X5D7M5_HUMAN Loading...

Tyrosine-protein kinase receptor

Receptor tyrosine kinase involved in nervous system and probably heart development. Upon binding of its ligand NTF3/neurotrophin-3, NTRK3 autophosphorylates and activates different signaling pathways, including the phosphatidylinositol 3-kinase/AKT and the MAPK pathways, that control cell survival and differentiation.

AlphaFold DB , UniProt , Accession X5D7M5, Species HUMAN (Homo sapiens, Human), Gene NTRK3, Length 825 aa.

						>X5D7M5_HUMAN|X5D7M5|NTRK3
MDVSLCPAKCSFWRIFLLGSVWLDYVGSVLACPANCVCSKTEINCRRPDDGNLFPLLEGQDSGNSNGNASINITDISRNITSIHIENWRSLHTLNAVDMELYTGLQKLTIKNSGLRSIQPRAFAKNPHLRYINLSSNRLTTLSWQLFQTLSLRELQLEQNFFNCSCDIRWMQLWQEQGEAKLNSQNLYCINADGSQLPLFRMNISQCDLPEISVSHVNLTVREGDNAVITCNGSGSPLPDVDWIVTGLQSINTHQTNLNWTNVHAINLTLVNVTSEDNGFTLTCIAENVVGMSNASVALTVYYPPRVVSLEEPELRLEHCIEFVVRGNPPPTLHWLHNGQPLRESKIIHVEYYQEGEISEGCLLFNKPTHYNNGNYTLIAKNPLGTANQTINGHFLKEPFPESTDNFILFDEVSPTPPITVTHKPEEDTFGVSIAVGLAAFACVLLVVLFVMINKYGRRSKFGMKGPVAVISGEEDSASPLHHINHGITTPSSLDAGPDTVVIGMTRIPVIENPQYFRQGHNCHKPDTYVQHIKRRDIVLKRELGEGAFGKVFLAECYNLSPTKDKMLVAVKALKDPTLAARKDFQREAELLTNLQHEHIVKFYGVCGDGDPLIMVFEYMKHGDLNKFLRAHGPDAMILVDGQPRQAKGELGLSQMLHIASQIASGMVYLASQHFVHRDLATRNCLVGANLLVKIGDFGMSRDVYSTDYYRVGGHTMLPIRWMPPESIMYRKFTTESDVWSFGVILWEIFTYGKQPWFQLSNTEVIECITQGRVLERPRVCPKEVYDVMLGCWQREPQQRLNIKEIYKILHALGKATPIYLDILG
					

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	30.9	Very low	28.7	Very low	222 Å²	222	134.5 Å²	134.5	100%	1.094	80%	0.795	S	S	*	*				0	71	0	-67.3	177.9	-174.3	0	0	110.2
2	D	30.2	Very low	28.5	Very low	140 Å²	140	138.3 Å²	138.3	75%	0.749	79%	0.794	S	S	*	*			cis	-170.8	141.8	-8.4	-96.4	-22.8	0	0	0	109.9
3	V	28	Very low	28.3	Very low	118 Å²	118	144.4 Å²	144.4	72%	0.715	80%	0.797	S	S	*	*			cis	-134.3	146.1	-3.2	-179.5	0	0	0	0	110
4	S	26.6	Very low	28.1	Very low	95 Å²	95	149.7 Å²	149.7	66%	0.664	80%	0.799	S	S	*	*			trans	-51.5	161.9	172.1	53	0	0	0	0	118.1
5	L	27.9	Very low	28.2	Very low	172 Å²	172	148.5 Å²	148.5	90%	0.901	79%	0.791	S	S	*	*				-172.2	147.7	116.1	-98.8	151	0	0	0	112.7
6	C	24.2	Very low	28.1	Very low	115 Å²	115	150.7 Å²	150.7	78%	0.777	79%	0.791	S	S	*	*			trans	-104.6	-166.1	-179.1	-141.7	0	0	0	0	108.2
7	P	43.6	Very low	28.2	Very low	107 Å²	107	151.2 Å²	151.2	70%	0.695	79%	0.794	S	S	*	*			cis	-144.9	172.4	-8.8	42	-23.1	0	0	0	118.2
8	A	27.8	Very low	28.2	Very low	91 Å²	91	152.7 Å²	152.7	75%	0.752	80%	0.801	S	S	*	*			trans	67.4	157.1	140.6	0	0	0	0	0	120.5
9	K	26.7	Very low	28	Very low	192 Å²	192	148.4 Å²	148.4	84%	0.835	80%	0.798	S	S	*	*			cis	-145.3	157.2	28.5	-87.3	-176.1	177	175.8	0	116.2
10	C	25.3	Very low	28	Very low	120 Å²	120	147 Å²	147	81%	0.811	80%	0.8	S	S	*	*			trans	69.5	93.9	152.2	-65.6	0	0	0	0	120.5
11	S	24.3	Very low	28.2	Very low	107 Å²	107	146.5 Å²	146.5	75%	0.748	80%	0.802	S	S	*	*			trans	-64.6	138.3	142.3	164.3	0	0	0	0	110.7
12	F	26.2	Very low	28.2	Very low	180 Å²	180	148 Å²	148	79%	0.789	80%	0.795	S	S	*	*			trans	-173.1	141.6	130.6	-113.1	-72.3	0	0	0	112.5
13	W	26.7	Very low	28.1	Very low	218 Å²	218	149.4 Å²	149.4	83%	0.826	80%	0.802	S	S	*	*			trans	75.8	91.4	170.1	-62.1	96.9	0	0	0	121.5
14	R	25.8	Very low	28.3	Very low	219 Å²	219	151.6 Å²	151.6	83%	0.826	81%	0.81	S	S	*	*				18.7	144.2	123.4	-85.5	-176.7	174.5	-173.1	-1.8	121.8
15	I	28.5	Very low	28.5	Very low	132 Å²	132	158.2 Å²	158.2	68%	0.677	82%	0.821	S	S	*	*			trans	102.9	109.9	140.2	-79	159.9	0	0	0	119.6
16	F	27	Very low	28.6	Very low	183 Å²	183	157.1 Å²	157.1	80%	0.803	82%	0.822	S	S	*	*			trans	62.3	146.4	149.6	-73.4	-119.7	0	0	0	118.5
17	L	29.3	Very low	29	Very low	159 Å²	159	155.2 Å²	155.2	83%	0.832	82%	0.822	S	S	*	*			cis	-131.4	150.9	15	-90.7	102.5	0	0	0	113.4
18	L	28.2	Very low	28.8	Very low	178 Å²	178	155.3 Å²	155.3	93%	0.932	83%	0.825	S	S	*	*			trans	-95.4	131.6	156.9	-91.4	158.5	0	0	0	109.1
19	G	25.5	Very low	29.6	Very low	71 Å²	71	155.9 Å²	155.9	73%	0.732	82%	0.819	S	S	*	*			trans	169.3	93.1	169.7	0	0	0	0	0	115.2
20	S	27.9	Very low	30.8	Very low	120 Å²	120	148.5 Å²	148.5	84%	0.839	79%	0.788	S	S	*	*			trans	169.6	53.7	153.7	51.3	0	0	0	0	114
21	V	31.7	Very low	32.4	Very low	138 Å²	138	144.9 Å²	144.9	84%	0.836	77%	0.767	S	S	*	*	S	Bend	trans	-139.9	46.5	169.9	-160.7	0	0	0	0	112.2
22	W	30.6	Very low	34.7	Very low	254 Å²	254	142 Å²	142	96%	0.962	75%	0.746	S	S	*	*			trans	-152.6	64.1	176.1	-98.1	88.6	0	0	0	111.6
23	L	28.6	Very low	37.1	Very low	169 Å²	169	134.8 Å²	134.8	89%	0.885	72%	0.717	S	S	*	*			trans	-162.3	55.6	171	-127.5	144.1	0	0	0	114
24	D	32.1	Very low	39.4	Very low	164 Å²	164	128.5 Å²	128.5	88%	0.877	71%	0.712	S	S	*	*			trans	-154.7	38.4	177.4	-113.6	-19.4	0	0	0	114.1
25	Y	30.7	Very low	42.1	Very low	233 Å²	233	120.2 Å²	120.2	91%	0.914	68%	0.684	S	S	*	*			trans	-150.2	47.1	-178.9	-135.2	-87.9	0	0	0	117.4
26	V	31.2	Very low	44.9	Very low	149 Å²	149	114.4 Å²	114.4	90%	0.903	66%	0.655	S	S	*	*			trans	-146.7	101.1	156.4	-173.4	0	0	0	0	109.8
27	G	32.5	Very low	47.8	Very low	76 Å²	76	110 Å²	110	78%	0.784	64%	0.643	S	S	*	*			trans	177.5	68.2	177.5	0	0	0	0	0	118.7
28	S	39.3	Very low	50.4	Low	109 Å²	109	104.4 Å²	104.4	76%	0.762	62%	0.617	S	S	*	*			trans	-179.2	126.7	141.6	54.2	0	0	0	0	111.8
29	V	43.4	Very low	53.1	Low	102 Å²	102	98.9 Å²	98.9	62%	0.618	59%	0.593	S	S	*	*	S	Bend	trans	-141.4	13.7	152.9	-158.6	0	0	0	0	112.2	I71	V29-I71 HydrophobicContact CB-CD1 4.14Å; V29-I71 HydrophobicContact CG1-CB 4.42Å; V29-I71 HydrophobicContact CG1-CD1 3.83Å; V29-I71 HydrophobicContact CG2-CD1 4.01Å
30	L	51.3	Low	55.8	Low	38 Å²	38	104 Å²	104	20%	0.199	60%	0.595	C	S	.	*	S	Bend	trans	-144.1	144.2	169.6	-76.9	171.6	0	0	0	108.3	C32 L57 E58 I73 I76	L30-C32 PolarHBondContact O-N 2.93Å; L30-L57 HydrophobicContact CD1-CB 4.16Å; L30-L57 HydrophobicContact CD1-CD1 4.07Å; L30-L57 HydrophobicContact CD1-CD2 4.34Å; L30-L57 HydrophobicContact CD1-CG 4.42Å; L30-E58 WeakPolarHBondContact CD2-O 3.23Å; L30-I73 HydrophobicContact CD2-CG1 4.29Å; L30-I76 HydrophobicContact CD1-CB 4.02Å; L30-I76 HydrophobicContact CD1-CD1 3.58Å; L30-I76 HydrophobicContact CD1-CG1 4.39Å; L30-I76 HydrophobicContact CD1-CG2 3.67Å; L30-I76 HydrophobicContact CG-CD1 4.12Å
31	A	60.2	Low	58.6	Low	44 Å²	44	101.6 Å²	101.6	36%	0.364	58%	0.575	S	S	.	*	B	Isolated β-bridge	trans	-76.9	104.2	167.8	0	0	0	0	0	108.2	E58	A31-E58 HydrophobicContact CB-CB 4.16Å; A31-E58 PolarHBondContact N-O 3.27Å
32	C	71.8	Confident	61.4	Low	46 Å²	46	98.5 Å²	98.5	31%	0.311	55%	0.552	S	S	.	*			trans	-62.5	135.9	165.1	-174.6	0	0	0	0	108.3	L30 A34 C38	L30-C32 PolarHBondContact O-N 2.93Å; C32-A34 PolarHBondContact O-N 2.86Å; C32-C38 HydrophobicContact CB-CB 3.69Å; C32-C38 WeakPolarHBondContact CB-SG 3.27Å; C32-C38 WeakPolarHBondContact SG-CB 3.45Å; C32-C38 PolarHBondContact SG-N 2.78Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 3.35Å
33	P	77.3	Confident	64.3	Low	28 Å²	28	86.4 Å²	86.4	18%	0.182	51%	0.506	C	S	.	.			trans	-54.2	140.1	179.3	-26.8	34.8	0	0	0	111.4	N35 C36 P55 L56	P33-N35 PolarHBondContact O-N 2.78Å; P33-C36 HydrophobicContact CB-CB 4.28Å; P33-C36 WeakPolarHBondContact O-CA 3.06Å; P33-C36 WeakPolarHBondContact O-CB 3.45Å; P33-C36 PolarHBondContact O-N 2.75Å; P33-P55 HydrophobicContact CB-CB 4.35Å; P33-P55 HydrophobicContact CG-CB 3.84Å; P33-L56 WeakPolarHBondContact CG-O 3.36Å
34	A	73.7	Confident	67.3	Low	86 Å²	86	80 Å²	80	71%	0.711	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-29.6	-165.4	0	0	0	0	0	115	C32 R47	C32-A34 PolarHBondContact O-N 2.86Å; A34-R47 PolarHBondContact O-NH1 3.08Å; A34-R47 VanDerWaalsContact O-NH1 3.12Å
35	N	83.7	Confident	70.1	Confident	46 Å²	46	72.2 Å²	72.2	25%	0.246	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	8.2	-179.9	-68.1	-43.1	0	0	0	114.3	P33 R47 D49 W88	P33-N35 PolarHBondContact O-N 2.78Å; N35-R47 HydrophobicContact CB-CB 4.12Å; N35-R47 WeakPolarHBondContact O-CB 3.47Å; N35-D49 HydrophobicContact CB-CB 4.31Å; N35-D49 PolarHBondContact ND2-OD2 3.04Å; N35-W88 HydrophobicContact CB-CZ2 3.91Å
36	C	86.4	Confident	72.7	Confident	9 Å²	9	68 Å²	68	6%	0.061	41%	0.413	C	S	.	.			trans	-116.7	161.4	-178.7	-55.1	0	0	0	0	112.7	P33 I43 N44 C45	P33-C36 HydrophobicContact CB-CB 4.28Å; P33-C36 WeakPolarHBondContact O-CA 3.06Å; P33-C36 WeakPolarHBondContact O-CB 3.45Å; P33-C36 PolarHBondContact O-N 2.75Å; C36-I43 HydrophobicContact CB-CG2 4.38Å; C36-N44 CarbonylContact C-O 3.59Å; C36-N44 WeakPolarHBondContact CA-O 3.36Å; C36-C45 HydrophobicContact CB-CB 4.03Å; C36-C45 WeakPolarHBondContact CB-SG 3.39Å; C36-C45 WeakPolarHBondContact SG-CB 3.46Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.89Å
37	V	87.6	Confident	75.2	Confident	91 Å²	91	67.5 Å²	67.5	55%	0.552	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.2	122.1	165.9	-179.9	0	0	0	0	107.2	N44	V37-N44 PolarHBondContact N-O 3.27Å; V37-N44 PolarHBondContact O-N 3.38Å
38	C	85.6	Confident	77.4	Confident	42 Å²	42	68.6 Å²	68.6	28%	0.284	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	139.6	-176.5	-54.2	0	0	0	0	110.5	C32 E42	C32-C38 HydrophobicContact CB-CB 3.69Å; C32-C38 WeakPolarHBondContact CB-SG 3.27Å; C32-C38 WeakPolarHBondContact SG-CB 3.45Å; C32-C38 PolarHBondContact SG-N 2.78Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 3.35Å; C38-E42 CarbonylContact C-O 3.33Å; C38-E42 WeakPolarHBondContact CA-O 3.45Å
39	S	84.7	Confident	79.2	Confident	62 Å²	62	65.2 Å²	65.2	43%	0.434	36%	0.362	S	S	.	.			trans	-118.3	-174.2	168.4	80.3	0	0	0	0	109.9	T41 E42	S39-T41 PolarHBondContact O-N 3.05Å; S39-T41 PolarHBondContact OG-N 3.47Å; S39-E42 PolarHBondContact N-O 2.85Å; S39-E42 PolarHBondContact OG-N 3.02Å
40	K	81.4	Confident	80.5	Confident	179 Å²	179	67.1 Å²	67.1	78%	0.778	37%	0.369	S	S	*	.	S	Bend	trans	-64.8	-18.3	175.4	-67.1	-174.1	177.7	-177.3	0	114
41	T	87.3	Confident	81.3	Confident	69 Å²	69	66.6 Å²	66.6	42%	0.423	37%	0.372	S	S	.	.	S	Bend	trans	-135.8	-4.6	-173.4	58.8	0	0	0	0	114.2	S39 N79 T81 S82	S39-T41 PolarHBondContact O-N 3.05Å; S39-T41 PolarHBondContact OG-N 3.47Å; T41-N79 WeakPolarHBondContact CA-O 3.39Å; T41-T81 PolarHBondContact O-N 3.39Å; T41-T81 PolarHBondContact O-OG1 3.03Å; T41-S82 PolarHBondContact O-N 3.43Å; T41-S82 VanDerWaalsContact O-N 3.14Å
42	E	90.8	Very high	81.9	Confident	72 Å²	72	69.8 Å²	69.8	34%	0.336	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	138.7	-174.7	180	166.5	-125.3	0	0	112.5	C38 S39 N44 S82	C38-E42 CarbonylContact C-O 3.33Å; C38-E42 WeakPolarHBondContact CA-O 3.45Å; S39-E42 PolarHBondContact N-O 2.85Å; S39-E42 PolarHBondContact OG-N 3.02Å; E42-N44 HydrophobicContact CG-CB 4.41Å; E42-S82 CarbonylContact C-O 3.58Å; E42-S82 VanDerWaalsContact CA-O 3.26Å; E42-S82 WeakPolarHBondContact CA-O 3.45Å; E42-S82 PolarHBondContact OE1-OG 3.13Å
43	I	90.8	Very high	82.1	Confident	1 Å²	1	73.8 Å²	73.8	1%	0.005	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.7	168.5	-57.4	175.5	0	0	0	108	C36 L57 I80 S82 I83 H84 Y102	C36-I43 HydrophobicContact CB-CG2 4.38Å; I43-L57 HydrophobicContact CD1-CD1 4.29Å; I43-L57 HydrophobicContact CD1-CD2 4.22Å; I43-L57 HydrophobicContact CD1-CG 4.15Å; I43-I80 HydrophobicContact CD1-CG1 4.31Å; I43-I80 HydrophobicContact CD1-CG2 4.23Å; I43-I80 HydrophobicContact CG1-CD1 4.2Å; I43-I80 HydrophobicContact CG1-CG1 4.42Å; I43-I80 HydrophobicContact CG1-CG2 4.13Å; I43-S82 PolarHBondContact N-O 2.8Å; I43-I83 HydrophobicContact CB-CG1 4.29Å; I43-I83 HydrophobicContact CD1-CG1 4.41Å; I43-I83 CarbonylContact O-C 3.59Å; I43-I83 WeakPolarHBondContact O-CA 3.47Å; I43-H84 PolarHBondContact O-N 3.29Å; I43-Y102 HydrophobicContact CD1-CE1 3.91Å
44	N	91.4	Very high	82.4	Confident	35 Å²	35	72.9 Å²	72.9	19%	0.187	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	99.8	-172.2	-167.4	-12.6	0	0	0	111.6	C36 V37 E42 R46 H84	C36-N44 CarbonylContact C-O 3.59Å; C36-N44 WeakPolarHBondContact CA-O 3.36Å; V37-N44 PolarHBondContact N-O 3.27Å; V37-N44 PolarHBondContact O-N 3.38Å; E42-N44 HydrophobicContact CG-CB 4.41Å; N44-R46 WeakPolarHBondContact OD1-CG 3.38Å; N44-R46 PolarHBondContact OD1-NE 2.81Å; N44-R46 VanDerWaalsContact OD1-NE 3.14Å; N44-H84 CarbonylContact C-O 3.49Å; N44-H84 PolarHBondContact OD1-CD2 2.92Å
45	C	90.6	Very high	82.4	Confident	0 Å²	0	69 Å²	69	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	82.7	-174.4	-49.6	0	0	0	0	110.2	C36 H84 I85 E86 W88	C36-C45 HydrophobicContact CB-CB 4.03Å; C36-C45 WeakPolarHBondContact CB-SG 3.39Å; C36-C45 WeakPolarHBondContact SG-CB 3.46Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.89Å; C45-H84 PolarHBondContact N-O 3.07Å; C45-I85 HydrophobicContact CB-CG1 4.36Å; C45-E86 PolarHBondContact O-N 3.06Å; C45-W88 HydrophobicContact CB-CH2 4.43Å; C45-W88 HydrophobicContact CB-CZ2 3.63Å
46	R	86.1	Confident	81.9	Confident	143 Å²	143	70.5 Å²	70.5	54%	0.54	37%	0.369	S	S	.	.			trans	-103.4	-13.4	177.3	-70.7	176.5	-169.9	-169.1	0.2	114.4	N44 H84 E86	N44-R46 WeakPolarHBondContact OD1-CG 3.38Å; N44-R46 PolarHBondContact OD1-NE 2.81Å; N44-R46 VanDerWaalsContact OD1-NE 3.14Å; R46-H84 PolarHBondContact NE-NE2 3.15Å; R46-E86 HydrophobicContact CG-CB 4.35Å
47	R	83.4	Confident	81.1	Confident	139 Å²	139	71 Å²	71	53%	0.525	37%	0.371	S	S	.	.	S	Bend	trans	-69	133.5	173.6	-61.9	-179.9	-177.2	151.1	2.4	107.2	A34 N35 D49 W88	A34-R47 PolarHBondContact O-NH1 3.08Å; A34-R47 VanDerWaalsContact O-NH1 3.12Å; N35-R47 HydrophobicContact CB-CB 4.12Å; N35-R47 WeakPolarHBondContact O-CB 3.47Å; R47-D49 PolarHBondContact O-N 3Å; R47-W88 PolarHBondContact O-NE1 3.15Å
48	P	78.8	Confident	79.7	Confident	99 Å²	99	73.2 Å²	73.2	64%	0.643	38%	0.376	S	S	*	.			trans	-55.1	138.8	174.3	-23.2	33.4	0	0	0	110.4
49	D	76.2	Confident	78	Confident	39 Å²	39	73.2 Å²	73.2	21%	0.209	38%	0.382	C	S	.	.			trans	-134.9	138.9	174.2	-158	-23.2	0	0	0	108.6	N35 R47 G51 W88	N35-D49 HydrophobicContact CB-CB 4.31Å; N35-D49 PolarHBondContact ND2-OD2 3.04Å; R47-D49 PolarHBondContact O-N 3Å; D49-G51 VanDerWaalsContact C-N 3.34Å; D49-G51 PolarHBondContact OD1-N 2.98Å; D49-W88 HydrophobicContact CB-CD2 3.75Å; D49-W88 HydrophobicContact CB-CE3 4.37Å; D49-W88 HydrophobicContact CB-CG 3.92Å; D49-W88 HydrophobicContact CB-CZ2 4.05Å
50	D	71.3	Confident	76	Confident	142 Å²	142	78 Å²	78	76%	0.759	40%	0.398	S	S	*	.			trans	-90.3	-5.4	173.3	-68.6	-39.6	0	0	0	111.5	S90	D50-S90 WeakPolarHBondContact O-CB 3.24Å; D50-S90 PolarHBondContact O-OG 3.16Å
51	G	68.2	Low	73.9	Confident	26 Å²	26	77.6 Å²	77.6	27%	0.268	40%	0.404	S	S	.	.			trans	-64.1	146.3	175.4	0	0	0	0	0	114.4	D49 S90	D49-G51 VanDerWaalsContact C-N 3.34Å; D49-G51 PolarHBondContact OD1-N 2.98Å; G51-S90 WeakPolarHBondContact O-CB 3.29Å
52	N	72.8	Confident	71.3	Confident	111 Å²	111	78.8 Å²	78.8	59%	0.594	42%	0.415	S	S	*	.			trans	-102.2	2.2	-177.6	66.3	-26.1	0	0	0	114.4	S90	N52-S90 WeakPolarHBondContact CA-O 3.35Å; N52-S90 WeakPolarHBondContact CB-O 3.47Å
53	L	77.1	Confident	68.7	Low	130 Å²	130	79.3 Å²	79.3	68%	0.681	44%	0.44	S	S	*	.	S	Bend	trans	-98.7	150.9	-176.9	-65.4	173.1	0	0	0	111.3	W88	L53-W88 WeakPolarHBondContact O-CZ3 3.29Å
54	F	82.1	Confident	65.9	Low	9 Å²	9	86.2 Å²	86.2	4%	0.039	48%	0.477	C	S	.	.			trans	-72.8	144.2	170.4	-167.2	-91.1	0	0	0	110.5	L56 I83 I85 L94 D98 M99 Y102 I110	F54-L56 PolarHBondContact O-N 3.35Å; F54-I83 HydrophobicContact CE1-CD1 4.39Å; F54-I83 HydrophobicContact CZ-CD1 4.28Å; F54-I83 HydrophobicContact CZ-CG2 4.09Å; F54-I85 HydrophobicContact CD2-CD1 3.81Å; F54-I85 HydrophobicContact CE2-CD1 3.41Å; F54-I85 VanDerWaalsContact CE2-CD1 3.41Å; F54-I85 HydrophobicContact CZ-CD1 3.88Å; F54-L94 HydrophobicContact CD2-CD1 3.41Å; F54-L94 VanDerWaalsContact CD2-CD1 3.41Å; F54-L94 HydrophobicContact CE2-CD1 3.53Å; F54-L94 HydrophobicContact CG-CD1 4.27Å; F54-L94 HydrophobicContact CZ-CD1 4.47Å; F54-D98 HydrophobicContact CB-CB 3.79Å; F54-D98 HydrophobicContact CD1-CB 3.97Å; F54-D98 HydrophobicContact CD2-CB 4.32Å; F54-D98 HydrophobicContact CG-CB 3.77Å; F54-M99 HydrophobicContact CE2-SD 4.26Å; F54-M99 HydrophobicContact CZ-SD 3.91Å; F54-Y102 AromaticContact CE1-CE2 3.88Å; F54-Y102 HydrophobicContact CE1-CE2 3.88Å; F54-I110 HydrophobicContact CE2-CD1 4.13Å
55	P	75.1	Confident	63.6	Low	4 Å²	4	89.6 Å²	89.6	3%	0.026	50%	0.504	C	S	.	.			trans	-64.9	104.3	176.7	25.7	-34.4	0	0	0	111.7	P33 I85 W88 Y102	P33-P55 HydrophobicContact CB-CB 4.35Å; P33-P55 HydrophobicContact CG-CB 3.84Å; P55-I85 VanDerWaalsContact CD-CD1 3.46Å; P55-I85 HydrophobicContact CG-CD1 3.55Å; P55-I85 HydrophobicContact CG-CG1 4.01Å; P55-W88 HydrophobicContact CB-CH2 4.09Å; P55-W88 HydrophobicContact CB-CZ3 4.36Å; P55-W88 HydrophobicContact CG-CH2 4.4Å; P55-W88 HydrophobicContact CG-CZ3 4.37Å; P55-Y102 PolarHBondContact O-OH 2.89Å; P55-Y102 VanDerWaalsContact O-OH 3.06Å
56	L	71.6	Confident	61.1	Low	79 Å²	79	97.3 Å²	97.3	41%	0.414	55%	0.545	S	S	.	.			trans	-97	143.9	170.7	-70.7	166.2	0	0	0	110.1	P33 F54 E58	P33-L56 WeakPolarHBondContact CG-O 3.36Å; F54-L56 PolarHBondContact O-N 3.35Å; L56-E58 PolarHBondContact O-N 3.15Å
57	L	71	Confident	59.1	Low	18 Å²	18	94.1 Å²	94.1	9%	0.094	56%	0.556	C	S	.	*			trans	-77	110.7	173.4	-69.5	170	0	0	0	109.5	L30 I43 I76 I80 Y102	L30-L57 HydrophobicContact CD1-CB 4.16Å; L30-L57 HydrophobicContact CD1-CD1 4.07Å; L30-L57 HydrophobicContact CD1-CD2 4.34Å; L30-L57 HydrophobicContact CD1-CG 4.42Å; I43-L57 HydrophobicContact CD1-CD1 4.29Å; I43-L57 HydrophobicContact CD1-CD2 4.22Å; I43-L57 HydrophobicContact CD1-CG 4.15Å; L57-I76 HydrophobicContact CD1-CG2 4.3Å; L57-I80 HydrophobicContact CD1-CG1 4.41Å; L57-Y102 HydrophobicContact CD1-CE1 4.36Å
58	E	57.7	Low	56.9	Low	139 Å²	139	95.2 Å²	95.2	65%	0.65	57%	0.573	S	S	*	*	B	Isolated β-bridge	trans	-77.8	125.7	178.6	-76.9	-174.4	168.3	0	0	111.6	L30 A31 L56	L30-E58 WeakPolarHBondContact CD2-O 3.23Å; A31-E58 HydrophobicContact CB-CB 4.16Å; A31-E58 PolarHBondContact N-O 3.27Å; L56-E58 PolarHBondContact O-N 3.15Å
59	G	50.9	Low	55	Low	41 Å²	41	94.7 Å²	94.7	42%	0.423	58%	0.577	S	S	.	*			trans	-82.1	123.5	169.6	0	0	0	0	0	111	D61	G59-D61 PolarHBondContact O-N 3.45Å
60	Q	41.9	Very low	53.3	Low	162 Å²	162	98.5 Å²	98.5	76%	0.757	61%	0.607	S	S	*	*			trans	-86.8	101.5	175.9	-160.9	173.6	33.2	0	0	109.5	S62	Q60-S62 PolarHBondContact O-N 2.97Å
61	D	36.5	Very low	52.5	Low	172 Å²	172	96 Å²	96	92%	0.92	59%	0.592	S	S	*	*			trans	-66	75.9	166.3	-92.4	-19	0	0	0	109.5	G59 G63	G59-D61 PolarHBondContact O-N 3.45Å; D61-G63 PolarHBondContact O-N 3.46Å; D61-G63 VanDerWaalsContact O-N 3.08Å
62	S	33.2	Very low	52	Low	93 Å²	93	98.7 Å²	98.7	65%	0.65	60%	0.601	S	S	*	*			trans	-78.2	90.7	171.4	48.6	0	0	0	0	108.3	Q60 N64	Q60-S62 PolarHBondContact O-N 2.97Å; S62-N64 VanDerWaalsContact C-N 3.28Å; S62-N64 PolarHBondContact O-N 2.75Å
63	G	36.7	Very low	51.6	Low	84 Å²	84	96.3 Å²	96.3	87%	0.866	59%	0.587	S	S	*	*			trans	-60.4	87.9	171.9	0	0	0	0	0	111.2	D61	D61-G63 PolarHBondContact O-N 3.46Å; D61-G63 VanDerWaalsContact O-N 3.08Å
64	N	31.9	Very low	51	Low	146 Å²	146	92.4 Å²	92.4	78%	0.781	57%	0.569	S	S	*	*			trans	-143.2	110.9	169.5	-143.8	0.6	0	0	0	109.8	S62 N66	S62-N64 VanDerWaalsContact C-N 3.28Å; S62-N64 PolarHBondContact O-N 2.75Å; N64-N66 PolarHBondContact O-N 3.12Å
65	S	43.4	Very low	50.2	Low	106 Å²	106	95.3 Å²	95.3	74%	0.741	59%	0.585	S	S	*	*			trans	-70.8	99.3	-177	53.3	0	0	0	0	111.1
66	N	37.1	Very low	49.9	Very low	161 Å²	161	97.3 Å²	97.3	86%	0.861	60%	0.595	S	S	*	*			trans	-160.8	119.8	150	-91.1	-37	0	0	0	108.9	N64 N68	N64-N66 PolarHBondContact O-N 3.12Å; N66-N68 PolarHBondContact O-N 2.95Å
67	G	44.4	Very low	50	Low	76 Å²	76	93.6 Å²	93.6	78%	0.784	58%	0.575	S	S	*	*			trans	-69.1	115.2	-170.5	0	0	0	0	0	113.3
68	N	36.3	Very low	50.4	Low	162 Å²	162	98.9 Å²	98.9	87%	0.866	59%	0.594	S	S	*	*	S	Bend	trans	-161.9	119.3	146.9	-96.2	-29.8	0	0	0	109.9	N66	N66-N68 PolarHBondContact O-N 2.95Å
69	A	39.8	Very low	51.7	Low	88 Å²	88	97 Å²	97	73%	0.727	59%	0.588	S	S	*	*			trans	46.4	91.7	171.6	0	0	0	0	0	117.2	I71	A69-I71 PolarHBondContact O-N 3.22Å
70	S	41.4	Very low	53.6	Low	120 Å²	120	95.1 Å²	95.1	84%	0.839	57%	0.569	S	S	*	*			trans	-60.9	104.3	156.7	53.2	0	0	0	0	109.4	N72	S70-N72 PolarHBondContact O-N 2.92Å; S70-N72 VanDerWaalsContact O-N 3.13Å
71	I	53.7	Low	56	Low	90 Å²	90	89.6 Å²	89.6	46%	0.462	55%	0.546	S	S	.	.			trans	-69.7	111	179.4	-69	-173	0	0	0	108.7	V29 A69 I73 I76	V29-I71 HydrophobicContact CB-CD1 4.14Å; V29-I71 HydrophobicContact CG1-CB 4.42Å; V29-I71 HydrophobicContact CG1-CD1 3.83Å; V29-I71 HydrophobicContact CG2-CD1 4.01Å; A69-I71 PolarHBondContact O-N 3.22Å; I71-I73 PolarHBondContact O-N 2.89Å; I71-I76 HydrophobicContact CG2-CD1 3.44Å; I71-I76 VanDerWaalsContact CG2-CD1 3.44Å; I71-I76 HydrophobicContact CG2-CG1 4.27Å
72	N	58.5	Low	58.9	Low	82 Å²	82	82.1 Å²	82.1	44%	0.439	51%	0.507	S	S	.	.			trans	-78.6	117.7	-172.4	-173.1	14.3	0	0	0	110.8	S70 T74 D75	S70-N72 PolarHBondContact O-N 2.92Å; S70-N72 VanDerWaalsContact O-N 3.13Å; N72-T74 VanDerWaalsContact CG-OG1 3.29Å; N72-T74 PolarHBondContact ND2-OG1 3.11Å; N72-T74 PolarHBondContact O-N 3.42Å; N72-T74 VanDerWaalsContact O-N 3.15Å; N72-T74 PolarHBondContact OD1-OG1 2.62Å; N72-D75 WeakPolarHBondContact CB-OD2 3.12Å; N72-D75 PolarHBondContact ND2-OD2 2.88Å; N72-D75 PolarHBondContact O-N 2.89Å
73	I	64.4	Low	61.8	Low	61 Å²	61	77.8 Å²	77.8	31%	0.313	48%	0.477	S	S	.	.	H	α-helix	trans	-54.5	-37.6	-175.9	-59.7	169.6	0	0	0	111	L30 I71 D75 I76 S77	L30-I73 HydrophobicContact CD2-CG1 4.29Å; I71-I73 PolarHBondContact O-N 2.89Å; I73-D75 PolarHBondContact O-N 3.12Å; I73-I76 PolarHBondContact O-N 3.27Å; I73-I76 VanDerWaalsContact O-N 3.16Å; I73-S77 PolarHBondContact O-N 3.31Å; I73-S77 PolarHBondContact O-OG 3.37Å
74	T	63.9	Low	64.6	Low	48 Å²	48	74.9 Å²	74.9	29%	0.294	44%	0.44	S	S	.	.	H	α-helix	trans	-60.5	-33.8	179.7	63.4	0	0	0	0	112.8	N72 R78	N72-T74 VanDerWaalsContact CG-OG1 3.29Å; N72-T74 PolarHBondContact ND2-OG1 3.11Å; N72-T74 PolarHBondContact O-N 3.42Å; N72-T74 VanDerWaalsContact O-N 3.15Å; N72-T74 PolarHBondContact OD1-OG1 2.62Å; T74-R78 WeakPolarHBondContact O-CB 3.24Å; T74-R78 WeakPolarHBondContact O-CD 3.46Å; T74-R78 WeakPolarHBondContact O-CG 3.35Å; T74-R78 PolarHBondContact O-N 3.17Å; T74-R78 VanDerWaalsContact O-N 3.1Å
75	D	64.8	Low	67.5	Low	70 Å²	70	67.9 Å²	67.9	37%	0.374	40%	0.403	S	S	.	.	H	α-helix	trans	-80.2	-21	-177.9	-62.1	-39.2	0	0	0	112.4	N72 I73 R78 N79	N72-D75 WeakPolarHBondContact CB-OD2 3.12Å; N72-D75 PolarHBondContact ND2-OD2 2.88Å; N72-D75 PolarHBondContact O-N 2.89Å; I73-D75 PolarHBondContact O-N 3.12Å; D75-R78 IonicContact OD1-CZ 3.75Å; D75-R78 IonicContact OD1-NH1 2.7Å; D75-R78 PolarHBondContact OD1-NH1 3.37Å; D75-N79 PolarHBondContact O-ND2 3.2Å
76	I	67.8	Low	69.8	Low	45 Å²	45	65.2 Å²	65.2	23%	0.231	38%	0.379	C	S	.	.	H	α-helix	trans	-81	-46.2	169.5	-61.3	176.4	0	0	0	110.6	L30 L57 I71 I73 R78 N79 I80	L30-I76 HydrophobicContact CD1-CB 4.02Å; L30-I76 HydrophobicContact CD1-CD1 3.58Å; L30-I76 HydrophobicContact CD1-CG1 4.39Å; L30-I76 HydrophobicContact CD1-CG2 3.67Å; L30-I76 HydrophobicContact CG-CD1 4.12Å; L57-I76 HydrophobicContact CD1-CG2 4.3Å; I71-I76 HydrophobicContact CG2-CD1 3.44Å; I71-I76 VanDerWaalsContact CG2-CD1 3.44Å; I71-I76 HydrophobicContact CG2-CG1 4.27Å; I73-I76 PolarHBondContact O-N 3.27Å; I73-I76 VanDerWaalsContact O-N 3.16Å; I76-R78 PolarHBondContact O-N 3.16Å; I76-N79 WeakPolarHBondContact O-CB 3.35Å; I76-N79 PolarHBondContact O-N 3.16Å; I76-I80 PolarHBondContact O-N 3.43Å
77	S	75.6	Confident	72.3	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.007	35%	0.35	C	S	.	.	H	α-helix	trans	-60.2	-32.2	178.1	-58.9	0	0	0	0	112.6	I73 N79 I80 L101	I73-S77 PolarHBondContact O-N 3.31Å; I73-S77 PolarHBondContact O-OG 3.37Å; S77-N79 VanDerWaalsContact C-N 3.3Å; S77-N79 PolarHBondContact O-N 3.22Å; S77-I80 PolarHBondContact O-N 3.24Å; S77-L101 CarbonylContact C-O 3.59Å; S77-L101 VanDerWaalsContact CB-O 3.23Å; S77-L101 WeakPolarHBondContact CB-O 3.41Å
78	R	78.8	Confident	74.5	Confident	130 Å²	130	56.6 Å²	56.6	49%	0.491	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-31.8	169.7	-80.6	166.5	177.4	165.6	-2.6	114.5	T74 D75 I76 G104	T74-R78 WeakPolarHBondContact O-CB 3.24Å; T74-R78 WeakPolarHBondContact O-CD 3.46Å; T74-R78 WeakPolarHBondContact O-CG 3.35Å; T74-R78 PolarHBondContact O-N 3.17Å; T74-R78 VanDerWaalsContact O-N 3.1Å; D75-R78 IonicContact OD1-CZ 3.75Å; D75-R78 IonicContact OD1-NH1 2.7Å; D75-R78 PolarHBondContact OD1-NH1 3.37Å; I76-R78 PolarHBondContact O-N 3.16Å; R78-G104 WeakPolarHBondContact O-CA 3.48Å
79	N	85.1	Confident	76.9	Confident	99 Å²	99	57.1 Å²	57.1	53%	0.529	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.1	-178.4	-72	-34.5	0	0	0	113.4	T41 D75 I76 S77 T81	T41-N79 WeakPolarHBondContact CA-O 3.39Å; D75-N79 PolarHBondContact O-ND2 3.2Å; I76-N79 WeakPolarHBondContact O-CB 3.35Å; I76-N79 PolarHBondContact O-N 3.16Å; S77-N79 VanDerWaalsContact C-N 3.3Å; S77-N79 PolarHBondContact O-N 3.22Å; N79-T81 PolarHBondContact O-N 2.87Å
80	I	89.7	Confident	79.2	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.01	28%	0.281	C	S	.	.			trans	-72.7	115.9	175.5	-57	-57.3	0	0	0	109.8	I43 L57 I76 S77 S82 I83 Y102 G104 L105	I43-I80 HydrophobicContact CD1-CG1 4.31Å; I43-I80 HydrophobicContact CD1-CG2 4.23Å; I43-I80 HydrophobicContact CG1-CD1 4.2Å; I43-I80 HydrophobicContact CG1-CG1 4.42Å; I43-I80 HydrophobicContact CG1-CG2 4.13Å; L57-I80 HydrophobicContact CD1-CG1 4.41Å; I76-I80 PolarHBondContact O-N 3.43Å; S77-I80 PolarHBondContact O-N 3.24Å; I80-S82 WeakPolarHBondContact CG2-O 3.44Å; I80-I83 HydrophobicContact CG2-CD1 4.32Å; I80-I83 HydrophobicContact CG2-CG1 3.81Å; I80-Y102 HydrophobicContact CB-CD1 4.06Å; I80-Y102 HydrophobicContact CB-CE1 4.45Å; I80-Y102 HydrophobicContact CG1-CD1 4.35Å; I80-Y102 HydrophobicContact CG1-CE1 4.31Å; I80-Y102 HydrophobicContact CG2-CD1 4.35Å; I80-G104 CarbonylContact O-C 3.3Å; I80-L105 HydrophobicContact CG2-CD1 4.31Å; I80-L105 WeakPolarHBondContact O-CA 3.46Å; I80-L105 PolarHBondContact O-N 2.84Å
81	T	93.9	Very high	81.5	Confident	46 Å²	46	48.9 Å²	48.9	28%	0.282	24%	0.241	S	C	.	.			trans	-104.9	-17.4	179.2	60.4	0	0	0	0	113.1	T41 N79 Q106 K107	T41-T81 PolarHBondContact O-N 3.39Å; T41-T81 PolarHBondContact O-OG1 3.03Å; N79-T81 PolarHBondContact O-N 2.87Å; T81-Q106 WeakPolarHBondContact O-CA 3.31Å; T81-Q106 PolarHBondContact O-N 3.25Å; T81-K107 PolarHBondContact O-N 3.16Å
82	S	95.7	Very high	83.3	Confident	15 Å²	15	48.2 Å²	48.2	11%	0.105	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	129.7	-179.9	-175.8	0	0	0	0	111.6	T41 E42 I43 I80 K107	T41-S82 PolarHBondContact O-N 3.43Å; T41-S82 VanDerWaalsContact O-N 3.14Å; E42-S82 CarbonylContact C-O 3.58Å; E42-S82 VanDerWaalsContact CA-O 3.26Å; E42-S82 WeakPolarHBondContact CA-O 3.45Å; E42-S82 PolarHBondContact OE1-OG 3.13Å; I43-S82 PolarHBondContact N-O 2.8Å; I80-S82 WeakPolarHBondContact CG2-O 3.44Å; S82-K107 WeakPolarHBondContact CA-O 3.3Å
83	I	94.5	Very high	84.9	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.4	167.9	-64.8	170.9	0	0	0	108.4	I43 F54 I80 I85 Y102 L105 K107 L108 T109	I43-I83 HydrophobicContact CB-CG1 4.29Å; I43-I83 HydrophobicContact CD1-CG1 4.41Å; I43-I83 CarbonylContact O-C 3.59Å; I43-I83 WeakPolarHBondContact O-CA 3.47Å; F54-I83 HydrophobicContact CE1-CD1 4.39Å; F54-I83 HydrophobicContact CZ-CD1 4.28Å; F54-I83 HydrophobicContact CZ-CG2 4.09Å; I80-I83 HydrophobicContact CG2-CD1 4.32Å; I80-I83 HydrophobicContact CG2-CG1 3.81Å; I83-I85 HydrophobicContact CG2-CD1 4.17Å; I83-I85 HydrophobicContact CG2-CG1 4.04Å; I83-Y102 HydrophobicContact CD1-CD1 4.1Å; I83-Y102 HydrophobicContact CD1-CD2 3.81Å; I83-Y102 HydrophobicContact CD1-CE1 4.24Å; I83-Y102 HydrophobicContact CD1-CE2 3.96Å; I83-Y102 HydrophobicContact CD1-CG 3.87Å; I83-L105 HydrophobicContact CB-CD1 4.17Å; I83-L105 HydrophobicContact CD1-CD1 3.78Å; I83-L105 HydrophobicContact CD1-CD2 4.15Å; I83-L105 HydrophobicContact CG1-CD1 3.64Å; I83-K107 PolarHBondContact N-O 3.32Å; I83-L108 HydrophobicContact CB-CD1 3.96Å; I83-L108 HydrophobicContact CG2-CD1 3.97Å; I83-L108 CarbonylContact O-C 3.51Å; I83-L108 WeakPolarHBondContact O-CA 3.48Å; I83-T109 PolarHBondContact O-N 3.46Å
84	H	95.2	Very high	86.3	Confident	23 Å²	23	43.7 Å²	43.7	11%	0.106	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	115.6	177.7	-177.1	100.1	0	0	0	110.3	I43 N44 C45 R46 E86 T109	I43-H84 PolarHBondContact O-N 3.29Å; N44-H84 CarbonylContact C-O 3.49Å; N44-H84 PolarHBondContact OD1-CD2 2.92Å; C45-H84 PolarHBondContact N-O 3.07Å; R46-H84 PolarHBondContact NE-NE2 3.15Å; H84-E86 IonicContact CD2-OE2 3.96Å; H84-E86 IonicContact CE1-OE2 3.51Å; H84-E86 IonicContact NE2-OE2 2.8Å; H84-E86 PolarHBondContact NE2-OE2 3.28Å; H84-T109 WeakPolarHBondContact ND1-CB 2.96Å; H84-T109 PolarHBondContact ND1-OG1 2.73Å
85	I	93.1	Very high	87.6	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	128.5	177.9	-56	172.2	0	0	0	108.4	C45 F54 P55 I83 W88 L91 T109 I110 K111	C45-I85 HydrophobicContact CB-CG1 4.36Å; F54-I85 HydrophobicContact CD2-CD1 3.81Å; F54-I85 HydrophobicContact CE2-CD1 3.41Å; F54-I85 VanDerWaalsContact CE2-CD1 3.41Å; F54-I85 HydrophobicContact CZ-CD1 3.88Å; P55-I85 VanDerWaalsContact CD-CD1 3.46Å; P55-I85 HydrophobicContact CG-CD1 3.55Å; P55-I85 HydrophobicContact CG-CG1 4.01Å; I83-I85 HydrophobicContact CG2-CD1 4.17Å; I83-I85 HydrophobicContact CG2-CG1 4.04Å; I85-W88 HydrophobicContact CG2-CB 3.94Å; I85-W88 HydrophobicContact CG2-CD2 3.79Å; I85-W88 HydrophobicContact CG2-CE3 4.14Å; I85-W88 HydrophobicContact CG2-CG 3.67Å; I85-L91 HydrophobicContact CD1-CD2 4.31Å; I85-L91 HydrophobicContact CG2-CD2 4.14Å; I85-T109 PolarHBondContact N-O 3.3Å; I85-I110 HydrophobicContact CB-CG1 4.5Å; I85-I110 HydrophobicContact CD1-CG1 4.37Å; I85-I110 WeakPolarHBondContact O-CA 3.36Å; I85-K111 PolarHBondContact O-N 3.3Å
86	E	92.5	Very high	88.8	Confident	50 Å²	50	42.1 Å²	42.1	23%	0.234	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	136.7	-176.1	-163.2	173.7	-177.9	0	0	112.3	C45 R46 H84 W88 K111	C45-E86 PolarHBondContact O-N 3.06Å; R46-E86 HydrophobicContact CG-CB 4.35Å; H84-E86 IonicContact CD2-OE2 3.96Å; H84-E86 IonicContact CE1-OE2 3.51Å; H84-E86 IonicContact NE2-OE2 2.8Å; H84-E86 PolarHBondContact NE2-OE2 3.28Å; E86-W88 VanDerWaalsContact C-N 3.35Å; E86-W88 PolarHBondContact O-N 2.98Å; E86-K111 VanDerWaalsContact CA-O 3.27Å; E86-K111 WeakPolarHBondContact CA-O 3.3Å; E86-K111 HydrophobicContact CG-CB 4.41Å
