact CG2-CD1 3.53Å; I803-L845 HydrophobicContact CD1-CD1 4.2Å; I803-L845 HydrophobicContact CD1-CD2 3.77Å; S824-L845 CarbonylContact C-O 3.54Å; S824-L845 WeakPolarHBondContact CA-O 3.16Å; S824-L845 WeakPolarHBondContact CB-O 3.4Å; H825-L845 PolarHBondContact N-O 3.2Å; H825-L845 PolarHBondContact O-N 3.24Å; L827-L845 HydrophobicContact CB-CD1 4.49Å; L845-V851 HydrophobicContact CB-CG1 4.23Å; L845-V851 HydrophobicContact CD2-CG1 3.73Å; L845-T852 CarbonylContact C-O 3.58Å; L845-T852 WeakPolarHBondContact CA-O 3.21Å; L845-M853 HydrophobicContact CD2-CB 3.63Å; L845-M853 HydrophobicContact CD2-CG 3.53Å; L845-M853 HydrophobicContact CD2-SD 3.91Å
846	A	91.6	Very high	89.3	Confident	47 Å²	47	37.2 Å²	37.2	39%	0.388	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	129.3	173.5	0	0	0	0	0	110.3	N823 V851 T852	N823-A846 WeakPolarHBondContact O-CA 3.41Å; A846-V851 WeakPolarHBondContact O-CA 3.44Å; A846-T852 PolarHBondContact N-O 3.34Å; A846-T852 PolarHBondContact O-N 2.99Å
847	L	86.7	Confident	90	Very high	53 Å²	53	36 Å²	36	28%	0.277	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.3	-179.2	-175.9	67.6	0	0	0	110.4	R794 L796 N823 V851	R794-L847 WeakPolarHBondContact O-CD1 3.24Å; L796-L847 HydrophobicContact CD1-CB 4.27Å; L796-L847 HydrophobicContact CD2-CB 4.05Å; L796-L847 HydrophobicContact CG-CB 3.99Å; L796-L847 HydrophobicContact CG-CD2 4.49Å; N823-L847 PolarHBondContact O-N 2.77Å; L847-V851 HydrophobicContact CD1-CG2 3.73Å
848	A	83	Confident	90.3	Very high	80 Å²	80	34.7 Å²	34.7	66%	0.661	19%	0.193	S	C	*	.	S	Bend	trans	-132.3	-119.4	171.3	0	0	0	0	0	109.3	G850	A848-G850 PolarHBondContact N-O 3.24Å; A848-G850 PolarHBondContact O-N 3.39Å
849	D	75.8	Confident	90.6	Very high	183 Å²	183	32.7 Å²	32.7	98%	0.979	18%	0.183	S	C	*	.	S	Bend	trans	-75.5	-1.3	171.8	-67	-35.5	0	0	0	113.4
850	G	82.3	Confident	90.4	Very high	14 Å²	14	36.3 Å²	36.3	14%	0.144	21%	0.205	C	C	.	.	S	Bend	trans	-172.7	-174.7	175.2	0	0	0	0	0	108.2	A848	A848-G850 PolarHBondContact N-O 3.24Å; A848-G850 PolarHBondContact O-N 3.39Å
851	V	86.9	Confident	90	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118	176.7	180	0	0	0	0	109.9	L790 V793 L796 A799 L845 A846 L847	L790-V851 HydrophobicContact CB-CB 4.28Å; L790-V851 WeakPolarHBondContact CB-O 3.28Å; L790-V851 HydrophobicContact CD1-CB 4.48Å; L790-V851 HydrophobicContact CD1-CG1 4.33Å; L790-V851 PolarHBondContact N-O 3.27Å; L790-V851 PolarHBondContact O-N 3.31Å; V793-V851 HydrophobicContact CG1-CG2 4.2Å; L796-V851 HydrophobicContact CD2-CG1 4.09Å; L796-V851 HydrophobicContact CD2-CG2 4.27Å; A799-V851 HydrophobicContact CB-CB 4.32Å; A799-V851 HydrophobicContact CB-CG1 3.93Å; A799-V851 HydrophobicContact CB-CG2 4.19Å; L845-V851 HydrophobicContact CB-CG1 4.23Å; L845-V851 HydrophobicContact CD2-CG1 3.73Å; A846-V851 WeakPolarHBondContact O-CA 3.44Å; L847-V851 HydrophobicContact CD1-CG2 3.73Å
852	T	90.1	Very high	89.7	Confident	64 Å²	64	44.3 Å²	44.3	39%	0.393	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.6	168.5	-45.9	0	0	0	0	108.6	T787 L845 A846	T787-T852 HydrophobicContact CG2-CG2 3.85Å; L845-T852 CarbonylContact C-O 3.58Å; L845-T852 WeakPolarHBondContact CA-O 3.21Å; A846-T852 PolarHBondContact N-O 3.34Å; A846-T852 PolarHBondContact O-N 2.99Å
853	M	92	Very high	89.3	Confident	5 Å²	5	44.5 Å²	44.5	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.3	-176.8	-177.6	177.6	57.1	0	0	110.3	T787 F788 I803 A843 R844 L845 V855 V872	T787-M853 CarbonylContact C-O 3.58Å; T787-M853 WeakPolarHBondContact CA-O 3.49Å; F788-M853 HydrophobicContact CB-CE 4.36Å; F788-M853 HydrophobicContact CD2-CE 4.19Å; F788-M853 PolarHBondContact N-O 2.91Å; F788-M853 PolarHBondContact O-N 2.98Å; I803-M853 HydrophobicContact CD1-SD 3.31Å; I803-M853 WeakPolarHBondContact CD1-SD 3.49Å; I803-M853 HydrophobicContact CG1-SD 3.84Å; A843-M853 HydrophobicContact CB-CG 4.11Å; A843-M853 HydrophobicContact CB-SD 3.95Å; R844-M853 CarbonylContact O-C 3.56Å; R844-M853 WeakPolarHBondContact O-CA 3.12Å; L845-M853 HydrophobicContact CD2-CB 3.63Å; L845-M853 HydrophobicContact CD2-CG 3.53Å; L845-M853 HydrophobicContact CD2-SD 3.91Å; M853-V855 HydrophobicContact CE-CG2 3.45Å; M853-V855 VanDerWaalsContact CE-CG2 3.45Å; M853-V855 HydrophobicContact CG-CG2 3.59Å; M853-V855 HydrophobicContact SD-CG2 3.55Å; M853-V855 VanDerWaalsContact SD-CG2 3.55Å; M853-V872 HydrophobicContact CE-CG1 3.55Å
854	Q	93.4	Very high	89.1	Confident	50 Å²	50	44.6 Å²	44.6	23%	0.234	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	116.5	166.2	177.6	-179.7	64.6	0	0	108.8	E785 E786 A843 R844	E785-Q854 HydrophobicContact CG-CG 3.84Å; E785-Q854 VanDerWaalsContact OE1-CD 3.28Å; E785-Q854 PolarHBondContact OE1-NE2 3.07Å; E786-Q854 CarbonylContact O-C 3.6Å; E786-Q854 WeakPolarHBondContact O-CA 3.43Å; A843-Q854 CarbonylContact C-O 3.35Å; A843-Q854 WeakPolarHBondContact CA-O 3.15Å; R844-Q854 HydrophobicContact CB-CB 4.34Å; R844-Q854 PolarHBondContact N-O 3.3Å; R844-Q854 PolarHBondContact O-N 3.17Å
855	V	93.3	Very high	88.9	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	117.6	-178.9	-173.6	0	0	0	0	109	E785 E786 F788 V841 A843 M853 V857 L869 V872	E785-V855 WeakPolarHBondContact CA-O 3.42Å; E786-V855 PolarHBondContact N-O 3.05Å; E786-V855 PolarHBondContact O-N 2.87Å; F788-V855 HydrophobicContact CD2-CB 4.45Å; F788-V855 HydrophobicContact CD2-CG2 3.9Å; F788-V855 HydrophobicContact CE2-CB 4.19Å; F788-V855 HydrophobicContact CE2-CG2 