87	N	89.9	Confident	89.7	Confident	47 Å²	47	44.8 Å²	44.8	25%	0.251	23%	0.226	S	C	.	.	S	Bend	trans	69.9	17.1	179.9	-48.8	-59.9	0	0	0	116.1	R89 K111 N112	N87-R89 PolarHBondContact O-N 3.13Å; N87-R89 VanDerWaalsContact O-N 3.15Å; N87-K111 PolarHBondContact N-O 3.27Å; N87-N112 WeakPolarHBondContact CA-O 3.32Å; N87-N112 PolarHBondContact OD1-ND2 2.89Å
88	W	89.6	Confident	90.3	Very high	8 Å²	8	45.6 Å²	45.6	3%	0.03	23%	0.23	C	C	.	.			trans	-87.8	72.1	-179	-77.7	30.7	0	0	0	111.1	N35 C45 R47 D49 L53 P55 I85 E86 S90 L91 S113	N35-W88 HydrophobicContact CB-CZ2 3.91Å; C45-W88 HydrophobicContact CB-CH2 4.43Å; C45-W88 HydrophobicContact CB-CZ2 3.63Å; R47-W88 PolarHBondContact O-NE1 3.15Å; D49-W88 HydrophobicContact CB-CD2 3.75Å; D49-W88 HydrophobicContact CB-CE3 4.37Å; D49-W88 HydrophobicContact CB-CG 3.92Å; D49-W88 HydrophobicContact CB-CZ2 4.05Å; L53-W88 WeakPolarHBondContact O-CZ3 3.29Å; P55-W88 HydrophobicContact CB-CH2 4.09Å; P55-W88 HydrophobicContact CB-CZ3 4.36Å; P55-W88 HydrophobicContact CG-CH2 4.4Å; P55-W88 HydrophobicContact CG-CZ3 4.37Å; I85-W88 HydrophobicContact CG2-CB 3.94Å; I85-W88 HydrophobicContact CG2-CD2 3.79Å; I85-W88 HydrophobicContact CG2-CE3 4.14Å; I85-W88 HydrophobicContact CG2-CG 3.67Å; E86-W88 VanDerWaalsContact C-N 3.35Å; E86-W88 PolarHBondContact O-N 2.98Å; W88-S90 PolarHBondContact O-N 3.4Å; W88-L91 HydrophobicContact CB-CB 4.35Å; W88-L91 WeakPolarHBondContact O-CB 3.39Å; W88-L91 PolarHBondContact O-N 2.99Å; W88-S113 PolarHBondContact N-OG 2.85Å; W88-S113 CarbonylContact O-C 3.57Å; W88-S113 VanDerWaalsContact O-CA 3.29Å; W88-S113 WeakPolarHBondContact O-CA 3.15Å; W88-S113 WeakPolarHBondContact O-CB 3.38Å
89	R	86.4	Confident	90.9	Very high	174 Å²	174	39.4 Å²	39.4	66%	0.657	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-17.3	-160.6	-67.7	-178.6	175.3	-179.6	0.5	116.2	N87 S113	N87-R89 PolarHBondContact O-N 3.13Å; N87-R89 VanDerWaalsContact O-N 3.15Å; R89-S113 CarbonylContact C-O 3.52Å
90	S	88.3	Confident	91	Very high	34 Å²	34	39 Å²	39	24%	0.238	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-2.4	179.8	-64	0	0	0	0	114.1	D50 G51 N52 W88 H92	D50-S90 WeakPolarHBondContact O-CB 3.24Å; D50-S90 PolarHBondContact O-OG 3.16Å; G51-S90 WeakPolarHBondContact O-CB 3.29Å; N52-S90 WeakPolarHBondContact CA-O 3.35Å; N52-S90 WeakPolarHBondContact CB-O 3.47Å; W88-S90 PolarHBondContact O-N 3.4Å; S90-H92 VanDerWaalsContact C-N 3.26Å; S90-H92 PolarHBondContact O-N 2.03Å; S90-H92 PolarHBondContact O-ND1 3.5Å
91	L	90	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.			trans	-76.6	73.8	179.4	-173.7	64.7	0	0	0	111.1	I85 W88 I110 L115	I85-L91 HydrophobicContact CD1-CD2 4.31Å; I85-L91 HydrophobicContact CG2-CD2 4.14Å; W88-L91 HydrophobicContact CB-CB 4.35Å; W88-L91 WeakPolarHBondContact O-CB 3.39Å; W88-L91 PolarHBondContact O-N 2.99Å; L91-I110 HydrophobicContact CD2-CG2 4.03Å; L91-L115 VanDerWaalsContact O-CA 3.24Å; L91-L115 WeakPolarHBondContact O-CA 3.39Å; L91-L115 WeakPolarHBondContact O-CD1 3.46Å; L91-L115 PolarHBondContact O-N 2.79Å
92	H	91.6	Very high	90.6	Very high	77 Å²	77	40.1 Å²	40.1	36%	0.356	21%	0.206	S	C	.	.			trans	-74.9	-27.1	-172.4	-69.5	109.2	0	0	0	115	S90 R116 S117	S90-H92 VanDerWaalsContact C-N 3.26Å; S90-H92 PolarHBondContact O-N 2.03Å; S90-H92 PolarHBondContact O-ND1 3.5Å; H92-R116 PolarHBondContact CD2-NE 3.07Å; H92-R116 VanDerWaalsContact CD2-NE 3.27Å; H92-R116 PolarHBondContact O-N 3.24Å; H92-S117 PolarHBondContact O-N 3.22Å
93	T	92.4	Very high	90.4	Very high	47 Å²	47	42 Å²	42	29%	0.288	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.7	-174.2	-59.8	0	0	0	0	110.3	S117 Q119	T93-S117 WeakPolarHBondContact CA-O 3.05Å; T93-S117 WeakPolarHBondContact CG2-OG 3.32Å; T93-S117 PolarHBondContact OG1-OG 3.33Å; T93-Q119 HydrophobicContact CG2-CG 4.36Å
94	L	94.1	Very high	90.1	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	120.2	166.4	-177.8	65.7	0	0	0	109.1	F54 D98 M99 L108 I110 L115 S117 I118 Q119 F123	F54-L94 HydrophobicContact CD2-CD1 3.41Å; F54-L94 VanDerWaalsContact CD2-CD1 3.41Å; F54-L94 HydrophobicContact CE2-CD1 3.53Å; F54-L94 HydrophobicContact CG-CD1 4.27Å; F54-L94 HydrophobicContact CZ-CD1 4.47Å; L94-D98 HydrophobicContact CD1-CB 3.99Å; L94-M99 HydrophobicContact CD1-CG 4.14Å; L94-M99 HydrophobicContact CD1-SD 4.04Å; L94-M99 HydrophobicContact CD2-CG 4.2Å; L94-M99 HydrophobicContact CD2-SD 4.22Å; L94-M99 HydrophobicContact CG-CG 4.28Å; L94-L108 HydrophobicContact CD2-CD2 4.45Å; L94-I110 HydrophobicContact CD1-CD1 4.31Å; L94-I110 HydrophobicContact CD2-CD1 4.02Å; L94-L115 HydrophobicContact CB-CD1 4.18Å; L94-S117 PolarHBondContact N-O 3.18Å; L94-S117 VanDerWaalsContact N-O 3.12Å; L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.31Å; L94-I118 HydrophobicContact CD2-CG2 4.23Å; L94-Q119 PolarHBondContact O-N 3.18Å; L94-F123 HydrophobicContact CD2-CE1 3.75Å; L94-F123 HydrophobicContact CD2-CZ 3.96Å
95	N	91.8	Very high	90.1	Very high	53 Å²	53	41.5 Å²	41.5	28%	0.283	22%	0.218	S	C	.	.			trans	-93.5	160.1	-178.4	-47.7	-76.3	0	0	0	111.1	V97 D98 Q119	N95-V97 VanDerWaalsContact C-N 3.32Å; N95-V97 PolarHBondContact O-N 3.22Å; N95-D98 WeakPolarHBondContact CA-OD2 3.29Å; N95-D98 VanDerWaalsContact CB-OD2 3.27Å; N95-D98 WeakPolarHBondContact CB-OD2 3.04Å; N95-D98 PolarHBondContact N-OD2 3.19Å; N95-D98 PolarHBondContact ND2-OD2 3.21Å; N95-D98 WeakPolarHBondContact O-CB 3.08Å; N95-D98 PolarHBondContact O-N 2.04Å; N95-Q119 VanDerWaalsContact CA-OE1 3.29Å; N95-Q119 PolarHBondContact OD1-NE2 3.07Å
96	A	88.1	Confident	90.3	Very high	31 Å²	31	46.3 Å²	46.3	26%	0.256	24%	0.241	S	C	.	.	H	α-helix	trans	-68	-33.3	178	0	0	0	0	0	113.2	D98 M99 E100	A96-D98 VanDerWaalsContact C-N 3.29Å; A96-D98 PolarHBondContact O-N 3.19Å; A96-M99 PolarHBondContact O-N 2.79Å; A96-E100 PolarHBondContact O-N 3.02Å
97	V	87.3	Confident	90.5	Very high	101 Å²	101	48.6 Å²	48.6	61%	0.612	25%	0.25	S	C	*	.	H	α-helix	trans	-64.2	-34.3	177.1	-177	0	0	0	0	111.7	N95 M99 E100	N95-V97 VanDerWaalsContact C-N 3.32Å; N95-V97 PolarHBondContact O-N 3.22Å; V97-M99 PolarHBondContact O-N 2.84Å; V97-M99 VanDerWaalsContact O-N 3.16Å; V97-E100 PolarHBondContact O-N 2.96Å
98	D	89.3	Confident	90.9	Very high	18 Å²	18	46.4 Å²	46.4	10%	0.096	24%	0.238	C	C	.	.	H	α-helix	trans	-60.6	-27.9	-179.6	-58.1	-27.2	0	0	0	112.3	F54 L94 N95 A96 Y102	F54-D98 HydrophobicContact CB-CB 3.79Å; F54-D98 HydrophobicContact CD1-CB 3.97Å; F54-D98 HydrophobicContact CD2-CB 4.32Å; F54-D98 HydrophobicContact CG-CB 3.77Å; L94-D98 HydrophobicContact CD1-CB 3.99Å; N95-D98 WeakPolarHBondContact CA-OD2 3.29Å; N95-D98 VanDerWaalsContact CB-OD2 3.27Å; N95-D98 WeakPolarHBondContact CB-OD2 3.04Å; N95-D98 PolarHBondContact N-OD2 3.19Å; N95-D98 PolarHBondContact ND2-OD2 3.21Å; N95-D98 WeakPolarHBondContact O-CB 3.08Å; N95-D98 PolarHBondContact O-N 2.04Å; A96-D98 VanDerWaalsContact C-N 3.29Å; A96-D98 PolarHBondContact O-N 3.19Å; D98-Y102 WeakPolarHBondContact O-CD2 3.35Å; D98-Y102 VanDerWaalsContact O-CE2 3.31Å; D98-Y102 WeakPolarHBondContact O-CE2 3.04Å
99	M	90.5	Very high	91.3	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-103.8	-17.4	-174.2	-63.4	-59.1	-57.6	0	0	113.8	F54 L94 A96 V97 L101 Y102 L105 L108 A122 F123 N126	F54-M99 HydrophobicContact CE2-SD 4.26Å; F54-M99 HydrophobicContact CZ-SD 3.91Å; L94-M99 HydrophobicContact CD1-CG 4.14Å; L94-M99 HydrophobicContact CD1-SD 4.04Å; L94-M99 HydrophobicContact CD2-CG 4.2Å; L94-M99 HydrophobicContact CD2-SD 4.22Å; L94-M99 HydrophobicContact CG-CG 4.28Å; A96-M99 PolarHBondContact O-N 2.79Å; V97-M99 PolarHBondContact O-N 2.84Å; V97-M99 VanDerWaalsContact O-N 3.16Å; M99-L101 VanDerWaalsContact C-N 3.3Å; M99-L101 PolarHBondContact O-N 3.08Å; M99-Y102 PolarHBondContact O-N 3.14Å; M99-Y102 VanDerWaalsContact O-N 3.15Å; M99-L105 HydrophobicContact CE-CD2 3.44Å; M99-L105 VanDerWaalsContact CE-CD2 3.44Å; M99-L108 HydrophobicContact CE-CD2 3.94Å; M99-L108 HydrophobicContact SD-CD2 4.32Å; M99-A122 WeakPolarHBondContact CB-O 3.45Å; M99-A122 WeakPolarHBondContact CG-O 3.3Å; M99-F123 HydrophobicContact CE-CD1 4.14Å; M99-F123 HydrophobicContact CE-CE1 4.19Å; M99-F123 HydrophobicContact CG-CD1 4.42Å; M99-F123 HydrophobicContact CG-CE1 4.42Å; M99-N126 PolarHBondContact O-ND2 2.04Å
100	E	87.9	Confident	91.7	Very high	91 Å²	91	38 Å²	38	43%	0.425	21%	0.207	S	C	.	.	H	α-helix	trans	-60.4	-34.5	-169.4	174.4	153.6	-133.5	0	0	113.8	A96 V97 K125	A96-E100 PolarHBondContact O-N 3.02Å; V97-E100 PolarHBondContact O-N 2.96Å; E100-K125 HydrophobicContact CB-CG 4.44Å; E100-K125 HydrophobicContact CG-CG 4.13Å; E100-K125 WeakPolarHBondContact OE1-CE 3.07Å
101	L	85.1	Confident	92	Very high	71 Å²	71	39.4 Å²	39.4	37%	0.372	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-19.6	-178.7	-61.7	176.9	0	0	0	113.8	S77 M99 T103	S77-L101 CarbonylContact C-O 3.59Å; S77-L101 VanDerWaalsContact CB-O 3.23Å; S77-L101 WeakPolarHBondContact CB-O 3.41Å; M99-L101 VanDerWaalsContact C-N 3.3Å; M99-L101 PolarHBondContact O-N 3.08Å; L101-T103 PolarHBondContact O-N 2.88Å
102	Y	90	Very high	92.1	Very high	1 Å²	1	42.3 Å²	42.3	0%	0.004	23%	0.225	C	C	.	.			trans	-95.5	52.7	-170.3	-59	-66.3	0	0	0	112.2	I43 F54 P55 L57 I80 I83 D98 M99 G104 L105 N126	I43-Y102 HydrophobicContact CD1-CE1 3.91Å; F54-Y102 AromaticContact CE1-CE2 3.88Å; F54-Y102 HydrophobicContact CE1-CE2 3.88Å; P55-Y102 PolarHBondContact O-OH 2.89Å; P55-Y102 VanDerWaalsContact O-OH 3.06Å; L57-Y102 HydrophobicContact CD1-CE1 4.36Å; I80-Y102 HydrophobicContact CB-CD1 4.06Å; I80-Y102 HydrophobicContact CB-CE1 4.45Å; I80-Y102 HydrophobicContact CG1-CD1 4.35Å; I80-Y102 HydrophobicContact CG1-CE1 4.31Å; I80-Y102 HydrophobicContact CG2-CD1 4.35Å; I83-Y102 HydrophobicContact CD1-CD1 4.1Å; I83-Y102 HydrophobicContact CD1-CD2 3.81Å; I83-Y102 HydrophobicContact CD1-CE1 4.24Å; I83-Y102 HydrophobicContact CD1-CE2 3.96Å; I83-Y102 HydrophobicContact CD1-CG 3.87Å; D98-Y102 WeakPolarHBondContact O-CD2 3.35Å; D98-Y102 VanDerWaalsContact O-CE2 3.31Å; D98-Y102 WeakPolarHBondContact O-CE2 3.04Å; M99-Y102 PolarHBondContact O-N 3.14Å; M99-Y102 VanDerWaalsContact O-N 3.15Å; Y102-G104 PolarHBondContact O-N 2.98Å; Y102-G104 VanDerWaalsContact O-N 3.17Å; Y102-L105 WeakPolarHBondContact O-CB 3.5Å; Y102-L105 PolarHBondContact O-N 2.89Å; Y102-L105 VanDerWaalsContact O-N 3.08Å; Y102-N126 PolarHBondContact O-ND2 2.86Å
103	T	90.3	Very high	92.1	Very high	53 Å²	53	38.7 Å²	38.7	33%	0.325	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.6	-170.3	67.5	0	0	0	0	114.1	L101 K125 H128	L101-T103 PolarHBondContact O-N 2.88Å; T103-K125 WeakPolarHBondContact CA-O 3.45Å; T103-H128 PolarHBondContact O-CD2 2.89Å
104	G	89.7	Confident	92	Very high	14 Å²	14	36.9 Å²	36.9	14%	0.144	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	1.4	176.2	0	0	0	0	0	115.4	R78 I80 Y102 Q106	R78-G104 WeakPolarHBondContact O-CA 3.48Å; I80-G104 CarbonylContact O-C 3.3Å; Y102-G104 PolarHBondContact O-N 2.98Å; Y102-G104 VanDerWaalsContact O-N 3.17Å; G104-Q106 PolarHBondContact O-N 3.31Å
105	L	94.7	Very high	92	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.198	C	C	.	.			trans	-63.2	131.4	-173	-167.4	72.1	0	0	0	112.4	I80 I83 M99 Y102 K107 L108 H128 L129	I80-L105 HydrophobicContact CG2-CD1 4.31Å; I80-L105 WeakPolarHBondContact O-CA 3.46Å; I80-L105 PolarHBondContact O-N 2.84Å; I83-L105 HydrophobicContact CB-CD1 4.17Å; I83-L105 HydrophobicContact CD1-CD1 3.78Å; I83-L105 HydrophobicContact CD1-CD2 4.15Å; I83-L105 HydrophobicContact CG1-CD1 3.64Å; M99-L105 HydrophobicContact CE-CD2 3.44Å; M99-L105 VanDerWaalsContact CE-CD2 3.44Å; Y102-L105 WeakPolarHBondContact O-CB 3.5Å; Y102-L105 PolarHBondContact O-N 2.89Å; Y102-L105 VanDerWaalsContact O-N 3.08Å; L105-K107 WeakPolarHBondContact CD1-O 3.13Å; L105-L108 HydrophobicContact CD2-CB 4.24Å; L105-H128 CarbonylContact O-C 3.56Å; L105-L129 HydrophobicContact CD2-CD1 4.16Å; L105-L129 HydrophobicContact CG-CD1 4.2Å; L105-L129 WeakPolarHBondContact O-CA 3.47Å; L105-L129 PolarHBondContact O-N 2.93Å
106	Q	96.6	Very high	92.1	Very high	102 Å²	102	40.4 Å²	40.4	48%	0.477	21%	0.208	S	C	.	.			trans	-114.5	-27.5	-179.8	-59.1	-177.8	17.2	0	0	112.9	T81 G104 H128 R130 Y131	T81-Q106 WeakPolarHBondContact O-CA 3.31Å; T81-Q106 PolarHBondContact O-N 3.25Å; G104-Q106 PolarHBondContact O-N 3.31Å; Q106-H128 HydrophobicContact CG-CB 4.33Å; Q106-R130 PolarHBondContact O-N 3.43Å; Q106-Y131 PolarHBondContact O-N 2.96Å
107	K	97.7	Very high	92.4	Very high	98 Å²	98	41.4 Å²	41.4	43%	0.426	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	130.4	-178.8	-178.3	175.3	-179.2	-175.2	0	111.7	T81 S82 I83 L105 Y131	T81-K107 PolarHBondContact O-N 3.16Å; S82-K107 WeakPolarHBondContact CA-O 3.3Å; I83-K107 PolarHBondContact N-O 3.32Å; L105-K107 WeakPolarHBondContact CD1-O 3.13Å; K107-Y131 WeakPolarHBondContact CA-O 3.47Å
108	L	97.4	Very high	92.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	123.7	173.8	-179.8	63.6	0	0	0	110.1	I83 L94 M99 L105 I110 F123 L129 Y131 I132 N133	I83-L108 HydrophobicContact CB-CD1 3.96Å; I83-L108 HydrophobicContact CG2-CD1 3.97Å; I83-L108 CarbonylContact O-C 3.51Å; I83-L108 WeakPolarHBondContact O-CA 3.48Å; L94-L108 HydrophobicContact CD2-CD2 4.45Å; M99-L108 HydrophobicContact CE-CD2 3.94Å; M99-L108 HydrophobicContact SD-CD2 4.32Å; L105-L108 HydrophobicContact CD2-CB 4.24Å; L108-I110 HydrophobicContact CD1-CD1 4.27Å; L108-I110 HydrophobicContact CD1-CG1 4.04Å; L108-I110 HydrophobicContact CD2-CD1 4.33Å; L108-I110 HydrophobicContact CG-CD1 4.45Å; L108-I110 HydrophobicContact CG-CG1 4.23Å; L108-F123 HydrophobicContact CD2-CE1 3.59Å; L108-F123 HydrophobicContact CD2-CZ 4.08Å; L108-L129 HydrophobicContact CB-CD1 3.96Å; L108-Y131 PolarHBondContact N-O 3.02Å; L108-I132 CarbonylContact O-C 3.57Å; L108-I132 WeakPolarHBondContact O-CA 3.48Å; L108-N133 PolarHBondContact O-N 3.05Å
109	T	97.3	Very high	93	Very high	7 Å²	7	40.4 Å²	40.4	4%	0.043	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	126.5	166.8	-54	0	0	0	0	108.8	I83 H84 I85 K111 N133	I83-T109 PolarHBondContact O-N 3.46Å; H84-T109 WeakPolarHBondContact ND1-CB 2.96Å; H84-T109 PolarHBondContact ND1-OG1 2.73Å; I85-T109 PolarHBondContact N-O 3.3Å; T109-K111 HydrophobicContact CG2-CB 4.04Å; T109-N133 WeakPolarHBondContact CA-O 3.43Å; T109-N133 HydrophobicContact CG2-CB 4.04Å
110	I	95.4	Very high	93	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	99.4	165.6	-53.9	178.5	0	0	0	106.1	F54 I85 L91 L94 L108 L115 N133 L134 N137	F54-I110 HydrophobicContact CE2-CD1 4.13Å; I85-I110 HydrophobicContact CB-CG1 4.5Å; I85-I110 HydrophobicContact CD1-CG1 4.37Å; I85-I110 WeakPolarHBondContact O-CA 3.36Å; L91-I110 HydrophobicContact CD2-CG2 4.03Å; L94-I110 HydrophobicContact CD1-CD1 4.31Å; L94-I110 HydrophobicContact CD2-CD1 4.02Å; L108-I110 HydrophobicContact CD1-CD1 4.27Å; L108-I110 HydrophobicContact CD1-CG1 4.04Å; L108-I110 HydrophobicContact CD2-CD1 4.33Å; L108-I110 HydrophobicContact CG-CD1 4.45Å; L108-I110 HydrophobicContact CG-CG1 4.23Å; I110-L115 HydrophobicContact CG2-CD2 4.34Å; I110-N133 PolarHBondContact N-O 3.16Å; I110-L134 HydrophobicContact CB-CD2 4.13Å; I110-L134 WeakPolarHBondContact O-CA 3.17Å; I110-N137 PolarHBondContact O-ND2 2.87Å
111	K	94.4	Very high	93	Very high	62 Å²	62	50.9 Å²	50.9	27%	0.27	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.2	-172.1	178.1	167.6	-168.5	164	0	112.1	I85 E86 N87 T109 S113 S135 S136	I85-K111 PolarHBondContact O-N 3.3Å; E86-K111 VanDerWaalsContact CA-O 3.27Å; E86-K111 WeakPolarHBondContact CA-O 3.3Å; E86-K111 HydrophobicContact CG-CB 4.41Å; N87-K111 PolarHBondContact N-O 3.27Å; T109-K111 HydrophobicContact CG2-CB 4.04Å; K111-S113 PolarHBondContact O-N 2.83Å; K111-S113 VanDerWaalsContact O-N 3.15Å; K111-S113 PolarHBondContact O-OG 3.19Å; K111-S113 VanDerWaalsContact O-OG 3.07Å; K111-S135 WeakPolarHBondContact CA-O 3.32Å; K111-S135 WeakPolarHBondContact CD-OG 3.44Å; K111-S135 WeakPolarHBondContact CE-OG 3.47Å; K111-S135 WeakPolarHBondContact CG-O 3.21Å; K111-S135 PolarHBondContact NZ-OG 3.08Å; K111-S136 VanDerWaalsContact CE-OG 3.23Å; K111-S136 WeakPolarHBondContact CE-OG 3.18Å
112	N	92.9	Very high	93.4	Very high	62 Å²	62	47.6 Å²	47.6	33%	0.332	23%	0.234	S	C	.	.	S	Bend	trans	55.9	30.4	176.5	-161.9	31	0	0	0	113.7	N87 S135 S136	N87-N112 WeakPolarHBondContact CA-O 3.32Å; N87-N112 PolarHBondContact OD1-ND2 2.89Å; N112-S135 PolarHBondContact N-O 3.29Å; N112-S136 VanDerWaalsContact CA-O 3.26Å; N112-S136 WeakPolarHBondContact CA-O 3.49Å; N112-S136 PolarHBondContact N-O 2.86Å
113	S	90.3	Very high	93.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.233	C	C	.	.	S	Bend	trans	-112	11.6	-172.4	-61.1	0	0	0	0	112.8	W88 R89 K111 L115 N137	W88-S113 PolarHBondContact N-OG 2.85Å; W88-S113 CarbonylContact O-C 3.57Å; W88-S113 VanDerWaalsContact O-CA 3.29Å; W88-S113 WeakPolarHBondContact O-CA 3.15Å; W88-S113 WeakPolarHBondContact O-CB 3.38Å; R89-S113 CarbonylContact C-O 3.52Å; K111-S113 PolarHBondContact O-N 2.83Å; K111-S113 VanDerWaalsContact O-N 3.15Å; K111-S113 PolarHBondContact O-OG 3.19Å; K111-S113 VanDerWaalsContact O-OG 3.07Å; S113-L115 PolarHBondContact O-N 2.87Å; S113-L115 VanDerWaalsContact O-N 3.16Å; S113-N137 PolarHBondContact N-OD1 2.89Å
114	G	90.5	Very high	93.7	Very high	9 Å²	9	47.6 Å²	47.6	9%	0.093	24%	0.24	C	C	.	.			trans	69.2	12.7	174.6	0	0	0	0	0	115.2	R116 N137	G114-R116 WeakPolarHBondContact O-CG 3.49Å; G114-R116 PolarHBondContact O-N 3.1Å; G114-N137 PolarHBondContact N-OD1 3.35Å
115	L	94.8	Very high	93.8	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.256	C	S	.	.			trans	-55.6	127.5	-178.8	-170.8	71.9	0	0	0	111.3	L91 L94 I110 S113 I118 L134 N137 R138 L139	L91-L115 VanDerWaalsContact O-CA 3.24Å; L91-L115 WeakPolarHBondContact O-CA 3.39Å; L91-L115 WeakPolarHBondContact O-CD1 3.46Å; L91-L115 PolarHBondContact O-N 2.79Å; L94-L115 HydrophobicContact CB-CD1 4.18Å; I110-L115 HydrophobicContact CG2-CD2 4.34Å; S113-L115 PolarHBondContact O-N 2.87Å; S113-L115 VanDerWaalsContact O-N 3.16Å; L115-I118 HydrophobicContact CD2-CD1 4.03Å; L115-I118 HydrophobicContact CD2-CG1 4.01Å; L115-L134 HydrophobicContact CD2-CD2 4Å; L115-N137 HydrophobicContact CB-CB 3.99Å; L115-N137 PolarHBondContact N-OD1 3.24Å; L115-R138 CarbonylContact O-C 3.37Å; L115-R138 VanDerWaalsContact O-CA 3.32Å; L115-R138 WeakPolarHBondContact O-CA 3.29Å; L115-R138 PolarHBondContact O-N 3.1Å; L115-L139 HydrophobicContact CD2-CD2 4.33Å; L115-L139 HydrophobicContact CG-CD2 4.16Å; L115-L139 PolarHBondContact O-N 2.03Å; L115-L139 VanDerWaalsContact O-N 3.16Å
116	R	94.5	Very high	93.8	Very high	128 Å²	128	52.3 Å²	52.3	48%	0.483	26%	0.256	S	S	.	.			trans	-114	-30.2	-176.9	-64.3	176.6	-175.3	-110.7	10.3	113.1	H92 G114 R138	H92-R116 PolarHBondContact CD2-NE 3.07Å; H92-R116 VanDerWaalsContact CD2-NE 3.27Å; H92-R116 PolarHBondContact O-N 3.24Å; G114-R116 WeakPolarHBondContact O-CG 3.49Å; G114-R116 PolarHBondContact O-N 3.1Å; R116-R138 HydrophobicContact CG-CB 4Å
117	S	94.3	Very high	93.7	Very high	52 Å²	52	50.8 Å²	50.8	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	154.5	-178.6	68.4	0	0	0	0	112.4	H92 T93 L94	H92-S117 PolarHBondContact O-N 3.22Å; T93-S117 WeakPolarHBondContact CA-O 3.05Å; T93-S117 WeakPolarHBondContact CG2-OG 3.32Å; T93-S117 PolarHBondContact OG1-OG 3.33Å; L94-S117 PolarHBondContact N-O 3.18Å; L94-S117 VanDerWaalsContact N-O 3.12Å
118	I	95.8	Very high	93.5	Very high	21 Å²	21	51 Å²	51	11%	0.108	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	128.1	172	-59	-176.1	0	0	0	106.1	L94 L115 A122 F123 L134 L142 L146	L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.31Å; L94-I118 HydrophobicContact CD2-CG2 4.23Å; L115-I118 HydrophobicContact CD2-CD1 4.03Å; L115-I118 HydrophobicContact CD2-CG1 4.01Å; I118-A122 HydrophobicContact CG2-CB 3.64Å; I118-F123 HydrophobicContact CD1-CZ 4.31Å; I118-F123 HydrophobicContact CG2-CE2 4.47Å; I118-F123 HydrophobicContact CG2-CZ 4.33Å; I118-L134 HydrophobicContact CD1-CD1 3.63Å; I118-L134 HydrophobicContact CD1-CD2 4.24Å; I118-L142 HydrophobicContact CD1-CD1 4.05Å; I118-L142 HydrophobicContact CG1-CD1 4.45Å; I118-L146 HydrophobicContact CB-CD1 4.01Å; I118-L146 HydrophobicContact CG2-CD1 3.99Å; I118-L146 HydrophobicContact CG2-CD2 4.01Å
119	Q	93.5	Very high	93.5	Very high	77 Å²	77	51 Å²	51	36%	0.36	26%	0.257	S	S	.	.			trans	-64.9	146.6	-178.8	-74.9	-173	-14.7	0	0	111.5	T93 L94 N95 A122 L146	T93-Q119 HydrophobicContact CG2-CG 4.36Å; L94-Q119 PolarHBondContact O-N 3.18Å; N95-Q119 VanDerWaalsContact CA-OE1 3.29Å; N95-Q119 PolarHBondContact OD1-NE2 3.07Å; Q119-A122 VanDerWaalsContact O-CB 3.24Å; Q119-A122 WeakPolarHBondContact O-CB 2.98Å; Q119-A122 PolarHBondContact O-N 2.76Å; Q119-L146 VanDerWaalsContact O-CD2 3.23Å; Q119-L146 WeakPolarHBondContact O-CD2 3.15Å
120	P	89.9	Confident	93.5	Very high	108 Å²	108	54.5 Å²	54.5	70%	0.701	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	143.1	170.3	-26.1	34.8	0	0	0	111.6	A122	P120-A122 PolarHBondContact O-N 3.43Å
121	R	88	Confident	93.6	Very high	204 Å²	204	58.5 Å²	58.5	77%	0.77	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	13.4	-178.3	-53.6	178.3	177.9	166.8	-0.5	115.6	F123 A124	R121-F123 PolarHBondContact O-N 3.01Å; R121-A124 HydrophobicContact CB-CB 3.9Å; R121-A124 WeakPolarHBondContact O-CB 3.39Å; R121-A124 PolarHBondContact O-N 3.31Å
122	A	93.4	Very high	93.8	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.008	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.8	-179.5	0	0	0	0	0	114.8	M99 I118 Q119 P120 N126	M99-A122 WeakPolarHBondContact CB-O 3.45Å; M99-A122 WeakPolarHBondContact CG-O 3.3Å; I118-A122 HydrophobicContact CG2-CB 3.64Å; Q119-A122 VanDerWaalsContact O-CB 3.24Å; Q119-A122 WeakPolarHBondContact O-CB 2.98Å; Q119-A122 PolarHBondContact O-N 2.76Å; P120-A122 PolarHBondContact O-N 3.43Å; A122-N126 PolarHBondContact O-OD1 2.95Å
123	F	95.5	Very high	94	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	7.2	176.6	-50.4	-49.3	0	0	0	114.5	L94 M99 L108 I118 R121 K125 N126 L129 I132 L146 F147 L150	L94-F123 HydrophobicContact CD2-CE1 3.75Å; L94-F123 HydrophobicContact CD2-CZ 3.96Å; M99-F123 HydrophobicContact CE-CD1 4.14Å; M99-F123 HydrophobicContact CE-CE1 4.19Å; M99-F123 HydrophobicContact CG-CD1 4.42Å; M99-F123 HydrophobicContact CG-CE1 4.42Å; L108-F123 HydrophobicContact CD2-CE1 3.59Å; L108-F123 HydrophobicContact CD2-CZ 4.08Å; I118-F123 HydrophobicContact CD1-CZ 4.31Å; I118-F123 HydrophobicContact CG2-CE2 4.47Å; I118-F123 HydrophobicContact CG2-CZ 4.33Å; R121-F123 PolarHBondContact O-N 3.01Å; F123-K125 PolarHBondContact O-N 3.28Å; F123-K125 VanDerWaalsContact O-N 3.11Å; F123-N126 WeakPolarHBondContact CA-OD1 3.2Å; F123-N126 PolarHBondContact O-N 3.34Å; F123-L129 HydrophobicContact CB-CD2 4.36Å; F123-L129 HydrophobicContact CD1-CD2 3.85Å; F123-L129 HydrophobicContact CE1-CD2 4.36Å; F123-L129 HydrophobicContact CG-CD2 4.07Å; F123-I132 HydrophobicContact CD2-CD1 4.31Å; F123-I132 HydrophobicContact CE2-CD1 4.19Å; F123-L146 HydrophobicContact CD2-CB 4.28Å; F123-L146 WeakPolarHBondContact CD2-O 3.32Å; F123-L146 HydrophobicContact CE2-CB 4.46Å; F123-F147 HydrophobicContact CD2-CD1 4.23Å; F123-F147 HydrophobicContact CD2-CE1 4.04Å; F123-F147 HydrophobicContact CE2-CD1 4.38Å; F123-F147 AromaticContact CE2-CE1 3.73Å; F123-F147 HydrophobicContact CE2-CE1 3.73Å; F123-L150 HydrophobicContact CB-CD1 3.88Å; F123-L150 HydrophobicContact CD2-CD1 4.36Å; F123-L150 HydrophobicContact CG-CD1 4.35Å
124	A	90.4	Very high	94.4	Very high	55 Å²	55	53.9 Å²	53.9	46%	0.455	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-17.6	-173.5	0	0	0	0	0	114.1	R121	R121-A124 HydrophobicContact CB-CB 3.9Å; R121-A124 WeakPolarHBondContact O-CB 3.39Å; R121-A124 PolarHBondContact O-N 3.31Å
125	K	92.1	Very high	94.7	Very high	113 Å²	113	53.6 Å²	53.6	49%	0.491	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	3.3	176.5	-62.6	-66.8	-170.7	175.7	0	113.4	E100 T103 F123 P127	E100-K125 HydrophobicContact CB-CG 4.44Å; E100-K125 HydrophobicContact CG-CG 4.13Å; E100-K125 WeakPolarHBondContact OE1-CE 3.07Å; T103-K125 WeakPolarHBondContact CA-O 3.45Å; F123-K125 PolarHBondContact O-N 3.28Å; F123-K125 VanDerWaalsContact O-N 3.11Å; K125-P127 WeakPolarHBondContact O-CD 3.5Å
126	N	94.6	Very high	94.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.267	C	S	.	.			trans	-118.5	58.1	-173.8	-42.5	95.3	0	0	0	111.7	M99 Y102 A122 F123 H128 L129 L150	M99-N126 PolarHBondContact O-ND2 2.04Å; Y102-N126 PolarHBondContact O-ND2 2.86Å; A122-N126 PolarHBondContact O-OD1 2.95Å; F123-N126 WeakPolarHBondContact CA-OD1 3.2Å; F123-N126 PolarHBondContact O-N 3.34Å; N126-H128 PolarHBondContact O-N 3.08Å; N126-L129 HydrophobicContact CB-CB 4.26Å; N126-L129 HydrophobicContact CB-CD2 4.48Å; N126-L129 VanDerWaalsContact O-CB 3.25Å; N126-L129 WeakPolarHBondContact O-CB 3.09Å; N126-L129 PolarHBondContact O-N 2.77Å; N126-L150 VanDerWaalsContact O-CD2 3.32Å; N126-L150 WeakPolarHBondContact O-CD2 3.21Å
127	P	93.9	Very high	94.8	Very high	69 Å²	69	48.6 Å²	48.6	45%	0.448	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.9	-171.9	29.8	-38	0	0	0	114.2	K125	K125-P127 WeakPolarHBondContact O-CD 3.5Å
128	H	95.3	Very high	94.8	Very high	104 Å²	104	52.7 Å²	52.7	48%	0.481	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.9	177.5	-60.1	-58.9	0	0	0	113.8	T103 L105 Q106 N126 R130	T103-H128 PolarHBondContact O-CD2 2.89Å; L105-H128 CarbonylContact O-C 3.56Å; Q106-H128 HydrophobicContact CG-CB 4.33Å; N126-H128 PolarHBondContact O-N 3.08Å; H128-R130 WeakPolarHBondContact O-CG 3.23Å; H128-R130 PolarHBondContact O-N 2.75Å
129	L	96.9	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.247	C	C	.	.			trans	-68.3	118.7	-176.1	-171.4	56.8	0	0	0	111	L105 L108 F123 N126 I132 L150	L105-L129 HydrophobicContact CD2-CD1 4.16Å; L105-L129 HydrophobicContact CG-CD1 4.2Å; L105-L129 WeakPolarHBondContact O-CA 3.47Å; L105-L129 PolarHBondContact O-N 2.93Å; L108-L129 HydrophobicContact CB-CD1 3.96Å; F123-L129 HydrophobicContact CB-CD2 4.36Å; F123-L129 HydrophobicContact CD1-CD2 3.85Å; F123-L129 HydrophobicContact CE1-CD2 4.36Å; F123-L129 HydrophobicContact CG-CD2 4.07Å; N126-L129 HydrophobicContact CB-CB 4.26Å; N126-L129 HydrophobicContact CB-CD2 4.48Å; N126-L129 VanDerWaalsContact O-CB 3.25Å; N126-L129 WeakPolarHBondContact O-CB 3.09Å; N126-L129 PolarHBondContact O-N 2.77Å; L129-I132 HydrophobicContact CD1-CG1 4.18Å; L129-I132 HydrophobicContact CD2-CD1 3.62Å; L129-I132 HydrophobicContact CD2-CG1 3.86Å; L129-I132 HydrophobicContact CG-CD1 3.95Å; L129-I132 HydrophobicContact CG-CG1 3.82Å; L129-L150 HydrophobicContact CB-CD1 4.24Å; L129-L150 HydrophobicContact CB-CD2 4.23Å; L129-L150 HydrophobicContact CD2-CD1 4.11Å; L129-L150 HydrophobicContact CG-CD1 4.36Å
130	R	97.1	Very high	94.9	Very high	80 Å²	80	51 Å²	51	30%	0.302	25%	0.248	S	C	.	.			trans	-117.9	-26	-175.9	-59.7	-53.2	172.9	153.5	-12.9	114.4	Q106 H128 S151 R153 E154	Q106-R130 PolarHBondContact O-N 3.43Å; H128-R130 WeakPolarHBondContact O-CG 3.23Å; H128-R130 PolarHBondContact O-N 2.75Å; R130-S151 WeakPolarHBondContact CD-O 3.37Å; R130-S151 PolarHBondContact NH1-O 2.69Å; R130-S151 PolarHBondContact NH1-OG 3.03Å; R130-S151 PolarHBondContact NH2-OG 3.48Å; R130-R153 HydrophobicContact CB-CG 4.44Å; R130-R153 PolarHBondContact O-N 2.83Å; R130-E154 PolarHBondContact O-N 3.32Å
131	Y	98.1	Very high	95.2	Very high	84 Å²	84	48.8 Å²	48.8	33%	0.329	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.2	-174.1	-61.5	-87.8	0	0	0	108.8	Q106 K107 L108 R153 E154	Q106-Y131 PolarHBondContact O-N 2.96Å; K107-Y131 WeakPolarHBondContact CA-O 3.47Å; L108-Y131 PolarHBondContact N-O 3.02Å; Y131-R153 HydrophobicContact CE1-CB 3.94Å; Y131-R153 VanDerWaalsContact OH-CD 3.24Å; Y131-R153 WeakPolarHBondContact OH-CD 3.46Å; Y131-R153 PolarHBondContact OH-NH1 2.97Å; Y131-E154 HydrophobicContact CD1-CB 3.78Å; Y131-E154 HydrophobicContact CE1-CB 4.26Å
132	I	98.1	Very high	95.5	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	129.2	178.8	-62.9	179.2	0	0	0	108.7	L108 F123 L129 L134 F147 L150 L152 E154 L155 Q156	L108-I132 CarbonylContact O-C 3.57Å; L108-I132 WeakPolarHBondContact O-CA 3.48Å; F123-I132 HydrophobicContact CD2-CD1 4.31Å; F123-I132 HydrophobicContact CE2-CD1 4.19Å; L129-I132 HydrophobicContact CD1-CG1 4.18Å; L129-I132 HydrophobicContact CD2-CD1 3.62Å; L129-I132 HydrophobicContact CD2-CG1 3.86Å; L129-I132 HydrophobicContact CG-CD1 3.95Å; L129-I132 HydrophobicContact CG-CG1 3.82Å; I132-L134 HydrophobicContact CG2-CD1 4.02Å; I132-L134 HydrophobicContact CG2-CD2 4.33Å; I132-L134 HydrophobicContact CG2-CG 3.79Å; I132-F147 HydrophobicContact CD1-CD1 3.97Å; I132-F147 HydrophobicContact CD1-CE1 3.73Å; I132-L150 HydrophobicContact CD1-CD1 4.04Å; I132-L152 HydrophobicContact CD1-CD1 4.24Å; I132-L152 HydrophobicContact CD1-CD2 3.72Å; I132-L152 HydrophobicContact CG1-CD2 3.94Å; I132-E154 PolarHBondContact N-O 3.11Å; I132-L155 HydrophobicContact CB-CD1 3.76Å; I132-L155 HydrophobicContact CG2-CD1 3.63Å; I132-L155 CarbonylContact O-C 3.57Å; I132-L155 WeakPolarHBondContact O-CA 3.48Å; I132-Q156 PolarHBondContact O-N 2.94Å
133	N	97.8	Very high	95.5	Very high	24 Å²	24	41.5 Å²	41.5	13%	0.128	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	111.9	174.4	-174.2	-17.5	0	0	0	110	L108 T109 I110 S135 Q156	L108-N133 PolarHBondContact O-N 3.05Å; T109-N133 WeakPolarHBondContact CA-O 3.43Å; T109-N133 HydrophobicContact CG2-CB 4.04Å; I110-N133 PolarHBondContact N-O 3.16Å; N133-S135 WeakPolarHBondContact OD1-CB 3.03Å; N133-S135 PolarHBondContact OD1-N 2.88Å; N133-S135 PolarHBondContact OD1-OG 3.24Å; N133-Q156 HydrophobicContact CB-CB 4.18Å; N133-Q156 PolarHBondContact ND2-OE1 3.48Å