4.05Å; V841-V855 HydrophobicContact CG1-CG1 3.55Å; A843-V855 HydrophobicContact CB-CG2 4.43Å; M853-V855 HydrophobicContact CE-CG2 3.45Å; M853-V855 VanDerWaalsContact CE-CG2 3.45Å; M853-V855 HydrophobicContact CG-CG2 3.59Å; M853-V855 HydrophobicContact SD-CG2 3.55Å; M853-V855 VanDerWaalsContact SD-CG2 3.55Å; V855-V857 HydrophobicContact CG1-CG2 3.74Å; V855-L869 HydrophobicContact CB-CD2 4.32Å; V855-L869 HydrophobicContact CG1-CD2 4.21Å; V855-V872 HydrophobicContact CG2-CG1 4.36Å
856	T	94.5	Very high	88.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.2	166.2	-38.1	0	0	0	0	108.4	W775 E783 K784 E785 V841 R842	W775-T856 HydrophobicContact CH2-CG2 3.91Å; W775-T856 HydrophobicContact CZ2-CG2 3.81Å; E783-T856 HydrophobicContact CG-CG2 3.69Å; K784-T856 WeakPolarHBondContact O-CA 3.17Å; E785-T856 HydrophobicContact CB-CG2 4.38Å; E785-T856 PolarHBondContact OE2-OG1 3.27Å; V841-T856 WeakPolarHBondContact CA-O 3.32Å; R842-T856 PolarHBondContact N-O 3.43Å; R842-T856 PolarHBondContact NH2-OG1 2.94Å; R842-T856 VanDerWaalsContact NH2-OG1 3.11Å; R842-T856 PolarHBondContact O-N 2.95Å
857	V	94.4	Very high	88.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.5	178.4	-174.9	0	0	0	0	109.7	E783 K784 V839 L840 V841 V855 V865 I868 L869	E783-V857 WeakPolarHBondContact CA-O 3.44Å; K784-V857 PolarHBondContact N-O 3.18Å; K784-V857 PolarHBondContact O-N 3.33Å; V839-V857 HydrophobicContact CG2-CG1 3.95Å; L840-V857 WeakPolarHBondContact O-CA 3.45Å; V841-V857 HydrophobicContact CG1-CG2 4.38Å; V841-V857 HydrophobicContact CG2-CG1 4.19Å; V841-V857 HydrophobicContact CG2-CG2 4.1Å; V855-V857 HydrophobicContact CG1-CG2 3.74Å; V857-V865 HydrophobicContact CB-CG1 4.01Å; V857-V865 HydrophobicContact CG1-CB 4.46Å; V857-V865 HydrophobicContact CG1-CG1 4.16Å; V857-V865 HydrophobicContact CG1-CG2 4.41Å; V857-I868 HydrophobicContact CG1-CB 4.16Å; V857-I868 HydrophobicContact CG1-CG1 4.26Å; V857-I868 HydrophobicContact CG1-CG2 4.26Å; V857-I868 HydrophobicContact CG2-CB 4.23Å; V857-I868 HydrophobicContact CG2-CG2 3.67Å; V857-L869 HydrophobicContact CG2-CD2 3.8Å; V857-L869 HydrophobicContact CG2-CG 4.09Å
858	R	93.9	Very high	88.7	Confident	24 Å²	24	37 Å²	37	9%	0.091	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	138.4	171	-76.9	-176.4	-179.4	-167.1	-1	110.5	W775 V778 G779 E783 V839 L840	W775-R858 HydrophobicContact CE3-CB 4.44Å; W775-R858 HydrophobicContact CE3-CG 4.5Å; W775-R858 HydrophobicContact CH2-CB 4.08Å; W775-R858 HydrophobicContact CH2-CG 3.69Å; W775-R858 HydrophobicContact CZ2-CB 4.48Å; W775-R858 VanDerWaalsContact CZ2-CD 3.45Å; W775-R858 HydrophobicContact CZ2-CG 3.66Å; W775-R858 HydrophobicContact CZ3-CB 4.07Å; W775-R858 HydrophobicContact CZ3-CG 4.13Å; W775-R858 VanDerWaalsContact NE1-NE 3.18Å; W775-R858 PolarHBondContact O-NH1 2.82Å; V778-R858 HydrophobicContact CG1-CB 4.11Å; G779-R858 VanDerWaalsContact O-CD 3.27Å; G779-R858 WeakPolarHBondContact O-CD 3.33Å; E783-R858 HydrophobicContact CB-CG 4.03Å; E783-R858 HydrophobicContact CG-CG 4.11Å; E783-R858 IonicContact OE2-CZ 2.69Å; E783-R858 IonicContact OE2-NE 2.98Å; E783-R858 PolarHBondContact OE2-NE 3.16Å; E783-R858 IonicContact OE2-NH2 3.14Å; E783-R858 PolarHBondContact OE2-NH2 2.98Å; V839-R858 WeakPolarHBondContact CA-O 3.41Å; L840-R858 PolarHBondContact N-O 2.94Å; L840-R858 PolarHBondContact O-N 3.43Å
859	S	92.1	Very high	88.9	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.014	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	165.1	172.1	-171.4	0	0	0	0	111.7	N782 D838 E861	N782-S859 WeakPolarHBondContact CB-O 3.49Å; N782-S859 PolarHBondContact ND2-O 3Å; N782-S859 PolarHBondContact O-N 3.42Å; D838-S859 VanDerWaalsContact O-CA 3.24Å; D838-S859 WeakPolarHBondContact O-CA 3.33Å; D838-S859 WeakPolarHBondContact O-CB 3.5Å; D838-S859 PolarHBondContact O-OG 3.29Å; S859-E861 PolarHBondContact O-N 3.27Å
860	T	86.1	Confident	89.4	Confident	77 Å²	77	27.7 Å²	27.7	47%	0.472	16%	0.158	S	C	.	.	S	Bend	trans	-67.9	-14.6	170.6	53.3	0	0	0	0	113.4	N782 D838	N782-T860 PolarHBondContact ND2-O 3.16Å; D838-T860 PolarHBondContact O-N 3.29Å
861	E	86.1	Confident	89.5	Confident	69 Å²	69	28 Å²	28	32%	0.322	16%	0.157	S	C	.	.	S	Bend	trans	-135	137.3	-179.4	-167.6	-179.9	160.4	0	0	111.2	H837 S859 T863 V864	H837-E861 IonicContact CD2-OE2 3.59Å; H837-E861 IonicContact CE1-OE2 2.64Å; H837-E861 PolarHBondContact CE1-OE2 3.16Å; H837-E861 IonicContact CG-OE2 2.68Å; H837-E861 IonicContact ND1-OE2 3.03Å; H837-E861 PolarHBondContact ND1-OE2 3.15Å; H837-E861 IonicContact NE2-OE2 2.83Å; H837-E861 PolarHBondContact NE2-OE2 3.45Å; S859-E861 PolarHBondContact O-N 3.27Å; E861-T863 WeakPolarHBondContact CG-OG1 3.46Å; E861-T863 PolarHBondContact O-N 3.17Å; E861-T863 PolarHBondContact OE1-OG1 3.45Å; E861-V864 HydrophobicContact CB-CG2 4.22Å; E861-V864 PolarHBondContact O-N 2.96Å
862	E	87.6	Confident	89.2	Confident	100 Å²	100	29.5 Å²	29.5	47%	0.467	17%	0.167	S	C	.	.	H	α-helix	trans	-63.7	-38.7	-177.3	-169.6	179.3	-179.7	0	0	112.9	K784 V864 V865 D866	K784-E862 WeakPolarHBondContact CE-OE1 3.4Å; K784-E862 IonicContact NZ-OE1 3.24Å; K784-E862 PolarHBondContact NZ-OE1 2.66Å; E862-V864 VanDerWaalsContact C-N 3.26Å; E862-V864 PolarHBondContact O-N 3.24Å; E862-V865 WeakPolarHBondContact O-CB 3.45Å; E862-V865 PolarHBondContact O-N 3.01Å; E862-D866 PolarHBondContact O-N 2.95Å; E862-D866 VanDerWaalsContact O-N 3.13Å