134	L	97.2	Very high	95.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.			trans	-117.8	21.2	178.3	-57.3	172.1	0	0	0	111.3	I110 L115 I118 I132 N137 L139 L142 Q156 L157 N160	I110-L134 HydrophobicContact CB-CD2 4.13Å; I110-L134 WeakPolarHBondContact O-CA 3.17Å; L115-L134 HydrophobicContact CD2-CD2 4Å; I118-L134 HydrophobicContact CD1-CD1 3.63Å; I118-L134 HydrophobicContact CD1-CD2 4.24Å; I132-L134 HydrophobicContact CG2-CD1 4.02Å; I132-L134 HydrophobicContact CG2-CD2 4.33Å; I132-L134 HydrophobicContact CG2-CG 3.79Å; L134-N137 VanDerWaalsContact C-ND2 3.3Å; L134-N137 PolarHBondContact O-ND2 3.15Å; L134-L139 HydrophobicContact CB-CD1 4.08Å; L134-L139 HydrophobicContact CD1-CD1 4.24Å; L134-L142 HydrophobicContact CD1-CD2 4.45Å; L134-Q156 PolarHBondContact N-O 2.86Å; L134-L157 HydrophobicContact CB-CD2 4.17Å; L134-L157 HydrophobicContact CD1-CD2 4.3Å; L134-N160 PolarHBondContact O-ND2 2.85Å
135	S	96.7	Very high	95.5	Very high	3 Å²	3	43.8 Å²	43.8	2%	0.021	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	157.1	-177.4	60.8	0	0	0	0	113.3	K111 N112 N133 N137 Q156 E158	K111-S135 WeakPolarHBondContact CA-O 3.32Å; K111-S135 WeakPolarHBondContact CD-OG 3.44Å; K111-S135 WeakPolarHBondContact CE-OG 3.47Å; K111-S135 WeakPolarHBondContact CG-O 3.21Å; K111-S135 PolarHBondContact NZ-OG 3.08Å; N112-S135 PolarHBondContact N-O 3.29Å; N133-S135 WeakPolarHBondContact OD1-CB 3.03Å; N133-S135 PolarHBondContact OD1-N 2.88Å; N133-S135 PolarHBondContact OD1-OG 3.24Å; S135-N137 VanDerWaalsContact C-N 3.3Å; S135-N137 PolarHBondContact O-N 2.87Å; S135-N137 PolarHBondContact O-ND2 3.44Å; S135-N137 VanDerWaalsContact O-ND2 3.17Å; S135-Q156 PolarHBondContact N-O 3.45Å; S135-E158 CarbonylContact C-O 3.58Å; S135-E158 WeakPolarHBondContact CA-O 3.23Å; S135-E158 VanDerWaalsContact CB-O 3.29Å; S135-E158 WeakPolarHBondContact CB-O 3.26Å
136	S	95.9	Very high	95.6	Very high	20 Å²	20	38.9 Å²	38.9	14%	0.14	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	33.7	175.3	-43.7	0	0	0	0	114.4	K111 N112 E158 Q159	K111-S136 VanDerWaalsContact CE-OG 3.23Å; K111-S136 WeakPolarHBondContact CE-OG 3.18Å; N112-S136 VanDerWaalsContact CA-O 3.26Å; N112-S136 WeakPolarHBondContact CA-O 3.49Å; N112-S136 PolarHBondContact N-O 2.86Å; S136-E158 PolarHBondContact N-O 3.48Å; S136-Q159 WeakPolarHBondContact CA-O 3.47Å; S136-Q159 PolarHBondContact OG-OE1 3.17Å
137	N	96.1	Very high	95.6	Very high	3 Å²	3	39 Å²	39	2%	0.016	19%	0.192	C	C	.	.	S	Bend	trans	-107	-157.7	176.8	-72.4	-63.4	0	0	0	111.7	I110 S113 G114 L115 L134 S135 N160	I110-N137 PolarHBondContact O-ND2 2.87Å; S113-N137 PolarHBondContact N-OD1 2.89Å; G114-N137 PolarHBondContact N-OD1 3.35Å; L115-N137 HydrophobicContact CB-CB 3.99Å; L115-N137 PolarHBondContact N-OD1 3.24Å; L134-N137 VanDerWaalsContact C-ND2 3.3Å; L134-N137 PolarHBondContact O-ND2 3.15Å; S135-N137 VanDerWaalsContact C-N 3.3Å; S135-N137 PolarHBondContact O-N 2.87Å; S135-N137 PolarHBondContact O-ND2 3.44Å; S135-N137 VanDerWaalsContact O-ND2 3.17Å; N137-N160 WeakPolarHBondContact CA-OD1 3.38Å; N137-N160 VanDerWaalsContact CB-OD1 3.29Å; N137-N160 WeakPolarHBondContact CB-OD1 3.41Å; N137-N160 PolarHBondContact N-OD1 2.8Å
138	R	95.3	Very high	95.3	Very high	138 Å²	138	40.8 Å²	40.8	52%	0.521	19%	0.194	S	C	.	.			trans	-124.6	32	-178.3	-63.7	-174.1	178.2	-151.1	0.9	111.4	L115 R116 T140 N160	L115-R138 CarbonylContact O-C 3.37Å; L115-R138 VanDerWaalsContact O-CA 3.32Å; L115-R138 WeakPolarHBondContact O-CA 3.29Å; L115-R138 PolarHBondContact O-N 3.1Å; R116-R138 HydrophobicContact CG-CB 4Å; R138-T140 PolarHBondContact O-N 3.1Å; R138-N160 PolarHBondContact N-OD1 2.7Å
139	L	96.2	Very high	94.9	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	20%	0.197	C	C	.	.			trans	-67.9	126.1	174.2	-59.4	173.6	0	0	0	108.9	L115 L134 N160 F161 F162	L115-L139 HydrophobicContact CD2-CD2 4.33Å; L115-L139 HydrophobicContact CG-CD2 4.16Å; L115-L139 PolarHBondContact O-N 2.03Å; L115-L139 VanDerWaalsContact O-N 3.16Å; L134-L139 HydrophobicContact CB-CD1 4.08Å; L134-L139 HydrophobicContact CD1-CD1 4.24Å; L139-N160 HydrophobicContact CB-CB 4.28Å; L139-N160 WeakPolarHBondContact CB-OD1 3.45Å; L139-N160 PolarHBondContact N-OD1 3.26Å; L139-N160 VanDerWaalsContact N-OD1 3.13Å; L139-F161 CarbonylContact O-C 3.58Å; L139-F161 PolarHBondContact O-N 2.98Å; L139-F162 HydrophobicContact CB-CE1 3.79Å; L139-F162 HydrophobicContact CB-CZ 4.37Å
140	T	94.9	Very high	94.7	Very high	62 Å²	62	40.8 Å²	40.8	38%	0.38	20%	0.201	S	C	.	.	S	Bend	trans	-103.1	-19.5	175.6	52.7	0	0	0	0	112.5	R138 F161 F162 N163	R138-T140 PolarHBondContact O-N 3.1Å; T140-F161 WeakPolarHBondContact CA-O 3.08Å; T140-F162 CarbonylContact O-C 3.54Å; T140-F162 WeakPolarHBondContact O-CA 3.2Å; T140-N163 PolarHBondContact O-N 3.24Å
141	T	95.1	Very high	94.5	Very high	62 Å²	62	40.3 Å²	40.3	38%	0.38	21%	0.21	S	C	.	.			trans	-155.1	165.3	172.2	-174.4	0	0	0	0	109.1	D167	T141-D167 VanDerWaalsContact OG1-CB 3.3Å; T141-D167 WeakPolarHBondContact OG1-CB 3.48Å
142	L	94.9	Very high	94.4	Very high	7 Å²	7	37.5 Å²	37.5	4%	0.037	20%	0.201	C	C	.	.			trans	-161	127.4	178.8	-172.2	68.3	0	0	0	108.3	I118 L134 L146 F147 L157 F162 W170 M171	I118-L142 HydrophobicContact CD1-CD1 4.05Å; I118-L142 HydrophobicContact CG1-CD1 4.45Å; L134-L142 HydrophobicContact CD1-CD2 4.45Å; L142-L146 HydrophobicContact CD1-CD1 3.45Å; L142-L146 VanDerWaalsContact CD1-CD1 3.45Å; L142-L146 HydrophobicContact CG-CD1 4.17Å; L142-F147 HydrophobicContact CD2-CE2 3.88Å; L142-F147 HydrophobicContact CD2-CZ 3.89Å; L142-F147 HydrophobicContact CG-CE2 4.18Å; L142-F147 HydrophobicContact CG-CZ 4.35Å; L142-L157 HydrophobicContact CD2-CD1 4.39Å; L142-L157 HydrophobicContact CD2-CD2 3.88Å; L142-F162 HydrophobicContact CB-CE1 4.44Å; L142-W170 HydrophobicContact CB-CZ2 4.29Å; L142-W170 HydrophobicContact CD2-CH2 4.41Å; L142-W170 HydrophobicContact CD2-CZ2 4.18Å; L142-W170 HydrophobicContact CG-CZ2 4.24Å; L142-W170 WeakPolarHBondContact O-CZ2 3.44Å; L142-W170 PolarHBondContact O-NE1 3.39Å; L142-M171 HydrophobicContact CB-CE 3.6Å; L142-M171 HydrophobicContact CD2-CE 4.22Å; L142-M171 HydrophobicContact CG-CE 4.48Å
143	S	94.2	Very high	94.3	Very high	44 Å²	44	44.9 Å²	44.9	31%	0.308	23%	0.228	S	C	.	.			trans	-82.2	138.3	178.4	174.6	0	0	0	0	111.7	Q145 L146	S143-Q145 PolarHBondContact O-N 3.35Å; S143-Q145 WeakPolarHBondContact OG-CB 3.46Å; S143-Q145 PolarHBondContact OG-N 2.84Å; S143-Q145 PolarHBondContact OG-OE1 2.8Å; S143-L146 WeakPolarHBondContact O-CB 3.45Å; S143-L146 PolarHBondContact O-N 2.76Å
144	W	93.6	Very high	94.3	Very high	19 Å²	19	45.8 Å²	45.8	7%	0.072	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-62.8	-26.1	172.8	67.8	-94.8	0	0	0	112.8	L146 F147 Q148 W170 E287 N288 M292	W144-L146 PolarHBondContact O-N 3.17Å; W144-L146 VanDerWaalsContact O-N 3.08Å; W144-F147 PolarHBondContact O-N 3.04Å; W144-Q148 HydrophobicContact CE3-CB 4.09Å; W144-Q148 HydrophobicContact CZ3-CB 3.67Å; W144-Q148 PolarHBondContact O-N 3.4Å; W144-W170 HydrophobicContact CB-CB 4.08Å; W144-W170 HydrophobicContact CB-CD2 3.64Å; W144-W170 HydrophobicContact CB-CE3 4.05Å; W144-W170 HydrophobicContact CB-CG 3.67Å; W144-W170 HydrophobicContact CG-CB 4.41Å; W144-W170 HydrophobicContact CG-CG 4.32Å; W144-E287 HydrophobicContact CH2-CB 4.37Å; W144-E287 HydrophobicContact CZ2-CB 4.11Å; W144-N288 PolarHBondContact NE1-O 3.46Å; W144-M292 HydrophobicContact CH2-CB 3.72Å; W144-M292 HydrophobicContact CH2-CE 4.35Å; W144-M292 HydrophobicContact CZ2-CB 4.23Å; W144-M292 HydrophobicContact CZ3-CB 4.37Å
145	Q	92.1	Very high	94.3	Very high	85 Å²	85	45.8 Å²	45.8	40%	0.397	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-60.4	-20.8	179.2	-65.9	168.6	-44.5	0	0	112.8	S143 F147 Q148 E287	S143-Q145 PolarHBondContact O-N 3.35Å; S143-Q145 WeakPolarHBondContact OG-CB 3.46Å; S143-Q145 PolarHBondContact OG-N 2.84Å; S143-Q145 PolarHBondContact OG-OE1 2.8Å; Q145-F147 PolarHBondContact O-N 2.82Å; Q145-Q148 WeakPolarHBondContact O-CG 3.43Å; Q145-E287 PolarHBondContact NE2-OE1 2.85Å
146	L	93.8	Very high	94.3	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-61.4	-26.3	171.2	-67.7	172.2	0	0	0	112.6	I118 Q119 F123 L142 S143 W144	I118-L146 HydrophobicContact CB-CD1 4.01Å; I118-L146 HydrophobicContact CG2-CD1 3.99Å; I118-L146 HydrophobicContact CG2-CD2 4.01Å; Q119-L146 VanDerWaalsContact O-CD2 3.23Å; Q119-L146 WeakPolarHBondContact O-CD2 3.15Å; F123-L146 HydrophobicContact CD2-CB 4.28Å; F123-L146 WeakPolarHBondContact CD2-O 3.32Å; F123-L146 HydrophobicContact CE2-CB 4.46Å; L142-L146 HydrophobicContact CD1-CD1 3.45Å; L142-L146 VanDerWaalsContact CD1-CD1 3.45Å; L142-L146 HydrophobicContact CG-CD1 4.17Å; S143-L146 WeakPolarHBondContact O-CB 3.45Å; S143-L146 PolarHBondContact O-N 2.76Å; W144-L146 PolarHBondContact O-N 3.17Å; W144-L146 VanDerWaalsContact O-N 3.08Å
147	F	94.4	Very high	94.4	Very high	3 Å²	3	47.5 Å²	47.5	1%	0.013	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-5.1	-173.1	-49	-59.6	0	0	0	113.3	F123 I132 L142 W144 Q145 T149 L150 L152 L155 W170 W174	F123-F147 HydrophobicContact CD2-CD1 4.23Å; F123-F147 HydrophobicContact CD2-CE1 4.04Å; F123-F147 HydrophobicContact CE2-CD1 4.38Å; F123-F147 AromaticContact CE2-CE1 3.73Å; F123-F147 HydrophobicContact CE2-CE1 3.73Å; I132-F147 HydrophobicContact CD1-CD1 3.97Å; I132-F147 HydrophobicContact CD1-CE1 3.73Å; L142-F147 HydrophobicContact CD2-CE2 3.88Å; L142-F147 HydrophobicContact CD2-CZ 3.89Å; L142-F147 HydrophobicContact CG-CE2 4.18Å; L142-F147 HydrophobicContact CG-CZ 4.35Å; W144-F147 PolarHBondContact O-N 3.04Å; Q145-F147 PolarHBondContact O-N 2.82Å; F147-T149 PolarHBondContact O-N 3.47Å; F147-T149 VanDerWaalsContact O-N 3.11Å; F147-L150 HydrophobicContact CD1-CD1 4.33Å; F147-L150 WeakPolarHBondContact O-CA 3.43Å; F147-L150 WeakPolarHBondContact O-CB 3.23Å; F147-L150 PolarHBondContact O-N 2.93Å; F147-L152 HydrophobicContact CB-CD1 4.06Å; F147-L152 HydrophobicContact CD1-CD1 3.72Å; F147-L152 HydrophobicContact CE1-CD1 4.41Å; F147-L152 HydrophobicContact CG-CD1 3.97Å; F147-L155 HydrophobicContact CD2-CD2 4.24Å; F147-L155 HydrophobicContact CE1-CD1 4.21Å; F147-L155 HydrophobicContact CE2-CD2 3.91Å; F147-L155 HydrophobicContact CZ-CD1 4.08Å; F147-L155 HydrophobicContact CZ-CD2 4.06Å; F147-W170 AromaticContact CD2-CH2 3.95Å; F147-W170 HydrophobicContact CD2-CH2 3.95Å; F147-W170 HydrophobicContact CD2-CZ3 4.41Å; F147-W170 AromaticContact CE2-CH2 3.66Å; F147-W170 HydrophobicContact CE2-CH2 3.66Å; F147-W170 HydrophobicContact CE2-CZ2 4.13Å; F147-W174 HydrophobicContact CB-CH2 4.06Å
148	Q	87.8	Confident	94.3	Very high	106 Å²	106	50.4 Å²	50.4	50%	0.495	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-28.6	-171.8	75.4	-169.4	16.2	0	0	114.8	W144 Q145	W144-Q148 HydrophobicContact CE3-CB 4.09Å; W144-Q148 HydrophobicContact CZ3-CB 3.67Å; W144-Q148 PolarHBondContact O-N 3.4Å; Q145-Q148 WeakPolarHBondContact O-CG 3.43Å
149	T	86.6	Confident	94.3	Very high	86 Å²	86	50.1 Å²	50.1	53%	0.528	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-1.3	177.2	57.3	0	0	0	0	113.4	F147	F147-T149 PolarHBondContact O-N 3.47Å; F147-T149 VanDerWaalsContact O-N 3.11Å
150	L	93.4	Very high	94.2	Very high	19 Å²	19	50.9 Å²	50.9	10%	0.099	26%	0.259	C	S	.	.			trans	-109.9	133.7	-173.6	-54	-176.3	0	0	0	110.8	F123 N126 L129 I132 F147 L152	F123-L150 HydrophobicContact CB-CD1 3.88Å; F123-L150 HydrophobicContact CD2-CD1 4.36Å; F123-L150 HydrophobicContact CG-CD1 4.35Å; N126-L150 VanDerWaalsContact O-CD2 3.32Å; N126-L150 WeakPolarHBondContact O-CD2 3.21Å; L129-L150 HydrophobicContact CB-CD1 4.24Å; L129-L150 HydrophobicContact CB-CD2 4.23Å; L129-L150 HydrophobicContact CD2-CD1 4.11Å; L129-L150 HydrophobicContact CG-CD1 4.36Å; I132-L150 HydrophobicContact CD1-CD1 4.04Å; F147-L150 HydrophobicContact CD1-CD1 4.33Å; F147-L150 WeakPolarHBondContact O-CA 3.43Å; F147-L150 WeakPolarHBondContact O-CB 3.23Å; F147-L150 PolarHBondContact O-N 2.93Å; L150-L152 HydrophobicContact CB-CD2 4.1Å; L150-L152 HydrophobicContact CB-CG 4.04Å; L150-L152 HydrophobicContact CD1-CD2 4.06Å; L150-L152 PolarHBondContact O-N 3.28Å
151	S	92.4	Very high	94.1	Very high	70 Å²	70	53.7 Å²	53.7	49%	0.49	27%	0.267	S	S	.	.			trans	-97.1	75.6	169.2	25.1	0	0	0	0	109.6	R130	R130-S151 WeakPolarHBondContact CD-O 3.37Å; R130-S151 PolarHBondContact NH1-O 2.69Å; R130-S151 PolarHBondContact NH1-OG 3.03Å; R130-S151 PolarHBondContact NH2-OG 3.48Å
152	L	95.8	Very high	94.1	Very high	24 Å²	24	51 Å²	51	13%	0.126	25%	0.249	C	C	.	.			trans	-63.9	142	-177.2	-65.6	178.3	0	0	0	112.1	I132 F147 L150 L155 A180	I132-L152 HydrophobicContact CD1-CD1 4.24Å; I132-L152 HydrophobicContact CD1-CD2 3.72Å; I132-L152 HydrophobicContact CG1-CD2 3.94Å; F147-L152 HydrophobicContact CB-CD1 4.06Å; F147-L152 HydrophobicContact CD1-CD1 3.72Å; F147-L152 HydrophobicContact CE1-CD1 4.41Å; F147-L152 HydrophobicContact CG-CD1 3.97Å; L150-L152 HydrophobicContact CB-CD2 4.1Å; L150-L152 HydrophobicContact CB-CG 4.04Å; L150-L152 HydrophobicContact CD1-CD2 4.06Å; L150-L152 PolarHBondContact O-N 3.28Å; L152-L155 HydrophobicContact CD1-CB 4.28Å; L152-L155 HydrophobicContact CD1-CD2 4.35Å; L152-A180 HydrophobicContact CB-CB 4.17Å
153	R	95.9	Very high	94.2	Very high	159 Å²	159	54.5 Å²	54.5	60%	0.6	27%	0.269	S	S	*	.	S	Bend	trans	-99.6	-26.3	170.5	-69.8	-177.2	170.2	-166.4	-3.8	112.3	R130 Y131	R130-R153 HydrophobicContact CB-CG 4.44Å; R130-R153 PolarHBondContact O-N 2.83Å; Y131-R153 HydrophobicContact CE1-CB 3.94Å; Y131-R153 VanDerWaalsContact OH-CD 3.24Å; Y131-R153 WeakPolarHBondContact OH-CD 3.46Å; Y131-R153 PolarHBondContact OH-NH1 2.97Å
154	E	97.3	Very high	94.2	Very high	42 Å²	42	53.6 Å²	53.6	20%	0.196	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	129.1	-179.1	-161	166.6	131.6	0	0	110.9	R130 Y131 I132 Q156 A180 K181	R130-E154 PolarHBondContact O-N 3.32Å; Y131-E154 HydrophobicContact CD1-CB 3.78Å; Y131-E154 HydrophobicContact CE1-CB 4.26Å; I132-E154 PolarHBondContact N-O 3.11Å; E154-Q156 HydrophobicContact CG-CG 4.31Å; E154-Q156 PolarHBondContact OE1-NE2 2.8Å; E154-A180 WeakPolarHBondContact CA-O 2.95Å; E154-K181 HydrophobicContact CG-CB 4.47Å; E154-K181 HydrophobicContact CG-CD 4.07Å; E154-K181 WeakPolarHBondContact OE2-CE 3.02Å; E154-K181 IonicContact OE2-NZ 2.66Å; E154-K181 PolarHBondContact OE2-NZ 3.31Å
155	L	97.7	Very high	94.3	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	104.8	174	177.8	59.4	0	0	0	109.2	I132 F147 L152 L157 W170 W174 A180 L182 Q185	I132-L155 HydrophobicContact CB-CD1 3.76Å; I132-L155 HydrophobicContact CG2-CD1 3.63Å; I132-L155 CarbonylContact O-C 3.57Å; I132-L155 WeakPolarHBondContact O-CA 3.48Å; F147-L155 HydrophobicContact CD2-CD2 4.24Å; F147-L155 HydrophobicContact CE1-CD1 4.21Å; F147-L155 HydrophobicContact CE2-CD2 3.91Å; F147-L155 HydrophobicContact CZ-CD1 4.08Å; F147-L155 HydrophobicContact CZ-CD2 4.06Å; L152-L155 HydrophobicContact CD1-CB 4.28Å; L152-L155 HydrophobicContact CD1-CD2 4.35Å; L155-L157 HydrophobicContact CD1-CD2 4.02Å; L155-L157 HydrophobicContact CD1-CG 4.41Å; L155-L157 HydrophobicContact CD2-CD1 4.16Å; L155-L157 HydrophobicContact CD2-CG 4.43Å; L155-L157 HydrophobicContact CG-CD1 4.27Å; L155-L157 HydrophobicContact CG-CD2 4.15Å; L155-L157 HydrophobicContact CG-CG 4Å; L155-W170 HydrophobicContact CD2-CH2 4.1Å; L155-W170 HydrophobicContact CD2-CZ3 4.33Å; L155-W174 HydrophobicContact CD2-CZ3 4.27Å; L155-A180 HydrophobicContact CB-CB 3.89Å; L155-A180 PolarHBondContact N-O 3.05Å; L155-L182 WeakPolarHBondContact O-CD2 3.26Å; L155-Q185 PolarHBondContact O-NE2 2.85Å
156	Q	97.7	Very high	94.4	Very high	59 Å²	59	50.9 Å²	50.9	28%	0.276	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	120.3	178.8	-61.9	-169.7	5.2	0	0	111.5	I132 N133 L134 S135 E154	I132-Q156 PolarHBondContact O-N 2.94Å; N133-Q156 HydrophobicContact CB-CB 4.18Å; N133-Q156 PolarHBondContact ND2-OE1 3.48Å; L134-Q156 PolarHBondContact N-O 2.86Å; S135-Q156 PolarHBondContact N-O 3.45Å; E154-Q156 HydrophobicContact CG-CG 4.31Å; E154-Q156 PolarHBondContact OE1-NE2 2.8Å
157	L	97.1	Very high	94.3	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.			trans	-124.2	-1.7	-176.7	-61.7	-179.8	0	0	0	114.2	L134 L142 L155 N160 F162 W170 M171 L182 L187	L134-L157 HydrophobicContact CB-CD2 4.17Å; L134-L157 HydrophobicContact CD1-CD2 4.3Å; L142-L157 HydrophobicContact CD2-CD1 4.39Å; L142-L157 HydrophobicContact CD2-CD2 3.88Å; L155-L157 HydrophobicContact CD1-CD2 4.02Å; L155-L157 HydrophobicContact CD1-CG 4.41Å; L155-L157 HydrophobicContact CD2-CD1 4.16Å; L155-L157 HydrophobicContact CD2-CG 4.43Å; L155-L157 HydrophobicContact CG-CD1 4.27Å; L155-L157 HydrophobicContact CG-CD2 4.15Å; L155-L157 HydrophobicContact CG-CG 4Å; L157-N160 PolarHBondContact O-ND2 3.24Å; L157-F162 HydrophobicContact CB-CE2 4.18Å; L157-F162 HydrophobicContact CB-CZ 4.23Å; L157-F162 HydrophobicContact CD1-CZ 4.41Å; L157-W170 HydrophobicContact CD1-CH2 4.43Å; L157-M171 HydrophobicContact CD1-CE 4.23Å; L157-M171 HydrophobicContact CD1-CG 4.43Å; L157-M171 HydrophobicContact CD1-SD 4Å; L157-L182 HydrophobicContact CD1-CD2 3.96Å; L157-L182 HydrophobicContact CG-CD2 4.27Å; L157-L187 HydrophobicContact CB-CD2 4.03Å
158	E	94.8	Very high	94.4	Very high	65 Å²	65	53.9 Å²	53.9	30%	0.304	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.2	151	-177.4	-62.6	-164.6	136.6	0	0	113.8	S135 S136 N160 Q185 N186 L187	S135-E158 CarbonylContact C-O 3.58Å; S135-E158 WeakPolarHBondContact CA-O 3.23Å; S135-E158 VanDerWaalsContact CB-O 3.29Å; S135-E158 WeakPolarHBondContact CB-O 3.26Å; S136-E158 PolarHBondContact N-O 3.48Å; E158-N160 VanDerWaalsContact C-N 3.27Å; E158-N160 PolarHBondContact O-N 2.74Å; E158-Q185 HydrophobicContact CG-CB 3.74Å; E158-Q185 HydrophobicContact CG-CG 3.79Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.43Å; E158-N186 PolarHBondContact OE1-N 3.3Å; E158-L187 HydrophobicContact CG-CD2 4.35Å
159	Q	94.1	Very high	94.7	Very high	132 Å²	132	50.6 Å²	50.6	62%	0.617	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	28.7	178.1	-51.2	176.1	0.4	0	0	114.6	S136	S136-Q159 WeakPolarHBondContact CA-O 3.47Å; S136-Q159 PolarHBondContact OG-OE1 3.17Å
160	N	95.3	Very high	95.1	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.08	23%	0.229	C	C	.	.			trans	-96.8	164.4	161	-76.7	-79.1	0	0	0	110.8	L134 N137 R138 L139 L157 E158 F162	L134-N160 PolarHBondContact O-ND2 2.85Å; N137-N160 WeakPolarHBondContact CA-OD1 3.38Å; N137-N160 VanDerWaalsContact CB-OD1 3.29Å; N137-N160 WeakPolarHBondContact CB-OD1 3.41Å; N137-N160 PolarHBondContact N-OD1 2.8Å; R138-N160 PolarHBondContact N-OD1 2.7Å; L139-N160 HydrophobicContact CB-CB 4.28Å; L139-N160 WeakPolarHBondContact CB-OD1 3.45Å; L139-N160 PolarHBondContact N-OD1 3.26Å; L139-N160 VanDerWaalsContact N-OD1 3.13Å; L157-N160 PolarHBondContact O-ND2 3.24Å; E158-N160 VanDerWaalsContact C-N 3.27Å; E158-N160 PolarHBondContact O-N 2.74Å; N160-F162 HydrophobicContact CB-CD2 4.11Å; N160-F162 HydrophobicContact CB-CE1 4.21Å; N160-F162 HydrophobicContact CB-CE2 3.6Å; N160-F162 HydrophobicContact CB-CZ 3.65Å
161	F	92.1	Very high	95.2	Very high	122 Å²	122	45.7 Å²	45.7	54%	0.535	22%	0.224	S	C	.	.			trans	-112.2	60.4	-172.6	-60.3	-83.6	0	0	0	110.5	L139 T140 I190	L139-F161 CarbonylContact O-C 3.58Å; L139-F161 PolarHBondContact O-N 2.98Å; T140-F161 WeakPolarHBondContact CA-O 3.08Å; F161-I190 HydrophobicContact CB-CD1 3.89Å; F161-I190 HydrophobicContact CD1-CD1 4.04Å; F161-I190 HydrophobicContact CG-CD1 4.47Å
162	F	96.4	Very high	95.4	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	141.1	-176.5	-61.4	-65.4	0	0	0	112.3	L139 T140 L142 L157 N160 I168 M171 C189 I190	L139-F162 HydrophobicContact CB-CE1 3.79Å; L139-F162 HydrophobicContact CB-CZ 4.37Å; T140-F162 CarbonylContact O-C 3.54Å; T140-F162 WeakPolarHBondContact O-CA 3.2Å; L142-F162 HydrophobicContact CB-CE1 4.44Å; L157-F162 HydrophobicContact CB-CE2 4.18Å; L157-F162 HydrophobicContact CB-CZ 4.23Å; L157-F162 HydrophobicContact CD1-CZ 4.41Å; N160-F162 HydrophobicContact CB-CD2 4.11Å; N160-F162 HydrophobicContact CB-CE1 4.21Å; N160-F162 HydrophobicContact CB-CE2 3.6Å; N160-F162 HydrophobicContact CB-CZ 3.65Å; F162-I168 HydrophobicContact CB-CD1 3.93Å; F162-I168 HydrophobicContact CB-CG2 4.37Å; F162-I168 HydrophobicContact CD1-CG2 4.28Å; F162-M171 HydrophobicContact CD1-CE 4.08Å; F162-M171 HydrophobicContact CD1-SD 4.5Å; F162-M171 HydrophobicContact CD2-SD 4.33Å; F162-M171 HydrophobicContact CE1-CE 3.68Å; F162-M171 HydrophobicContact CE1-SD 4.31Å; F162-M171 HydrophobicContact CE2-CE 4.48Å; F162-M171 HydrophobicContact CE2-SD 4.12Å; F162-M171 HydrophobicContact CZ-CE 3.9Å; F162-M171 HydrophobicContact CZ-SD 4.11Å; F162-C189 CarbonylContact O-C 3.55Å; F162-C189 WeakPolarHBondContact O-CA 3.31Å; F162-I190 PolarHBondContact O-N 2.84Å
163	N	95.6	Very high	95.3	Very high	82 Å²	82	42.9 Å²	42.9	44%	0.439	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	130.3	174.9	-68.3	-15.7	0	0	0	110.1	T140 S165 I168	T140-N163 PolarHBondContact O-N 3.24Å; N163-S165 WeakPolarHBondContact O-CB 3.49Å; N163-S165 PolarHBondContact O-N 3.14Å; N163-S165 PolarHBondContact O-OG 2.86Å; N163-I168 WeakPolarHBondContact O-CD1 3.25Å
164	C	95.3	Very high	95.2	Very high	24 Å²	24	38.1 Å²	38.1	16%	0.162	19%	0.186	C	C	.	.	S	Bend	trans	-62.6	105.6	175.8	-61.3	0	0	0	0	109.6	C189 I190 N191 M202	C164-C189 WeakPolarHBondContact CA-SG 3.48Å; C164-C189 HydrophobicContact CB-CB 3.92Å; C164-C189 WeakPolarHBondContact CB-SG 3.45Å; C164-C189 WeakPolarHBondContact SG-CB 3.44Å; C164-C189 CovalentContact SG-SG 2.04Å; C164-C189 PolarHBondContact SG-SG 3.47Å; C164-I190 PolarHBondContact N-O 2.85Å; C164-I190 PolarHBondContact SG-N 2.96Å; C164-I190 VanDerWaalsContact SG-N 3.43Å; C164-N191 WeakPolarHBondContact CB-OD1 3.42Å; C164-N191 PolarHBondContact SG-OD1 3.4Å; C164-M202 HydrophobicContact CB-SD 4.32Å
165	S	94.2	Very high	95.1	Very high	26 Å²	26	37.3 Å²	37.3	18%	0.182	18%	0.182	C	C	.	.	S	Bend	trans	-162.7	168.3	-165.9	59	0	0	0	0	110.3	N163 D167 I168	N163-S165 WeakPolarHBondContact O-CB 3.49Å; N163-S165 PolarHBondContact O-N 3.14Å; N163-S165 PolarHBondContact O-OG 2.86Å; S165-D167 VanDerWaalsContact C-N 3.28Å; S165-D167 PolarHBondContact O-N 2.69Å; S165-I168 WeakPolarHBondContact O-CG1 3.43Å
166	C	94.3	Very high	94.8	Very high	21 Å²	21	42.7 Å²	42.7	14%	0.142	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-68.6	-28.9	179.7	-162.3	0	0	0	0	113	I168 R169 C207 V289 V290	C166-I168 PolarHBondContact O-N 2.82Å; C166-I168 VanDerWaalsContact O-N 3.07Å; C166-R169 WeakPolarHBondContact O-CB 3.41Å; C166-R169 PolarHBondContact O-N 2.95Å; C166-C207 WeakPolarHBondContact CA-SG 3.33Å; C166-C207 HydrophobicContact CB-CB 3.95Å; C166-C207 WeakPolarHBondContact CB-SG 3.27Å; C166-C207 WeakPolarHBondContact SG-CB 3.38Å; C166-C207 CovalentContact SG-SG 2.03Å; C166-C207 PolarHBondContact SG-SG 2.79Å; C166-V289 HydrophobicContact CB-CG2 4.19Å; C166-V290 WeakPolarHBondContact SG-CG2 3.31Å
167	D	93.3	Very high	94.6	Very high	75 Å²	75	45.8 Å²	45.8	40%	0.401	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-63.6	-16.5	-177.5	-51.9	-60.8	0	0	0	114.3	T141 S165 W170	T141-D167 VanDerWaalsContact OG1-CB 3.3Å; T141-D167 WeakPolarHBondContact OG1-CB 3.48Å; S165-D167 VanDerWaalsContact C-N 3.28Å; S165-D167 PolarHBondContact O-N 2.69Å; D167-W170 PolarHBondContact O-NE1 3.4Å
168	I	95.2	Very high	94.4	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-110.5	3.7	176.8	66.2	164.6	0	0	0	113.3	F162 N163 S165 C166 W170 M171 C189 L199 M202	F162-I168 HydrophobicContact CB-CD1 3.93Å; F162-I168 HydrophobicContact CB-CG2 4.37Å; F162-I168 HydrophobicContact CD1-CG2 4.28Å; N163-I168 WeakPolarHBondContact O-CD1 3.25Å; S165-I168 WeakPolarHBondContact O-CG1 3.43Å; C166-I168 PolarHBondContact O-N 2.82Å; C166-I168 VanDerWaalsContact O-N 3.07Å; I168-W170 PolarHBondContact O-N 2.91Å; I168-M171 HydrophobicContact CB-CE 4.28Å; I168-M171 HydrophobicContact CB-SD 4.09Å; I168-M171 HydrophobicContact CG2-CE 3.92Å; I168-M171 HydrophobicContact CG2-SD 4.28Å; I168-M171 WeakPolarHBondContact O-CB 3.42Å; I168-M171 PolarHBondContact O-N 2.82Å; I168-C189 HydrophobicContact CD1-CB 3.56Å; I168-L199 HydrophobicContact CD1-CD1 3.91Å; I168-L199 HydrophobicContact CG1-CD1 4.5Å; I168-M202 HydrophobicContact CD1-SD 3.93Å; I168-M202 HydrophobicContact CG1-CE 4.05Å; I168-M202 HydrophobicContact CG1-SD 3.94Å
169	R	94.9	Very high	94.4	Very high	37 Å²	37	48.9 Å²	48.9	14%	0.14	24%	0.244	C	C	.	.	H	α-helix	trans	-59	-34.3	179.9	-178	69	161	144.1	7.7	112.2	C166 M171 Q172 L173 M202 C207 D208 V290	C166-R169 WeakPolarHBondContact O-CB 3.41Å; C166-R169 PolarHBondContact O-N 2.95Å; R169-M171 PolarHBondContact O-N 2.86Å; R169-Q172 VanDerWaalsContact NH1-CD 3.28Å; R169-Q172 WeakPolarHBondContact O-CB 3.4Å; R169-Q172 PolarHBondContact O-N 2.82Å; R169-Q172 VanDerWaalsContact O-N 3.12Å; R169-L173 PolarHBondContact O-N 3.24Å; R169-L173 VanDerWaalsContact O-N 3.1Å; R169-M202 HydrophobicContact CB-CE 4.26Å; R169-C207 PolarHBondContact NE-O 2.86Å; R169-C207 VanDerWaalsContact NE-O 3.12Å; R169-D208 IonicContact NH2-OD1 2.85Å; R169-D208 PolarHBondContact NH2-OD1 3.4Å; R169-D208 VanDerWaalsContact NH2-OD1 3.14Å; R169-V290 HydrophobicContact CB-CG1 4.01Å; R169-V290 HydrophobicContact CB-CG2 4.1Å; R169-V290 HydrophobicContact CG-CB 4.44Å; R169-V290 HydrophobicContact CG-CG1 3.54Å; R169-V290 HydrophobicContact CG-CG2 4.12Å
170	W	95.1	Very high	94.4	Very high	2 Å²	2	43 Å²	43	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-58.2	-35.1	174.3	71.2	-96.4	0	0	0	112.9	L142 W144 F147 L155 L157 D167 I168 Q172 L173 W174 V290	L142-W170 HydrophobicContact CB-CZ2 4.29Å; L142-W170 HydrophobicContact CD2-CH2 4.41Å; L142-W170 HydrophobicContact CD2-CZ2 4.18Å; L142-W170 HydrophobicContact CG-CZ2 4.24Å; L142-W170 WeakPolarHBondContact O-CZ2 3.44Å; L142-W170 PolarHBondContact O-NE1 3.39Å; W144-W170 HydrophobicContact CB-CB 4.08Å; W144-W170 HydrophobicContact CB-CD2 3.64Å; W144-W170 HydrophobicContact CB-CE3 4.05Å; W144-W170 HydrophobicContact CB-CG 3.67Å; W144-W170 HydrophobicContact CG-CB 4.41Å; W144-W170 HydrophobicContact CG-CG 4.32Å; F147-W170 AromaticContact CD2-CH2 3.95Å; F147-W170 HydrophobicContact CD2-CH2 3.95Å; F147-W170 HydrophobicContact CD2-CZ3 4.41Å; F147-W170 AromaticContact CE2-CH2 3.66Å; F147-W170 HydrophobicContact CE2-CH2 3.66Å; F147-W170 HydrophobicContact CE2-CZ2 4.13Å; L155-W170 HydrophobicContact CD2-CH2 4.1Å; L155-W170 HydrophobicContact CD2-CZ3 4.33Å; L157-W170 HydrophobicContact CD1-CH2 4.43Å; D167-W170 PolarHBondContact O-NE1 3.4Å; I168-W170 PolarHBondContact O-N 2.91Å; W170-Q172 VanDerWaalsContact C-N 3.32Å; W170-Q172 PolarHBondContact O-N 2.94Å; W170-L173 PolarHBondContact O-N 2.95Å; W170-W174 AromaticContact CE3-CD2 3.9Å; W170-W174 HydrophobicContact CE3-CD2 3.9Å; W170-W174 HydrophobicContact CE3-CE3 4.16Å; W170-W174 HydrophobicContact CE3-CG 4.2Å; W170-W174 AromaticContact CZ3-CD2 3.97Å; W170-W174 HydrophobicContact CZ3-CD2 3.97Å; W170-W174 AromaticContact CZ3-CE3 3.73Å; W170-W174 HydrophobicContact CZ3-CE3 3.73Å; W170-W174 HydrophobicContact CZ3-CH2 4.39Å; W170-W174 AromaticContact CZ3-CZ3 3.95Å; W170-W174 HydrophobicContact CZ3-CZ3 3.95Å; W170-W174 WeakPolarHBondContact O-CB 3.37Å; W170-W174 PolarHBondContact O-N 2.82Å; W170-V290 VanDerWaalsContact CB-O 3.23Å; W170-V290 WeakPolarHBondContact CB-O 3.26Å
171	M	95.8	Very high	94.4	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-37.2	178	-59.7	179.9	-170	0	0	111.2	L142 L157 F162 I168 R169 Q175 L199	L142-M171 HydrophobicContact CB-CE 3.6Å; L142-M171 HydrophobicContact CD2-CE 4.22Å; L142-M171 HydrophobicContact CG-CE 4.48Å; L157-M171 HydrophobicContact CD1-CE 4.23Å; L157-M171 HydrophobicContact CD1-CG 4.43Å; L157-M171 HydrophobicContact CD1-SD 4Å; F162-M171 HydrophobicContact CD1-CE 4.08Å; F162-M171 HydrophobicContact CD1-SD 4.5Å; F162-M171 HydrophobicContact CD2-SD 4.33Å; F162-M171 HydrophobicContact CE1-CE 3.68Å; F162-M171 HydrophobicContact CE1-SD 4.31Å; F162-M171 HydrophobicContact CE2-CE 4.48Å; F162-M171 HydrophobicContact CE2-SD 4.12Å; F162-M171 HydrophobicContact CZ-CE 3.9Å; F162-M171 HydrophobicContact CZ-SD 4.11Å; I168-M171 HydrophobicContact CB-CE 4.28Å; I168-M171 HydrophobicContact CB-SD 4.09Å; I168-M171 HydrophobicContact CG2-CE 3.92Å; I168-M171 HydrophobicContact CG2-SD 4.28Å; I168-M171 WeakPolarHBondContact O-CB 3.42Å; I168-M171 PolarHBondContact O-N 2.82Å; R169-M171 PolarHBondContact O-N 2.86Å; M171-Q175 VanDerWaalsContact O-CB 3.29Å; M171-Q175 WeakPolarHBondContact O-CB 3.21Å; M171-Q175 PolarHBondContact O-N 3.14Å; M171-L199 HydrophobicContact CB-CD2 3.73Å
172	Q	94.9	Very high	94.5	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.028	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-47.5	175.2	-176.6	-177.6	2.7	0	0	110.2	R169 W170 W174 Q175 E176 L199 M202	R169-Q172 VanDerWaalsContact NH1-CD 3.28Å; R169-Q172 WeakPolarHBondContact O-CB 3.4Å; R169-Q172 PolarHBondContact O-N 2.82Å; R169-Q172 VanDerWaalsContact O-N 3.12Å; W170-Q172 VanDerWaalsContact C-N 3.32Å; W170-Q172 PolarHBondContact O-N 2.94Å; Q172-W174 PolarHBondContact O-N 3.08Å; Q172-Q175 WeakPolarHBondContact O-CB 3.4Å; Q172-Q175 PolarHBondContact O-N 3.14Å; Q172-Q175 VanDerWaalsContact O-N 3.15Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.48Å; Q172-E176 PolarHBondContact NE2-OE1 2.8Å; Q172-E176 WeakPolarHBondContact O-CG 3.44Å; Q172-E176 PolarHBondContact O-N 2.77Å; Q172-L199 HydrophobicContact CB-CD1 4.35Å; Q172-L199 HydrophobicContact CB-CD2 4.41Å; Q172-L199 HydrophobicContact CB-CG 4Å; Q172-M202 PolarHBondContact NE2-O 2.88Å; Q172-M202 VanDerWaalsContact NE2-O 3.15Å; Q172-M202 PolarHBondContact OE1-O 2.99Å
173	L	93.6	Very high	94.4	Very high	30 Å²	30	45.7 Å²	45.7	16%	0.157	23%	0.233	C	C	.	.	H	α-helix	trans	-60.3	-44.2	177	-64.3	175.4	0	0	0	111.8	R169 W170 Q175 E176 Q177 L209 V290	R169-L173 PolarHBondContact O-N 3.24Å; R169-L173 VanDerWaalsContact O-N 3.1Å; W170-L173 PolarHBondContact O-N 2.95Å; L173-Q175 VanDerWaalsContact C-N 3.34Å; L173-Q175 PolarHBondContact O-N 2.03Å; L173-E176 PolarHBondContact O-N 2.86Å; L173-Q177 WeakPolarHBondContact O-CB 3.3Å; L173-Q177 VanDerWaalsContact O-CG 3.23Å; L173-Q177 WeakPolarHBondContact O-CG 3.17Å; L173-Q177 PolarHBondContact O-N 2.9Å; L173-L209 HydrophobicContact CD1-CD1 4.21Å; L173-L209 HydrophobicContact CD1-CD2 4.27Å; L173-L209 HydrophobicContact CD1-CG 4.01Å; L173-V290 HydrophobicContact CD1-CG1 3.61Å