863	T	86.4	Confident	87.9	Confident	52 Å²	52	31 Å²	31	32%	0.319	20%	0.195	S	C	.	.	H	α-helix	trans	-57.5	-39.1	-179	56.9	0	0	0	0	112.1	E861 V865 D866 V867	E861-T863 WeakPolarHBondContact CG-OG1 3.46Å; E861-T863 PolarHBondContact O-N 3.17Å; E861-T863 PolarHBondContact OE1-OG1 3.45Å; T863-V865 VanDerWaalsContact C-N 3.32Å; T863-V865 PolarHBondContact O-N 3.07Å; T863-D866 PolarHBondContact O-N 3.28Å; T863-V867 VanDerWaalsContact O-CG2 3.25Å; T863-V867 WeakPolarHBondContact O-CG2 3.41Å; T863-V867 PolarHBondContact O-N 2.86Å
864	V	88.3	Confident	87.7	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-65.9	-37.9	178.4	-178.8	0	0	0	0	110.9	F833 H837 V839 E861 E862 D866 V867 I868	F833-V864 HydrophobicContact CB-CG1 3.71Å; F833-V864 HydrophobicContact CB-CG2 4.17Å; F833-V864 HydrophobicContact CD1-CG1 4.4Å; F833-V864 HydrophobicContact CD1-CG2 3.73Å; F833-V864 HydrophobicContact CD2-CG1 4.21Å; F833-V864 HydrophobicContact CE1-CG2 4.35Å; F833-V864 HydrophobicContact CG-CG1 3.87Å; F833-V864 HydrophobicContact CG-CG2 4.04Å; H837-V864 HydrophobicContact CB-CG2 4.08Å; V839-V864 HydrophobicContact CB-CG1 3.96Å; V839-V864 HydrophobicContact CG1-CG1 4.49Å; V839-V864 HydrophobicContact CG2-CG1 4.04Å; E861-V864 HydrophobicContact CB-CG2 4.22Å; E861-V864 PolarHBondContact O-N 2.96Å; E862-V864 VanDerWaalsContact C-N 3.26Å; E862-V864 PolarHBondContact O-N 3.24Å; V864-D866 VanDerWaalsContact C-N 3.35Å; V864-V867 PolarHBondContact O-N 3.33Å; V864-I868 WeakPolarHBondContact O-CG1 3.44Å; V864-I868 PolarHBondContact O-N 2.81Å; V864-I868 VanDerWaalsContact O-N 3.15Å
865	V	89.5	Confident	87.4	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-44.6	177.3	-176.8	0	0	0	0	110.3	N782 K784 V857 E862 T863 I868 L869	N782-V865 HydrophobicContact CB-CG2 4.17Å; N782-V865 WeakPolarHBondContact O-CG2 3.45Å; K784-V865 HydrophobicContact CB-CG1 3.55Å; K784-V865 HydrophobicContact CD-CG1 3.88Å; K784-V865 HydrophobicContact CG-CG1 3.72Å; V857-V865 HydrophobicContact CB-CG1 4.01Å; V857-V865 HydrophobicContact CG1-CB 4.46Å; V857-V865 HydrophobicContact CG1-CG1 4.16Å; V857-V865 HydrophobicContact CG1-CG2 4.41Å; E862-V865 WeakPolarHBondContact O-CB 3.45Å; E862-V865 PolarHBondContact O-N 3.01Å; T863-V865 VanDerWaalsContact C-N 3.32Å; T863-V865 PolarHBondContact O-N 3.07Å; V865-I868 PolarHBondContact O-N 3.3Å; V865-L869 HydrophobicContact CG1-CD1 4.39Å; V865-L869 PolarHBondContact O-N 3.17Å; V865-L869 VanDerWaalsContact O-N 3.13Å
866	D	88.6	Confident	87	Confident	51 Å²	51	33 Å²	33	27%	0.273	21%	0.212	S	C	.	.	H	α-helix	trans	-64.6	-41.7	177.9	-70.4	-33.1	0	0	0	112.3	T717 K784 E862 T863 V864 I868 L869 A870	T717-D866 HydrophobicContact CG2-CB 4.22Å; K784-D866 VanDerWaalsContact CD-OD1 3.22Å; K784-D866 WeakPolarHBondContact CD-OD1 3.44Å; K784-D866 WeakPolarHBondContact CE-OD1 3.04Å; K784-D866 IonicContact NZ-OD1 3.53Å; K784-D866 PolarHBondContact NZ-OD1 3.32Å; K784-D866 IonicContact NZ-OD2 2.87Å; K784-D866 PolarHBondContact NZ-OD2 3.03Å; E862-D866 PolarHBondContact O-N 2.95Å; E862-D866 VanDerWaalsContact O-N 3.13Å; T863-D866 PolarHBondContact O-N 3.28Å; V864-D866 VanDerWaalsContact C-N 3.35Å; D866-I868 PolarHBondContact O-N 3.28Å; D866-L869 PolarHBondContact O-N 3.08Å; D866-A870 WeakPolarHBondContact O-CB 3.24Å; D866-A870 PolarHBondContact O-N 3.35Å
867	V	88.1	Confident	86.6	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-56.3	-48.6	174.7	167.8	0	0	0	0	111.5	P716 V719 F833 T863 V864 S871	P716-V867 WeakPolarHBondContact O-CG2 3.46Å; V719-V867 HydrophobicContact CB-CG1 4.28Å; V719-V867 HydrophobicContact CG1-CG1 3.68Å; V719-V867 HydrophobicContact CG1-CG2 4.11Å; V719-V867 HydrophobicContact CG2-CG1 3.66Å; F833-V867 HydrophobicContact CE2-CG1 4.03Å; F833-V867 HydrophobicContact CZ-CG1 4.37Å; T863-V867 VanDerWaalsContact O-CG2 3.25Å; T863-V867 WeakPolarHBondContact O-CG2 3.41Å; T863-V867 PolarHBondContact O-N 2.86Å; V864-V867 PolarHBondContact O-N 3.33Å; V867-S871 VanDerWaalsContact O-CB 3.31Å; V867-S871 WeakPolarHBondContact O-CB 3.4Å; V867-S871 PolarHBondContact O-N 3.38Å; V867-S871 VanDerWaalsContact O-N 3.09Å; V867-S871 PolarHBondContact O-OG 2.97Å
868	I	89.5	Confident	86.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-64.4	-47.3	-178	-62.2	-66.8	0	0	0	110.6	V759 I763 L807 V839 V841 V857 V864 V865 D866 S871 V872	V759-I868 HydrophobicContact CG1-CD1 4.04Å; I763-I868 HydrophobicContact CD1-CD1 3.44Å; I763-I868 VanDerWaalsContact CD1-CD1 3.44Å; L807-I868 HydrophobicContact CD2-CD1 4.4Å; L807-I868 HydrophobicContact CD2-CG2 4.08Å; V839-I868 HydrophobicContact CG2-CD1 4.45Å; V839-I868 HydrophobicContact CG2-CG1 4.03Å; V841-I868 HydrophobicContact CG2-CG2 4.15Å; V857-I868 HydrophobicContact CG1-CB 4.16Å; V857-I868 HydrophobicContact CG1-CG1 4.26Å; V857-I868 HydrophobicContact CG1-CG2 4.26Å; V857-I868 HydrophobicContact CG2-CB 4.23Å; V857-I868 HydrophobicContact CG2-CG2 3.67Å; V864-I868 WeakPolarHBondContact O-CG1 3.44Å; V864-I868 PolarHBondContact O-N 2.81Å; V864-I868 VanDerWaalsContact O-N 3.15Å; V865-I868 PolarHBondContact O-N 3.3Å; D866-I868 PolarHBondContact O-N 3.28Å; I868-S871 PolarHBondContact O-N 3.39Å; I868-V872 VanDerWaalsContact O-CG2 3.29Å; I868-V872 WeakPolarHBondContact O-CG2 3.34Å; I868-V872 PolarHBondContact O-N 3.43Å