174	W	94.7	Very high	94.3	Very high	59 Å²	59	45.8 Å²	45.8	22%	0.223	24%	0.24	C	C	.	.	H	α-helix	trans	-65.7	-34.9	175.4	-76.3	22.7	0	0	0	112.4	F147 L155 W170 Q172 G178 E179 A180 L182	F147-W174 HydrophobicContact CB-CH2 4.06Å; L155-W174 HydrophobicContact CD2-CZ3 4.27Å; W170-W174 AromaticContact CE3-CD2 3.9Å; W170-W174 HydrophobicContact CE3-CD2 3.9Å; W170-W174 HydrophobicContact CE3-CE3 4.16Å; W170-W174 HydrophobicContact CE3-CG 4.2Å; W170-W174 AromaticContact CZ3-CD2 3.97Å; W170-W174 HydrophobicContact CZ3-CD2 3.97Å; W170-W174 AromaticContact CZ3-CE3 3.73Å; W170-W174 HydrophobicContact CZ3-CE3 3.73Å; W170-W174 HydrophobicContact CZ3-CH2 4.39Å; W170-W174 AromaticContact CZ3-CZ3 3.95Å; W170-W174 HydrophobicContact CZ3-CZ3 3.95Å; W170-W174 WeakPolarHBondContact O-CB 3.37Å; W170-W174 PolarHBondContact O-N 2.82Å; Q172-W174 PolarHBondContact O-N 3.08Å; W174-G178 PolarHBondContact O-N 2.87Å; W174-E179 HydrophobicContact CB-CB 3.84Å; W174-E179 HydrophobicContact CD2-CB 3.96Å; W174-E179 HydrophobicContact CE3-CB 4.21Å; W174-E179 HydrophobicContact CG-CB 3.8Å; W174-E179 HydrophobicContact CG-CG 4.41Å; W174-E179 PolarHBondContact O-N 2.93Å; W174-A180 HydrophobicContact CE3-CB 4.41Å; W174-A180 HydrophobicContact CZ3-CB 4.39Å; W174-L182 HydrophobicContact CB-CD1 3.57Å; W174-L182 HydrophobicContact CD2-CD1 4.29Å; W174-L182 HydrophobicContact CE3-CD1 3.66Å; W174-L182 HydrophobicContact CG-CD1 4.33Å
175	Q	94.4	Very high	94.3	Very high	25 Å²	25	45.2 Å²	45.2	12%	0.117	24%	0.235	C	C	.	.	H	α-helix	trans	-66	-38.5	173.8	-170.2	178	34.7	0	0	111.8	M171 Q172 L173 L182 N183 Q185	M171-Q175 VanDerWaalsContact O-CB 3.29Å; M171-Q175 WeakPolarHBondContact O-CB 3.21Å; M171-Q175 PolarHBondContact O-N 3.14Å; Q172-Q175 WeakPolarHBondContact O-CB 3.4Å; Q172-Q175 PolarHBondContact O-N 3.14Å; Q172-Q175 VanDerWaalsContact O-N 3.15Å; L173-Q175 VanDerWaalsContact C-N 3.34Å; L173-Q175 PolarHBondContact O-N 2.03Å; Q175-L182 HydrophobicContact CB-CB 4.33Å; Q175-N183 VanDerWaalsContact O-CB 3.31Å; Q175-N183 WeakPolarHBondContact O-CB 3.26Å; Q175-Q185 PolarHBondContact NE2-O 3.1Å
176	E	93.2	Very high	94.2	Very high	112 Å²	112	49.3 Å²	49.3	52%	0.523	26%	0.255	S	S	.	.	H	α-helix	trans	-72	-37.3	176.3	-71.4	169.2	-168.1	0	0	112.2	Q172 L173	Q172-E176 WeakPolarHBondContact CG-OE1 3.48Å; Q172-E176 PolarHBondContact NE2-OE1 2.8Å; Q172-E176 WeakPolarHBondContact O-CG 3.44Å; Q172-E176 PolarHBondContact O-N 2.77Å; L173-E176 PolarHBondContact O-N 2.86Å
177	Q	93.3	Very high	94.3	Very high	125 Å²	125	48.7 Å²	48.7	58%	0.584	25%	0.25	S	S	*	.	H	α-helix	trans	-80.4	-20	179.3	-69.8	167.6	-10.7	0	0	113.8	L173 E179	L173-Q177 WeakPolarHBondContact O-CB 3.3Å; L173-Q177 VanDerWaalsContact O-CG 3.23Å; L173-Q177 WeakPolarHBondContact O-CG 3.17Å; L173-Q177 PolarHBondContact O-N 2.9Å; Q177-E179 HydrophobicContact CB-CG 4.17Å
178	G	92.6	Very high	94.4	Very high	28 Å²	28	49.5 Å²	49.5	29%	0.289	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	12.2	-176.1	0	0	0	0	0	115	W174	W174-G178 PolarHBondContact O-N 2.87Å
179	E	93.8	Very high	94.4	Very high	101 Å²	101	49.5 Å²	49.5	47%	0.472	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-65.7	140.9	-178.2	-72.6	-62	164.5	0	0	112.3	W174 Q177 K181 L182	W174-E179 HydrophobicContact CB-CB 3.84Å; W174-E179 HydrophobicContact CD2-CB 3.96Å; W174-E179 HydrophobicContact CE3-CB 4.21Å; W174-E179 HydrophobicContact CG-CB 3.8Å; W174-E179 HydrophobicContact CG-CG 4.41Å; W174-E179 PolarHBondContact O-N 2.93Å; Q177-E179 HydrophobicContact CB-CG 4.17Å; E179-K181 PolarHBondContact O-N 2.98Å; E179-L182 PolarHBondContact O-N 2.92Å
180	A	95.2	Very high	94.5	Very high	8 Å²	8	50.2 Å²	50.2	7%	0.066	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	44.8	28.7	179.9	0	0	0	0	0	115.8	L152 E154 L155 W174 L182	L152-A180 HydrophobicContact CB-CB 4.17Å; E154-A180 WeakPolarHBondContact CA-O 2.95Å; L155-A180 HydrophobicContact CB-CB 3.89Å; L155-A180 PolarHBondContact N-O 3.05Å; W174-A180 HydrophobicContact CE3-CB 4.41Å; W174-A180 HydrophobicContact CZ3-CB 4.39Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 2.88Å
181	K	95.1	Very high	94.4	Very high	101 Å²	101	52.6 Å²	52.6	44%	0.439	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	58.6	27.4	-174.4	-53.1	-175	-170.4	168.9	0	115.7	E154 E179 N183 S184 Q185	E154-K181 HydrophobicContact CG-CB 4.47Å; E154-K181 HydrophobicContact CG-CD 4.07Å; E154-K181 WeakPolarHBondContact OE2-CE 3.02Å; E154-K181 IonicContact OE2-NZ 2.66Å; E154-K181 PolarHBondContact OE2-NZ 3.31Å; E179-K181 PolarHBondContact O-N 2.98Å; K181-N183 PolarHBondContact O-N 2.89Å; K181-S184 PolarHBondContact O-N 3.12Å; K181-S184 PolarHBondContact O-OG 3.27Å; K181-Q185 PolarHBondContact O-NE2 3.12Å
182	L	94.5	Very high	94	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-66.5	-29	173.6	-72.2	160.5	0	0	0	112.1	L155 L157 W174 Q175 E179 A180 S184 Q185 L187	L155-L182 WeakPolarHBondContact O-CD2 3.26Å; L157-L182 HydrophobicContact CD1-CD2 3.96Å; L157-L182 HydrophobicContact CG-CD2 4.27Å; W174-L182 HydrophobicContact CB-CD1 3.57Å; W174-L182 HydrophobicContact CD2-CD1 4.29Å; W174-L182 HydrophobicContact CE3-CD1 3.66Å; W174-L182 HydrophobicContact CG-CD1 4.33Å; Q175-L182 HydrophobicContact CB-CB 4.33Å; E179-L182 PolarHBondContact O-N 2.92Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 2.88Å; L182-S184 PolarHBondContact O-N 3.46Å; L182-Q185 WeakPolarHBondContact O-CB 3.34Å; L182-Q185 PolarHBondContact O-N 3.19Å; L182-L187 HydrophobicContact CD2-CD1 3.77Å
183	N	93.8	Very high	93.8	Very high	97 Å²	97	64 Å²	64	52%	0.519	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-58.4	-26.5	173.4	65.4	-16.1	0	0	0	114.8	Q175 K181 Q185	Q175-N183 VanDerWaalsContact O-CB 3.31Å; Q175-N183 WeakPolarHBondContact O-CB 3.26Å; K181-N183 PolarHBondContact O-N 2.89Å; N183-Q185 VanDerWaalsContact C-N 3.32Å
184	S	94.3	Very high	93.5	Very high	84 Å²	84	65.3 Å²	65.3	59%	0.587	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-83.6	-2	176.4	64.5	0	0	0	0	114.8	K181 L182	K181-S184 PolarHBondContact O-N 3.12Å; K181-S184 PolarHBondContact O-OG 3.27Å; L182-S184 PolarHBondContact O-N 3.46Å
185	Q	94.5	Very high	93.4	Very high	12 Å²	12	64.8 Å²	64.8	6%	0.056	37%	0.371	C	S	.	.	S	Bend	trans	-108.2	145	-174.7	-69.8	170.6	69.2	0	0	111.9	L155 E158 Q175 K181 L182 N183 L187	L155-Q185 PolarHBondContact O-NE2 2.85Å; E158-Q185 HydrophobicContact CG-CB 3.74Å; E158-Q185 HydrophobicContact CG-CG 3.79Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.43Å; Q175-Q185 PolarHBondContact NE2-O 3.1Å; K181-Q185 PolarHBondContact O-NE2 3.12Å; L182-Q185 WeakPolarHBondContact O-CB 3.34Å; L182-Q185 PolarHBondContact O-N 3.19Å; N183-Q185 VanDerWaalsContact C-N 3.32Å; Q185-L187 HydrophobicContact CB-CD2 4.15Å; Q185-L187 HydrophobicContact CB-CG 4.14Å; Q185-L187 PolarHBondContact O-N 3.3Å
186	N	92.7	Very high	93.4	Very high	113 Å²	113	70 Å²	70	60%	0.604	40%	0.395	S	S	*	.			trans	-91	84.9	174.1	-69.2	-66.6	0	0	0	110.1	E158 Y188	E158-N186 PolarHBondContact OE1-N 3.3Å; N186-Y188 HydrophobicContact CB-CE2 3.92Å; N186-Y188 VanDerWaalsContact O-CD2 3.24Å; N186-Y188 WeakPolarHBondContact O-CD2 3.21Å; N186-Y188 WeakPolarHBondContact O-CE2 3.35Å
187	L	95.4	Very high	93.5	Very high	7 Å²	7	66.7 Å²	66.7	4%	0.037	38%	0.381	C	S	.	.			trans	-88.2	143.9	178.1	-57	-179	0	0	0	112.1	L157 E158 L182 Q185 L199	L157-L187 HydrophobicContact CB-CD2 4.03Å; E158-L187 HydrophobicContact CG-CD2 4.35Å; L182-L187 HydrophobicContact CD2-CD1 3.77Å; Q185-L187 HydrophobicContact CB-CD2 4.15Å; Q185-L187 HydrophobicContact CB-CG 4.14Å; Q185-L187 PolarHBondContact O-N 3.3Å; L187-L199 HydrophobicContact CB-CB 3.98Å; L187-L199 HydrophobicContact CB-CD2 3.81Å; L187-L199 HydrophobicContact CD1-CD2 3.93Å; L187-L199 WeakPolarHBondContact O-CB 3.45Å; L187-L199 PolarHBondContact O-N 3.02Å
188	Y	95.1	Very high	93.5	Very high	92 Å²	92	62.2 Å²	62.2	36%	0.361	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	155.1	-179.6	-57.5	-97.4	0	0	0	110.1	N186 Q196 L197 P198	N186-Y188 HydrophobicContact CB-CE2 3.92Å; N186-Y188 VanDerWaalsContact O-CD2 3.24Å; N186-Y188 WeakPolarHBondContact O-CD2 3.21Å; N186-Y188 WeakPolarHBondContact O-CE2 3.35Å; Y188-Q196 HydrophobicContact CD1-CG 3.84Å; Y188-Q196 HydrophobicContact CG-CG 3.97Å; Y188-L197 CarbonylContact C-O 3.59Å; Y188-L197 VanDerWaalsContact CA-O 3.22Å; Y188-L197 WeakPolarHBondContact CA-O 3.36Å; Y188-L197 WeakPolarHBondContact CB-O 3.19Å; Y188-P198 HydrophobicContact CD1-CB 4.2Å; Y188-P198 HydrophobicContact CD1-CG 4.14Å; Y188-P198 HydrophobicContact CE1-CB 4.23Å; Y188-P198 HydrophobicContact CE1-CG 3.99Å
189	C	96.3	Very high	93.6	Very high	1 Å²	1	61 Å²	61	1%	0.007	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	164	167.6	68.9	0	0	0	0	110.8	F162 C164 I168 Q196 L197	F162-C189 CarbonylContact O-C 3.55Å; F162-C189 WeakPolarHBondContact O-CA 3.31Å; C164-C189 WeakPolarHBondContact CA-SG 3.48Å; C164-C189 HydrophobicContact CB-CB 3.92Å; C164-C189 WeakPolarHBondContact CB-SG 3.45Å; C164-C189 WeakPolarHBondContact SG-CB 3.44Å; C164-C189 CovalentContact SG-SG 2.04Å; C164-C189 PolarHBondContact SG-SG 3.47Å; I168-C189 HydrophobicContact CD1-CB 3.56Å; C189-Q196 WeakPolarHBondContact O-CA 3.48Å; C189-L197 PolarHBondContact N-O 3.2Å; C189-L197 PolarHBondContact O-N 3.15Å
190	I	95.6	Very high	93.5	Very high	51 Å²	51	61.8 Å²	61.8	26%	0.262	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	124.3	-179.8	-54.1	176.6	0	0	0	108.6	F161 F162 C164 S195	F161-I190 HydrophobicContact CB-CD1 3.89Å; F161-I190 HydrophobicContact CD1-CD1 4.04Å; F161-I190 HydrophobicContact CG-CD1 4.47Å; F162-I190 PolarHBondContact O-N 2.84Å; C164-I190 PolarHBondContact N-O 2.85Å; C164-I190 PolarHBondContact SG-N 2.96Å; C164-I190 VanDerWaalsContact SG-N 3.43Å; I190-S195 WeakPolarHBondContact CA-O 3.23Å
191	N	93.6	Very high	93.4	Very high	53 Å²	53	69.4 Å²	69.4	28%	0.283	38%	0.379	S	S	.	.			trans	-74.5	166.7	174.7	-74.1	-42.9	0	0	0	111.5	C164 D193 G194 S195	C164-N191 WeakPolarHBondContact CB-OD1 3.42Å; C164-N191 PolarHBondContact SG-OD1 3.4Å; N191-D193 WeakPolarHBondContact CB-OD1 3.26Å; N191-D193 PolarHBondContact O-N 2.87Å; N191-D193 VanDerWaalsContact O-N 3.11Å; N191-G194 PolarHBondContact O-N 3.11Å; N191-S195 WeakPolarHBondContact CB-OG 3.29Å; N191-S195 PolarHBondContact N-O 2.95Å; N191-S195 PolarHBondContact ND2-OG 3.47Å
192	A	88.3	Confident	93.3	Very high	120 Å²	120	64.9 Å²	64.9	99%	0.992	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-19.5	177.4	0	0	0	0	0	114.3	G194	A192-G194 VanDerWaalsContact C-N 3.34Å
193	D	89.8	Confident	93.2	Very high	126 Å²	126	71.7 Å²	71.7	67%	0.674	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	0.2	174	67.7	-5.5	0	0	0	113.7	N191 S195	N191-D193 WeakPolarHBondContact CB-OD1 3.26Å; N191-D193 PolarHBondContact O-N 2.87Å; N191-D193 VanDerWaalsContact O-N 3.11Å; D193-S195 VanDerWaalsContact C-N 3.33Å; D193-S195 VanDerWaalsContact OD1-CB 3.23Å; D193-S195 WeakPolarHBondContact OD1-CB 3.39Å; D193-S195 PolarHBondContact OD1-N 3.01Å; D193-S195 PolarHBondContact OD1-OG 2.86Å; D193-S195 PolarHBondContact OD2-OG 2.89Å
194	G	88.3	Confident	93.1	Very high	56 Å²	56	69.5 Å²	69.5	58%	0.577	38%	0.383	S	S	*	.	S	Bend	trans	82.4	1.2	-176.2	0	0	0	0	0	114.9	N191 A192	N191-G194 PolarHBondContact O-N 3.11Å; A192-G194 VanDerWaalsContact C-N 3.34Å
195	S	92.3	Very high	92.8	Very high	48 Å²	48	70.3 Å²	70.3	34%	0.336	39%	0.389	S	S	.	.			trans	-72.6	140	176.8	65.9	0	0	0	0	112	I190 N191 D193	I190-S195 WeakPolarHBondContact CA-O 3.23Å; N191-S195 WeakPolarHBondContact CB-OG 3.29Å; N191-S195 PolarHBondContact N-O 2.95Å; N191-S195 PolarHBondContact ND2-OG 3.47Å; D193-S195 VanDerWaalsContact C-N 3.33Å; D193-S195 VanDerWaalsContact OD1-CB 3.23Å; D193-S195 WeakPolarHBondContact OD1-CB 3.39Å; D193-S195 PolarHBondContact OD1-N 3.01Å; D193-S195 PolarHBondContact OD1-OG 2.86Å; D193-S195 PolarHBondContact OD2-OG 2.89Å
196	Q	93.9	Very high	92.5	Very high	134 Å²	134	76.8 Å²	76.8	63%	0.626	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	118	178.5	-174.4	177.9	-5.7	0	0	110.4	Y188 C189	Y188-Q196 HydrophobicContact CD1-CG 3.84Å; Y188-Q196 HydrophobicContact CG-CG 3.97Å; C189-Q196 WeakPolarHBondContact O-CA 3.48Å
197	L	94.9	Very high	92.4	Very high	43 Å²	43	71.4 Å²	71.4	23%	0.225	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	131.1	-179.5	-172.3	69.5	0	0	0	110.2	Y188 C189 L199 R201 M202	Y188-L197 CarbonylContact C-O 3.59Å; Y188-L197 VanDerWaalsContact CA-O 3.22Å; Y188-L197 WeakPolarHBondContact CA-O 3.36Å; Y188-L197 WeakPolarHBondContact CB-O 3.19Å; C189-L197 PolarHBondContact N-O 3.2Å; C189-L197 PolarHBondContact O-N 3.15Å; L197-L199 PolarHBondContact O-N 3.47Å; L197-R201 HydrophobicContact CD1-CB 4Å; L197-R201 HydrophobicContact CG-CB 4.22Å; L197-M202 HydrophobicContact CD2-CB 4.42Å
198	P	94.6	Very high	92.1	Very high	32 Å²	32	75.1 Å²	75.1	21%	0.208	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.2	169.7	-20.1	31.8	0	0	0	110.6	Y188 F200 R201	Y188-P198 HydrophobicContact CD1-CB 4.2Å; Y188-P198 HydrophobicContact CD1-CG 4.14Å; Y188-P198 HydrophobicContact CE1-CB 4.23Å; Y188-P198 HydrophobicContact CE1-CG 3.99Å; P198-F200 VanDerWaalsContact C-N 3.31Å; P198-F200 HydrophobicContact CB-CD1 3.75Å; P198-F200 HydrophobicContact CB-CE1 3.37Å; P198-F200 HydrophobicContact CB-CZ 4.07Å; P198-F200 HydrophobicContact CG-CE1 4.29Å; P198-F200 PolarHBondContact O-N 2.87Å; P198-R201 WeakPolarHBondContact O-CB 3.5Å; P198-R201 PolarHBondContact O-N 3.01Å
199	L	94.1	Very high	92	Very high	3 Å²	3	74.6 Å²	74.6	2%	0.016	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-58.9	-38.2	-167.8	-175.7	64.8	0	0	0	113.4	I168 M171 Q172 L187 L197 R201 M202	I168-L199 HydrophobicContact CD1-CD1 3.91Å; I168-L199 HydrophobicContact CG1-CD1 4.5Å; M171-L199 HydrophobicContact CB-CD2 3.73Å; Q172-L199 HydrophobicContact CB-CD1 4.35Å; Q172-L199 HydrophobicContact CB-CD2 4.41Å; Q172-L199 HydrophobicContact CB-CG 4Å; L187-L199 HydrophobicContact CB-CB 3.98Å; L187-L199 HydrophobicContact CB-CD2 3.81Å; L187-L199 HydrophobicContact CD1-CD2 3.93Å; L187-L199 WeakPolarHBondContact O-CB 3.45Å; L187-L199 PolarHBondContact O-N 3.02Å; L197-L199 PolarHBondContact O-N 3.47Å; L199-R201 PolarHBondContact O-N 3.07Å; L199-R201 VanDerWaalsContact O-N 3.07Å; L199-M202 HydrophobicContact CD1-CE 4.13Å; L199-M202 HydrophobicContact CD1-SD 4.23Å; L199-M202 WeakPolarHBondContact O-CB 3.49Å; L199-M202 PolarHBondContact O-N 2.86Å
200	F	90.9	Very high	91.8	Very high	116 Å²	116	74.8 Å²	74.8	51%	0.509	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-62.7	-10.8	175	74	-92.2	0	0	0	115	P198	P198-F200 VanDerWaalsContact C-N 3.31Å; P198-F200 HydrophobicContact CB-CD1 3.75Å; P198-F200 HydrophobicContact CB-CE1 3.37Å; P198-F200 HydrophobicContact CB-CZ 4.07Å; P198-F200 HydrophobicContact CG-CE1 4.29Å; P198-F200 PolarHBondContact O-N 2.87Å
201	R	93.2	Very high	91.6	Very high	169 Å²	169	79 Å²	79	64%	0.638	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-100.5	-0.5	173.6	-61.5	-169.9	175.8	-171.1	-2.8	113.1	L197 P198 L199 N203	L197-R201 HydrophobicContact CD1-CB 4Å; L197-R201 HydrophobicContact CG-CB 4.22Å; P198-R201 WeakPolarHBondContact O-CB 3.5Å; P198-R201 PolarHBondContact O-N 3.01Å; L199-R201 PolarHBondContact O-N 3.07Å; L199-R201 VanDerWaalsContact O-N 3.07Å; R201-N203 PolarHBondContact O-N 2.9Å
202	M	93.3	Very high	91.6	Very high	6 Å²	6	78.3 Å²	78.3	3%	0.03	43%	0.429	C	S	.	.			trans	-66.2	132.2	178	-170.4	178.9	68.2	0	0	109.9	C164 I168 R169 Q172 L197 L199 I204	C164-M202 HydrophobicContact CB-SD 4.32Å; I168-M202 HydrophobicContact CD1-SD 3.93Å; I168-M202 HydrophobicContact CG1-CE 4.05Å; I168-M202 HydrophobicContact CG1-SD 3.94Å; R169-M202 HydrophobicContact CB-CE 4.26Å; Q172-M202 PolarHBondContact NE2-O 2.88Å; Q172-M202 VanDerWaalsContact NE2-O 3.15Å; Q172-M202 PolarHBondContact OE1-O 2.99Å; L197-M202 HydrophobicContact CD2-CB 4.42Å; L199-M202 HydrophobicContact CD1-CE 4.13Å; L199-M202 HydrophobicContact CD1-SD 4.23Å; L199-M202 WeakPolarHBondContact O-CB 3.49Å; L199-M202 PolarHBondContact O-N 2.86Å; M202-I204 HydrophobicContact CG-CD1 4.22Å; M202-I204 HydrophobicContact CG-CG1 4.02Å; M202-I204 HydrophobicContact SD-CG1 4.23Å
203	N	92	Very high	91.8	Very high	142 Å²	142	75.4 Å²	75.4	76%	0.759	40%	0.402	S	S	*	.			trans	-138.5	107.7	177.7	-177.7	8	0	0	0	108.2	R201	R201-N203 PolarHBondContact O-N 2.9Å
204	I	91.3	Very high	92	Very high	51 Å²	51	71.2 Å²	71.2	26%	0.262	38%	0.38	S	S	.	.			trans	-114.1	121.4	178.4	-54.7	-60.9	0	0	0	106.8	M202 C207	M202-I204 HydrophobicContact CG-CD1 4.22Å; M202-I204 HydrophobicContact CG-CG1 4.02Å; M202-I204 HydrophobicContact SD-CG1 4.23Å; I204-C207 HydrophobicContact CB-CB 3.83Å; I204-C207 HydrophobicContact CG2-CB 3.67Å
205	S	88.9	Confident	92.1	Very high	101 Å²	101	71.4 Å²	71.4	71%	0.706	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	139.5	177.2	56.7	0	0	0	0	111.1
206	Q	87.4	Confident	92	Very high	149 Å²	149	72.8 Å²	72.8	70%	0.696	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	49.3	177	-49.4	179.8	-3	0	0	111.9	S236	Q206-S236 CarbonylContact C-O 3.59Å; Q206-S236 WeakPolarHBondContact CB-OG 3.34Å; Q206-S236 CarbonylContact O-C 3.59Å; Q206-S236 WeakPolarHBondContact O-CB 3.47Å; Q206-S236 PolarHBondContact O-OG 3.35Å; Q206-S236 VanDerWaalsContact O-OG 3.1Å
207	C	91.9	Very high	91.7	Very high	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.376	C	S	.	.			trans	-146.4	77	-176	178.2	0	0	0	0	110.7	C166 R169 I204 S236	C166-C207 WeakPolarHBondContact CA-SG 3.33Å; C166-C207 HydrophobicContact CB-CB 3.95Å; C166-C207 WeakPolarHBondContact CB-SG 3.27Å; C166-C207 WeakPolarHBondContact SG-CB 3.38Å; C166-C207 CovalentContact SG-SG 2.03Å; C166-C207 PolarHBondContact SG-SG 2.79Å; R169-C207 PolarHBondContact NE-O 2.86Å; R169-C207 VanDerWaalsContact NE-O 3.12Å; I204-C207 HydrophobicContact CB-CB 3.83Å; I204-C207 HydrophobicContact CG2-CB 3.67Å; C207-S236 WeakPolarHBondContact CA-O 3.34Å
208	D	89.2	Confident	91.4	Very high	85 Å²	85	74.9 Å²	74.9	46%	0.455	39%	0.393	S	S	.	.			trans	-135.5	172.2	-175	-62.8	-67.4	0	0	0	110.9	R169 S236 N288	R169-D208 IonicContact NH2-OD1 2.85Å; R169-D208 PolarHBondContact NH2-OD1 3.4Å; R169-D208 VanDerWaalsContact NH2-OD1 3.14Å; D208-S236 PolarHBondContact N-O 3.09Å; D208-N288 PolarHBondContact O-ND2 3.44Å
209	L	91.4	Very high	91.4	Very high	80 Å²	80	74.1 Å²	74.1	42%	0.419	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-62.5	148.7	176.3	-72.9	170.5	0	0	0	110.7	L173 V290	L173-L209 HydrophobicContact CD1-CD1 4.21Å; L173-L209 HydrophobicContact CD1-CD2 4.27Å; L173-L209 HydrophobicContact CD1-CG 4.01Å; L209-V290 HydrophobicContact CD2-CB 4.49Å; L209-V290 HydrophobicContact CD2-CG1 4.06Å; L209-V290 HydrophobicContact CG-CG1 4.24Å
210	P	93.1	Very high	91.4	Very high	6 Å²	6	77.8 Å²	77.8	4%	0.039	41%	0.41	C	S	.	.	P	Polyproline II helix	trans	-70.2	134.9	-178.7	27.5	-31.7	0	0	0	111.5	P239 A286 S293	P210-P239 HydrophobicContact CB-CB 3.68Å; P210-P239 HydrophobicContact CB-CG 3.84Å; P210-P239 HydrophobicContact CG-CB 4.45Å; P210-A286 HydrophobicContact CB-CB 4.07Å; P210-A286 HydrophobicContact CG-CB 4.26Å; P210-A286 WeakPolarHBondContact CG-O 3.3Å; P210-S293 WeakPolarHBondContact O-CB 3.32Å; P210-S293 PolarHBondContact O-OG 3.26Å
211	E	92	Very high	91.5	Very high	138 Å²	138	72.8 Å²	72.8	65%	0.645	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	140	169.2	-65.4	-177.1	159.3	0	0	109.3	G233 S234	E211-G233 CarbonylContact O-C 3.31Å; E211-G233 WeakPolarHBondContact O-CA 3.48Å; E211-S234 PolarHBondContact N-O 3Å; E211-S234 PolarHBondContact O-N 3.02Å
212	I	93.5	Very high	91.6	Very high	39 Å²	39	71.6 Å²	71.6	20%	0.2	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137	-176.1	-170	170.2	0	0	0	110.3	C284 A286 S293 A295	I212-C284 HydrophobicContact CD1-CB 4.08Å; I212-C284 WeakPolarHBondContact CD1-O 3.35Å; I212-A286 HydrophobicContact CB-CB 4.26Å; I212-A286 HydrophobicContact CD1-CB 3.96Å; I212-A286 HydrophobicContact CG1-CB 4.29Å; I212-S293 WeakPolarHBondContact CG2-OG 3.47Å; I212-A295 HydrophobicContact CD1-CB 3.93Å; I212-A295 HydrophobicContact CG1-CB 3.98Å; I212-A295 HydrophobicContact CG2-CB 4.07Å
213	S	92.5	Very high	91.6	Very high	60 Å²	60	74 Å²	74	42%	0.42	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	141.9	176.7	59.7	0	0	0	0	110.9	C231 N232	S213-C231 CarbonylContact O-C 3.47Å; S213-C231 WeakPolarHBondContact O-CA 3.47Å; S213-N232 PolarHBondContact N-O 3.26Å; S213-N232 PolarHBondContact O-N 2.91Å; S213-N232 PolarHBondContact OG-O 2.87Å
214	V	93.5	Very high	91.6	Very high	37 Å²	37	68.8 Å²	68.8	22%	0.224	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	142.9	179.8	-74.3	0	0	0	0	110	H216 C231 W243 C284 A295 V297	V214-H216 VanDerWaalsContact CG2-O 3.26Å; V214-H216 WeakPolarHBondContact CG2-O 3.45Å; V214-H216 PolarHBondContact O-N 2.9Å; V214-C231 HydrophobicContact CG1-CB 4.12Å; V214-W243 HydrophobicContact CG1-CH2 3.92Å; V214-W243 HydrophobicContact CG1-CZ2 4.45Å; V214-C284 HydrophobicContact CG1-CB 4.25Å; V214-A295 HydrophobicContact CG1-CB 3.78Å; V214-A295 HydrophobicContact CG2-CB 4.18Å; V214-V297 HydrophobicContact CB-CG2 3.98Å; V214-V297 HydrophobicContact CG1-CG2 4.12Å; V214-V297 HydrophobicContact CG2-CG2 4.02Å
215	S	91	Very high	91.7	Very high	61 Å²	61	70.4 Å²	70.4	43%	0.427	39%	0.385	S	S	.	.	S	Bend	trans	-61.2	-23.1	180	52.3	0	0	0	0	114.4	I229 T230	S215-I229 WeakPolarHBondContact OG-CG2 3.5Å; S215-T230 PolarHBondContact N-O 3.31Å; S215-T230 PolarHBondContact OG-N 2.83Å; S215-T230 PolarHBondContact OG-O 3.46Å; S215-T230 VanDerWaalsContact OG-O 3.04Å
216	H	89.8	Confident	92	Very high	77 Å²	77	70.6 Å²	70.6	36%	0.356	38%	0.378	S	S	.	.			trans	-140.4	145.2	-177.1	-63.8	82.8	0	0	0	109.5	V214 V297	V214-H216 VanDerWaalsContact CG2-O 3.26Å; V214-H216 WeakPolarHBondContact CG2-O 3.45Å; V214-H216 PolarHBondContact O-N 2.9Å; H216-V297 HydrophobicContact CB-CG1 4.04Å; H216-V297 WeakPolarHBondContact O-CG2 3.48Å
217	V	86.8	Confident	92.3	Very high	110 Å²	110	64.1 Å²	64.1	67%	0.667	35%	0.35	S	S	*	.	S	Bend	trans	-92.4	-40.5	168.2	-179.8	0	0	0	0	110.4	V297 A298	V217-V297 WeakPolarHBondContact O-CA 3.22Å; V217-A298 PolarHBondContact O-N 2.84Å; V217-A298 VanDerWaalsContact O-N 3.09Å
218	N	90.1	Very high	92.3	Very high	110 Å²	110	67.6 Å²	67.6	59%	0.588	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.8	136.9	170.7	-58.3	-33.1	0	0	0	107.7	A298	N218-A298 WeakPolarHBondContact CA-O 3.33Å
219	L	93	Very high	92.5	Very high	16 Å²	16	63.5 Å²	63.5	8%	0.084	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	129.5	172.1	-175.9	72.6	0	0	0	109.2	V221 A227 I229 V297 A298 L299 T300	L219-V221 HydrophobicContact CD1-CG2 4.49Å; L219-V221 HydrophobicContact CD2-CG2 3.68Å; L219-V221 HydrophobicContact CG-CG2 3.72Å; L219-A227 HydrophobicContact CD2-CB 3.83Å; L219-I229 HydrophobicContact CD2-CD1 3.61Å; L219-I229 HydrophobicContact CD2-CG1 3.71Å; L219-V297 HydrophobicContact CB-CG1 4.13Å; L219-A298 PolarHBondContact N-O 3.39Å; L219-L299 HydrophobicContact CB-CD1 4.38Å; L219-L299 HydrophobicContact CD2-CD1 3.89Å; L219-L299 HydrophobicContact CG-CD1 4.32Å; L219-T300 PolarHBondContact O-N 3.3Å
220	T	93.8	Very high	92.6	Very high	80 Å²	80	61.5 Å²	61.5	49%	0.491	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.2	174.1	-50.5	0	0	0	0	109.8	T300 Y302	T220-T300 VanDerWaalsContact CA-O 3.31Å; T220-T300 WeakPolarHBondContact CA-O 3.25Å; T220-T300 HydrophobicContact CG2-CG2 4.3Å; T220-Y302 HydrophobicContact CG2-CD2 3.82Å; T220-Y302 HydrophobicContact CG2-CE1 4.35Å; T220-Y302 HydrophobicContact CG2-CE2 3.6Å; T220-Y302 HydrophobicContact CG2-CG 4.29Å
221	V	94.6	Very high	92.6	Very high	12 Å²	12	61.2 Å²	61.2	7%	0.073	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	155.1	-176.3	-163.1	0	0	0	0	108.5	L219 D225 A227 V273 L299 T300 V301 Y302	L219-V221 HydrophobicContact CD1-CG2 4.49Å; L219-V221 HydrophobicContact CD2-CG2 3.68Å; L219-V221 HydrophobicContact CG-CG2 3.72Å; V221-D225 HydrophobicContact CG1-CB 3.88Å; V221-A227 HydrophobicContact CG1-CB 4.16Å; V221-A227 HydrophobicContact CG2-CB 3.68Å; V221-V273 HydrophobicContact CG1-CB 4.24Å; V221-V273 HydrophobicContact CG1-CG2 4.1Å; V221-L299 HydrophobicContact CG2-CD1 3.86Å; V221-T300 PolarHBondContact N-O 3.42Å; V221-V301 CarbonylContact O-C 3.57Å; V221-V301 WeakPolarHBondContact O-CA 3.32Å; V221-Y302 PolarHBondContact O-N 3Å
222	R	93.9	Very high	92.7	Very high	143 Å²	143	56.5 Å²	56.5	54%	0.54	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	151.6	168.3	-61.3	178	173.5	-162	-3.4	110.1	G224 D225 Y302	R222-G224 PolarHBondContact O-N 2.96Å; R222-D225 WeakPolarHBondContact CB-OD2 3.35Å; R222-D225 WeakPolarHBondContact O-CB 3.34Å; R222-D225 PolarHBondContact O-N 2.67Å; R222-D225 VanDerWaalsContact O-N 3.09Å; R222-Y302 CarbonylContact C-O 3.57Å; R222-Y302 VanDerWaalsContact CA-O 3.31Å; R222-Y302 WeakPolarHBondContact CA-O 3.46Å
223	E	93.3	Very high	92.6	Very high	57 Å²	57	54.6 Å²	54.6	27%	0.266	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	131.6	172.4	176.6	178.7	-137.5	0	0	110.7	D225 V273 V301 Y302 Y303 R306	E223-D225 VanDerWaalsContact C-N 3.33Å; E223-V273 CarbonylContact C-O 3.56Å; E223-V273 VanDerWaalsContact CA-O 3.3Å; E223-V273 WeakPolarHBondContact CA-O 3.24Å; E223-V301 HydrophobicContact CB-CG1 4.25Å; E223-Y302 PolarHBondContact N-O 3.48Å; E223-Y303 WeakPolarHBondContact OE2-CB 3.28Å; E223-R306 IonicContact OE1-CZ 3.75Å; E223-R306 IonicContact OE1-NH1 2.7Å; E223-R306 IonicContact OE1-NH2 2.73Å; E223-R306 PolarHBondContact OE1-NH2 2.88Å; E223-R306 IonicContact OE2-CZ 3.14Å; E223-R306 IonicContact OE2-NH2 3.5Å; E223-R306 PolarHBondContact OE2-NH2 2.91Å
224	G	92.3	Very high	92.6	Very high	33 Å²	33	53.3 Å²	53.3	34%	0.34	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-16.3	-176.2	0	0	0	0	0	115.5	R222 V273	R222-G224 PolarHBondContact O-N 2.96Å; G224-V273 PolarHBondContact N-O 3.5Å
225	D	94.3	Very high	92.3	Very high	85 Å²	85	52.8 Å²	52.8	46%	0.455	30%	0.301	S	S	.	.			trans	-76.8	163.4	175.4	-75.2	-20.4	0	0	0	111.6	V221 R222 E223 V273	V221-D225 HydrophobicContact CG1-CB 3.88Å; R222-D225 WeakPolarHBondContact CB-OD2 3.35Å; R222-D225 WeakPolarHBondContact O-CB 3.34Å; R222-D225 PolarHBondContact O-N 2.67Å; R222-D225 VanDerWaalsContact O-N 3.09Å; E223-D225 VanDerWaalsContact C-N 3.33Å; D225-V273 WeakPolarHBondContact O-CG2 3.33Å; D225-V273 PolarHBondContact O-N 2.8Å
226	N	94.4	Very high	92.1	Very high	105 Å²	105	52.1 Å²	52.1	56%	0.561	30%	0.296	S	S	*	.			trans	-102.8	149.3	172.8	-62	-14.9	0	0	0	110.2	L270 V271 N272	N226-L270 CarbonylContact C-O 3.58Å; N226-L270 VanDerWaalsContact CA-O 3.25Å; N226-L270 WeakPolarHBondContact CA-O 3.37Å; N226-L270 WeakPolarHBondContact CB-O 3.29Å; N226-V271 VanDerWaalsContact OD1-CA 3.31Å; N226-V271 WeakPolarHBondContact OD1-CA 3.17Å; N226-N272 PolarHBondContact OD1-N 3.43Å
227	A	93	Very high	92.1	Very high	12 Å²	12	50.6 Å²	50.6	10%	0.099	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	154.7	176	0	0	0	0	0	112	L219 V221 T269 L270	L219-A227 HydrophobicContact CD2-CB 3.83Å; V221-A227 HydrophobicContact CG1-CB 4.16Å; V221-A227 HydrophobicContact CG2-CB 3.68Å; A227-T269 CarbonylContact O-C 3.39Å; A227-T269 WeakPolarHBondContact O-CA 3.21Å; A227-L270 PolarHBondContact N-O 3.31Å; A227-L270 PolarHBondContact O-N 3.14Å
228	V	93.3	Very high	92.3	Very high	73 Å²	73	49.7 Å²	49.7	44%	0.442	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	131.1	177.7	-176	0	0	0	0	109.4	N267 L268 T269	V228-N267 HydrophobicContact CG1-CB 4.14Å; V228-L268 WeakPolarHBondContact CA-O 3.49Å; V228-T269 HydrophobicContact CG2-CG2 4.02Å
229	I	93.6	Very high	92.4	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	123.2	177.3	-41.1	173.6	0	0	0	108.5	S215 L219 W243 N267 L268 L282 V297	S215-I229 WeakPolarHBondContact OG-CG2 3.5Å; L219-I229 HydrophobicContact CD2-CD1 3.61Å; L219-I229 HydrophobicContact CD2-CG1 3.71Å; I229-W243 HydrophobicContact CB-CH2 4.21Å; I229-W243 HydrophobicContact CB-CZ2 4.04Å; I229-W243 HydrophobicContact CG2-CH2 3.6Å; I229-W243 HydrophobicContact CG2-CZ2 3.72Å; I229-N267 CarbonylContact O-C 3.52Å; I229-N267 WeakPolarHBondContact O-CA 3.49Å; I229-L268 PolarHBondContact N-O 2.97Å; I229-L268 PolarHBondContact O-N 3.39Å; I229-L282 HydrophobicContact CD1-CD1 3.32Å; I229-V297 HydrophobicContact CD1-CG1 4.46Å; I229-V297 HydrophobicContact CG2-CG2 4.33Å
230	T	93.2	Very high	92.2	Very high	37 Å²	37	48.4 Å²	48.4	23%	0.227	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	137.7	170.7	-53.1	0	0	0	0	110.5	S215 N232 N267	S215-T230 PolarHBondContact N-O 3.31Å; S215-T230 PolarHBondContact OG-N 2.83Å; S215-T230 PolarHBondContact OG-O 3.46Å; S215-T230 VanDerWaalsContact OG-O 3.04Å; T230-N232 VanDerWaalsContact CG2-OD1 3.26Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.45Å; T230-N267 WeakPolarHBondContact CB-OD1 3.34Å; T230-N267 VanDerWaalsContact CG2-OD1 3.3Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.5Å; T230-N267 PolarHBondContact OG1-OD1 2.8Å
231	C	93.5	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.1	162.1	178	0	0	0	0	109.2	S213 V214 V241 W243 A265 I266 C284	S213-C231 CarbonylContact O-C 3.47Å; S213-C231 WeakPolarHBondContact O-CA 3.47Å; V214-C231 HydrophobicContact CG1-CB 4.12Å; C231-V241 HydrophobicContact CB-CG1 4.48Å; C231-W243 HydrophobicContact CB-CH2 4.24Å; C231-W243 HydrophobicContact CB-CZ2 3.43Å; C231-W243 VanDerWaalsContact CB-CZ2 3.43Å; C231-A265 CarbonylContact O-C 3.48Å; C231-A265 VanDerWaalsContact O-CA 3.3Å; C231-A265 WeakPolarHBondContact O-CA 3.45Å; C231-I266 PolarHBondContact N-O 3.48Å; C231-I266 PolarHBondContact O-N 3.45Å; C231-C284 HydrophobicContact CB-CB 3.66Å; C231-C284 WeakPolarHBondContact CB-SG 3.31Å; C231-C284 WeakPolarHBondContact SG-CB 3.49Å; C231-C284 CovalentContact SG-SG 2.03Å; C231-C284 PolarHBondContact SG-SG 2.81Å
232	N	92.9	Very high	92	Very high	39 Å²	39	47.4 Å²	47.4	21%	0.209	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	119.1	177.7	-59.4	-33.2	0	0	0	109	S213 T230 V263 A265	S213-N232 PolarHBondContact N-O 3.26Å; S213-N232 PolarHBondContact O-N 2.91Å; S213-N232 PolarHBondContact OG-O 2.87Å; T230-N232 VanDerWaalsContact CG2-OD1 3.26Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.45Å; N232-V263 HydrophobicContact CB-CG1 3.92Å; N232-A265 WeakPolarHBondContact OD1-CB 3.44Å
233	G	93	Very high	92	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	129.1	166.4	0	0	0	0	0	110.9	E211 V263 H264	E211-G233 CarbonylContact O-C 3.31Å; E211-G233 WeakPolarHBondContact O-CA 3.48Å; G233-V263 WeakPolarHBondContact O-CA 3.48Å; G233-V263 WeakPolarHBondContact O-CG1 3.4Å; G233-H264 PolarHBondContact N-O 3.14Å; G233-H264 PolarHBondContact O-N 2.65Å
234	S	90.8	Very high	91.8	Very high	32 Å²	32	41.5 Å²	41.5	22%	0.224	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	150.1	175.8	48.8	0	0	0	0	110.5	E211	E211-S234 PolarHBondContact N-O 3Å; E211-S234 PolarHBondContact O-N 3.02Å
235	G	87.2	Confident	91.5	Very high	26 Å²	26	41.4 Å²	41.4	27%	0.268	24%	0.241	S	C	.	.			trans	158.7	174.2	177.8	0	0	0	0	0	112.4	P237	G235-P237 CarbonylContact C-O 3.47Å; G235-P237 CarbonylContact O-C 3.12Å
236	S	87.7	Confident	90.9	Very high	47 Å²	47	42.9 Å²	42.9	33%	0.329	25%	0.254	S	S	.	.	S	Bend	trans	-130.3	124.5	167	-170.2	0	0	0	0	109	Q206 C207 D208	Q206-S236 CarbonylContact C-O 3.59Å; Q206-S236 WeakPolarHBondContact CB-OG 3.34Å; Q206-S236 CarbonylContact O-C 3.59Å; Q206-S236 WeakPolarHBondContact O-CB 3.47Å; Q206-S236 PolarHBondContact O-OG 3.35Å; Q206-S236 VanDerWaalsContact O-OG 3.1Å; C207-S236 WeakPolarHBondContact CA-O 3.34Å; D208-S236 PolarHBondContact N-O 3.09Å
237	P	90.1	Very high	90.3	Very high	46 Å²	46	40.5 Å²	40.5	30%	0.299	25%	0.254	S	S	.	.	S	Bend	cis	-61.4	152.1	-6.5	-26.3	39.2	0	0	0	113.4	G235 N288 V289	G235-P237 CarbonylContact C-O 3.47Å; G235-P237 CarbonylContact O-C 3.12Å; P237-N288 PolarHBondContact O-ND2 2.87Å; P237-V289 HydrophobicContact CG-CG2 3.87Å
238	L	89.7	Confident	90.1	Very high	90 Å²	90	40.7 Å²	40.7	47%	0.471	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-55.6	123	-179.9	-179.5	73.6	0	0	0	110	N262	L238-N262 VanDerWaalsContact CD1-C 3.41Å
239	P	92.2	Very high	89.9	Confident	3 Å²	3	43 Å²	43	2%	0.019	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-74.8	149.1	-179.4	26.6	-32.3	0	0	0	113.5	P210 V241 H264 A286 E287 N288	P210-P239 HydrophobicContact CB-CB 3.68Å; P210-P239 HydrophobicContact CB-CG 3.84Å; P210-P239 HydrophobicContact CG-CB 4.45Å; P239-V241 HydrophobicContact CB-CG2 4.44Å; P239-V241 HydrophobicContact CG-CG2 4.36Å; P239-H264 WeakPolarHBondContact O-CB 3.45Å; P239-H264 PolarHBondContact O-ND1 3.34Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.44Å; P239-E287 CarbonylContact C-O 3.6Å; P239-E287 WeakPolarHBondContact CA-O 3.31Å; P239-E287 WeakPolarHBondContact CB-O 3.46Å; P239-N288 HydrophobicContact CB-CB 4.42Å
240	D	90.4	Very high	89.6	Confident	96 Å²	96	43.2 Å²	43.2	51%	0.513	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	143.2	156	-160.6	15.8	0	0	0	109	H264 A286 E287	D240-H264 IonicContact OD1-CE1 3.16Å; D240-H264 PolarHBondContact OD1-CE1 3.36Å; D240-H264 IonicContact OD1-ND1 3.5Å; D240-A286 CarbonylContact O-C 3.33Å; D240-A286 VanDerWaalsContact O-CA 3.3Å; D240-A286 WeakPolarHBondContact O-CA 3.37Å; D240-E287 HydrophobicContact CB-CG 4.23Å; D240-E287 PolarHBondContact N-O 3.37Å; D240-E287 PolarHBondContact O-N 3.2Å
241	V	92.4	Very high	89.3	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	132.1	-170.9	176.9	0	0	0	0	108.2	C231 P239 H264 I266 I285 A286	C231-V241 HydrophobicContact CB-CG1 4.48Å; P239-V241 HydrophobicContact CB-CG2 4.44Å; P239-V241 HydrophobicContact CG-CG2 4.36Å; V241-H264 HydrophobicContact CB-CB 4.37Å; V241-H264 HydrophobicContact CG2-CB 3.86Å; V241-H264 PolarHBondContact N-ND1 3.18Å; V241-I266 HydrophobicContact CG1-CG1 4.43Å; V241-I266 WeakPolarHBondContact O-CD1 3.25Å; V241-I285 WeakPolarHBondContact CA-O 3.44Å; V241-A286 HydrophobicContact CG2-CB 4.02Å
242	D	91.3	Very high	89.2	Confident	70 Å²	70	49.1 Å²	49.1	37%	0.374	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	165.5	176	-160.5	15.3	0	0	0	112.3	H254 C284 I285	D242-H254 IonicContact OD1-CE1 3.3Å; D242-H254 PolarHBondContact OD1-CE1 2.82Å; D242-H254 VanDerWaalsContact OD1-CE1 3.3Å; D242-H254 IonicContact OD1-CG 3.96Å; D242-H254 IonicContact OD1-ND1 2.73Å; D242-H254 PolarHBondContact OD1-ND1 2.91Å; D242-C284 WeakPolarHBondContact O-CA 3.26Å; D242-I285 HydrophobicContact CB-CG1 4.49Å; D242-I285 PolarHBondContact N-O 2.87Å; D242-I285 WeakPolarHBondContact O-CG1 3.46Å; D242-I285 PolarHBondContact O-N 3.04Å
243	W	92.8	Very high	89	Confident	5 Å²	5	50.9 Å²	50.9	2%	0.019	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.6	176.4	-72.1	92.1	0	0	0	111.8	V214 I229 C231 V245 H254 I266 L268 L282 C284 V297	V214-W243 HydrophobicContact CG1-CH2 3.92Å; V214-W243 HydrophobicContact CG1-CZ2 4.45Å; I229-W243 HydrophobicContact CB-CH2 4.21Å; I229-W243 HydrophobicContact CB-CZ2 4.04Å; I229-W243 HydrophobicContact CG2-CH2 3.6Å; I229-W243 HydrophobicContact CG2-CZ2 3.72Å; C231-W243 HydrophobicContact CB-CH2 4.24Å; C231-W243 HydrophobicContact CB-CZ2 3.43Å; C231-W243 VanDerWaalsContact CB-CZ2 3.43Å; W243-V245 HydrophobicContact CB-CG1 4.14Å; W243-V245 PolarHBondContact O-N 3.21Å; W243-V245 VanDerWaalsContact O-N 3.14Å; W243-H254 PolarHBondContact O-CE1 3.21Å; W243-H254 VanDerWaalsContact O-CE1 3.32Å; W243-I266 PolarHBondContact NE1-O 3.15Å; W243-L268 HydrophobicContact CB-CD2 4.22Å; W243-L268 HydrophobicContact CD2-CB 4Å; W243-L268 HydrophobicContact CD2-CD2 3.9Å; W243-L268 HydrophobicContact CE3-CD2 4.04Å; W243-L268 HydrophobicContact CG-CB 3.87Å; W243-L268 HydrophobicContact CG-CD2 4.02Å; W243-L268 HydrophobicContact CG-CG 4.42Å; W243-L268 HydrophobicContact CZ2-CB 4.48Å; W243-L282 HydrophobicContact CE3-CB 4.25Å; W243-L282 HydrophobicContact CZ3-CB 3.95Å; W243-C284 HydrophobicContact CD2-CB 3.92Å; W243-C284 HydrophobicContact CE3-CB 3.77Å; W243-C284 HydrophobicContact CH2-CB 4.06Å; W243-C284 HydrophobicContact CZ2-CB 4.22Å; W243-C284 HydrophobicContact CZ3-CB 3.83Å; W243-V297 HydrophobicContact CH2-CG2 3.85Å; W243-V297 HydrophobicContact CZ3-CG2 4.1Å
244	I	89	Confident	88.8	Confident	71 Å²	71	54.1 Å²	54.1	36%	0.364	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	98.4	171.3	-56.9	179.2	0	0	0	108.6	T246 T283 I285	I244-T246 WeakPolarHBondContact CG2-OG1 3.46Å; I244-T283 PolarHBondContact N-O 2.88Å; I244-I285 HydrophobicContact CD1-CD1 4.41Å; I244-I285 HydrophobicContact CD1-CG2 3.65Å; I244-I285 HydrophobicContact CG1-CD1 4.3Å; I244-I285 HydrophobicContact CG1-CG1 4.35Å; I244-I285 HydrophobicContact CG1-CG2 4.19Å
245	V	86.9	Confident	88.7	Confident	30 Å²	30	58 Å²	58	18%	0.182	33%	0.332	C	S	.	.			trans	-104.9	12.3	178.5	-63.1	0	0	0	0	113.3	W243 G247 L248 L268	W243-V245 HydrophobicContact CB-CG1 4.14Å; W243-V245 PolarHBondContact O-N 3.21Å; W243-V245 VanDerWaalsContact O-N 3.14Å; V245-G247 PolarHBondContact O-N 3.4Å; V245-G247 VanDerWaalsContact O-N 3.14Å; V245-L248 HydrophobicContact CB-CB 4.37Å; V245-L248 HydrophobicContact CB-CD2 4.3Å; V245-L248 HydrophobicContact CG1-CD2 4.26Å; V245-L248 VanDerWaalsContact O-CB 3.26Å; V245-L248 WeakPolarHBondContact O-CB 3.42Å; V245-L248 PolarHBondContact O-N 3.27Å; V245-L248 VanDerWaalsContact O-N 3.08Å; V245-L268 HydrophobicContact CG1-CD1 3.87Å; V245-L268 HydrophobicContact CG1-CD2 4.07Å
246	T	82.5	Confident	88.5	Confident	117 Å²	117	60.2 Å²	60.2	72%	0.718	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	115.5	-179.3	52.1	0	0	0	0	111.5	I244	I244-T246 WeakPolarHBondContact CG2-OG1 3.46Å
247	G	81.3	Confident	87.8	Confident	55 Å²	55	60 Å²	60	57%	0.567	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	-8.9	-178.5	0	0	0	0	0	114.7	V245 Q249	V245-G247 PolarHBondContact O-N 3.4Å; V245-G247 VanDerWaalsContact O-N 3.14Å; G247-Q249 PolarHBondContact O-NE2 2.53Å
248	L	88.9	Confident	86.7	Confident	16 Å²	16	63.9 Å²	63.9	8%	0.084	35%	0.353	C	S	.	.			trans	-68.1	131.5	172.3	-167.4	75.6	0	0	0	109.9	V245 N252 L270 D277 F280 L282	V245-L248 HydrophobicContact CB-CB 4.37Å; V245-L248 HydrophobicContact CB-CD2 4.3Å; V245-L248 HydrophobicContact CG1-CD2 4.26Å; V245-L248 VanDerWaalsContact O-CB 3.26Å; V245-L248 WeakPolarHBondContact O-CB 3.42Å; V245-L248 PolarHBondContact O-N 3.27Å; V245-L248 VanDerWaalsContact O-N 3.08Å; L248-N252 HydrophobicContact CD2-CB 4.46Å; L248-L270 HydrophobicContact CD2-CD2 3.67Å; L248-D277 HydrophobicContact CD1-CB 3.87Å; L248-D277 VanDerWaalsContact CD1-CG 3.42Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.33Å; L248-F280 HydrophobicContact CB-CE1 4.37Å; L248-F280 HydrophobicContact CB-CE2 4.24Å; L248-F280 HydrophobicContact CB-CZ 4.04Å; L248-F280 HydrophobicContact CD1-CB 4.25Å; L248-F280 HydrophobicContact CD1-CD1 3.69Å; L248-F280 HydrophobicContact CD1-CD2 4.01Å; L248-F280 HydrophobicContact CD1-CE1 3.99Å; L248-F280 HydrophobicContact CD1-CE2 4.29Å; L248-F280 HydrophobicContact CD1-CG 3.71Å; L248-F280 HydrophobicContact CD1-CZ 4.28Å; L248-L282 HydrophobicContact CD1-CD2 3.94Å; L248-L282 HydrophobicContact CD2-CD2 3.99Å
249	Q	87.9	Confident	85.3	Confident	120 Å²	120	66 Å²	66	56%	0.561	36%	0.364	S	S	*	.			trans	-89.2	-28.7	-178.1	-60	-51	-58.4	0	0	112.8	G247 T274 E276 D277	G247-Q249 PolarHBondContact O-NE2 2.53Å; Q249-T274 HydrophobicContact CB-CG2 3.67Å; Q249-E276 HydrophobicContact CG-CB 4.4Å; Q249-D277 PolarHBondContact N-OD1 2.88Å; Q249-D277 PolarHBondContact N-OD2 2.8Å
250	S	88.4	Confident	83.9	Confident	5 Å²	5	73.3 Å²	73.3	4%	0.035	39%	0.392	C	S	.	.	S	Bend	trans	-62.7	138.8	176.9	-63	0	0	0	0	111.9	N252 V273 T274 D277	S250-N252 PolarHBondContact O-N 2.83Å; S250-N252 PolarHBondContact O-ND2 3.27Å; S250-V273 WeakPolarHBondContact OG-CA 3.29Å; S250-T274 PolarHBondContact OG-N 3.27Å; S250-D277 WeakPolarHBondContact CB-OD2 3.39Å; S250-D277 PolarHBondContact N-OD2 3.39Å; S250-D277 PolarHBondContact OG-OD2 3.21Å
251	I	87.3	Confident	82.9	Confident	112 Å²	112	75.3 Å²	75.3	57%	0.574	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	130	172.6	-61.6	172.9	0	0	0	108	V271	I251-V271 HydrophobicContact CB-CB 4.26Å; I251-V271 HydrophobicContact CG2-CB 4.33Å; I251-V271 PolarHBondContact O-N 3.21Å
252	N	90.4	Very high	82.1	Confident	50 Å²	50	80.4 Å²	80.4	27%	0.267	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	148.8	-175.7	56.9	84.9	0	0	0	112.2	L248 S250 L268 T269 L270	L248-N252 HydrophobicContact CD2-CB 4.46Å; S250-N252 PolarHBondContact O-N 2.83Å; S250-N252 PolarHBondContact O-ND2 3.27Å; N252-L268 HydrophobicContact CB-CD1 3.87Å; N252-T269 CarbonylContact C-O 3.51Å; N252-T269 WeakPolarHBondContact CA-O 3.44Å; N252-L270 HydrophobicContact CB-CD2 3.94Å
253	T	88.5	Confident	81.8	Confident	75 Å²	75	78.6 Å²	78.6	46%	0.46	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	136.6	173.6	60	0	0	0	0	110.5	T269	T253-T269 PolarHBondContact N-O 3.17Å; T253-T269 PolarHBondContact O-N 2.8Å
254	H	89.9	Confident	81.6	Confident	69 Å²	69	79.4 Å²	79.4	32%	0.319	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	123.2	179.8	-64	-156.6	0	0	0	108	D242 W243 I266 N267	D242-H254 IonicContact OD1-CE1 3.3Å; D242-H254 PolarHBondContact OD1-CE1 2.82Å; D242-H254 VanDerWaalsContact OD1-CE1 3.3Å; D242-H254 IonicContact OD1-CG 3.96Å; D242-H254 IonicContact OD1-ND1 2.73Å; D242-H254 PolarHBondContact OD1-ND1 2.91Å; W243-H254 PolarHBondContact O-CE1 3.21Å; W243-H254 VanDerWaalsContact O-CE1 3.32Å; H254-I266 HydrophobicContact CB-CG2 4.06Å; H254-N267 WeakPolarHBondContact CA-O 3.22Å
255	Q	87.9	Confident	81.6	Confident	114 Å²	114	76.2 Å²	76.2	53%	0.533	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	117.6	178.4	-176.7	177.2	-5.9	0	0	110.7	N267	Q255-N267 PolarHBondContact N-O 2.9Å; Q255-N267 PolarHBondContact O-N 2.91Å
256	T	82.3	Confident	81.9	Confident	72 Å²	72	75.3 Å²	75.3	44%	0.442	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	131.9	174	30.1	0	0	0	0	111.9	H264 A265 I266	T256-H264 VanDerWaalsContact CG2-NE2 3.29Å; T256-H264 WeakPolarHBondContact CG2-NE2 3.33Å; T256-A265 WeakPolarHBondContact CA-O 3.32Å; T256-I266 HydrophobicContact CG2-CD1 3.54Å; T256-I266 HydrophobicContact CG2-CG1 3.75Å
257	N	74.1	Confident	82.4	Confident	42 Å²	42	71.1 Å²	71.1	23%	0.225	38%	0.382	C	S	.	.			trans	-114.9	83.6	177.1	-73.1	-48.7	0	0	0	110.4	N259 A265 N267	N257-N259 PolarHBondContact O-N 3.21Å; N257-A265 HydrophobicContact CB-CB 4.19Å; N257-A265 PolarHBondContact N-O 2.9Å; N257-N267 PolarHBondContact ND2-ND2 3.07Å; N257-N267 PolarHBondContact ND2-OD1 3.41Å; N257-N267 VanDerWaalsContact ND2-OD1 3.14Å
258	L	65.7	Low	83	Confident	128 Å²	128	68.5 Å²	68.5	67%	0.67	36%	0.355	S	S	*	.			trans	-80.5	61	179.8	-74.2	156.9	0	0	0	112.2
259	N	62.1	Low	83.2	Confident	133 Å²	133	69.2 Å²	69.2	71%	0.711	36%	0.359	S	S	*	.			trans	-99.6	-11.5	-178.2	-75.5	-13.6	0	0	0	114.4	N257	N257-N259 PolarHBondContact O-N 3.21Å
260	W	62.5	Low	83.5	Confident	158 Å²	158	63.5 Å²	63.5	60%	0.598	33%	0.333	S	S	*	.	B	Isolated β-bridge	trans	-128.8	142.3	-173.7	-64	-42.7	0	0	0	112	N262 V263	W260-N262 VanDerWaalsContact C-N 3.29Å; W260-N262 PolarHBondContact O-N 2.95Å; W260-V263 HydrophobicContact CB-CB 4.07Å; W260-V263 HydrophobicContact CB-CG2 4.27Å; W260-V263 HydrophobicContact CE3-CB 4.02Å; W260-V263 HydrophobicContact CE3-CG1 4.01Å; W260-V263 HydrophobicContact CE3-CG2 4.41Å
261	T	68	Low	83.7	Confident	138 Å²	138	65.5 Å²	65.5	85%	0.847	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-5.8	-168.6	48.5	0	0	0	0	115.5
262	N	76.1	Confident	83.8	Confident	108 Å²	108	65 Å²	65	58%	0.578	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-145	23.1	178.8	-68	-60.4	0	0	0	113.1	L238 W260	L238-N262 VanDerWaalsContact CD1-C 3.41Å; W260-N262 VanDerWaalsContact C-N 3.29Å; W260-N262 PolarHBondContact O-N 2.95Å
263	V	85.1	Confident	84	Confident	33 Å²	33	62.7 Å²	62.7	20%	0.2	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	127.3	-179.5	-174.3	0	0	0	0	109.1	N232 G233 W260	N232-V263 HydrophobicContact CB-CG1 3.92Å; G233-V263 WeakPolarHBondContact O-CA 3.48Å; G233-V263 WeakPolarHBondContact O-CG1 3.4Å; W260-V263 HydrophobicContact CB-CB 4.07Å; W260-V263 HydrophobicContact CB-CG2 4.27Å; W260-V263 HydrophobicContact CE3-CB 4.02Å; W260-V263 HydrophobicContact CE3-CG1 4.01Å; W260-V263 HydrophobicContact CE3-CG2 4.41Å
264	H	88.1	Confident	84.2	Confident	22 Å²	22	60.8 Å²	60.8	10%	0.102	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118	170.2	-170.5	-172.3	0	0	0	108.5	G233 P239 D240 V241 T256	G233-H264 PolarHBondContact N-O 3.14Å; G233-H264 PolarHBondContact O-N 2.65Å; P239-H264 WeakPolarHBondContact O-CB 3.45Å; P239-H264 PolarHBondContact O-ND1 3.34Å; D240-H264 IonicContact OD1-CE1 3.16Å; D240-H264 PolarHBondContact OD1-CE1 3.36Å; D240-H264 IonicContact OD1-ND1 3.5Å; V241-H264 HydrophobicContact CB-CB 4.37Å; V241-H264 HydrophobicContact CG2-CB 3.86Å; V241-H264 PolarHBondContact N-ND1 3.18Å; T256-H264 VanDerWaalsContact CG2-NE2 3.29Å; T256-H264 WeakPolarHBondContact CG2-NE2 3.33Å
265	A	90	Very high	84.2	Confident	3 Å²	3	58.2 Å²	58.2	3%	0.025	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	127.9	-177	0	0	0	0	0	111	C231 N232 T256 N257	C231-A265 CarbonylContact O-C 3.48Å; C231-A265 VanDerWaalsContact O-CA 3.3Å; C231-A265 WeakPolarHBondContact O-CA 3.45Å; N232-A265 WeakPolarHBondContact OD1-CB 3.44Å; T256-A265 WeakPolarHBondContact CA-O 3.32Å; N257-A265 HydrophobicContact CB-CB 4.19Å; N257-A265 PolarHBondContact N-O 2.9Å
266	I	92.6	Very high	84.2	Confident	11 Å²	11	59.5 Å²	59.5	6%	0.056	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.9	172.7	-59.8	-148	0	0	0	110.6	C231 V241 W243 H254 T256	C231-I266 PolarHBondContact N-O 3.48Å; C231-I266 PolarHBondContact O-N 3.45Å; V241-I266 HydrophobicContact CG1-CG1 4.43Å; V241-I266 WeakPolarHBondContact O-CD1 3.25Å; W243-I266 PolarHBondContact NE1-O 3.15Å; H254-I266 HydrophobicContact CB-CG2 4.06Å; T256-I266 HydrophobicContact CG2-CD1 3.54Å; T256-I266 HydrophobicContact CG2-CG1 3.75Å
267	N	92.6	Very high	84.6	Confident	30 Å²	30	56.2 Å²	56.2	16%	0.16	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.4	166.3	-71.7	4.5	0	0	0	109.7	V228 I229 T230 H254 Q255 N257	V228-N267 HydrophobicContact CG1-CB 4.14Å; I229-N267 CarbonylContact O-C 3.52Å; I229-N267 WeakPolarHBondContact O-CA 3.49Å; T230-N267 WeakPolarHBondContact CB-OD1 3.34Å; T230-N267 VanDerWaalsContact CG2-OD1 3.3Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.5Å; T230-N267 PolarHBondContact OG1-OD1 2.8Å; H254-N267 WeakPolarHBondContact CA-O 3.22Å; Q255-N267 PolarHBondContact N-O 2.9Å; Q255-N267 PolarHBondContact O-N 2.91Å; N257-N267 PolarHBondContact ND2-ND2 3.07Å; N257-N267 PolarHBondContact ND2-OD1 3.41Å; N257-N267 VanDerWaalsContact ND2-OD1 3.14Å
268	L	93.9	Very high	85.4	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.4	162.2	176.7	62.2	0	0	0	108.3	V228 I229 W243 V245 N252 L270 L282	V228-L268 WeakPolarHBondContact CA-O 3.49Å; I229-L268 PolarHBondContact N-O 2.97Å; I229-L268 PolarHBondContact O-N 3.39Å; W243-L268 HydrophobicContact CB-CD2 4.22Å; W243-L268 HydrophobicContact CD2-CB 4Å; W243-L268 HydrophobicContact CD2-CD2 3.9Å; W243-L268 HydrophobicContact CE3-CD2 4.04Å; W243-L268 HydrophobicContact CG-CB 3.87Å; W243-L268 HydrophobicContact CG-CD2 4.02Å; W243-L268 HydrophobicContact CG-CG 4.42Å; W243-L268 HydrophobicContact CZ2-CB 4.48Å; V245-L268 HydrophobicContact CG1-CD1 3.87Å; V245-L268 HydrophobicContact CG1-CD2 4.07Å; N252-L268 HydrophobicContact CB-CD1 3.87Å; L268-L270 HydrophobicContact CD1-CD2 4.12Å; L268-L270 HydrophobicContact CD2-CD2 4.09Å; L268-L270 HydrophobicContact CG-CD2 3.93Å; L268-L282 HydrophobicContact CD2-CD1 4.35Å; L268-L282 HydrophobicContact CD2-CD2 4.03Å
269	T	93.6	Very high	86.4	Confident	30 Å²	30	52.6 Å²	52.6	18%	0.184	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.3	169.8	-56.2	0	0	0	0	108.8	A227 V228 N252 T253 V271	A227-T269 CarbonylContact O-C 3.39Å; A227-T269 WeakPolarHBondContact O-CA 3.21Å; V228-T269 HydrophobicContact CG2-CG2 4.02Å; N252-T269 CarbonylContact C-O 3.51Å; N252-T269 WeakPolarHBondContact CA-O 3.44Å; T253-T269 PolarHBondContact N-O 3.17Å; T253-T269 PolarHBondContact O-N 2.8Å; T269-V271 HydrophobicContact CG2-CG2 4.02Å
270	L	94.4	Very high	87.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	131	170	-53.8	-176.5	0	0	0	108.9	N226 A227 L248 N252 L268 V273 L282 L299	N226-L270 CarbonylContact C-O 3.58Å; N226-L270 VanDerWaalsContact CA-O 3.25Å; N226-L270 WeakPolarHBondContact CA-O 3.37Å; N226-L270 WeakPolarHBondContact CB-O 3.29Å; A227-L270 PolarHBondContact N-O 3.31Å; A227-L270 PolarHBondContact O-N 3.14Å; L248-L270 HydrophobicContact CD2-CD2 3.67Å; N252-L270 HydrophobicContact CB-CD2 3.94Å; L268-L270 HydrophobicContact CD1-CD2 4.12Å; L268-L270 HydrophobicContact CD2-CD2 4.09Å; L268-L270 HydrophobicContact CG-CD2 3.93Å; L270-V273 HydrophobicContact CB-CG2 3.67Å; L270-V273 HydrophobicContact CD1-CG2 4.29Å; L270-L282 HydrophobicContact CD1-CD1 4.06Å; L270-L299 HydrophobicContact CD1-CD1 4.48Å; L270-L299 HydrophobicContact CD1-CD2 4.15Å
271	V	92.4	Very high	89.2	Confident	48 Å²	48	44.7 Å²	44.7	29%	0.291	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.3	-176.7	-178.5	0	0	0	0	109.6	N226 I251 T269	N226-V271 VanDerWaalsContact OD1-CA 3.31Å; N226-V271 WeakPolarHBondContact OD1-CA 3.17Å; I251-V271 HydrophobicContact CB-CB 4.26Å; I251-V271 HydrophobicContact CG2-CB 4.33Å; I251-V271 PolarHBondContact O-N 3.21Å; T269-V271 HydrophobicContact CG2-CG2 4.02Å
272	N	90.7	Very high	90.4	Very high	102 Å²	102	38.2 Å²	38.2	55%	0.545	22%	0.219	S	C	.	.	S	Bend	trans	52.3	61.8	-179.5	-175.2	66.1	0	0	0	111.6	N226 T274	N226-N272 PolarHBondContact OD1-N 3.43Å; N272-T274 PolarHBondContact O-N 3.05Å
273	V	93.8	Very high	91.2	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.006	20%	0.2	C	C	.	.			trans	-59.5	130.3	-171.7	173.3	0	0	0	0	111.4	V221 E223 G224 D225 S250 L270 V301	V221-V273 HydrophobicContact CG1-CB 4.24Å; V221-V273 HydrophobicContact CG1-CG2 4.1Å; E223-V273 CarbonylContact C-O 3.56Å; E223-V273 VanDerWaalsContact CA-O 3.3Å; E223-V273 WeakPolarHBondContact CA-O 3.24Å; G224-V273 PolarHBondContact N-O 3.5Å; D225-V273 WeakPolarHBondContact O-CG2 3.33Å; D225-V273 PolarHBondContact O-N 2.8Å; S250-V273 WeakPolarHBondContact OG-CA 3.29Å; L270-V273 HydrophobicContact CB-CG2 3.67Å; L270-V273 HydrophobicContact CD1-CG2 4.29Å; V273-V301 HydrophobicContact CG1-CB 4.41Å; V273-V301 HydrophobicContact CG1-CG1 3.94Å; V273-V301 HydrophobicContact CG1-CG2 3.54Å
274	T	92	Very high	91.6	Very high	34 Å²	34	32.9 Å²	32.9	21%	0.209	19%	0.191	C	C	.	.			trans	-91.9	149.5	-179.7	175	0	0	0	0	112.6	Q249 S250 N272 E276 D277	Q249-T274 HydrophobicContact CB-CG2 3.67Å; S250-T274 PolarHBondContact OG-N 3.27Å; N272-T274 PolarHBondContact O-N 3.05Å; T274-E276 HydrophobicContact CG2-CB 4.19Å; T274-E276 PolarHBondContact O-N 2.94Å; T274-E276 PolarHBondContact OG1-N 3.19Å; T274-D277 WeakPolarHBondContact CG2-OD2 3.49Å; T274-D277 PolarHBondContact O-N 3.3Å
275	S	90.3	Very high	91.9	Very high	15 Å²	15	33.1 Å²	33.1	11%	0.105	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-57.2	-24.3	171.2	59.9	0	0	0	0	113.7	D277 N278 Y303	S275-D277 VanDerWaalsContact C-N 3.25Å; S275-D277 PolarHBondContact O-N 2.81Å; S275-N278 WeakPolarHBondContact O-CB 3.14Å; S275-N278 PolarHBondContact O-N 2.91Å; S275-Y303 VanDerWaalsContact CB-CD1 3.47Å
276	E	88.9	Confident	92	Very high	141 Å²	141	33 Å²	33	66%	0.659	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-70.1	-19	-178.5	-61.6	-168.8	152.6	0	0	113.8	Q249 T274 N278	Q249-E276 HydrophobicContact CG-CB 4.4Å; T274-E276 HydrophobicContact CG2-CB 4.19Å; T274-E276 PolarHBondContact O-N 2.94Å; T274-E276 PolarHBondContact OG1-N 3.19Å; E276-N278 VanDerWaalsContact C-N 3.31Å
277	D	90.4	Very high	92	Very high	4 Å²	4	34.4 Å²	34.4	2%	0.021	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-90.1	10.2	175.5	-63.5	-40.3	0	0	0	112.8	L248 Q249 S250 T274 S275 G279 F280 L299	L248-D277 HydrophobicContact CD1-CB 3.87Å; L248-D277 VanDerWaalsContact CD1-CG 3.42Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.33Å; Q249-D277 PolarHBondContact N-OD1 2.88Å; Q249-D277 PolarHBondContact N-OD2 2.8Å; S250-D277 WeakPolarHBondContact CB-OD2 3.39Å; S250-D277 PolarHBondContact N-OD2 3.39Å; S250-D277 PolarHBondContact OG-OD2 3.21Å; T274-D277 WeakPolarHBondContact CG2-OD2 3.49Å; T274-D277 PolarHBondContact O-N 3.3Å; S275-D277 VanDerWaalsContact C-N 3.25Å; S275-D277 PolarHBondContact O-N 2.81Å; D277-G279 PolarHBondContact O-N 3.33Å; D277-F280 HydrophobicContact CB-CB 4.32Å; D277-F280 WeakPolarHBondContact O-CB 3.48Å; D277-F280 PolarHBondContact O-N 2.86Å; D277-L299 HydrophobicContact CB-CD2 3.89Å
278	N	89.4	Confident	92.1	Very high	38 Å²	38	33.6 Å²	33.6	20%	0.203	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	129.6	175.6	-171.9	44.7	0	0	0	111.3	S275 E276 F280 T300 V301 Y303 N328 E357	S275-N278 WeakPolarHBondContact O-CB 3.14Å; S275-N278 PolarHBondContact O-N 2.91Å; E276-N278 VanDerWaalsContact C-N 3.31Å; N278-F280 PolarHBondContact O-N 2.85Å; N278-T300 WeakPolarHBondContact OD1-CA 3.24Å; N278-V301 HydrophobicContact CB-CB 4.1Å; N278-V301 HydrophobicContact CB-CG2 4.45Å; N278-V301 PolarHBondContact OD1-N 3.42Å; N278-V301 PolarHBondContact OD1-O 3.46Å; N278-Y303 HydrophobicContact CB-CE1 4.41Å; N278-N328 PolarHBondContact ND2-ND2 3.23Å; N278-N328 VanDerWaalsContact ND2-ND2 3.15Å; N278-N328 PolarHBondContact OD1-ND2 2.82Å; N278-E357 PolarHBondContact ND2-OE2 2.96Å
279	G	88.2	Confident	92	Very high	55 Å²	55	36.1 Å²	36.1	57%	0.567	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.3	0.4	-173.7	0	0	0	0	0	114.3	D277 T281 L299	D277-G279 PolarHBondContact O-N 3.33Å; G279-T281 PolarHBondContact O-N 2.76Å; G279-L299 WeakPolarHBondContact CA-O 3.31Å; G279-L299 PolarHBondContact N-O 2.89Å
280	F	91.1	Very high	92	Very high	50 Å²	50	34.9 Å²	34.9	22%	0.219	20%	0.201	C	C	.	.			trans	-62.3	137.3	176.7	-163.4	-81.4	0	0	0	110.8	L248 D277 N278 L282 L299	L248-F280 HydrophobicContact CB-CE1 4.37Å; L248-F280 HydrophobicContact CB-CE2 4.24Å; L248-F280 HydrophobicContact CB-CZ 4.04Å; L248-F280 HydrophobicContact CD1-CB 4.25Å; L248-F280 HydrophobicContact CD1-CD1 3.69Å; L248-F280 HydrophobicContact CD1-CD2 4.01Å; L248-F280 HydrophobicContact CD1-CE1 3.99Å; L248-F280 HydrophobicContact CD1-CE2 4.29Å; L248-F280 HydrophobicContact CD1-CG 3.71Å; L248-F280 HydrophobicContact CD1-CZ 4.28Å; D277-F280 HydrophobicContact CB-CB 4.32Å; D277-F280 WeakPolarHBondContact O-CB 3.48Å; D277-F280 PolarHBondContact O-N 2.86Å; N278-F280 PolarHBondContact O-N 2.85Å; F280-L282 HydrophobicContact CD1-CD2 3.74Å; F280-L282 HydrophobicContact CD1-CG 4.11Å; F280-L282 HydrophobicContact CE1-CD2 3.94Å; F280-L299 HydrophobicContact CB-CB 4.49Å; F280-L299 WeakPolarHBondContact O-CB 3.39Å; F280-L299 PolarHBondContact O-N 2.75Å
281	T	91.8	Very high	91.9	Very high	76 Å²	76	35.2 Å²	35.2	47%	0.466	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	96.5	178.6	-57.6	0	0	0	0	109.8	G279 T283	G279-T281 PolarHBondContact O-N 2.76Å; T281-T283 PolarHBondContact O-N 2.73Å; T281-T283 PolarHBondContact O-OG1 2.66Å
282	L	92.9	Very high	91.8	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	112.4	177.3	-63.6	169.5	0	0	0	108.2	I229 W243 L248 L268 L270 F280 S296 V297 L299	I229-L282 HydrophobicContact CD1-CD1 3.32Å; W243-L282 HydrophobicContact CE3-CB 4.25Å; W243-L282 HydrophobicContact CZ3-CB 3.95Å; L248-L282 HydrophobicContact CD1-CD2 3.94Å; L248-L282 HydrophobicContact CD2-CD2 3.99Å; L268-L282 HydrophobicContact CD2-CD1 4.35Å; L268-L282 HydrophobicContact CD2-CD2 4.03Å; L270-L282 HydrophobicContact CD1-CD1 4.06Å; F280-L282 HydrophobicContact CD1-CD2 3.74Å; F280-L282 HydrophobicContact CD1-CG 4.11Å; F280-L282 HydrophobicContact CE1-CD2 3.94Å; L282-S296 CarbonylContact O-C 3.6Å; L282-S296 WeakPolarHBondContact O-CA 3.39Å; L282-V297 HydrophobicContact CB-CB 4.37Å; L282-V297 PolarHBondContact N-O 2.93Å; L282-V297 PolarHBondContact O-N 2.94Å; L282-L299 HydrophobicContact CD1-CB 4.23Å; L282-L299 HydrophobicContact CD1-CD2 4.4Å
283	T	93.1	Very high	91.9	Very high	29 Å²	29	32.8 Å²	32.8	18%	0.178	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	117	-175.8	-60.8	0	0	0	0	109.6	I244 T281 N294 A295 S296	I244-T283 PolarHBondContact N-O 2.88Å; T281-T283 PolarHBondContact O-N 2.73Å; T281-T283 PolarHBondContact O-OG1 2.66Å; T283-N294 HydrophobicContact CG2-CB 4.09Å; T283-A295 CarbonylContact C-O 3.57Å; T283-A295 WeakPolarHBondContact CA-O 3.23Å; T283-S296 PolarHBondContact OG1-OG 2.83Å
284	C	94.1	Very high	91.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	141.1	166.1	-174.3	0	0	0	0	109.5	I212 V214 C231 D242 W243 N294 A295	I212-C284 HydrophobicContact CD1-CB 4.08Å; I212-C284 WeakPolarHBondContact CD1-O 3.35Å; V214-C284 HydrophobicContact CG1-CB 4.25Å; C231-C284 HydrophobicContact CB-CB 3.66Å; C231-C284 WeakPolarHBondContact CB-SG 3.31Å; C231-C284 WeakPolarHBondContact SG-CB 3.49Å; C231-C284 CovalentContact SG-SG 2.03Å; C231-C284 PolarHBondContact SG-SG 2.81Å; D242-C284 WeakPolarHBondContact O-CA 3.26Å; W243-C284 HydrophobicContact CD2-CB 3.92Å; W243-C284 HydrophobicContact CE3-CB 3.77Å; W243-C284 HydrophobicContact CH2-CB 4.06Å; W243-C284 HydrophobicContact CZ2-CB 4.22Å; W243-C284 HydrophobicContact CZ3-CB 3.83Å; C284-N294 VanDerWaalsContact O-CA 3.25Å; C284-N294 WeakPolarHBondContact O-CA 3.34Å; C284-N294 WeakPolarHBondContact O-CB 3.16Å; C284-A295 PolarHBondContact N-O 2.95Å; C284-A295 PolarHBondContact O-N 3.47Å
285	I	93.1	Very high	91.9	Very high	28 Å²	28	36.9 Å²	36.9	14%	0.144	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	145.9	171.2	52.4	169.1	0	0	0	110	V241 D242 I244 M292 N294	V241-I285 WeakPolarHBondContact CA-O 3.44Å; D242-I285 HydrophobicContact CB-CG1 4.49Å; D242-I285 PolarHBondContact N-O 2.87Å; D242-I285 WeakPolarHBondContact O-CG1 3.46Å; D242-I285 PolarHBondContact O-N 3.04Å; I244-I285 HydrophobicContact CD1-CD1 4.41Å; I244-I285 HydrophobicContact CD1-CG2 3.65Å; I244-I285 HydrophobicContact CG1-CD1 4.3Å; I244-I285 HydrophobicContact CG1-CG1 4.35Å; I244-I285 HydrophobicContact CG1-CG2 4.19Å; I285-M292 HydrophobicContact CB-CE 4.06Å; I285-M292 HydrophobicContact CB-CG 4.46Å; I285-M292 HydrophobicContact CB-SD 4.19Å; I285-M292 HydrophobicContact CD1-CE 3.77Å; I285-M292 HydrophobicContact CG1-CE 4.49Å; I285-M292 HydrophobicContact CG2-CE 4.19Å; I285-M292 HydrophobicContact CG2-SD 3.84Å; I285-N294 HydrophobicContact CG2-CB 4.16Å
286	A	93.4	Very high	92	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	126	167.5	0	0	0	0	0	108.1	P210 I212 P239 D240 V241 M292 S293	P210-A286 HydrophobicContact CB-CB 4.07Å; P210-A286 HydrophobicContact CG-CB 4.26Å; P210-A286 WeakPolarHBondContact CG-O 3.3Å; I212-A286 HydrophobicContact CB-CB 4.26Å; I212-A286 HydrophobicContact CD1-CB 3.96Å; I212-A286 HydrophobicContact CG1-CB 4.29Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.44Å; D240-A286 CarbonylContact O-C 3.33Å; D240-A286 VanDerWaalsContact O-CA 3.3Å; D240-A286 WeakPolarHBondContact O-CA 3.37Å; V241-A286 HydrophobicContact CG2-CB 4.02Å; A286-M292 CarbonylContact O-C 3.57Å; A286-M292 VanDerWaalsContact O-CA 3.31Å; A286-M292 WeakPolarHBondContact O-CA 3.35Å; A286-S293 PolarHBondContact N-O 3.09Å; A286-S293 PolarHBondContact O-N 3.25Å
287	E	92.6	Very high	92.2	Very high	40 Å²	40	32.3 Å²	32.3	19%	0.187	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139	-177.2	63.5	169.1	-124	0	0	113.1	W144 Q145 P239 D240 G291 M292	W144-E287 HydrophobicContact CH2-CB 4.37Å; W144-E287 HydrophobicContact CZ2-CB 4.11Å; Q145-E287 PolarHBondContact NE2-OE1 2.85Å; P239-E287 CarbonylContact C-O 3.6Å; P239-E287 WeakPolarHBondContact CA-O 3.31Å; P239-E287 WeakPolarHBondContact CB-O 3.46Å; D240-E287 HydrophobicContact CB-CG 4.23Å; D240-E287 PolarHBondContact N-O 3.37Å; D240-E287 PolarHBondContact O-N 3.2Å; E287-G291 WeakPolarHBondContact CA-O 3.37Å; E287-M292 HydrophobicContact CB-CB 4.32Å; E287-M292 HydrophobicContact CB-CE 4.17Å; E287-M292 VanDerWaalsContact OE2-CE 3.29Å; E287-M292 WeakPolarHBondContact OE2-CE 3.47Å