869	L	88.6	Confident	85.6	Confident	10 Å²	10	38 Å²	38	5%	0.052	25%	0.249	C	C	.	.	H	α-helix	trans	-68.3	-44.9	-177.7	-70.9	179.7	0	0	0	112.1	K784 E786 F788 V855 V857 V865 D866 S871 V872 G873	K784-L869 HydrophobicContact CB-CD1 3.36Å; K784-L869 HydrophobicContact CD-CD1 4.48Å; K784-L869 HydrophobicContact CG-CD1 4.5Å; E786-L869 HydrophobicContact CB-CD2 4.04Å; F788-L869 HydrophobicContact CE2-CD2 4.33Å; V855-L869 HydrophobicContact CB-CD2 4.32Å; V855-L869 HydrophobicContact CG1-CD2 4.21Å; V857-L869 HydrophobicContact CG2-CD2 3.8Å; V857-L869 HydrophobicContact CG2-CG 4.09Å; V865-L869 HydrophobicContact CG1-CD1 4.39Å; V865-L869 PolarHBondContact O-N 3.17Å; V865-L869 VanDerWaalsContact O-N 3.13Å; D866-L869 PolarHBondContact O-N 3.08Å; L869-S871 PolarHBondContact O-N 3.21Å; L869-V872 PolarHBondContact O-N 2.63Å; L869-V872 VanDerWaalsContact O-N 3.1Å; L869-G873 PolarHBondContact O-N 3.1Å
870	A	86.5	Confident	85.1	Confident	56 Å²	56	40.6 Å²	40.6	46%	0.463	27%	0.266	S	S	.	.	H	α-helix	trans	-62.1	-27.4	177.3	0	0	0	0	0	112.9	D866	D866-A870 WeakPolarHBondContact O-CB 3.24Å; D866-A870 PolarHBondContact O-N 3.35Å
871	S	83.9	Confident	85	Confident	20 Å²	20	37.8 Å²	37.8	14%	0.14	25%	0.25	C	C	.	.	H	α-helix	trans	-83.4	-24.3	177.1	-56.1	0	0	0	0	113.4	V759 F806 V867 I868 L869	V759-S871 WeakPolarHBondContact CG2-OG 3.3Å; F806-S871 VanDerWaalsContact CE1-O 3.29Å; F806-S871 WeakPolarHBondContact CE1-O 3.4Å; F806-S871 WeakPolarHBondContact CZ-O 3.44Å; V867-S871 VanDerWaalsContact O-CB 3.31Å; V867-S871 WeakPolarHBondContact O-CB 3.4Å; V867-S871 PolarHBondContact O-N 3.38Å; V867-S871 VanDerWaalsContact O-N 3.09Å; V867-S871 PolarHBondContact O-OG 2.97Å; I868-S871 PolarHBondContact O-N 3.39Å; L869-S871 PolarHBondContact O-N 3.21Å
872	V	80.8	Confident	85	Confident	34 Å²	34	35.2 Å²	35.2	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-82.8	-31.3	177.5	173.6	0	0	0	0	111.5	F788 F806 L807 M853 V855 I868 L869	F788-V872 HydrophobicContact CD1-CG1 4.27Å; F788-V872 HydrophobicContact CD2-CG1 3.5Å; F788-V872 HydrophobicContact CE1-CG1 4.31Å; F788-V872 HydrophobicContact CE2-CB 4.07Å; F788-V872 HydrophobicContact CE2-CG1 3.52Å; F788-V872 HydrophobicContact CG-CG1 3.87Å; F788-V872 HydrophobicContact CZ-CB 4.12Å; F788-V872 HydrophobicContact CZ-CG1 3.94Å; F806-V872 HydrophobicContact CE1-CG2 4.24Å; L807-V872 HydrophobicContact CD2-CG2 3.98Å; M853-V872 HydrophobicContact CE-CG1 3.55Å; V855-V872 HydrophobicContact CG2-CG1 4.36Å; I868-V872 VanDerWaalsContact O-CG2 3.29Å; I868-V872 WeakPolarHBondContact O-CG2 3.34Å; I868-V872 PolarHBondContact O-N 3.43Å; L869-V872 PolarHBondContact O-N 2.63Å; L869-V872 VanDerWaalsContact O-N 3.1Å
873	G	61.8	Low	84.7	Confident	95 Å²	95	29.3 Å²	29.3	98%	0.979	22%	0.223	S	C	*	.			trans	-75.8	0	173.9	0	0	0	0	0	113.4	L869	L869-G873 PolarHBondContact O-N 3.1Å

Retrieved 873 of 873 residues in 1351.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).