288	N	93.1	Very high	92.3	Very high	14 Å²	14	33.9 Å²	33.9	8%	0.075	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	-175.9	170.7	74.9	7.7	0	0	0	110.3	W144 D208 P237 P239 V290 G291	W144-N288 PolarHBondContact NE1-O 3.46Å; D208-N288 PolarHBondContact O-ND2 3.44Å; P237-N288 PolarHBondContact O-ND2 2.87Å; P239-N288 HydrophobicContact CB-CB 4.42Å; N288-V290 PolarHBondContact O-N 3.07Å; N288-V290 VanDerWaalsContact O-N 3.1Å; N288-V290 WeakPolarHBondContact OD1-CA 3.37Å; N288-V290 VanDerWaalsContact OD1-CB 3.29Å; N288-V290 WeakPolarHBondContact OD1-CB 3.21Å; N288-V290 PolarHBondContact OD1-N 2.92Å; N288-G291 PolarHBondContact N-O 3.49Å; N288-G291 PolarHBondContact O-N 3.38Å; N288-G291 PolarHBondContact OD1-N 2.95Å; N288-G291 PolarHBondContact OD1-O 2.88Å
289	V	92.4	Very high	92.5	Very high	53 Å²	53	32 Å²	32	32%	0.321	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-14.8	-179.3	-60.1	0	0	0	0	114.5	C166 P237	C166-V289 HydrophobicContact CB-CG2 4.19Å; P237-V289 HydrophobicContact CG-CG2 3.87Å
290	V	93.6	Very high	92.7	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.018	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-31.1	178.7	-173.2	0	0	0	0	112.1	C166 R169 W170 L173 L209 N288	C166-V290 WeakPolarHBondContact SG-CG2 3.31Å; R169-V290 HydrophobicContact CB-CG1 4.01Å; R169-V290 HydrophobicContact CB-CG2 4.1Å; R169-V290 HydrophobicContact CG-CB 4.44Å; R169-V290 HydrophobicContact CG-CG1 3.54Å; R169-V290 HydrophobicContact CG-CG2 4.12Å; W170-V290 VanDerWaalsContact CB-O 3.23Å; W170-V290 WeakPolarHBondContact CB-O 3.26Å; L173-V290 HydrophobicContact CD1-CG1 3.61Å; L209-V290 HydrophobicContact CD2-CB 4.49Å; L209-V290 HydrophobicContact CD2-CG1 4.06Å; L209-V290 HydrophobicContact CG-CG1 4.24Å; N288-V290 PolarHBondContact O-N 3.07Å; N288-V290 VanDerWaalsContact O-N 3.1Å; N288-V290 WeakPolarHBondContact OD1-CA 3.37Å; N288-V290 VanDerWaalsContact OD1-CB 3.29Å; N288-V290 WeakPolarHBondContact OD1-CB 3.21Å; N288-V290 PolarHBondContact OD1-N 2.92Å
291	G	91.6	Very high	92.9	Very high	8 Å²	8	29 Å²	29	8%	0.082	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.1	-164	178.7	0	0	0	0	0	113.4	E287 N288	E287-G291 WeakPolarHBondContact CA-O 3.37Å; N288-G291 PolarHBondContact N-O 3.49Å; N288-G291 PolarHBondContact O-N 3.38Å; N288-G291 PolarHBondContact OD1-N 2.95Å; N288-G291 PolarHBondContact OD1-O 2.88Å
292	M	91.8	Very high	93.1	Very high	73 Å²	73	29.5 Å²	29.5	36%	0.36	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	141.3	178	173.9	-178.1	-79	0	0	110.5	W144 I285 A286 E287	W144-M292 HydrophobicContact CH2-CB 3.72Å; W144-M292 HydrophobicContact CH2-CE 4.35Å; W144-M292 HydrophobicContact CZ2-CB 4.23Å; W144-M292 HydrophobicContact CZ3-CB 4.37Å; I285-M292 HydrophobicContact CB-CE 4.06Å; I285-M292 HydrophobicContact CB-CG 4.46Å; I285-M292 HydrophobicContact CB-SD 4.19Å; I285-M292 HydrophobicContact CD1-CE 3.77Å; I285-M292 HydrophobicContact CG1-CE 4.49Å; I285-M292 HydrophobicContact CG2-CE 4.19Å; I285-M292 HydrophobicContact CG2-SD 3.84Å; A286-M292 CarbonylContact O-C 3.57Å; A286-M292 VanDerWaalsContact O-CA 3.31Å; A286-M292 WeakPolarHBondContact O-CA 3.35Å; E287-M292 HydrophobicContact CB-CB 4.32Å; E287-M292 HydrophobicContact CB-CE 4.17Å; E287-M292 VanDerWaalsContact OE2-CE 3.29Å; E287-M292 WeakPolarHBondContact OE2-CE 3.47Å
293	S	91.3	Very high	93.1	Very high	25 Å²	25	29.7 Å²	29.7	18%	0.175	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	160.5	161.7	66.3	0	0	0	0	110.1	P210 I212 A286	P210-S293 WeakPolarHBondContact O-CB 3.32Å; P210-S293 PolarHBondContact O-OG 3.26Å; I212-S293 WeakPolarHBondContact CG2-OG 3.47Å; A286-S293 PolarHBondContact N-O 3.09Å; A286-S293 PolarHBondContact O-N 3.25Å
294	N	93.3	Very high	93.2	Very high	105 Å²	105	30.5 Å²	30.5	56%	0.561	18%	0.176	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-140	156.9	178.5	60.3	40.8	0	0	0	111.8	T283 C284 I285	T283-N294 HydrophobicContact CG2-CB 4.09Å; C284-N294 VanDerWaalsContact O-CA 3.25Å; C284-N294 WeakPolarHBondContact O-CA 3.34Å; C284-N294 WeakPolarHBondContact O-CB 3.16Å; I285-N294 HydrophobicContact CG2-CB 4.16Å
295	A	92.9	Very high	93.2	Very high	17 Å²	17	30.8 Å²	30.8	14%	0.14	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	136.9	175.8	0	0	0	0	0	108.8	I212 V214 T283 C284	I212-A295 HydrophobicContact CD1-CB 3.93Å; I212-A295 HydrophobicContact CG1-CB 3.98Å; I212-A295 HydrophobicContact CG2-CB 4.07Å; V214-A295 HydrophobicContact CG1-CB 3.78Å; V214-A295 HydrophobicContact CG2-CB 4.18Å; T283-A295 CarbonylContact C-O 3.57Å; T283-A295 WeakPolarHBondContact CA-O 3.23Å; C284-A295 PolarHBondContact N-O 2.95Å; C284-A295 PolarHBondContact O-N 3.47Å
296	S	92.9	Very high	93.1	Very high	59 Å²	59	34.8 Å²	34.8	41%	0.413	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	140.5	-175.3	-66.3	0	0	0	0	111.5	L282 T283	L282-S296 CarbonylContact O-C 3.6Å; L282-S296 WeakPolarHBondContact O-CA 3.39Å; T283-S296 PolarHBondContact OG1-OG 2.83Å
297	V	93	Very high	92.9	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	122.4	175.2	-170.3	0	0	0	0	108.5	V214 H216 V217 L219 I229 W243 L282 L299	V214-V297 HydrophobicContact CB-CG2 3.98Å; V214-V297 HydrophobicContact CG1-CG2 4.12Å; V214-V297 HydrophobicContact CG2-CG2 4.02Å; H216-V297 HydrophobicContact CB-CG1 4.04Å; H216-V297 WeakPolarHBondContact O-CG2 3.48Å; V217-V297 WeakPolarHBondContact O-CA 3.22Å; L219-V297 HydrophobicContact CB-CG1 4.13Å; I229-V297 HydrophobicContact CD1-CG1 4.46Å; I229-V297 HydrophobicContact CG2-CG2 4.33Å; W243-V297 HydrophobicContact CH2-CG2 3.85Å; W243-V297 HydrophobicContact CZ3-CG2 4.1Å; L282-V297 HydrophobicContact CB-CB 4.37Å; L282-V297 PolarHBondContact N-O 2.93Å; L282-V297 PolarHBondContact O-N 2.94Å; V297-L299 PolarHBondContact O-N 2.97Å
298	A	92.3	Very high	92.5	Very high	37 Å²	37	38.2 Å²	38.2	31%	0.306	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	118	176.5	0	0	0	0	0	110.2	V217 N218 L219	V217-A298 PolarHBondContact O-N 2.84Å; V217-A298 VanDerWaalsContact O-N 3.09Å; N218-A298 WeakPolarHBondContact CA-O 3.33Å; L219-A298 PolarHBondContact N-O 3.39Å
299	L	93.7	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	124	174.7	-178.6	61.3	0	0	0	110.2	L219 V221 L270 D277 G279 F280 L282 V297 V301	L219-L299 HydrophobicContact CB-CD1 4.38Å; L219-L299 HydrophobicContact CD2-CD1 3.89Å; L219-L299 HydrophobicContact CG-CD1 4.32Å; V221-L299 HydrophobicContact CG2-CD1 3.86Å; L270-L299 HydrophobicContact CD1-CD1 4.48Å; L270-L299 HydrophobicContact CD1-CD2 4.15Å; D277-L299 HydrophobicContact CB-CD2 3.89Å; G279-L299 WeakPolarHBondContact CA-O 3.31Å; G279-L299 PolarHBondContact N-O 2.89Å; F280-L299 HydrophobicContact CB-CB 4.49Å; F280-L299 WeakPolarHBondContact O-CB 3.39Å; F280-L299 PolarHBondContact O-N 2.75Å; L282-L299 HydrophobicContact CD1-CB 4.23Å; L282-L299 HydrophobicContact CD1-CD2 4.4Å; V297-L299 PolarHBondContact O-N 2.97Å; L299-V301 HydrophobicContact CD1-CG2 4.37Å; L299-V301 HydrophobicContact CD2-CG2 4.15Å; L299-V301 HydrophobicContact CG-CG2 3.96Å
300	T	93.4	Very high	91.9	Very high	41 Å²	41	37.1 Å²	37.1	25%	0.252	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	119.6	170	-55.5	0	0	0	0	108.9	L219 T220 V221 N278 Y302	L219-T300 PolarHBondContact O-N 3.3Å; T220-T300 VanDerWaalsContact CA-O 3.31Å; T220-T300 WeakPolarHBondContact CA-O 3.25Å; T220-T300 HydrophobicContact CG2-CG2 4.3Å; V221-T300 PolarHBondContact N-O 3.42Å; N278-T300 WeakPolarHBondContact OD1-CA 3.24Å; T300-Y302 HydrophobicContact CG2-CD1 4.07Å; T300-Y302 HydrophobicContact CG2-CE1 3.73Å
301	V	94.6	Very high	91.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.8	177.4	-171.7	0	0	0	0	109.1	V221 E223 V273 N278 L299 Y303 N328	V221-V301 CarbonylContact O-C 3.57Å; V221-V301 WeakPolarHBondContact O-CA 3.32Å; E223-V301 HydrophobicContact CB-CG1 4.25Å; V273-V301 HydrophobicContact CG1-CB 4.41Å; V273-V301 HydrophobicContact CG1-CG1 3.94Å; V273-V301 HydrophobicContact CG1-CG2 3.54Å; N278-V301 HydrophobicContact CB-CB 4.1Å; N278-V301 HydrophobicContact CB-CG2 4.45Å; N278-V301 PolarHBondContact OD1-N 3.42Å; N278-V301 PolarHBondContact OD1-O 3.46Å; L299-V301 HydrophobicContact CD1-CG2 4.37Å; L299-V301 HydrophobicContact CD2-CG2 4.15Å; L299-V301 HydrophobicContact CG-CG2 3.96Å; V301-Y303 WeakPolarHBondContact O-CD1 3.38Å; V301-N328 PolarHBondContact O-ND2 2.94Å
302	Y	95.1	Very high	90.8	Very high	86 Å²	86	48 Å²	48	34%	0.337	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130	173.7	-68.4	-24	0	0	0	111.5	T220 V221 R222 E223 T300 N328 P329 L384	T220-Y302 HydrophobicContact CG2-CD2 3.82Å; T220-Y302 HydrophobicContact CG2-CE1 4.35Å; T220-Y302 HydrophobicContact CG2-CE2 3.6Å; T220-Y302 HydrophobicContact CG2-CG 4.29Å; V221-Y302 PolarHBondContact O-N 3Å; R222-Y302 CarbonylContact C-O 3.57Å; R222-Y302 VanDerWaalsContact CA-O 3.31Å; R222-Y302 WeakPolarHBondContact CA-O 3.46Å; E223-Y302 PolarHBondContact N-O 3.48Å; T300-Y302 HydrophobicContact CG2-CD1 4.07Å; T300-Y302 HydrophobicContact CG2-CE1 3.73Å; Y302-N328 CarbonylContact C-O 3.51Å; Y302-N328 WeakPolarHBondContact CA-O 3.46Å; Y302-N328 WeakPolarHBondContact CB-O 3.45Å; Y302-N328 HydrophobicContact CD1-CB 4.37Å; Y302-P329 HydrophobicContact CD1-CG 4.32Å; Y302-P329 HydrophobicContact CE1-CG 4.2Å; Y302-L384 VanDerWaalsContact C-CD1 3.48Å
303	Y	94.9	Very high	89.9	Confident	5 Å²	5	45.7 Å²	45.7	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153	-175.3	58.8	-86.4	0	0	0	111.9	E223 S275 N278 V301 R326 N328 E357 N382	E223-Y303 WeakPolarHBondContact OE2-CB 3.28Å; S275-Y303 VanDerWaalsContact CB-CD1 3.47Å; N278-Y303 HydrophobicContact CB-CE1 4.41Å; V301-Y303 WeakPolarHBondContact O-CD1 3.38Å; Y303-R326 HydrophobicContact CE2-CB 4.35Å; Y303-N328 HydrophobicContact CD1-CB 3.89Å; Y303-N328 HydrophobicContact CE1-CB 3.53Å; Y303-N328 PolarHBondContact N-O 2.81Å; Y303-N328 PolarHBondContact O-N 3.05Å; Y303-E357 WeakPolarHBondContact OH-CB 3.45Å; Y303-E357 PolarHBondContact OH-OE1 2.81Å; Y303-E357 PolarHBondContact OH-OE2 2.69Å; Y303-N382 PolarHBondContact O-ND2 3.18Å
304	P	94.3	Very high	88.3	Confident	46 Å²	46	48.7 Å²	48.7	30%	0.299	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	156.2	176.4	29.6	-36.5	0	0	0	111.4	L384	P304-L384 HydrophobicContact CB-CB 4.32Å
305	P	93.3	Very high	86.2	Confident	6 Å²	6	49.1 Å²	49.1	4%	0.039	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	151.8	-178.1	28.4	-34.4	0	0	0	111.9	V325 R326 P331 A380 N382 A387	P305-V325 HydrophobicContact CB-CG1 4.3Å; P305-R326 CarbonylContact C-O 3.36Å; P305-R326 WeakPolarHBondContact CA-O 3.43Å; P305-P331 HydrophobicContact CB-CB 3.88Å; P305-P331 HydrophobicContact CB-CG 4.12Å; P305-P331 HydrophobicContact CG-CB 4.36Å; P305-A380 HydrophobicContact CB-CB 3.85Å; P305-A380 HydrophobicContact CG-CB 4.22Å; P305-A380 WeakPolarHBondContact CG-O 3.41Å; P305-N382 WeakPolarHBondContact CD-OD1 3.48Å; P305-A387 HydrophobicContact CG-CB 4.46Å; P305-A387 WeakPolarHBondContact O-CB 3.46Å
306	R	91.2	Very high	84.2	Confident	112 Å²	112	53.4 Å²	53.4	42%	0.423	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	130	174.2	-60.5	-178.9	-176.6	166.8	2.6	108.5	E223 V308 V325 R326	E223-R306 IonicContact OE1-CZ 3.75Å; E223-R306 IonicContact OE1-NH1 2.7Å; E223-R306 IonicContact OE1-NH2 2.73Å; E223-R306 PolarHBondContact OE1-NH2 2.88Å; E223-R306 IonicContact OE2-CZ 3.14Å; E223-R306 IonicContact OE2-NH2 3.5Å; E223-R306 PolarHBondContact OE2-NH2 2.91Å; R306-V308 PolarHBondContact O-N 3.2Å; R306-V325 WeakPolarHBondContact O-CA 3.16Å; R306-R326 PolarHBondContact N-O 3.37Å; R306-R326 PolarHBondContact O-N 3.12Å
307	V	90.1	Very high	81.8	Confident	26 Å²	26	59.5 Å²	59.5	16%	0.158	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	117.9	168.1	-169.9	0	0	0	0	106.5	S309 L310 V325 L378 A387 Q389	V307-S309 WeakPolarHBondContact CG1-O 3.19Å; V307-L310 HydrophobicContact CG1-CB 4.22Å; V307-V325 HydrophobicContact CG2-CG2 4.33Å; V307-L378 HydrophobicContact CG1-CD2 4.36Å; V307-A387 HydrophobicContact CG2-CB 4.43Å; V307-Q389 HydrophobicContact CB-CB 4.13Å; V307-Q389 HydrophobicContact CG1-CB 4.1Å; V307-Q389 HydrophobicContact CG2-CB 4.17Å
308	V	83.6	Confident	80	Confident	87 Å²	87	62.9 Å²	62.9	53%	0.527	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-42.4	-176.4	179.1	0	0	0	0	110.3	R306 V324 R326	R306-V308 PolarHBondContact O-N 3.2Å; V308-V324 HydrophobicContact CB-CB 4.31Å; V308-V324 HydrophobicContact CB-CG1 4.18Å; V308-V324 PolarHBondContact N-O 2.87Å; V308-R326 HydrophobicContact CG2-CB 4.17Å; V308-R326 HydrophobicContact CG2-CG 3.84Å
309	S	85.8	Confident	78.9	Confident	30 Å²	30	62.8 Å²	62.8	21%	0.21	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149	170.4	64.3	0	0	0	0	110.9	V307 F323 V324	V307-S309 WeakPolarHBondContact CG1-O 3.19Å; S309-F323 WeakPolarHBondContact O-CA 3.49Å; S309-V324 PolarHBondContact N-O 2.92Å; S309-V324 PolarHBondContact O-N 3.28Å; S309-V324 WeakPolarHBondContact OG-CB 3.38Å; S309-V324 WeakPolarHBondContact OG-CG2 3.18Å; S309-V324 PolarHBondContact OG-N 3.38Å
310	L	87.8	Confident	78.4	Confident	14 Å²	14	63.4 Å²	63.4	7%	0.073	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	104.2	169.5	180	67.5	0	0	0	105.4	V307 I321 E322 F323 W335 Q389 I391	V307-L310 HydrophobicContact CG1-CB 4.22Å; L310-I321 HydrophobicContact CD1-CG2 3.55Å; L310-I321 HydrophobicContact CG-CG2 4.41Å; L310-E322 WeakPolarHBondContact CA-O 3.4Å; L310-F323 HydrophobicContact CD1-CB 4.12Å; L310-W335 HydrophobicContact CD1-CH2 3.62Å; L310-W335 HydrophobicContact CD1-CZ3 4.18Å; L310-Q389 HydrophobicContact CB-CG 4.35Å; L310-Q389 HydrophobicContact CD2-CB 3.89Å; L310-Q389 HydrophobicContact CD2-CG 3.84Å; L310-Q389 WeakPolarHBondContact CD2-O 3.38Å; L310-I391 HydrophobicContact CD1-CG2 4.25Å; L310-I391 HydrophobicContact CD2-CB 3.82Å; L310-I391 HydrophobicContact CD2-CG2 3.83Å; L310-I391 HydrophobicContact CG-CB 4.03Å; L310-I391 HydrophobicContact CG-CD1 4.36Å; L310-I391 HydrophobicContact CG-CG2 3.87Å; L310-I391 VanDerWaalsContact O-CD1 3.28Å; L310-I391 WeakPolarHBondContact O-CD1 3.05Å
311	E	81.4	Confident	78.1	Confident	93 Å²	93	61.4 Å²	61.4	44%	0.435	30%	0.301	S	S	.	.			trans	-102.6	151.9	-168.6	-63.5	-171.6	-165.7	0	0	112.4	E322	E311-E322 PolarHBondContact N-O 2.95Å
312	E	80.6	Confident	77.6	Confident	147 Å²	147	64 Å²	64	69%	0.687	31%	0.313	S	S	*	.			trans	-60.2	147.8	177.4	-72.4	-171	173.6	0	0	110.1	E314 I391	E312-E314 PolarHBondContact O-N 2.79Å; E312-I391 HydrophobicContact CB-CD1 4.47Å; E312-I391 HydrophobicContact CG-CD1 3.91Å; E312-I391 HydrophobicContact CG-CG1 4.28Å
313	P	71.9	Confident	77.3	Confident	24 Å²	24	60 Å²	60	16%	0.156	30%	0.297	C	S	.	.			trans	-60.1	103.2	-171.4	21.8	-33.4	0	0	0	112.9	H319 C320 I321 F395	P313-H319 HydrophobicContact CB-CB 4.48Å; P313-C320 WeakPolarHBondContact CA-O 3.42Å; P313-I321 HydrophobicContact CB-CG1 3.91Å; P313-I321 HydrophobicContact CG-CG1 4.47Å; P313-F395 HydrophobicContact CB-CD1 4.25Å; P313-F395 HydrophobicContact CB-CE1 3.59Å; P313-F395 HydrophobicContact CB-CZ 4.32Å; P313-F395 HydrophobicContact CG-CD1 4.34Å; P313-F395 HydrophobicContact CG-CE1 3.89Å; P313-F395 HydrophobicContact CG-CZ 4.41Å
314	E	57.6	Low	77	Confident	88 Å²	88	61.4 Å²	61.4	41%	0.411	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	138	177.1	-79.6	-149.9	148.5	0	0	111.2	E312 R316 C320	E312-E314 PolarHBondContact O-N 2.79Å; E314-R316 PolarHBondContact O-N 3.41Å; E314-R316 IonicContact OE2-CZ 2.81Å; E314-R316 IonicContact OE2-NE 3.65Å; E314-R316 PolarHBondContact OE2-NE 2.79Å; E314-R316 IonicContact OE2-NH2 3.69Å; E314-R316 PolarHBondContact OE2-NH2 2.88Å; E314-C320 PolarHBondContact N-O 3.46Å; E314-C320 VanDerWaalsContact N-O 3.14Å; E314-C320 PolarHBondContact O-N 2.78Å
315	L	50.6	Low	76.8	Confident	113 Å²	113	59.2 Å²	59.2	59%	0.592	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.3	88.3	174	-173.2	74.7	0	0	0	111.2	H319	L315-H319 VanDerWaalsContact CD1-CE1 3.49Å; L315-H319 WeakPolarHBondContact CD1-CE1 3.28Å; L315-H319 WeakPolarHBondContact CD1-NE2 3.45Å
316	R	50.5	Low	76.6	Confident	107 Å²	107	64 Å²	64	40%	0.404	31%	0.31	S	S	.	.	S	Bend	trans	-99.9	-155.9	165.9	-62.5	-175.8	-177.9	176.2	9.2	108.8	E314 E318 E322	E314-R316 PolarHBondContact O-N 3.41Å; E314-R316 IonicContact OE2-CZ 2.81Å; E314-R316 IonicContact OE2-NE 3.65Å; E314-R316 PolarHBondContact OE2-NE 2.79Å; E314-R316 IonicContact OE2-NH2 3.69Å; E314-R316 PolarHBondContact OE2-NH2 2.88Å; R316-E318 CarbonylContact C-O 3.56Å; R316-E318 VanDerWaalsContact C-O 3.31Å; R316-E318 PolarHBondContact N-O 3.17Å; R316-E318 PolarHBondContact O-N 3.15Å; R316-E322 IonicContact CZ-OE1 2.7Å; R316-E322 IonicContact NE-OE1 2.72Å; R316-E322 IonicContact NH1-OE1 2.79Å; R316-E322 PolarHBondContact NH1-OE1 3Å; R316-E322 IonicContact NH1-OE2 3.55Å; R316-E322 IonicContact NH2-OE1 2.83Å; R316-E322 PolarHBondContact NH2-OE1 2.69Å; R316-E322 IonicContact NH2-OE2 3.9Å
317	L	42.5	Very low	76.6	Confident	188 Å²	188	58.7 Å²	58.7	98%	0.984	29%	0.29	S	S	*	.	S	Bend	trans	-63.6	-23.2	177.7	-81.3	153.9	0	0	0	112.3
318	E	56.3	Low	76.7	Confident	70 Å²	70	58.4 Å²	58.4	33%	0.327	29%	0.287	S	S	.	.	S	Bend	trans	-129.5	160.2	166.1	-66.7	170.9	144.5	0	0	106.9	R316 L364	R316-E318 CarbonylContact C-O 3.56Å; R316-E318 VanDerWaalsContact C-O 3.31Å; R316-E318 PolarHBondContact N-O 3.17Å; R316-E318 PolarHBondContact O-N 3.15Å; E318-L364 HydrophobicContact CB-CD2 4.42Å
319	H	68.9	Low	77.1	Confident	36 Å²	36	56 Å²	56	17%	0.167	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	138.9	171.8	-70	80.2	0	0	0	108.7	P313 L315 F365 P368 F395	P313-H319 HydrophobicContact CB-CB 4.48Å; L315-H319 VanDerWaalsContact CD1-CE1 3.49Å; L315-H319 WeakPolarHBondContact CD1-CE1 3.28Å; L315-H319 WeakPolarHBondContact CD1-NE2 3.45Å; H319-F365 HydrophobicContact CB-CB 4.11Å; H319-F365 PolarHBondContact N-O 2.99Å; H319-F365 VanDerWaalsContact N-O 3.12Å; H319-F365 PolarHBondContact O-N 3.39Å; H319-P368 HydrophobicContact CB-CG 4.07Å; H319-F395 HydrophobicContact CB-CD1 3.95Å; H319-F395 HydrophobicContact CB-CE1 3.79Å; H319-F395 AromaticContact CD2-CD1 3.76Å; H319-F395 AromaticContact CG-CD1 3.84Å
320	C	81.8	Confident	77.3	Confident	12 Å²	12	57.2 Å²	57.2	8%	0.081	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	115.8	-170.9	-179.7	0	0	0	0	110.8	P313 E314 E322 C362 L364	P313-C320 WeakPolarHBondContact CA-O 3.42Å; E314-C320 PolarHBondContact N-O 3.46Å; E314-C320 VanDerWaalsContact N-O 3.14Å; E314-C320 PolarHBondContact O-N 2.78Å; C320-E322 PolarHBondContact O-N 2.87Å; C320-E322 WeakPolarHBondContact SG-CG 3.35Å; C320-C362 WeakPolarHBondContact CA-SG 3.34Å; C320-C362 HydrophobicContact CB-CB 4.48Å; C320-C362 WeakPolarHBondContact CB-SG 3.43Å; C320-C362 WeakPolarHBondContact SG-CB 3.44Å; C320-C362 CovalentContact SG-SG 2.02Å; C320-C362 PolarHBondContact SG-SG 2.78Å; C320-L364 HydrophobicContact CB-CD2 4.36Å
321	I	87.1	Confident	77.4	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	96	165.1	-63.5	178.7	0	0	0	106	L310 P313 W335 C362 L363 F365 Y376 I391	L310-I321 HydrophobicContact CD1-CG2 3.55Å; L310-I321 HydrophobicContact CG-CG2 4.41Å; P313-I321 HydrophobicContact CB-CG1 3.91Å; P313-I321 HydrophobicContact CG-CG1 4.47Å; I321-W335 HydrophobicContact CG2-CH2 3.83Å; I321-W335 HydrophobicContact CG2-CZ3 4.39Å; I321-C362 WeakPolarHBondContact O-CA 3.2Å; I321-L363 HydrophobicContact CB-CB 4.32Å; I321-L363 PolarHBondContact N-O 2.92Å; I321-L363 VanDerWaalsContact N-O 3.14Å; I321-L363 PolarHBondContact O-N 3.3Å; I321-F365 HydrophobicContact CB-CE2 4.35Å; I321-F365 HydrophobicContact CD1-CE2 3.61Å; I321-F365 HydrophobicContact CD1-CZ 3.87Å; I321-F365 HydrophobicContact CG1-CE2 3.77Å; I321-Y376 HydrophobicContact CD1-CD2 4.02Å; I321-Y376 HydrophobicContact CD1-CG 4.02Å; I321-I391 HydrophobicContact CD1-CG2 4.18Å; I321-I391 HydrophobicContact CG2-CG2 3.96Å
322	E	85.5	Confident	78	Confident	53 Å²	53	55.9 Å²	55.9	25%	0.248	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	136.5	178.2	-67.3	-169.1	177.8	0	0	110	L310 E311 R316 C320	L310-E322 WeakPolarHBondContact CA-O 3.4Å; E311-E322 PolarHBondContact N-O 2.95Å; R316-E322 IonicContact CZ-OE1 2.7Å; R316-E322 IonicContact NE-OE1 2.72Å; R316-E322 IonicContact NH1-OE1 2.79Å; R316-E322 PolarHBondContact NH1-OE1 3Å; R316-E322 IonicContact NH1-OE2 3.55Å; R316-E322 IonicContact NH2-OE1 2.83Å; R316-E322 PolarHBondContact NH2-OE1 2.69Å; R316-E322 IonicContact NH2-OE2 3.9Å; C320-E322 PolarHBondContact O-N 2.87Å; C320-E322 WeakPolarHBondContact SG-CG 3.35Å
323	F	88.3	Confident	78.6	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.9	177.6	68.6	-97	0	0	0	112.1	S309 L310 V325 L333 W335 Y352 G361 L378	S309-F323 WeakPolarHBondContact O-CA 3.49Å; L310-F323 HydrophobicContact CD1-CB 4.12Å; F323-V325 HydrophobicContact CD2-CG2 4.2Å; F323-L333 HydrophobicContact CD2-CD1 4.39Å; F323-L333 HydrophobicContact CE2-CD1 3.4Å; F323-L333 VanDerWaalsContact CE2-CD1 3.4Å; F323-L333 HydrophobicContact CZ-CD1 3.81Å; F323-W335 HydrophobicContact CD1-CH2 4.4Å; F323-W335 AromaticContact CD1-CZ2 3.6Å; F323-W335 HydrophobicContact CD1-CZ2 3.6Å; F323-W335 AromaticContact CE1-CZ2 3.9Å; F323-W335 HydrophobicContact CE1-CZ2 3.9Å; F323-W335 HydrophobicContact CG-CZ2 4.31Å; F323-Y352 HydrophobicContact CZ-CG 4.19Å; F323-G361 WeakPolarHBondContact CD1-O 3.38Å; F323-G361 PolarHBondContact N-O 2.86Å; F323-G361 PolarHBondContact O-N 2.91Å; F323-L378 HydrophobicContact CB-CD2 3.74Å; F323-L378 HydrophobicContact CD2-CD2 3.82Å; F323-L378 HydrophobicContact CG-CD2 3.78Å
324	V	87.8	Confident	79.6	Confident	35 Å²	35	53.9 Å²	53.9	21%	0.212	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	123.7	168.3	-179.6	0	0	0	0	108.3	V308 S309 I358 E360	V308-V324 HydrophobicContact CB-CB 4.31Å; V308-V324 HydrophobicContact CB-CG1 4.18Å; V308-V324 PolarHBondContact N-O 2.87Å; S309-V324 PolarHBondContact N-O 2.92Å; S309-V324 PolarHBondContact O-N 3.28Å; S309-V324 WeakPolarHBondContact OG-CB 3.38Å; S309-V324 WeakPolarHBondContact OG-CG2 3.18Å; S309-V324 PolarHBondContact OG-N 3.38Å; V324-I358 HydrophobicContact CG1-CG2 4.03Å; V324-E360 HydrophobicContact CG2-CB 4.15Å
325	V	90.1	Very high	81.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	137.3	174.5	179.4	0	0	0	0	108.7	P305 R306 V307 F323 P331 L333 S359 L378 A380	P305-V325 HydrophobicContact CB-CG1 4.3Å; R306-V325 WeakPolarHBondContact O-CA 3.16Å; V307-V325 HydrophobicContact CG2-CG2 4.33Å; F323-V325 HydrophobicContact CD2-CG2 4.2Å; V325-P331 HydrophobicContact CG1-CG 3.74Å; V325-L333 HydrophobicContact CB-CD2 4.34Å; V325-L333 HydrophobicContact CG1-CD2 4.25Å; V325-L333 HydrophobicContact CG2-CD2 4.08Å; V325-S359 PolarHBondContact N-O 3.01Å; V325-S359 PolarHBondContact O-N 3.17Å; V325-L378 HydrophobicContact CG2-CD2 3.67Å; V325-A380 HydrophobicContact CG1-CB 3.57Å; V325-A380 HydrophobicContact CG2-CB 4.32Å
326	R	89.5	Confident	83.5	Confident	108 Å²	108	47.1 Å²	47.1	41%	0.408	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	143.1	168	-71.3	-171.8	179.2	-177.8	-1.7	110.7	Y303 P305 R306 V308 E357 I358	Y303-R326 HydrophobicContact CE2-CB 4.35Å; P305-R326 CarbonylContact C-O 3.36Å; P305-R326 WeakPolarHBondContact CA-O 3.43Å; R306-R326 PolarHBondContact N-O 3.37Å; R306-R326 PolarHBondContact O-N 3.12Å; V308-R326 HydrophobicContact CG2-CB 4.17Å; V308-R326 HydrophobicContact CG2-CG 3.84Å; R326-E357 CarbonylContact C-O 3.56Å; R326-E357 VanDerWaalsContact CA-O 3.28Å; R326-E357 WeakPolarHBondContact CA-O 3.34Å; R326-I358 HydrophobicContact CG-CG1 4.24Å
327	G	90.6	Very high	85.5	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.5	140.3	173.6	0	0	0	0	0	112.3	P329 P330 E357	G327-P329 CarbonylContact C-O 3.56Å; G327-P329 CarbonylContact O-C 3.54Å; G327-P330 WeakPolarHBondContact O-CA 3.46Å; G327-E357 PolarHBondContact N-O 3.33Å; G327-E357 WeakPolarHBondContact O-CA 3.3Å
328	N	92.4	Very high	87.9	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.107	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	116.4	177.9	-169.4	13.6	0	0	0	110.2	N278 V301 Y302 Y303 E357	N278-N328 PolarHBondContact ND2-ND2 3.23Å; N278-N328 VanDerWaalsContact ND2-ND2 3.15Å; N278-N328 PolarHBondContact OD1-ND2 2.82Å; V301-N328 PolarHBondContact O-ND2 2.94Å; Y302-N328 CarbonylContact C-O 3.51Å; Y302-N328 WeakPolarHBondContact CA-O 3.46Å; Y302-N328 WeakPolarHBondContact CB-O 3.45Å; Y302-N328 HydrophobicContact CD1-CB 4.37Å; Y303-N328 HydrophobicContact CD1-CB 3.89Å; Y303-N328 HydrophobicContact CE1-CB 3.53Å; Y303-N328 PolarHBondContact N-O 2.81Å; Y303-N328 PolarHBondContact O-N 3.05Å; N328-E357 HydrophobicContact CB-CB 4.29Å
329	P	92.8	Very high	89.4	Confident	36 Å²	36	38.2 Å²	38.2	23%	0.234	21%	0.208	C	C	.	.	S	Bend	cis	-61.2	158.3	1.8	-24.4	35.7	0	0	0	114.1	Y302 G327 N382	Y302-P329 HydrophobicContact CD1-CG 4.32Å; Y302-P329 HydrophobicContact CE1-CG 4.2Å; G327-P329 CarbonylContact C-O 3.56Å; G327-P329 CarbonylContact O-C 3.54Å; P329-N382 WeakPolarHBondContact O-CB 3.4Å; P329-N382 PolarHBondContact O-ND2 3.1Å
330	P	88.8	Confident	90.6	Very high	56 Å²	56	43 Å²	43	36%	0.364	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-58.4	132.8	-174.7	-23.2	34.1	0	0	0	111.9	G327 Q354 G356	G327-P330 WeakPolarHBondContact O-CA 3.46Å; P330-Q354 HydrophobicContact CB-CG 4.37Å; P330-G356 VanDerWaalsContact CG-O 3.28Å; P330-G356 WeakPolarHBondContact CG-O 3.21Å
331	P	91.4	Very high	91.1	Very high	1 Å²	1	47 Å²	47	1%	0.006	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-82.7	147.6	-172.8	31.1	-33.5	0	0	0	113.6	P305 V325 L333 A380 K381 N382	P305-P331 HydrophobicContact CB-CB 3.88Å; P305-P331 HydrophobicContact CB-CG 4.12Å; P305-P331 HydrophobicContact CG-CB 4.36Å; V325-P331 HydrophobicContact CG1-CG 3.74Å; P331-L333 HydrophobicContact CG-CD2 4.31Å; P331-A380 HydrophobicContact CB-CB 4.18Å; P331-A380 HydrophobicContact CG-CB 4.43Å; P331-K381 CarbonylContact C-O 3.53Å; P331-K381 WeakPolarHBondContact CA-O 3.37Å; P331-K381 WeakPolarHBondContact CB-O 3.44Å; P331-N382 HydrophobicContact CB-CB 4.3Å
332	T	92.3	Very high	91.3	Very high	78 Å²	78	48.5 Å²	48.5	48%	0.479	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	134.5	164.3	57.6	0	0	0	0	109.9	K381	T332-K381 PolarHBondContact N-O 2.89Å; T332-K381 PolarHBondContact O-N 2.69Å; T332-K381 PolarHBondContact OG1-O 2.84Å
333	L	93.8	Very high	91.3	Very high	20 Å²	20	56.4 Å²	56.4	11%	0.105	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.6	-177.5	-54.4	-175.7	0	0	0	111.8	F323 V325 P331 Y352 L378 I379 A380	F323-L333 HydrophobicContact CD2-CD1 4.39Å; F323-L333 HydrophobicContact CE2-CD1 3.4Å; F323-L333 VanDerWaalsContact CE2-CD1 3.4Å; F323-L333 HydrophobicContact CZ-CD1 3.81Å; V325-L333 HydrophobicContact CB-CD2 4.34Å; V325-L333 HydrophobicContact CG1-CD2 4.25Å; V325-L333 HydrophobicContact CG2-CD2 4.08Å; P331-L333 HydrophobicContact CG-CD2 4.31Å; L333-Y352 HydrophobicContact CD1-CD2 3.9Å; L333-Y352 HydrophobicContact CD1-CE2 3.86Å; L333-Y352 HydrophobicContact CD1-CG 4.36Å; L333-Y352 HydrophobicContact CG-CE2 4.41Å; L333-L378 HydrophobicContact CB-CD1 4.24Å; L333-L378 HydrophobicContact CD2-CD1 4.45Å; L333-I379 WeakPolarHBondContact CA-O 3.5Å; L333-A380 HydrophobicContact CD2-CB 3.61Å
334	H	93.4	Very high	91.1	Very high	109 Å²	109	62.5 Å²	62.5	51%	0.505	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	152.2	175.2	-57.3	-45.9	0	0	0	110.3	I379	H334-I379 HydrophobicContact CB-CB 4.5Å; H334-I379 PolarHBondContact N-O 2.65Å; H334-I379 PolarHBondContact O-N 2.59Å
335	W	95	Very high	90.9	Very high	18 Å²	18	63.6 Å²	63.6	7%	0.068	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.8	177.9	-74.2	89.5	0	0	0	112.3	L310 I321 F323 L342 V350 L363 T377 L378	L310-W335 HydrophobicContact CD1-CH2 3.62Å; L310-W335 HydrophobicContact CD1-CZ3 4.18Å; I321-W335 HydrophobicContact CG2-CH2 3.83Å; I321-W335 HydrophobicContact CG2-CZ3 4.39Å; F323-W335 HydrophobicContact CD1-CH2 4.4Å; F323-W335 AromaticContact CD1-CZ2 3.6Å; F323-W335 HydrophobicContact CD1-CZ2 3.6Å; F323-W335 AromaticContact CE1-CZ2 3.9Å; F323-W335 HydrophobicContact CE1-CZ2 3.9Å; F323-W335 HydrophobicContact CG-CZ2 4.31Å; W335-L342 HydrophobicContact CB-CB 3.85Å; W335-L342 HydrophobicContact CB-CD2 3.68Å; W335-L342 HydrophobicContact CB-CG 4.36Å; W335-L342 HydrophobicContact CG-CD2 4.32Å; W335-L342 WeakPolarHBondContact O-CB 3.22Å; W335-L342 PolarHBondContact O-N 3.06Å; W335-V350 VanDerWaalsContact CD1-CG2 3.46Å; W335-L363 HydrophobicContact CD2-CB 4.43Å; W335-L363 HydrophobicContact CD2-CD1 4.42Å; W335-L363 HydrophobicContact CD2-CD2 3.78Å; W335-L363 HydrophobicContact CD2-CG 4.46Å; W335-L363 HydrophobicContact CE3-CD2 3.7Å; W335-L363 HydrophobicContact CG-CD1 4.35Å; W335-L363 HydrophobicContact CG-CD2 4.33Å; W335-L363 HydrophobicContact CH2-CB 3.97Å; W335-L363 HydrophobicContact CH2-CD2 4.18Å; W335-L363 HydrophobicContact CZ2-CB 3.63Å; W335-L363 HydrophobicContact CZ2-CD2 4.3Å; W335-L363 HydrophobicContact CZ2-CG 4.49Å; W335-L363 HydrophobicContact CZ3-CD2 3.91Å; W335-T377 CarbonylContact C-O 3.5Å; W335-T377 WeakPolarHBondContact CA-O 3.3Å; W335-L378 HydrophobicContact CD2-CB 4.23Å; W335-L378 HydrophobicContact CD2-CD1 4.16Å; W335-L378 HydrophobicContact CE3-CB 4.04Å; W335-L378 HydrophobicContact CH2-CB 3.84Å; W335-L378 HydrophobicContact CZ2-CB 3.97Å; W335-L378 HydrophobicContact CZ2-CD1 3.92Å; W335-L378 HydrophobicContact CZ2-CD2 4.25Å; W335-L378 HydrophobicContact CZ2-CG 4.26Å; W335-L378 HydrophobicContact CZ3-CB 3.85Å
336	L	94.8	Very high	90.3	Very high	41 Å²	41	72.5 Å²	72.5	22%	0.215	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	148.8	163.5	-48.3	-178.7	0	0	0	109.9	Q340 P341 Y376 T377 I379	L336-Q340 CarbonylContact C-O 3.57Å; L336-Q340 WeakPolarHBondContact CA-O 3.31Å; L336-Q340 WeakPolarHBondContact CB-O 3.38Å; L336-P341 HydrophobicContact CD2-CB 4.46Å; L336-P341 HydrophobicContact CD2-CG 4.33Å; L336-Y376 WeakPolarHBondContact O-CA 3.39Å; L336-T377 PolarHBondContact N-O 3.27Å; L336-T377 PolarHBondContact O-N 2.78Å; L336-I379 HydrophobicContact CD1-CD1 3.78Å; L336-I379 HydrophobicContact CD2-CD1 4.26Å; L336-I379 HydrophobicContact CG-CD1 3.8Å
337	H	93.4	Very high	89.7	Confident	38 Å²	38	70.7 Å²	70.7	18%	0.176	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	122.8	166.8	176	-140.6	0	0	0	108.3	G339 Q340 L342 N375 Y376	H337-G339 PolarHBondContact O-N 2.86Å; H337-Q340 PolarHBondContact N-O 2.87Å; H337-Q340 PolarHBondContact O-N 2.88Å; H337-L342 HydrophobicContact CB-CB 4.4Å; H337-L342 HydrophobicContact CB-CD1 3.97Å; H337-N375 WeakPolarHBondContact CA-O 3.46Å; H337-Y376 HydrophobicContact CB-CD1 4.19Å; H337-Y376 HydrophobicContact CB-CE1 3.84Å; H337-Y376 AromaticContact CD2-CE1 3.65Å; H337-Y376 AromaticContact CD2-CE2 3.71Å; H337-Y376 AromaticContact CD2-CZ 3.37Å; H337-Y376 AromaticContact CG-CE1 3.73Å; H337-Y376 AromaticContact CG-CZ 3.82Å; H337-Y376 AromaticContact NE2-CE2 3.96Å; H337-Y376 AromaticContact NE2-CZ 3.69Å; H337-Y376 PolarHBondContact NE2-OH 2.95Å
338	N	91.4	Very high	89.5	Confident	90 Å²	90	71.2 Å²	71.2	48%	0.481	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	39.7	-174.6	-63.5	-32.4	0	0	0	113.1	Q340 G374 N375	N338-Q340 VanDerWaalsContact C-N 3.28Å; N338-Q340 PolarHBondContact O-N 3.08Å; N338-G374 VanDerWaalsContact OD1-CA 3.32Å; N338-G374 WeakPolarHBondContact OD1-CA 3.5Å; N338-N375 PolarHBondContact N-O 2.88Å; N338-N375 PolarHBondContact OD1-N 3.14Å
339	G	89.4	Confident	89.3	Confident	49 Å²	49	72.3 Å²	72.3	51%	0.505	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	-3.6	179.8	0	0	0	0	0	115.9	H337	H337-G339 PolarHBondContact O-N 2.86Å
340	Q	92.4	Very high	89.1	Confident	138 Å²	138	72 Å²	72	65%	0.645	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	148.8	176.8	-65.2	-60.6	-34	0	0	111.5	L336 H337 N338 L342	L336-Q340 CarbonylContact C-O 3.57Å; L336-Q340 WeakPolarHBondContact CA-O 3.31Å; L336-Q340 WeakPolarHBondContact CB-O 3.38Å; H337-Q340 PolarHBondContact N-O 2.87Å; H337-Q340 PolarHBondContact O-N 2.88Å; N338-Q340 VanDerWaalsContact C-N 3.28Å; N338-Q340 PolarHBondContact O-N 3.08Å; Q340-L342 PolarHBondContact O-N 2.84Å
341	P	92.4	Very high	88.9	Confident	94 Å²	94	74.8 Å²	74.8	61%	0.61	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.2	121	176.9	-26.3	35.3	0	0	0	112.4	L336 R343	L336-P341 HydrophobicContact CD2-CB 4.46Å; L336-P341 HydrophobicContact CD2-CG 4.33Å; P341-R343 PolarHBondContact O-N 3.3Å
342	L	91.1	Very high	88.5	Confident	32 Å²	32	79.6 Å²	79.6	17%	0.168	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-69.9	123.9	178.1	179	60	0	0	0	109.1	W335 H337 Q340 I348 L363 Y376	W335-L342 HydrophobicContact CB-CB 3.85Å; W335-L342 HydrophobicContact CB-CD2 3.68Å; W335-L342 HydrophobicContact CB-CG 4.36Å; W335-L342 HydrophobicContact CG-CD2 4.32Å; W335-L342 WeakPolarHBondContact O-CB 3.22Å; W335-L342 PolarHBondContact O-N 3.06Å; H337-L342 HydrophobicContact CB-CB 4.4Å; H337-L342 HydrophobicContact CB-CD1 3.97Å; Q340-L342 PolarHBondContact O-N 2.84Å; L342-I348 HydrophobicContact CD1-CD1 4.09Å; L342-I348 HydrophobicContact CD1-CG2 4.35Å; L342-I348 HydrophobicContact CD2-CG2 4.01Å; L342-L363 HydrophobicContact CD2-CD1 3.78Å; L342-L363 HydrophobicContact CD2-CD2 3.7Å; L342-L363 HydrophobicContact CD2-CG 4.37Å; L342-Y376 HydrophobicContact CD1-CE1 4.39Å; L342-Y376 HydrophobicContact CD2-CD1 4.22Å; L342-Y376 HydrophobicContact CD2-CE1 4.13Å
343	R	86.4	Confident	87.7	Confident	220 Å²	220	82.3 Å²	82.3	83%	0.83	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-93	121.6	175.1	-64.7	-175.7	-178	-174.5	1	109.5	P341	P341-R343 PolarHBondContact O-N 3.3Å
344	E	84.6	Confident	87.1	Confident	129 Å²	129	85.2 Å²	85.2	60%	0.603	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-66.6	147.7	175.5	-63.8	-171.4	-110.2	0	0	111.8	I348 H349 V350	E344-I348 CarbonylContact C-O 3.56Å; E344-I348 VanDerWaalsContact CA-O 3.29Å; E344-I348 WeakPolarHBondContact CA-O 3.33Å; E344-H349 WeakPolarHBondContact OE2-CA 3.12Å; E344-V350 PolarHBondContact OE2-N 2.74Å
345	S	83.4	Confident	86.1	Confident	58 Å²	58	86 Å²	86	41%	0.406	42%	0.416	S	S	.	.			trans	-157.4	179.1	-173.2	66.6	0	0	0	0	110	I347 I348	S345-I347 PolarHBondContact O-N 2.97Å; S345-I347 VanDerWaalsContact O-N 3.14Å; S345-I347 PolarHBondContact OG-N 3.44Å; S345-I348 PolarHBondContact N-O 3.18Å; S345-I348 CarbonylContact O-C 3.54Å; S345-I348 VanDerWaalsContact O-O 3.09Å; S345-I348 PolarHBondContact OG-N 3.02Å; S345-I348 VanDerWaalsContact OG-N 3.14Å
346	K	76.1	Confident	85.4	Confident	187 Å²	187	87.9 Å²	87.9	81%	0.813	44%	0.441	S	S	*	.	S	Bend	trans	-67.6	-7.4	172.5	-62.1	-175.8	179.1	-178.2	0	114.5	N366	K346-N366 PolarHBondContact O-ND2 3.46Å
347	I	76.8	Confident	84.8	Confident	70 Å²	70	87.8 Å²	87.8	36%	0.359	44%	0.44	S	S	.	.	S	Bend	trans	-106.2	-35.6	-176.5	-60	172.2	0	0	0	110.6	S345 F365 N366	S345-I347 PolarHBondContact O-N 2.97Å; S345-I347 VanDerWaalsContact O-N 3.14Å; S345-I347 PolarHBondContact OG-N 3.44Å; I347-F365 CarbonylContact O-C 3.49Å; I347-F365 WeakPolarHBondContact O-CA 3.49Å; I347-N366 PolarHBondContact O-N 2.83Å
348	I	88	Confident	84.2	Confident	12 Å²	12	88.4 Å²	88.4	6%	0.062	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	116.8	178.8	-43.9	175.6	0	0	0	108.4	L342 E344 S345 L363 L364 F365	L342-I348 HydrophobicContact CD1-CD1 4.09Å; L342-I348 HydrophobicContact CD1-CG2 4.35Å; L342-I348 HydrophobicContact CD2-CG2 4.01Å; E344-I348 CarbonylContact C-O 3.56Å; E344-I348 VanDerWaalsContact CA-O 3.29Å; E344-I348 WeakPolarHBondContact CA-O 3.33Å; S345-I348 PolarHBondContact N-O 3.18Å; S345-I348 CarbonylContact O-C 3.54Å; S345-I348 VanDerWaalsContact O-O 3.09Å; S345-I348 PolarHBondContact OG-N 3.02Å; S345-I348 VanDerWaalsContact OG-N 3.14Å; I348-L363 HydrophobicContact CG2-CD1 3.8Å; I348-L363 HydrophobicContact CG2-CD2 4.45Å; I348-L363 HydrophobicContact CG2-CG 4.11Å; I348-L364 WeakPolarHBondContact CA-O 3.4Å; I348-F365 HydrophobicContact CB-CD1 4.37Å; I348-F365 HydrophobicContact CB-CE1 4.46Å; I348-F365 HydrophobicContact CD1-CD1 4.15Å; I348-F365 HydrophobicContact CD1-CE1 3.96Å; I348-F365 HydrophobicContact CG1-CD1 3.8Å; I348-F365 HydrophobicContact CG1-CE1 4.04Å; I348-F365 HydrophobicContact CG2-CD1 3.89Å; I348-F365 HydrophobicContact CG2-CE1 3.63Å; I348-F365 HydrophobicContact CG2-CZ 4.11Å
349	H	87.7	Confident	83.9	Confident	43 Å²	43	84.1 Å²	84.1	20%	0.199	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	160	178.3	68.6	-81.1	0	0	0	111.1	E344 E351 L364	E344-H349 WeakPolarHBondContact OE2-CA 3.12Å; H349-E351 IonicContact CD2-OE1 2.79Å; H349-E351 IonicContact CE1-OE1 2.62Å; H349-E351 IonicContact NE2-OE1 2.56Å; H349-E351 PolarHBondContact NE2-OE1 2.82Å; H349-L364 PolarHBondContact N-O 2.94Å; H349-L364 PolarHBondContact O-N 2.79Å
350	V	88.1	Confident	83.7	Confident	29 Å²	29	85 Å²	85	18%	0.176	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.2	-179.1	160.8	0	0	0	0	110.1	W335 E344 Y352 L363	W335-V350 VanDerWaalsContact CD1-CG2 3.46Å; E344-V350 PolarHBondContact OE2-N 2.74Å; V350-Y352 HydrophobicContact CG1-CD1 3.37Å; V350-Y352 HydrophobicContact CG1-CE1 3.78Å; V350-Y352 HydrophobicContact CG1-CG 4.39Å; V350-L363 HydrophobicContact CG2-CD1 3.47Å; V350-L363 VanDerWaalsContact CG2-CD1 3.47Å
351	E	85.1	Confident	83.3	Confident	114 Å²	114	79.4 Å²	79.4	53%	0.533	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	119.7	166.5	-76.5	-178.3	-149.6	0	0	109.2	H349 G361 C362 L364	H349-E351 IonicContact CD2-OE1 2.79Å; H349-E351 IonicContact CE1-OE1 2.62Å; H349-E351 IonicContact NE2-OE1 2.56Å; H349-E351 PolarHBondContact NE2-OE1 2.82Å; E351-G361 WeakPolarHBondContact O-CA 3.28Å; E351-C362 PolarHBondContact N-O 3.4Å; E351-C362 PolarHBondContact O-N 2.87Å; E351-L364 HydrophobicContact CB-CD1 3.76Å; E351-L364 VanDerWaalsContact CD-CD1 3.4Å; E351-L364 HydrophobicContact CG-CD1 3.75Å
352	Y	83.1	Confident	83.1	Confident	102 Å²	102	75.5 Å²	75.5	40%	0.4	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	153.8	178.1	71.8	-71.8	0	0	0	111.3	F323 L333 V350 Q354 E360	F323-Y352 HydrophobicContact CZ-CG 4.19Å; L333-Y352 HydrophobicContact CD1-CD2 3.9Å; L333-Y352 HydrophobicContact CD1-CE2 3.86Å; L333-Y352 HydrophobicContact CD1-CG 4.36Å; L333-Y352 HydrophobicContact CG-CE2 4.41Å; V350-Y352 HydrophobicContact CG1-CD1 3.37Å; V350-Y352 HydrophobicContact CG1-CE1 3.78Å; V350-Y352 HydrophobicContact CG1-CG 4.39Å; Y352-Q354 HydrophobicContact CD2-CB 4.38Å; Y352-Q354 HydrophobicContact CE2-CB 4.24Å; Y352-E360 WeakPolarHBondContact CA-O 3.45Å; Y352-E360 WeakPolarHBondContact CB-O 3.5Å
353	Y	76.3	Confident	83	Confident	136 Å²	136	74 Å²	74	53%	0.533	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	140.8	170.9	-176.5	-121.5	0	0	0	108.8	E355 S359 E360	Y353-E355 HydrophobicContact CD1-CB 4.25Å; Y353-E355 HydrophobicContact CE1-CB 3.58Å; Y353-E355 HydrophobicContact CE1-CG 4.27Å; Y353-S359 WeakPolarHBondContact O-CA 3.43Å; Y353-E360 PolarHBondContact N-O 2.85Å; Y353-E360 PolarHBondContact O-N 3.18Å; Y353-E360 VanDerWaalsContact O-O 3.13Å
354	Q	79.3	Confident	83	Confident	80 Å²	80	64.4 Å²	64.4	37%	0.374	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	110.6	-179.2	-173.3	176.1	-62.5	0	0	108.9	P330 Y352 I358 S359	P330-Q354 HydrophobicContact CB-CG 4.37Å; Y352-Q354 HydrophobicContact CD2-CB 4.38Å; Y352-Q354 HydrophobicContact CE2-CB 4.24Å; Q354-I358 WeakPolarHBondContact CA-O 3.45Å; Q354-S359 WeakPolarHBondContact CG-OG 3.28Å; Q354-S359 PolarHBondContact OE1-OG 2.95Å
355	E	74	Confident	83	Confident	126 Å²	126	58.3 Å²	58.3	59%	0.589	30%	0.295	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	111.5	-178.8	-171.8	173.4	-161.1	0	0	109.3	Y353 E357 I358	Y353-E355 HydrophobicContact CD1-CB 4.25Å; Y353-E355 HydrophobicContact CE1-CB 3.58Å; Y353-E355 HydrophobicContact CE1-CG 4.27Å; E355-E357 PolarHBondContact O-N 2.86Å; E355-I358 PolarHBondContact N-O 3.36Å; E355-I358 PolarHBondContact O-N 3.43Å
356	G	79.8	Confident	82.8	Confident	57 Å²	57	57.5 Å²	57.5	59%	0.588	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	-122	-174.3	0	0	0	0	0	111.5	P330	P330-G356 VanDerWaalsContact CG-O 3.28Å; P330-G356 WeakPolarHBondContact CG-O 3.21Å
357	E	81.1	Confident	82.6	Confident	39 Å²	39	52.4 Å²	52.4	18%	0.182	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-10.3	-178.7	65.7	173.6	-137.1	0	0	115	N278 Y303 R326 G327 N328 E355	N278-E357 PolarHBondContact ND2-OE2 2.96Å; Y303-E357 WeakPolarHBondContact OH-CB 3.45Å; Y303-E357 PolarHBondContact OH-OE1 2.81Å; Y303-E357 PolarHBondContact OH-OE2 2.69Å; R326-E357 CarbonylContact C-O 3.56Å; R326-E357 VanDerWaalsContact CA-O 3.28Å; R326-E357 WeakPolarHBondContact CA-O 3.34Å; G327-E357 PolarHBondContact N-O 3.33Å; G327-E357 WeakPolarHBondContact O-CA 3.3Å; N328-E357 HydrophobicContact CB-CB 4.29Å; E355-E357 PolarHBondContact O-N 2.86Å
358	I	81.1	Confident	82.8	Confident	51 Å²	51	49.3 Å²	49.3	26%	0.262	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	128.7	-173.1	-47.4	-170.5	0	0	0	110.1	V324 R326 Q354 E355	V324-I358 HydrophobicContact CG1-CG2 4.03Å; R326-I358 HydrophobicContact CG-CG1 4.24Å; Q354-I358 WeakPolarHBondContact CA-O 3.45Å; E355-I358 PolarHBondContact N-O 3.36Å; E355-I358 PolarHBondContact O-N 3.43Å
359	S	85.3	Confident	82.4	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	105.1	165.5	-48.5	0	0	0	0	108.3	V325 Y353 Q354	V325-S359 PolarHBondContact N-O 3.01Å; V325-S359 PolarHBondContact O-N 3.17Å; Y353-S359 WeakPolarHBondContact O-CA 3.43Å; Q354-S359 WeakPolarHBondContact CG-OG 3.28Å; Q354-S359 PolarHBondContact OE1-OG 2.95Å
360	E	85.6	Confident	82.1	Confident	68 Å²	68	50.8 Å²	50.8	32%	0.318	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	137	175.7	63.8	170.8	-154	0	0	110.1	V324 Y352 Y353 K541	V324-E360 HydrophobicContact CG2-CB 4.15Å; Y352-E360 WeakPolarHBondContact CA-O 3.45Å; Y352-E360 WeakPolarHBondContact CB-O 3.5Å; Y353-E360 PolarHBondContact N-O 2.85Å; Y353-E360 PolarHBondContact O-N 3.18Å; Y353-E360 VanDerWaalsContact O-O 3.13Å; E360-K541 IonicContact OE1-NZ 2.94Å; E360-K541 PolarHBondContact OE1-NZ 3.45Å; E360-K541 IonicContact OE2-NZ 2.78Å; E360-K541 PolarHBondContact OE2-NZ 2.84Å
361	G	84.8	Confident	81.8	Confident	21 Å²	21	58.1 Å²	58.1	22%	0.216	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-162.3	-175.8	0	0	0	0	0	114.4	F323 E351	F323-G361 WeakPolarHBondContact CD1-O 3.38Å; F323-G361 PolarHBondContact N-O 2.86Å; F323-G361 PolarHBondContact O-N 2.91Å; E351-G361 WeakPolarHBondContact O-CA 3.28Å
362	C	86.6	Confident	81.9	Confident	12 Å²	12	54 Å²	54	8%	0.081	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	135.8	-173	-174.9	0	0	0	0	111.5	C320 I321 E351 L364	C320-C362 WeakPolarHBondContact CA-SG 3.34Å; C320-C362 HydrophobicContact CB-CB 4.48Å; C320-C362 WeakPolarHBondContact CB-SG 3.43Å; C320-C362 WeakPolarHBondContact SG-CB 3.44Å; C320-C362 CovalentContact SG-SG 2.02Å; C320-C362 PolarHBondContact SG-SG 2.78Å; I321-C362 WeakPolarHBondContact O-CA 3.2Å; E351-C362 PolarHBondContact N-O 3.4Å; E351-C362 PolarHBondContact O-N 2.87Å; C362-L364 HydrophobicContact CB-CD2 4.19Å; C362-L364 HydrophobicContact CB-CG 4.13Å; C362-L364 PolarHBondContact O-N 3.42Å; C362-L364 WeakPolarHBondContact SG-CD2 3.47Å
363	L	90.4	Very high	82.1	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	105.1	154.5	-177.7	67.8	0	0	0	106.9	I321 W335 L342 I348 V350 F365 Y376	I321-L363 HydrophobicContact CB-CB 4.32Å; I321-L363 PolarHBondContact N-O 2.92Å; I321-L363 VanDerWaalsContact N-O 3.14Å; I321-L363 PolarHBondContact O-N 3.3Å; W335-L363 HydrophobicContact CD2-CB 4.43Å; W335-L363 HydrophobicContact CD2-CD1 4.42Å; W335-L363 HydrophobicContact CD2-CD2 3.78Å; W335-L363 HydrophobicContact CD2-CG 4.46Å; W335-L363 HydrophobicContact CE3-CD2 3.7Å; W335-L363 HydrophobicContact CG-CD1 4.35Å; W335-L363 HydrophobicContact CG-CD2 4.33Å; W335-L363 HydrophobicContact CH2-CB 3.97Å; W335-L363 HydrophobicContact CH2-CD2 4.18Å; W335-L363 HydrophobicContact CZ2-CB 3.63Å; W335-L363 HydrophobicContact CZ2-CD2 4.3Å; W335-L363 HydrophobicContact CZ2-CG 4.49Å; W335-L363 HydrophobicContact CZ3-CD2 3.91Å; L342-L363 HydrophobicContact CD2-CD1 3.78Å; L342-L363 HydrophobicContact CD2-CD2 3.7Å; L342-L363 HydrophobicContact CD2-CG 4.37Å; I348-L363 HydrophobicContact CG2-CD1 3.8Å; I348-L363 HydrophobicContact CG2-CD2 4.45Å; I348-L363 HydrophobicContact CG2-CG 4.11Å; V350-L363 HydrophobicContact CG2-CD1 3.47Å; V350-L363 VanDerWaalsContact CG2-CD1 3.47Å; L363-F365 HydrophobicContact CB-CE2 4.12Å; L363-F365 HydrophobicContact CD2-CE1 4.42Å; L363-F365 HydrophobicContact CD2-CE2 3.7Å; L363-F365 HydrophobicContact CD2-CZ 3.4Å; L363-F365 VanDerWaalsContact CD2-CZ 3.4Å; L363-F365 HydrophobicContact CG-CD2 4.46Å; L363-F365 HydrophobicContact CG-CE2 3.6Å; L363-F365 HydrophobicContact CG-CZ 3.73Å; L363-F365 WeakPolarHBondContact O-CD2 3.27Å; L363-F365 VanDerWaalsContact O-CE2 3.27Å; L363-F365 WeakPolarHBondContact O-CE2 3.36Å; L363-Y376 HydrophobicContact CD2-CD1 3.66Å; L363-Y376 HydrophobicContact CD2-CE1 4.15Å; L363-Y376 HydrophobicContact CD2-CG 4.39Å
364	L	86.6	Confident	82.8	Confident	19 Å²	19	45 Å²	45	10%	0.099	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	139	-176.2	-73.2	168.7	0	0	0	110.6	E318 C320 I348 H349 E351 C362	E318-L364 HydrophobicContact CB-CD2 4.42Å; C320-L364 HydrophobicContact CB-CD2 4.36Å; I348-L364 WeakPolarHBondContact CA-O 3.4Å; H349-L364 PolarHBondContact N-O 2.94Å; H349-L364 PolarHBondContact O-N 2.79Å; E351-L364 HydrophobicContact CB-CD1 3.76Å; E351-L364 VanDerWaalsContact CD-CD1 3.4Å; E351-L364 HydrophobicContact CG-CD1 3.75Å; C362-L364 HydrophobicContact CB-CD2 4.19Å; C362-L364 HydrophobicContact CB-CG 4.13Å; C362-L364 PolarHBondContact O-N 3.42Å; C362-L364 WeakPolarHBondContact SG-CD2 3.47Å
365	F	84.1	Confident	83.5	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	106.7	175.9	-60.4	-100.6	0	0	0	110	H319 I321 I347 I348 L363 K367 P368 Y376 F395	H319-F365 HydrophobicContact CB-CB 4.11Å; H319-F365 PolarHBondContact N-O 2.99Å; H319-F365 VanDerWaalsContact N-O 3.12Å; H319-F365 PolarHBondContact O-N 3.39Å; I321-F365 HydrophobicContact CB-CE2 4.35Å; I321-F365 HydrophobicContact CD1-CE2 3.61Å; I321-F365 HydrophobicContact CD1-CZ 3.87Å; I321-F365 HydrophobicContact CG1-CE2 3.77Å; I347-F365 CarbonylContact O-C 3.49Å; I347-F365 WeakPolarHBondContact O-CA 3.49Å; I348-F365 HydrophobicContact CB-CD1 4.37Å; I348-F365 HydrophobicContact CB-CE1 4.46Å; I348-F365 HydrophobicContact CD1-CD1 4.15Å; I348-F365 HydrophobicContact CD1-CE1 3.96Å; I348-F365 HydrophobicContact CG1-CD1 3.8Å; I348-F365 HydrophobicContact CG1-CE1 4.04Å; I348-F365 HydrophobicContact CG2-CD1 3.89Å; I348-F365 HydrophobicContact CG2-CE1 3.63Å; I348-F365 HydrophobicContact CG2-CZ 4.11Å; L363-F365 HydrophobicContact CB-CE2 4.12Å; L363-F365 HydrophobicContact CD2-CE1 4.42Å; L363-F365 HydrophobicContact CD2-CE2 3.7Å; L363-F365 HydrophobicContact CD2-CZ 3.4Å; L363-F365 VanDerWaalsContact CD2-CZ 3.4Å; L363-F365 HydrophobicContact CG-CD2 4.46Å; L363-F365 HydrophobicContact CG-CE2 3.6Å; L363-F365 HydrophobicContact CG-CZ 3.73Å; L363-F365 WeakPolarHBondContact O-CD2 3.27Å; L363-F365 VanDerWaalsContact O-CE2 3.27Å; L363-F365 WeakPolarHBondContact O-CE2 3.36Å; F365-K367 PolarHBondContact O-N 3.41Å; F365-P368 HydrophobicContact CB-CB 3.95Å; F365-P368 HydrophobicContact CB-CG 3.62Å; F365-P368 HydrophobicContact CD1-CB 4.18Å; F365-P368 HydrophobicContact CG-CB 4.43Å; F365-P368 HydrophobicContact CG-CG 4.41Å; F365-P368 WeakPolarHBondContact O-CD 3.46Å; F365-Y376 AromaticContact CE1-CE1 3.69Å; F365-Y376 HydrophobicContact CE1-CE1 3.69Å; F365-Y376 HydrophobicContact CE1-CE2 4.19Å; F365-Y376 AromaticContact CE1-CZ 3.51Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.22Å; F365-Y376 AromaticContact CZ-CD1 3.96Å; F365-Y376 HydrophobicContact CZ-CD1 3.96Å; F365-Y376 HydrophobicContact CZ-CD2 4.41Å; F365-Y376 AromaticContact CZ-CE1 3.59Å; F365-Y376 HydrophobicContact CZ-CE1 3.59Å; F365-Y376 HydrophobicContact CZ-CE2 4.08Å; F365-Y376 HydrophobicContact CZ-CG 4.36Å; F365-Y376 AromaticContact CZ-CZ 3.67Å; F365-F395 HydrophobicContact CB-CE1 4.32Å; F365-F395 HydrophobicContact CB-CZ 4.5Å; F365-F395 HydrophobicContact CD1-CE1 4.3Å; F365-F395 HydrophobicContact CD1-CE2 4.07Å; F365-F395 AromaticContact CD1-CZ 3.66Å; F365-F395 HydrophobicContact CD1-CZ 3.66Å; F365-F395 HydrophobicContact CD2-CE1 4.01Å; F365-F395 AromaticContact CD2-CZ 3.78Å; F365-F395 HydrophobicContact CD2-CZ 3.78Å; F365-F395 AromaticContact CE1-CE2 3.95Å; F365-F395 HydrophobicContact CE1-CE2 3.95Å; F365-F395 AromaticContact CE1-CZ 3.64Å; F365-F395 HydrophobicContact CE1-CZ 3.64Å; F365-F395 HydrophobicContact CE2-CE1 4.38Å; F365-F395 AromaticContact CE2-CZ 3.77Å; F365-F395 HydrophobicContact CE2-CZ 3.77Å; F365-F395 AromaticContact CG-CE1 3.97Å; F365-F395 HydrophobicContact CG-CE1 3.97Å; F365-F395 AromaticContact CG-CZ 3.73Å; F365-F395 HydrophobicContact CG-CZ 3.73Å; F365-F395 HydrophobicContact CZ-CE2 4.31Å; F365-F395 AromaticContact CZ-CZ 3.69Å; F365-F395 HydrophobicContact CZ-CZ 3.69Å
366	N	79.6	Confident	84.4	Confident	42 Å²	42	39 Å²	39	23%	0.225	21%	0.211	C	C	.	.	S	Bend	trans	-84.4	89.1	178.3	178.3	21.9	0	0	0	109.3	K346 I347	K346-N366 PolarHBondContact O-ND2 3.46Å; I347-N366 PolarHBondContact O-N 2.83Å
367	K	72.1	Confident	85.2	Confident	79 Å²	79	37.1 Å²	37.1	34%	0.343	19%	0.188	S	C	.	.	S	Bend	trans	55.5	67.5	-172	-74.5	132.3	-67.5	-160.2	0	114.6	F365 V640	F365-K367 PolarHBondContact O-N 3.41Å; K367-V640 HydrophobicContact CD-CB 3.51Å; K367-V640 HydrophobicContact CD-CG1 3.56Å; K367-V640 HydrophobicContact CD-CG2 4.17Å
368	P	79.8	Confident	85.9	Confident	6 Å²	6	35.3 Å²	35.3	4%	0.039	18%	0.179	C	C	.	.			trans	-64.3	146.7	170.1	28.8	-33.3	0	0	0	111.6	H319 F365 N372 F395	H319-P368 HydrophobicContact CB-CG 4.07Å; F365-P368 HydrophobicContact CB-CB 3.95Å; F365-P368 HydrophobicContact CB-CG 3.62Å; F365-P368 HydrophobicContact CD1-CB 4.18Å; F365-P368 HydrophobicContact CG-CB 4.43Å; F365-P368 HydrophobicContact CG-CG 4.41Å; F365-P368 WeakPolarHBondContact O-CD 3.46Å; P368-N372 WeakPolarHBondContact CA-OD1 3.48Å; P368-N372 HydrophobicContact CB-CB 3.82Å; P368-F395 HydrophobicContact CB-CB 3.86Å; P368-F395 HydrophobicContact CB-CD1 3.77Å; P368-F395 HydrophobicContact CB-CD2 3.7Å; P368-F395 HydrophobicContact CB-CE1 4.2Å; P368-F395 HydrophobicContact CB-CE2 4.14Å; P368-F395 HydrophobicContact CB-CG 3.48Å; P368-F395 VanDerWaalsContact CB-CG 3.48Å; P368-F395 HydrophobicContact CB-CZ 4.37Å; P368-F395 HydrophobicContact CG-CB 3.77Å; P368-F395 HydrophobicContact CG-CD1 3.23Å; P368-F395 HydrophobicContact CG-CD2 4.14Å; P368-F395 HydrophobicContact CG-CE1 3.76Å; P368-F395 HydrophobicContact CG-CG 3.44Å; P368-F395 VanDerWaalsContact CG-CG 3.44Å; P368-F395 HydrophobicContact CG-CZ 4.4Å
369	T	80.9	Confident	86.6	Confident	46 Å²	46	34.5 Å²	34.5	28%	0.282	18%	0.175	S	C	.	.			trans	-109.1	-176.5	176.2	69.2	0	0	0	0	111.1	Y371 N372	T369-Y371 PolarHBondContact O-N 3.38Å; T369-Y371 PolarHBondContact OG1-N 3.35Å; T369-N372 PolarHBondContact N-OD1 2.92Å; T369-N372 WeakPolarHBondContact O-CB 3.29Å; T369-N372 PolarHBondContact O-N 3.07Å; T369-N372 PolarHBondContact OG1-OD1 3.02Å
370	H	80.3	Confident	87.1	Confident	40 Å²	40	34.5 Å²	34.5	19%	0.185	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-63.1	-26.7	174.5	62	-86.9	0	0	0	112.9	N372 N373 L396 E398	H370-N372 PolarHBondContact O-N 3.49Å; H370-N373 VanDerWaalsContact O-CB 3.23Å; H370-N373 WeakPolarHBondContact O-CB 3.21Å; H370-N373 VanDerWaalsContact O-CG 3.28Å; H370-N373 PolarHBondContact O-N 2.81Å; H370-N373 PolarHBondContact O-ND2 2.93Å; H370-L396 HydrophobicContact CB-CB 4.42Å; H370-L396 VanDerWaalsContact CB-O 3.24Å; H370-L396 WeakPolarHBondContact CB-O 3.31Å; H370-E398 HydrophobicContact CB-CG 3.97Å
371	Y	82.9	Confident	87.5	Confident	183 Å²	183	36.8 Å²	36.8	72%	0.718	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-66.9	-13.9	171.9	-65.9	-71.9	0	0	0	114	T369	T369-Y371 PolarHBondContact O-N 3.38Å; T369-Y371 PolarHBondContact OG1-N 3.35Å
372	N	86.6	Confident	87.9	Confident	26 Å²	26	36.3 Å²	36.3	14%	0.139	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-95	1.4	172.7	-52.7	105.4	0	0	0	111.4	P368 T369 H370 Y376 F395	P368-N372 WeakPolarHBondContact CA-OD1 3.48Å; P368-N372 HydrophobicContact CB-CB 3.82Å; T369-N372 PolarHBondContact N-OD1 2.92Å; T369-N372 WeakPolarHBondContact O-CB 3.29Å; T369-N372 PolarHBondContact O-N 3.07Å; T369-N372 PolarHBondContact OG1-OD1 3.02Å; H370-N372 PolarHBondContact O-N 3.49Å; N372-Y376 WeakPolarHBondContact O-CE2 3.46Å; N372-Y376 PolarHBondContact O-OH 3.14Å; N372-F395 HydrophobicContact CB-CD2 3.94Å; N372-F395 HydrophobicContact CB-CE2 4.14Å; N372-F395 WeakPolarHBondContact O-CD2 3.32Å; N372-F395 WeakPolarHBondContact O-CE2 3.45Å
373	N	87.4	Confident	88.3	Confident	40 Å²	40	41.2 Å²	41.2	21%	0.214	21%	0.208	C	C	.	.			trans	-70.3	135.9	172.8	-63.5	-15.8	0	0	0	110	H370 G393 F395 L396	H370-N373 VanDerWaalsContact O-CB 3.23Å; H370-N373 WeakPolarHBondContact O-CB 3.21Å; H370-N373 VanDerWaalsContact O-CG 3.28Å; H370-N373 PolarHBondContact O-N 2.81Å; H370-N373 PolarHBondContact O-ND2 2.93Å; N373-G393 CarbonylContact C-O 3.53Å; N373-G393 VanDerWaalsContact CA-O 3.22Å; N373-G393 WeakPolarHBondContact CA-O 3.46Å; N373-F395 PolarHBondContact OD1-N 3.38Å; N373-L396 PolarHBondContact ND2-O 3.21Å; N373-L396 PolarHBondContact OD1-N 3.33Å
374	G	90.3	Very high	88.4	Confident	9 Å²	9	43.9 Å²	43.9	9%	0.093	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-178.9	177.7	0	0	0	0	0	114.4	N338 Y376 N392 G393	N338-G374 VanDerWaalsContact OD1-CA 3.32Å; N338-G374 WeakPolarHBondContact OD1-CA 3.5Å; G374-Y376 VanDerWaalsContact O-CD2 3.3Å; G374-Y376 WeakPolarHBondContact O-CD2 3.4Å; G374-Y376 PolarHBondContact O-N 2.85Å; G374-N392 PolarHBondContact O-OD1 2.95Å; G374-G393 PolarHBondContact N-O 2.93Å; G374-G393 PolarHBondContact O-N 2.99Å
375	N	93.4	Very high	88.7	Confident	82 Å²	82	44.1 Å²	44.1	44%	0.439	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	114.6	178	-71.5	-32.5	0	0	0	109.9	H337 N338 T390 I391	H337-N375 WeakPolarHBondContact CA-O 3.46Å; N338-N375 PolarHBondContact N-O 2.88Å; N338-N375 PolarHBondContact OD1-N 3.14Å; N375-T390 HydrophobicContact CB-CG2 3.79Å; N375-I391 WeakPolarHBondContact CA-O 3.37Å
376	Y	94.4	Very high	89.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.7	174.8	-73.2	-85.2	0	0	0	109.7	I321 L336 H337 L342 L363 F365 N372 G374 T390 I391 F395	I321-Y376 HydrophobicContact CD1-CD2 4.02Å; I321-Y376 HydrophobicContact CD1-CG 4.02Å; L336-Y376 WeakPolarHBondContact O-CA 3.39Å; H337-Y376 HydrophobicContact CB-CD1 4.19Å; H337-Y376 HydrophobicContact CB-CE1 3.84Å; H337-Y376 AromaticContact CD2-CE1 3.65Å; H337-Y376 AromaticContact CD2-CE2 3.71Å; H337-Y376 AromaticContact CD2-CZ 3.37Å; H337-Y376 AromaticContact CG-CE1 3.73Å; H337-Y376 AromaticContact CG-CZ 3.82Å; H337-Y376 AromaticContact NE2-CE2 3.96Å; H337-Y376 AromaticContact NE2-CZ 3.69Å; H337-Y376 PolarHBondContact NE2-OH 2.95Å; L342-Y376 HydrophobicContact CD1-CE1 4.39Å; L342-Y376 HydrophobicContact CD2-CD1 4.22Å; L342-Y376 HydrophobicContact CD2-CE1 4.13Å; L363-Y376 HydrophobicContact CD2-CD1 3.66Å; L363-Y376 HydrophobicContact CD2-CE1 4.15Å; L363-Y376 HydrophobicContact CD2-CG 4.39Å; F365-Y376 AromaticContact CE1-CE1 3.69Å; F365-Y376 HydrophobicContact CE1-CE1 3.69Å; F365-Y376 HydrophobicContact CE1-CE2 4.19Å; F365-Y376 AromaticContact CE1-CZ 3.51Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.22Å; F365-Y376 AromaticContact CZ-CD1 3.96Å; F365-Y376 HydrophobicContact CZ-CD1 3.96Å; F365-Y376 HydrophobicContact CZ-CD2 4.41Å; F365-Y376 AromaticContact CZ-CE1 3.59Å; F365-Y376 HydrophobicContact CZ-CE1 3.59Å; F365-Y376 HydrophobicContact CZ-CE2 4.08Å; F365-Y376 HydrophobicContact CZ-CG 4.36Å; F365-Y376 AromaticContact CZ-CZ 3.67Å; N372-Y376 WeakPolarHBondContact O-CE2 3.46Å; N372-Y376 PolarHBondContact O-OH 3.14Å; G374-Y376 VanDerWaalsContact O-CD2 3.3Å; G374-Y376 WeakPolarHBondContact O-CD2 3.4Å; G374-Y376 PolarHBondContact O-N 2.85Å; Y376-T390 CarbonylContact O-C 3.52Å; Y376-T390 VanDerWaalsContact O-CA 3.31Å; Y376-T390 WeakPolarHBondContact O-CA 3.39Å; Y376-I391 PolarHBondContact N-O 2.74Å; Y376-I391 PolarHBondContact O-N 2.7Å; Y376-F395 AromaticContact CE2-CE2 3.95Å; Y376-F395 HydrophobicContact CE2-CE2 3.95Å; Y376-F395 HydrophobicContact CE2-CZ 4.44Å
377	T	95.3	Very high	89.9	Confident	17 Å²	17	46.8 Å²	46.8	10%	0.104	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.6	179.1	-51.9	0	0	0	0	110	W335 L336 I379 N388 Q389 T390	W335-T377 CarbonylContact C-O 3.5Å; W335-T377 WeakPolarHBondContact CA-O 3.3Å; L336-T377 PolarHBondContact N-O 3.27Å; L336-T377 PolarHBondContact O-N 2.78Å; T377-I379 HydrophobicContact CG2-CG1 4.16Å; T377-N388 HydrophobicContact CG2-CB 4.03Å; T377-Q389 CarbonylContact C-O 3.15Å; T377-Q389 WeakPolarHBondContact CA-O 3.27Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.19Å; T377-T390 WeakPolarHBondContact OG1-CG2 3.39Å; T377-T390 PolarHBondContact OG1-OG1 2.85Å
378	L	96.2	Very high	91	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	134.1	166.6	175.8	59.7	0	0	0	108.9	V307 F323 V325 L333 W335 N388 Q389	V307-L378 HydrophobicContact CG1-CD2 4.36Å; F323-L378 HydrophobicContact CB-CD2 3.74Å; F323-L378 HydrophobicContact CD2-CD2 3.82Å; F323-L378 HydrophobicContact CG-CD2 3.78Å; V325-L378 HydrophobicContact CG2-CD2 3.67Å; L333-L378 HydrophobicContact CB-CD1 4.24Å; L333-L378 HydrophobicContact CD2-CD1 4.45Å; W335-L378 HydrophobicContact CD2-CB 4.23Å; W335-L378 HydrophobicContact CD2-CD1 4.16Å; W335-L378 HydrophobicContact CE3-CB 4.04Å; W335-L378 HydrophobicContact CH2-CB 3.84Å; W335-L378 HydrophobicContact CZ2-CB 3.97Å; W335-L378 HydrophobicContact CZ2-CD1 3.92Å; W335-L378 HydrophobicContact CZ2-CD2 4.25Å; W335-L378 HydrophobicContact CZ2-CG 4.26Å; W335-L378 HydrophobicContact CZ3-CB 3.85Å; L378-N388 WeakPolarHBondContact O-CA 3.48Å; L378-N388 VanDerWaalsContact O-CB 3.3Å; L378-N388 WeakPolarHBondContact O-CB 3.34Å; L378-Q389 PolarHBondContact N-O 2.98Å; L378-Q389 PolarHBondContact O-N 3.24Å; L378-Q389 VanDerWaalsContact O-N 3.08Å
379	I	95.7	Very high	91.6	Very high	35 Å²	35	51.6 Å²	51.6	18%	0.179	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	118	174.5	-56.1	-179	0	0	0	108.2	L333 H334 L336 T377 T386 A387 N388	L333-I379 WeakPolarHBondContact CA-O 3.5Å; H334-I379 HydrophobicContact CB-CB 4.5Å; H334-I379 PolarHBondContact N-O 2.65Å; H334-I379 PolarHBondContact O-N 2.59Å; L336-I379 HydrophobicContact CD1-CD1 3.78Å; L336-I379 HydrophobicContact CD2-CD1 4.26Å; L336-I379 HydrophobicContact CG-CD1 3.8Å; T377-I379 HydrophobicContact CG2-CG1 4.16Å; I379-T386 HydrophobicContact CG2-CG2 3.67Å; I379-A387 WeakPolarHBondContact CA-O 3.41Å; I379-N388 HydrophobicContact CG1-CB 3.96Å
380	A	95.9	Very high	92.2	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.2	174.3	0	0	0	0	0	109.9	P305 V325 P331 L333 T386 A387	P305-A380 HydrophobicContact CB-CB 3.85Å; P305-A380 HydrophobicContact CG-CB 4.22Å; P305-A380 WeakPolarHBondContact CG-O 3.41Å; V325-A380 HydrophobicContact CG1-CB 3.57Å; V325-A380 HydrophobicContact CG2-CB 4.32Å; P331-A380 HydrophobicContact CB-CB 4.18Å; P331-A380 HydrophobicContact CG-CB 4.43Å; L333-A380 HydrophobicContact CD2-CB 3.61Å; A380-T386 CarbonylContact O-C 3.25Å; A380-T386 VanDerWaalsContact O-CA 3.28Å; A380-T386 WeakPolarHBondContact O-CA 3.39Å; A380-T386 WeakPolarHBondContact O-CG2 3.25Å; A380-A387 PolarHBondContact N-O 3.21Å; A380-A387 PolarHBondContact O-N 2.84Å
381	K	94.1	Very high	92.8	Very high	115 Å²	115	52.2 Å²	52.2	50%	0.5	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.1	-177.1	179.9	170.3	-175.1	-178.3	0	112.3	P331 T332 T386	P331-K381 CarbonylContact C-O 3.53Å; P331-K381 WeakPolarHBondContact CA-O 3.37Å; P331-K381 WeakPolarHBondContact CB-O 3.44Å; T332-K381 PolarHBondContact N-O 2.89Å; T332-K381 PolarHBondContact O-N 2.69Å; T332-K381 PolarHBondContact OG1-O 2.84Å; K381-T386 HydrophobicContact CB-CG2 4.31Å; K381-T386 WeakPolarHBondContact CG-OG1 3.17Å
382	N	94.5	Very high	93.2	Very high	11 Å²	11	47.7 Å²	47.7	6%	0.059	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	179.7	167.1	82.9	0.6	0	0	0	109.9	Y303 P305 P329 P331 L384 G385	Y303-N382 PolarHBondContact O-ND2 3.18Å; P305-N382 WeakPolarHBondContact CD-OD1 3.48Å; P329-N382 WeakPolarHBondContact O-CB 3.4Å; P329-N382 PolarHBondContact O-ND2 3.1Å; P331-N382 HydrophobicContact CB-CB 4.3Å; N382-L384 PolarHBondContact O-N 3.28Å; N382-L384 VanDerWaalsContact O-N 3.12Å; N382-L384 WeakPolarHBondContact OD1-CA 3.45Å; N382-L384 WeakPolarHBondContact OD1-CB 3.38Å; N382-L384 PolarHBondContact OD1-N 2.98Å; N382-G385 PolarHBondContact N-O 2.89Å; N382-G385 PolarHBondContact O-N 2.85Å; N382-G385 PolarHBondContact OD1-N 2.86Å
383	P	94.3	Very high	93.1	Very high	116 Å²	116	46.5 Å²	46.5	75%	0.753	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-14.2	-179.4	-25.7	36.3	0	0	0	115.9
384	L	92.9	Very high	92.9	Very high	55 Å²	55	49.1 Å²	49.1	29%	0.288	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-17.5	-179.5	-64.1	-178.8	0	0	0	113.7	Y302 P304 N382	Y302-L384 VanDerWaalsContact C-CD1 3.48Å; P304-L384 HydrophobicContact CB-CB 4.32Å; N382-L384 PolarHBondContact O-N 3.28Å; N382-L384 VanDerWaalsContact O-N 3.12Å; N382-L384 WeakPolarHBondContact OD1-CA 3.45Å; N382-L384 WeakPolarHBondContact OD1-CB 3.38Å; N382-L384 PolarHBondContact OD1-N 2.98Å
385	G	92.4	Very high	92.4	Very high	24 Å²	24	49.4 Å²	49.4	25%	0.247	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.8	-168.4	-179.9	0	0	0	0	0	115	N382	N382-G385 PolarHBondContact N-O 2.89Å; N382-G385 PolarHBondContact O-N 2.85Å; N382-G385 PolarHBondContact OD1-N 2.86Å
386	T	94.4	Very high	91.5	Very high	78 Å²	78	47.7 Å²	47.7	48%	0.479	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	133.4	178.7	-57.9	0	0	0	0	108.6	I379 A380 K381	I379-T386 HydrophobicContact CG2-CG2 3.67Å; A380-T386 CarbonylContact O-C 3.25Å; A380-T386 VanDerWaalsContact O-CA 3.28Å; A380-T386 WeakPolarHBondContact O-CA 3.39Å; A380-T386 WeakPolarHBondContact O-CG2 3.25Å; K381-T386 HydrophobicContact CB-CG2 4.31Å; K381-T386 WeakPolarHBondContact CG-OG1 3.17Å
387	A	93.9	Very high	90.5	Very high	21 Å²	21	54.9 Å²	54.9	17%	0.174	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	149.7	170.3	0	0	0	0	0	109.4	P305 V307 I379 A380	P305-A387 HydrophobicContact CG-CB 4.46Å; P305-A387 WeakPolarHBondContact O-CB 3.46Å; V307-A387 HydrophobicContact CG2-CB 4.43Å; I379-A387 WeakPolarHBondContact CA-O 3.41Å; A380-A387 PolarHBondContact N-O 3.21Å; A380-A387 PolarHBondContact O-N 2.84Å
388	N	94.8	Very high	89.6	Confident	108 Å²	108	59.8 Å²	59.8	58%	0.578	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.3	154.7	171.1	60.8	49.3	0	0	0	110.7	T377 L378 I379	T377-N388 HydrophobicContact CG2-CB 4.03Å; L378-N388 WeakPolarHBondContact O-CA 3.48Å; L378-N388 VanDerWaalsContact O-CB 3.3Å; L378-N388 WeakPolarHBondContact O-CB 3.34Å; I379-N388 HydrophobicContact CG1-CB 3.96Å
389	Q	93.9	Very high	87.6	Confident	78 Å²	78	63.5 Å²	63.5	36%	0.364	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	141.7	173.5	-168.5	175.1	-9.5	0	0	108.4	V307 L310 T377 L378	V307-Q389 HydrophobicContact CB-CB 4.13Å; V307-Q389 HydrophobicContact CG1-CB 4.1Å; V307-Q389 HydrophobicContact CG2-CB 4.17Å; L310-Q389 HydrophobicContact CB-CG 4.35Å; L310-Q389 HydrophobicContact CD2-CB 3.89Å; L310-Q389 HydrophobicContact CD2-CG 3.84Å; L310-Q389 WeakPolarHBondContact CD2-O 3.38Å; T377-Q389 CarbonylContact C-O 3.15Å; T377-Q389 WeakPolarHBondContact CA-O 3.27Å; L378-Q389 PolarHBondContact N-O 2.98Å; L378-Q389 PolarHBondContact O-N 3.24Å; L378-Q389 VanDerWaalsContact O-N 3.08Å
390	T	93.8	Very high	86.2	Confident	73 Å²	73	69.5 Å²	69.5	45%	0.448	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	138.1	-177.1	-56.4	0	0	0	0	110	N375 Y376 T377	N375-T390 HydrophobicContact CB-CG2 3.79Å; Y376-T390 CarbonylContact O-C 3.52Å; Y376-T390 VanDerWaalsContact O-CA 3.31Å; Y376-T390 WeakPolarHBondContact O-CA 3.39Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.19Å; T377-T390 WeakPolarHBondContact OG1-CG2 3.39Å; T377-T390 PolarHBondContact OG1-OG1 2.85Å
391	I	92.3	Very high	84.2	Confident	25 Å²	25	75.2 Å²	75.2	13%	0.128	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	151.3	172.6	-164.1	147.5	0	0	0	110.6	L310 E312 I321 N375 Y376 G393	L310-I391 HydrophobicContact CD1-CG2 4.25Å; L310-I391 HydrophobicContact CD2-CB 3.82Å; L310-I391 HydrophobicContact CD2-CG2 3.83Å; L310-I391 HydrophobicContact CG-CB 4.03Å; L310-I391 HydrophobicContact CG-CD1 4.36Å; L310-I391 HydrophobicContact CG-CG2 3.87Å; L310-I391 VanDerWaalsContact O-CD1 3.28Å; L310-I391 WeakPolarHBondContact O-CD1 3.05Å; E312-I391 HydrophobicContact CB-CD1 4.47Å; E312-I391 HydrophobicContact CG-CD1 3.91Å; E312-I391 HydrophobicContact CG-CG1 4.28Å; I321-I391 HydrophobicContact CD1-CG2 4.18Å; I321-I391 HydrophobicContact CG2-CG2 3.96Å; N375-I391 WeakPolarHBondContact CA-O 3.37Å; Y376-I391 PolarHBondContact N-O 2.74Å; Y376-I391 PolarHBondContact O-N 2.7Å; I391-G393 PolarHBondContact O-N 2.84Å
392	N	90.1	Very high	82.2	Confident	89 Å²	89	78.2 Å²	78.2	48%	0.476	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	107.8	175	-175.3	19.7	0	0	0	109.5	G374 H394	G374-N392 PolarHBondContact O-OD1 2.95Å; N392-H394 PolarHBondContact O-N 3.36Å
393	G	84.6	Confident	79.7	Confident	0 Å²	0	82.3 Å²	82.3	0%	0	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	109.1	169.8	0	0	0	0	0	109.1	N373 G374 I391	N373-G393 CarbonylContact C-O 3.53Å; N373-G393 VanDerWaalsContact CA-O 3.22Å; N373-G393 WeakPolarHBondContact CA-O 3.46Å; G374-G393 PolarHBondContact N-O 2.93Å; G374-G393 PolarHBondContact O-N 2.99Å; I391-G393 PolarHBondContact O-N 2.84Å
394	H	83.1	Confident	77.4	Confident	95 Å²	95	83.7 Å²	83.7	44%	0.44	45%	0.454	S	S	.	.			trans	-117.9	110.6	172.9	171.3	-74.1	0	0	0	109.9	N392	N392-H394 PolarHBondContact O-N 3.36Å
395	F	81.3	Confident	74.8	Confident	16 Å²	16	87.7 Å²	87.7	7%	0.07	48%	0.476	C	S	.	.			trans	-102.5	-58.6	-172.7	-56.8	-74.3	0	0	0	111.9	P313 H319 F365 P368 N372 N373 Y376	P313-F395 HydrophobicContact CB-CD1 4.25Å; P313-F395 HydrophobicContact CB-CE1 3.59Å; P313-F395 HydrophobicContact CB-CZ 4.32Å; P313-F395 HydrophobicContact CG-CD1 4.34Å; P313-F395 HydrophobicContact CG-CE1 3.89Å; P313-F395 HydrophobicContact CG-CZ 4.41Å; H319-F395 HydrophobicContact CB-CD1 3.95Å; H319-F395 HydrophobicContact CB-CE1 3.79Å; H319-F395 AromaticContact CD2-CD1 3.76Å; H319-F395 AromaticContact CG-CD1 3.84Å; F365-F395 HydrophobicContact CB-CE1 4.32Å; F365-F395 HydrophobicContact CB-CZ 4.5Å; F365-F395 HydrophobicContact CD1-CE1 4.3Å; F365-F395 HydrophobicContact CD1-CE2 4.07Å; F365-F395 AromaticContact CD1-CZ 3.66Å; F365-F395 HydrophobicContact CD1-CZ 3.66Å; F365-F395 HydrophobicContact CD2-CE1 4.01Å; F365-F395 AromaticContact CD2-CZ 3.78Å; F365-F395 HydrophobicContact CD2-CZ 3.78Å; F365-F395 AromaticContact CE1-CE2 3.95Å; F365-F395 HydrophobicContact CE1-CE2 3.95Å; F365-F395 AromaticContact CE1-CZ 3.64Å; F365-F395 HydrophobicContact CE1-CZ 3.64Å; F365-F395 HydrophobicContact CE2-CE1 4.38Å; F365-F395 AromaticContact CE2-CZ 3.77Å; F365-F395 HydrophobicContact CE2-CZ 3.77Å; F365-F395 AromaticContact CG-CE1 3.97Å; F365-F395 HydrophobicContact CG-CE1 3.97Å; F365-F395 AromaticContact CG-CZ 3.73Å; F365-F395 HydrophobicContact CG-CZ 3.73Å; F365-F395 HydrophobicContact CZ-CE2 4.31Å; F365-F395 AromaticContact CZ-CZ 3.69Å; F365-F395 HydrophobicContact CZ-CZ 3.69Å; P368-F395 HydrophobicContact CB-CB 3.86Å; P368-F395 HydrophobicContact CB-CD1 3.77Å; P368-F395 HydrophobicContact CB-CD2 3.7Å; P368-F395 HydrophobicContact CB-CE1 4.2Å; P368-F395 HydrophobicContact CB-CE2 4.14Å; P368-F395 HydrophobicContact CB-CG 3.48Å; P368-F395 VanDerWaalsContact CB-CG 3.48Å; P368-F395 HydrophobicContact CB-CZ 4.37Å; P368-F395 HydrophobicContact CG-CB 3.77Å; P368-F395 HydrophobicContact CG-CD1 3.23Å; P368-F395 HydrophobicContact CG-CD2 4.14Å; P368-F395 HydrophobicContact CG-CE1 3.76Å; P368-F395 HydrophobicContact CG-CG 3.44Å; P368-F395 VanDerWaalsContact CG-CG 3.44Å; P368-F395 HydrophobicContact CG-CZ 4.4Å; N372-F395 HydrophobicContact CB-CD2 3.94Å; N372-F395 HydrophobicContact CB-CE2 4.14Å; N372-F395 WeakPolarHBondContact O-CD2 3.32Å; N372-F395 WeakPolarHBondContact O-CE2 3.45Å; N373-F395 PolarHBondContact OD1-N 3.38Å; Y376-F395 AromaticContact CE2-CE2 3.95Å; Y376-F395 HydrophobicContact CE2-CE2 3.95Å; Y376-F395 HydrophobicContact CE2-CZ 4.44Å
396	L	74	Confident	72.5	Confident	46 Å²	46	93.7 Å²	93.7	24%	0.241	50%	0.503	C	S	.	.			trans	-129.3	134.2	178.8	-55	-176.1	0	0	0	110.1	H370 N373 R645	H370-L396 HydrophobicContact CB-CB 4.42Å; H370-L396 VanDerWaalsContact CB-O 3.24Å; H370-L396 WeakPolarHBondContact CB-O 3.31Å; N373-L396 PolarHBondContact ND2-O 3.21Å; N373-L396 PolarHBondContact OD1-N 3.33Å; L396-R645 VanDerWaalsContact CD2-NH1 3.35Å
397	K	73.1	Confident	69.5	Low	151 Å²	151	100 Å²	100	66%	0.657	52%	0.524	S	S	*	.			trans	-60.6	140.9	162.9	-64.3	-174.1	178.6	-175	0	110.5	R645	K397-R645 PolarHBondContact O-NH2 3.24Å
398	E	75.6	Confident	66.7	Low	119 Å²	119	104.8 Å²	104.8	56%	0.556	55%	0.545	S	S	*	.			trans	-54.2	139.2	170.6	-80.7	173	153.2	0	0	111.2	H370 F400	H370-E398 HydrophobicContact CB-CG 3.97Å; E398-F400 VanDerWaalsContact C-N 3.28Å; E398-F400 PolarHBondContact O-N 3.36Å
399	P	54.7	Low	63.8	Low	79 Å²	79	106 Å²	106	51%	0.513	55%	0.551	S	S	.	*	S	Bend	trans	-73.5	-18.4	-175	27.8	-33.2	0	0	0	113.8
400	F	67.3	Low	60.8	Low	160 Å²	160	111.3 Å²	111.3	70%	0.702	57%	0.573	S	S	*	*	S	Bend	trans	-136.4	130.7	176.5	-51.4	-75.8	0	0	0	108.2	E398	E398-F400 VanDerWaalsContact C-N 3.28Å; E398-F400 PolarHBondContact O-N 3.36Å
401	P	54.3	Low	57.8	Low	120 Å²	120	113.8 Å²	113.8	78%	0.779	58%	0.583	S	S	*	*			trans	-62.6	138.8	162.9	29.2	-32.4	0	0	0	108	S403	P401-S403 PolarHBondContact O-N 2.9Å
402	E	50.3	Low	55	Low	179 Å²	179	121 Å²	121	84%	0.836	62%	0.616	S	S	*	*			trans	-53	112.8	173.3	-71.8	-168	143.2	0	0	109.3	T404	E402-T404 PolarHBondContact O-N 3.08Å; E402-T404 VanDerWaalsContact O-N 3.1Å
403	S	42.8	Very low	52.1	Low	97 Å²	97	123.9 Å²	123.9	68%	0.678	64%	0.637	S	S	*	*			trans	-64.8	112.6	169.3	49.1	0	0	0	0	107.1	P401 D405	P401-S403 PolarHBondContact O-N 2.9Å; S403-D405 PolarHBondContact O-N 3.02Å
404	T	46.2	Very low	49.4	Very low	144 Å²	144	128.9 Å²	128.9	88%	0.883	67%	0.672	S	S	*	*			trans	-64.2	77.9	163.3	46.8	0	0	0	0	109.1	E402	E402-T404 PolarHBondContact O-N 3.08Å; E402-T404 VanDerWaalsContact O-N 3.1Å
405	D	37.9	Very low	47.5	Very low	139 Å²	139	129 Å²	129	74%	0.743	68%	0.682	S	S	*	*			trans	-110	127.4	164.1	-109.5	-32.5	0	0	0	108.1	S403 F407	S403-D405 PolarHBondContact O-N 3.02Å; D405-F407 PolarHBondContact O-N 3.03Å
406	N	43.3	Very low	45.1	Very low	151 Å²	151	134.7 Å²	134.7	81%	0.807	72%	0.718	S	S	*	*			trans	-66.9	96.3	-171.1	-64.3	-67.2	0	0	0	111	I408	N406-I408 PolarHBondContact O-N 2.82Å
407	F	32.9	Very low	43.9	Very low	210 Å²	210	137.9 Å²	137.9	92%	0.921	74%	0.741	S	S	*	*			trans	-79.5	104.8	159.9	-137.4	-87.9	0	0	0	108.9	D405 L409	D405-F407 PolarHBondContact O-N 3.03Å; F407-L409 PolarHBondContact O-N 3.18Å
408	I	34.6	Very low	42.3	Very low	121 Å²	121	135.9 Å²	135.9	62%	0.621	74%	0.744	S	S	*	*			trans	-62.5	128.2	-178.1	-67.7	174.7	0	0	0	109.6	N406 F410	N406-I408 PolarHBondContact O-N 2.82Å; I408-F410 HydrophobicContact CG2-CD2 4.41Å; I408-F410 HydrophobicContact CG2-CE2 4.08Å; I408-F410 PolarHBondContact O-N 2.91Å
409	L	32.8	Very low	40.2	Very low	133 Å²	133	137.1 Å²	137.1	70%	0.696	75%	0.752	S	S	*	*			trans	-55.4	120.5	169.6	-174.4	78.1	0	0	0	110	F407	F407-L409 PolarHBondContact O-N 3.18Å
410	F	32.3	Very low	38.9	Very low	191 Å²	191	140.3 Å²	140.3	84%	0.838	77%	0.771	S	S	*	*			trans	-113.1	109.8	157.2	-82.2	-78.1	0	0	0	108.2	I408	I408-F410 HydrophobicContact CG2-CD2 4.41Å; I408-F410 HydrophobicContact CG2-CE2 4.08Å; I408-F410 PolarHBondContact O-N 2.91Å
411	D	30.7	Very low	37.2	Very low	124 Å²	124	138 Å²	138	66%	0.663	77%	0.769	S	S	*	*			trans	-66.4	156.5	179.7	-94.5	-38.2	0	0	0	113.3
412	E	33.2	Very low	36.2	Very low	176 Å²	176	138.8 Å²	138.8	82%	0.822	77%	0.772	S	S	*	*			trans	3.5	121.6	156.9	-54.2	-170.1	140.2	0	0	119.5
413	V	29.6	Very low	35.3	Very low	150 Å²	150	139 Å²	139	91%	0.909	77%	0.773	S	S	*	*				-146.5	140.5	121.6	-178	0	0	0	0	110
414	S	27.4	Very low	34.7	Very low	105 Å²	105	143.8 Å²	143.8	73%	0.734	78%	0.781	S	S	*	*			trans	-137.8	161.5	170.7	-168.7	0	0	0	0	107.8
415	P	44.2	Very low	34.4	Very low	99 Å²	99	142.6 Å²	142.6	64%	0.643	78%	0.776	S	S	*	*			cis	-132.7	169.8	-8.6	33.4	-13.7	0	0	0	116.5
416	T	30.6	Very low	34.5	Very low	135 Å²	135	144.5 Å²	144.5	83%	0.828	78%	0.781	S	S	*	*			trans	76	156	147.2	40.8	0	0	0	0	122.2
417	P	48.3	Very low	34.5	Very low	112 Å²	112	146.2 Å²	146.2	73%	0.727	78%	0.784	S	S	*	*			trans	-116.3	-171.1	-151.8	47.1	-36.6	0	0	0	114.6
418	P	39.8	Very low	35.4	Very low	110 Å²	110	143.1 Å²	143.1	71%	0.714	78%	0.777	S	S	*	*				-149.8	147.5	83.9	37	-17.2	0	0	0	118.4
419	I	31.8	Very low	36.2	Very low	144 Å²	144	143 Å²	143	74%	0.738	78%	0.782	S	S	*	*			trans	45.9	114.3	135.9	-49.6	165.9	0	0	0	119.5	V421	I419-V421 HydrophobicContact CG2-CG2 4.38Å
420	T	27.8	Very low	37	Very low	147 Å²	147	144.6 Å²	144.6	90%	0.902	78%	0.784	S	S	*	*			trans	-140.6	126.8	132.8	18.1	0	0	0	0	110.1
421	V	31.5	Very low	38	Very low	111 Å²	111	137.9 Å²	137.9	67%	0.673	77%	0.768	S	S	*	*			trans	-97	128	179.4	174	0	0	0	0	109.7	I419	I419-V421 HydrophobicContact CG2-CG2 4.38Å
422	T	31.5	Very low	39.2	Very low	137 Å²	137	136.4 Å²	136.4	84%	0.84	76%	0.764	S	S	*	*			trans	-139.8	121	160.3	41.1	0	0	0	0	110.1
423	H	32.4	Very low	40.4	Very low	182 Å²	182	132.2 Å²	132.2	84%	0.843	75%	0.754	S	S	*	*			trans	-65.3	150.8	179.1	-76	-109.4	0	0	0	112.8
424	K	30.7	Very low	42	Very low	198 Å²	198	129.5 Å²	129.5	86%	0.861	73%	0.733	S	S	*	*			trans	-135.9	136.8	154	-131.1	-178.1	178.1	-171.6	0	108
425	P	38.5	Very low	43.7	Very low	120 Å²	120	127.3 Å²	127.3	78%	0.779	72%	0.721	S	S	*	*			trans	-87.1	167.7	-164.5	34.9	-36.4	0	0	0	114.1
426	E	40.3	Very low	44.9	Very low	178 Å²	178	127 Å²	127	83%	0.832	72%	0.718	S	S	*	*			trans	-70	129.2	-177.9	-60	162.8	162.6	0	0	112.4
427	E	44.2	Very low	46.9	Very low	187 Å²	187	122.6 Å²	122.6	87%	0.874	70%	0.699	S	S	*	*			trans	-105.3	42.4	172.9	-76.6	-164.9	145.9	0	0	112.9
428	D	52.1	Low	48.3	Very low	146 Å²	146	122.8 Å²	122.8	78%	0.781	69%	0.693	S	S	*	*			trans	-100.6	5.2	180	-90.4	-39.4	0	0	0	115.1
429	T	51.3	Low	49.8	Very low	119 Å²	119	120.2 Å²	120.2	73%	0.73	68%	0.681	S	S	*	*	S	Bend	trans	-94.4	-18.9	-179.9	-14.4	0	0	0	0	114.5
430	F	49.7	Very low	52	Low	165 Å²	165	115.9 Å²	115.9	72%	0.724	67%	0.667	S	S	*	*	H	α-helix	trans	-83.3	-40.7	-170.6	-152.7	-102	0	0	0	113.2	V432 S433 I434	F430-V432 PolarHBondContact O-N 3.1Å; F430-S433 PolarHBondContact O-N 3.38Å; F430-I434 HydrophobicContact CD1-CD1 3.89Å; F430-I434 HydrophobicContact CE1-CD1 3.88Å; F430-I434 PolarHBondContact O-N 2.76Å
431	G	53.3	Low	54.6	Low	50 Å²	50	115.3 Å²	115.3	52%	0.515	65%	0.652	S	S	.	*	H	α-helix	trans	-65.7	-38.4	-179	0	0	0	0	0	113.9	S433 I434 A435	G431-S433 PolarHBondContact O-N 2.94Å; G431-I434 PolarHBondContact O-N 3.45Å; G431-A435 PolarHBondContact O-N 3.04Å; G431-A435 VanDerWaalsContact O-N 3.15Å
432	V	55.6	Low	56.9	Low	94 Å²	94	112.3 Å²	112.3	57%	0.57	64%	0.639	S	S	*	*	H	α-helix	trans	-65.1	-39.4	-179.3	-175.5	0	0	0	0	111.4	F430 I434 A435 V436	F430-V432 PolarHBondContact O-N 3.1Å; V432-I434 PolarHBondContact O-N 3.23Å; V432-A435 PolarHBondContact O-N 3.42Å; V432-V436 HydrophobicContact CG1-CG2 4.49Å; V432-V436 WeakPolarHBondContact O-CG2 3.12Å; V432-V436 PolarHBondContact O-N 2.91Å
433	S	58.1	Low	59.1	Low	88 Å²	88	109.6 Å²	109.6	62%	0.615	63%	0.625	S	S	*	*	H	α-helix	trans	-65.4	-37.9	179.5	-162	0	0	0	0	112.3	F430 G431 G437	F430-S433 PolarHBondContact O-N 3.38Å; G431-S433 PolarHBondContact O-N 2.94Å; S433-G437 PolarHBondContact O-N 3.47Å
434	I	63.8	Low	61.5	Low	93 Å²	93	105.3 Å²	105.3	48%	0.477	61%	0.611	S	S	.	*	H	α-helix	trans	-67	-43.7	175.7	-64.1	171.8	0	0	0	110.9	F430 G431 V432 G437 L438	F430-I434 HydrophobicContact CD1-CD1 3.89Å; F430-I434 HydrophobicContact CE1-CD1 3.88Å; F430-I434 PolarHBondContact O-N 2.76Å; G431-I434 PolarHBondContact O-N 3.45Å; V432-I434 PolarHBondContact O-N 3.23Å; I434-G437 PolarHBondContact O-N 2.96Å; I434-L438 HydrophobicContact CG2-CD1 4.03Å; I434-L438 HydrophobicContact CG2-CG 4.5Å; I434-L438 WeakPolarHBondContact O-CG 3.41Å; I434-L438 PolarHBondContact O-N 2.91Å
435	A	61.8	Low	63.9	Low	58 Å²	58	100.4 Å²	100.4	48%	0.479	59%	0.594	S	S	.	*	H	α-helix	trans	-62.2	-43.8	178.2	0	0	0	0	0	112.4	G431 V432 L438 A439	G431-A435 PolarHBondContact O-N 3.04Å; G431-A435 VanDerWaalsContact O-N 3.15Å; V432-A435 PolarHBondContact O-N 3.42Å; A435-L438 PolarHBondContact O-N 3.44Å; A435-A439 WeakPolarHBondContact O-CB 3.39Å; A435-A439 PolarHBondContact O-N 3.42Å
436	V	71	Confident	65.9	Low	94 Å²	94	100.3 Å²	100.3	57%	0.57	59%	0.586	S	S	*	*	H	α-helix	trans	-66.1	-39.6	175.9	174.8	0	0	0	0	111.3	V432 A439 A440	V432-V436 HydrophobicContact CG1-CG2 4.49Å; V432-V436 WeakPolarHBondContact O-CG2 3.12Å; V432-V436 PolarHBondContact O-N 2.91Å; V436-A439 PolarHBondContact O-N 2.86Å; V436-A440 WeakPolarHBondContact O-CB 3.43Å; V436-A440 PolarHBondContact O-N 3.31Å
437	G	71.9	Confident	67.9	Low	42 Å²	42	96.2 Å²	96.2	43%	0.433	57%	0.573	S	S	.	*	H	α-helix	trans	-61.5	-43.7	175.1	0	0	0	0	0	113.4	S433 I434 A440 F441	S433-G437 PolarHBondContact O-N 3.47Å; I434-G437 PolarHBondContact O-N 2.96Å; G437-A440 PolarHBondContact O-N 3.27Å; G437-F441 WeakPolarHBondContact O-CB 3.04Å; G437-F441 PolarHBondContact O-N 2.81Å
438	L	76.6	Confident	69.6	Low	116 Å²	116	91 Å²	91	61%	0.607	55%	0.554	S	S	*	*	H	α-helix	trans	-65.9	-41.9	176.4	-72.6	169.9	0	0	0	112.2	I434 A435 F441 A442	I434-L438 HydrophobicContact CG2-CD1 4.03Å; I434-L438 HydrophobicContact CG2-CG 4.5Å; I434-L438 WeakPolarHBondContact O-CG 3.41Å; I434-L438 PolarHBondContact O-N 2.91Å; A435-L438 PolarHBondContact O-N 3.44Å; L438-F441 PolarHBondContact O-N 2.83Å; L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 3.31Å
439	A	72.1	Confident	70.8	Confident	56 Å²	56	88.8 Å²	88.8	46%	0.463	54%	0.542	S	S	.	.	H	α-helix	trans	-63.4	-44.3	175.9	0	0	0	0	0	112	A435 V436 F441 A442 C443	A435-A439 WeakPolarHBondContact O-CB 3.39Å; A435-A439 PolarHBondContact O-N 3.42Å; V436-A439 PolarHBondContact O-N 2.86Å; A439-F441 PolarHBondContact O-N 2.02Å; A439-A442 PolarHBondContact O-N 2.81Å; A439-C443 PolarHBondContact O-N 2.81Å
440	A	78.3	Confident	71.9	Confident	53 Å²	53	89.8 Å²	89.8	44%	0.438	54%	0.536	S	S	.	.	H	α-helix	trans	-61.6	-42.9	175.9	0	0	0	0	0	111.9	V436 G437 C443 V444	V436-A440 WeakPolarHBondContact O-CB 3.43Å; V436-A440 PolarHBondContact O-N 3.31Å; G437-A440 PolarHBondContact O-N 3.27Å; A440-C443 PolarHBondContact O-N 2.79Å; A440-V444 WeakPolarHBondContact O-CG2 3.18Å; A440-V444 PolarHBondContact O-N 2.85Å
441	F	82.1	Confident	73.2	Confident	134 Å²	134	85.3 Å²	85.3	59%	0.588	52%	0.522	S	S	*	.	H	α-helix	trans	-63.3	-42.1	177.1	-172.1	-106.5	0	0	0	112.4	G437 L438 A439 V444 L445	G437-F441 WeakPolarHBondContact O-CB 3.04Å; G437-F441 PolarHBondContact O-N 2.81Å; L438-F441 PolarHBondContact O-N 2.83Å; A439-F441 PolarHBondContact O-N 2.02Å; F441-V444 PolarHBondContact O-N 2.82Å; F441-L445 HydrophobicContact CD1-CD1 3.81Å; F441-L445 HydrophobicContact CE1-CD1 3.43Å; F441-L445 VanDerWaalsContact CE1-CD1 3.43Å; F441-L445 HydrophobicContact CE1-CG 4.26Å; F441-L445 HydrophobicContact CZ-CD1 4.01Å; F441-L445 HydrophobicContact CZ-CG 4.44Å; F441-L445 PolarHBondContact O-N 3.04Å
442	A	80.2	Confident	74	Confident	48 Å²	48	86.8 Å²	86.8	40%	0.397	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-43.6	174.9	0	0	0	0	0	112.3	L438 A439 L445 L446	L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 3.31Å; A439-A442 PolarHBondContact O-N 2.81Å; A442-L445 PolarHBondContact O-N 3.06Å; A442-L446 WeakPolarHBondContact O-CG 3.36Å; A442-L446 PolarHBondContact O-N 3.01Å
443	C	77.6	Confident	74.7	Confident	80 Å²	80	87.3 Å²	87.3	54%	0.541	52%	0.515	S	S	.	.	H	α-helix	trans	-62.1	-43.3	174.7	-77.8	0	0	0	0	112.5	A439 A440 L446 V447	A439-C443 PolarHBondContact O-N 2.81Å; A440-C443 PolarHBondContact O-N 2.79Å; C443-L446 PolarHBondContact O-N 3.05Å; C443-V447 WeakPolarHBondContact O-CG2 3.43Å; C443-V447 PolarHBondContact O-N 2.83Å
444	V	82.6	Confident	74.9	Confident	92 Å²	92	88 Å²	88	56%	0.558	51%	0.512	S	S	*	.	H	α-helix	trans	-63.1	-43	176.5	171.4	0	0	0	0	111.1	A440 F441 L446 V447 V448	A440-V444 WeakPolarHBondContact O-CG2 3.18Å; A440-V444 PolarHBondContact O-N 2.85Å; F441-V444 PolarHBondContact O-N 2.82Å; V444-L446 PolarHBondContact O-N 3.42Å; V444-V447 PolarHBondContact O-N 3.44Å; V444-V448 HydrophobicContact CG1-CG2 4.39Å; V444-V448 WeakPolarHBondContact O-CB 3.17Å; V444-V448 WeakPolarHBondContact O-CG2 3.4Å; V444-V448 PolarHBondContact O-N 2.93Å
445	L	80.4	Confident	74.9	Confident	96 Å²	96	90.7 Å²	90.7	50%	0.503	52%	0.52	S	S	.	.	H	α-helix	trans	-60.2	-43.9	175.2	-86.1	171.5	0	0	0	112.6	F441 A442 V448 L449	F441-L445 HydrophobicContact CD1-CD1 3.81Å; F441-L445 HydrophobicContact CE1-CD1 3.43Å; F441-L445 VanDerWaalsContact CE1-CD1 3.43Å; F441-L445 HydrophobicContact CE1-CG 4.26Å; F441-L445 HydrophobicContact CZ-CD1 4.01Å; F441-L445 HydrophobicContact CZ-CG 4.44Å; F441-L445 PolarHBondContact O-N 3.04Å; A442-L445 PolarHBondContact O-N 3.06Å; L445-V448 PolarHBondContact O-N 3.17Å; L445-L449 WeakPolarHBondContact O-CB 3.23Å; L445-L449 PolarHBondContact O-N 2.93Å
446	L	80.9	Confident	74.8	Confident	117 Å²	117	95.6 Å²	95.6	61%	0.613	53%	0.527	S	S	*	.	H	α-helix	trans	-65.9	-39.2	177.8	-72.2	171.1	0	0	0	112.3	A442 C443 V444 L449 F450	A442-L446 WeakPolarHBondContact O-CG 3.36Å; A442-L446 PolarHBondContact O-N 3.01Å; C443-L446 PolarHBondContact O-N 3.05Å; V444-L446 PolarHBondContact O-N 3.42Å; L446-L449 PolarHBondContact O-N 3.18Å; L446-F450 VanDerWaalsContact O-CB 3.3Å; L446-F450 WeakPolarHBondContact O-CB 3.27Å; L446-F450 PolarHBondContact O-N 3.02Å
447	V	81.7	Confident	74	Confident	93 Å²	93	94.2 Å²	94.2	56%	0.564	53%	0.532	S	S	*	.	H	α-helix	trans	-66.5	-42.6	174.7	172	0	0	0	0	111.1	C443 V444 F450 V451	C443-V447 WeakPolarHBondContact O-CG2 3.43Å; C443-V447 PolarHBondContact O-N 2.83Å; V444-V447 PolarHBondContact O-N 3.44Å; V447-F450 PolarHBondContact O-N 2.92Å; V447-V451 WeakPolarHBondContact O-CB 3.17Å; V447-V451 VanDerWaalsContact O-CG2 3.3Å; V447-V451 WeakPolarHBondContact O-CG2 3.36Å; V447-V451 PolarHBondContact O-N 2.9Å
448	V	80.6	Confident	73.1	Confident	76 Å²	76	103 Å²	103	46%	0.461	55%	0.552	S	S	.	*	H	α-helix	trans	-63.1	-42.6	175.1	170.7	0	0	0	0	111	V444 L445 V451 M452	V444-V448 HydrophobicContact CG1-CG2 4.39Å; V444-V448 WeakPolarHBondContact O-CB 3.17Å; V444-V448 WeakPolarHBondContact O-CG2 3.4Å; V444-V448 PolarHBondContact O-N 2.93Å; L445-V448 PolarHBondContact O-N 3.17Å; V448-V451 PolarHBondContact O-N 2.91Å; V448-M452 HydrophobicContact CG1-CG 4.37Å; V448-M452 WeakPolarHBondContact O-CB 3.49Å; V448-M452 VanDerWaalsContact O-CG 3.29Å; V448-M452 WeakPolarHBondContact O-CG 3.2Å; V448-M452 PolarHBondContact O-N 2.88Å
449	L	76.5	Confident	71.6	Confident	101 Å²	101	108.9 Å²	108.9	53%	0.529	57%	0.567	S	S	.	*	H	α-helix	trans	-62.9	-44.2	176.6	-169.3	72.4	0	0	0	111.5	L445 L446 V451 M452 I453	L445-L449 WeakPolarHBondContact O-CB 3.23Å; L445-L449 PolarHBondContact O-N 2.93Å; L446-L449 PolarHBondContact O-N 3.18Å; L449-V451 VanDerWaalsContact C-N 3.35Å; L449-V451 PolarHBondContact O-N 3.48Å; L449-M452 PolarHBondContact O-N 2.85Å; L449-I453 HydrophobicContact CG-CD1 4.05Å; L449-I453 VanDerWaalsContact O-CG1 3.3Å; L449-I453 WeakPolarHBondContact O-CG1 3.24Å; L449-I453 PolarHBondContact O-N 2.79Å
450	F	76.4	Confident	70.4	Confident	140 Å²	140	110.9 Å²	110.9	61%	0.614	58%	0.577	S	S	*	*	H	α-helix	trans	-62.9	-39.3	176	-173.4	-103.8	0	0	0	112.2	L446 V447 N454	L446-F450 VanDerWaalsContact O-CB 3.3Å; L446-F450 WeakPolarHBondContact O-CB 3.27Å; L446-F450 PolarHBondContact O-N 3.02Å; V447-F450 PolarHBondContact O-N 2.92Å; F450-N454 WeakPolarHBondContact CD1-ND2 3.48Å; F450-N454 WeakPolarHBondContact CE1-ND2 2.98Å; F450-N454 VanDerWaalsContact CZ-ND2 3.31Å; F450-N454 WeakPolarHBondContact CZ-ND2 3.22Å; F450-N454 WeakPolarHBondContact O-CB 3.21Å; F450-N454 PolarHBondContact O-N 3.23Å; F450-N454 PolarHBondContact O-ND2 2.8Å
451	V	75.3	Confident	68.7	Low	71 Å²	71	117.2 Å²	117.2	43%	0.43	60%	0.595	S	S	.	*	H	α-helix	trans	-68.8	-39.1	173.5	170.8	0	0	0	0	111.5	V447 V448 L449 N454 K455	V447-V451 WeakPolarHBondContact O-CB 3.17Å; V447-V451 VanDerWaalsContact O-CG2 3.3Å; V447-V451 WeakPolarHBondContact O-CG2 3.36Å; V447-V451 PolarHBondContact O-N 2.9Å; V448-V451 PolarHBondContact O-N 2.91Å; L449-V451 VanDerWaalsContact C-N 3.35Å; L449-V451 PolarHBondContact O-N 3.48Å; V451-N454 PolarHBondContact O-N 3.05Å; V451-K455 WeakPolarHBondContact O-CB 3Å; V451-K455 PolarHBondContact O-N 3.37Å
452	M	71.6	Confident	66.6	Low	81 Å²	81	121.3 Å²	121.3	40%	0.399	61%	0.613	S	S	.	*	H	α-helix	trans	-63	-46.5	174.8	-74.6	-65.7	109.7	0	0	111.6	V448 L449 N454 K455 Y456	V448-M452 HydrophobicContact CG1-CG 4.37Å; V448-M452 WeakPolarHBondContact O-CB 3.49Å; V448-M452 VanDerWaalsContact O-CG 3.29Å; V448-M452 WeakPolarHBondContact O-CG 3.2Å; V448-M452 PolarHBondContact O-N 2.88Å; L449-M452 PolarHBondContact O-N 2.85Å; M452-N454 PolarHBondContact O-N 3.2Å; M452-K455 PolarHBondContact O-N 3.39Å; M452-Y456 HydrophobicContact CE-CD2 4.47Å; M452-Y456 HydrophobicContact CE-CE2 3.91Å; M452-Y456 WeakPolarHBondContact O-CB 3.43Å; M452-Y456 WeakPolarHBondContact O-CD2 3.49Å; M452-Y456 PolarHBondContact O-N 3.31Å; M452-Y456 HydrophobicContact SD-CD2 3.85Å; M452-Y456 HydrophobicContact SD-CE2 3.6Å; M452-Y456 VanDerWaalsContact SD-CE2 3.6Å
453	I	70.5	Confident	64.4	Low	105 Å²	105	122.2 Å²	122.2	54%	0.538	63%	0.627	S	S	.	*	H	α-helix	trans	-60.9	-46.1	177.3	-69.3	166.1	0	0	0	110.5	L449 G457	L449-I453 HydrophobicContact CG-CD1 4.05Å; L449-I453 VanDerWaalsContact O-CG1 3.3Å; L449-I453 WeakPolarHBondContact O-CG1 3.24Å; L449-I453 PolarHBondContact O-N 2.79Å; I453-G457 VanDerWaalsContact O-CA 3.28Å; I453-G457 WeakPolarHBondContact O-CA 3.4Å; I453-G457 PolarHBondContact O-N 3.46Å
454	N	61.2	Low	62.4	Low	102 Å²	102	126.2 Å²	126.2	55%	0.545	64%	0.639	S	S	.	*	H	α-helix	trans	-71.7	-28.7	179	-75.6	-51.4	0	0	0	114	F450 V451 M452	F450-N454 WeakPolarHBondContact CD1-ND2 3.48Å; F450-N454 WeakPolarHBondContact CE1-ND2 2.98Å; F450-N454 VanDerWaalsContact CZ-ND2 3.31Å; F450-N454 WeakPolarHBondContact CZ-ND2 3.22Å; F450-N454 WeakPolarHBondContact O-CB 3.21Å; F450-N454 PolarHBondContact O-N 3.23Å; F450-N454 PolarHBondContact O-ND2 2.8Å; V451-N454 PolarHBondContact O-N 3.05Å; M452-N454 PolarHBondContact O-N 3.2Å
455	K	64.4	Low	59.9	Low	150 Å²	150	130.5 Å²	130.5	65%	0.652	65%	0.65	S	S	*	*	H	α-helix	trans	-86.4	-30.6	-179	-167.3	174.9	-175.8	-179.4	0	113.4	V451 M452	V451-K455 WeakPolarHBondContact O-CB 3Å; V451-K455 PolarHBondContact O-N 3.37Å; M452-K455 PolarHBondContact O-N 3.39Å
456	Y	58.3	Low	57.7	Low	160 Å²	160	129.5 Å²	129.5	63%	0.627	66%	0.664	S	S	*	*	H	α-helix	trans	-109.1	-11.2	-178.3	-67.9	-87.2	0	0	0	114.4	M452 R458	M452-Y456 HydrophobicContact CE-CD2 4.47Å; M452-Y456 HydrophobicContact CE-CE2 3.91Å; M452-Y456 WeakPolarHBondContact O-CB 3.43Å; M452-Y456 WeakPolarHBondContact O-CD2 3.49Å; M452-Y456 PolarHBondContact O-N 3.31Å; M452-Y456 HydrophobicContact SD-CD2 3.85Å; M452-Y456 HydrophobicContact SD-CE2 3.6Å; M452-Y456 VanDerWaalsContact SD-CE2 3.6Å; Y456-R458 PolarHBondContact O-N 2.9Å
457	G	54.1	Low	55.7	Low	66 Å²	66	130.4 Å²	130.4	68%	0.68	68%	0.676	S	S	*	*	S	Bend	trans	-64.1	5	177	0	0	0	0	0	116.4	I453	I453-G457 VanDerWaalsContact O-CA 3.28Å; I453-G457 WeakPolarHBondContact O-CA 3.4Å; I453-G457 PolarHBondContact O-N 3.46Å
458	R	54.5	Low	53.3	Low	226 Å²	226	132.6 Å²	132.6	85%	0.853	69%	0.69	S	S	*	*	S	Bend	trans	-117	64.3	175.3	-72.6	-175.2	172.4	179.5	-1.5	112.3	Y456	Y456-R458 PolarHBondContact O-N 2.9Å
459	R	43.8	Very low	51	Low	240 Å²	240	133.3 Å²	133.3	91%	0.906	70%	0.704	S	S	*	*	S	Bend	trans	-171.8	92.4	154.5	-103.1	161.6	-144.4	-141.2	7.7	114.8
460	S	47.2	Very low	48.7	Very low	98 Å²	98	134.6 Å²	134.6	69%	0.685	72%	0.715	S	S	*	*			trans	48.4	118.5	133	178.7	0	0	0	0	123.9
461	K	42.6	Very low	46.7	Very low	186 Å²	186	135.8 Å²	135.8	81%	0.809	73%	0.726	S	S	*	*			trans	70.4	118.7	136.8	-69.3	177.3	-179.9	179	0	122.6
462	F	37.7	Very low	44.3	Very low	219 Å²	219	138 Å²	138	96%	0.961	75%	0.745	S	S	*	*				-171	145.3	123.3	-102.9	-72.1	0	0	0	110.1
463	G	33.9	Very low	42.3	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	75%	0.754	S	S	*	*			cis	176.8	-7.5	-18	0	0	0	0	0	121.3
464	M	36.6	Very low	40.3	Very low	164 Å²	164	141.4 Å²	141.4	81%	0.808	77%	0.773	S	S	*	*			trans	-148.5	147.3	-171.4	-73.5	172.7	44.6	0	0	113.3
465	K	30.7	Very low	38.9	Very low	182 Å²	182	145.5 Å²	145.5	79%	0.791	79%	0.789	S	S	*	*			cis	-164.5	122.5	-11.6	-110.4	173.9	-171.1	177	0	110
466	G	32.8	Very low	37	Very low	76 Å²	76	145.3 Å²	145.3	78%	0.784	80%	0.795	S	S	*	*			trans	54.2	169	136.3	0	0	0	0	0	123.2
467	P	40	Very low	35.5	Very low	135 Å²	135	142.8 Å²	142.8	88%	0.877	80%	0.8	S	S	*	*			cis	-115.2	-178.1	2.7	40.7	-28.8	0	0	0	115.1
468	V	31.2	Very low	34.1	Very low	140 Å²	140	144 Å²	144	85%	0.848	81%	0.805	S	S	*	*			trans	-128.9	145.7	-169.9	167.4	0	0	0	0	110.3
469	A	32	Very low	33	Very low	91 Å²	91	139 Å²	139	75%	0.752	80%	0.804	S	S	*	*			trans	-173.5	147.2	147.3	0	0	0	0	0	110.7
470	V	27.7	Very low	32.2	Very low	127 Å²	127	133.6 Å²	133.6	77%	0.77	80%	0.8	S	S	*	*			cis	-154.1	145	-18.6	137.4	0	0	0	0	105.5
471	I	35.4	Very low	31.2	Very low	165 Å²	165	136.1 Å²	136.1	85%	0.846	81%	0.805	S	S	*	*			trans	-98.4	136.3	164.9	-62.5	170.8	0	0	0	107.7
472	S	25.1	Very low	30.4	Very low	118 Å²	118	134.4 Å²	134.4	83%	0.825	80%	0.8	S	S	*	*			trans	-136.9	125.8	151.6	-156.2	0	0	0	0	107.4
473	G	28	Very low	29.8	Very low	56 Å²	56	130.5 Å²	130.5	58%	0.577	78%	0.784	S	S	*	*			trans	-104.9	160.2	167.1	0	0	0	0	0	109.5
474	E	28.8	Very low	29.4	Very low	202 Å²	202	134.9 Å²	134.9	94%	0.944	79%	0.79	S	S	*	*				-168.3	170.5	125.5	-106.9	171.4	174.7	0	0	109
475	E	32.9	Very low	28.9	Very low	187 Å²	187	132.4 Å²	132.4	87%	0.874	78%	0.78	S	S	*	*			trans	-76.3	141.1	-169.9	-51.7	-179.2	145.9	0	0	111.3
476	D	24.6	Very low	28.6	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	78%	0.783	S	S	*	*				-162.8	130	125.3	-123.1	-33.2	0	0	0	115.3
477	S	26.9	Very low	28.1	Very low	107 Å²	107	132 Å²	132	75%	0.748	78%	0.778	S	S	*	*			trans	-1	118	145	-41.7	0	0	0	0	119
478	A	23.4	Very low	27.3	Very low	93 Å²	93	133.3 Å²	133.3	77%	0.769	78%	0.776	S	S	*	*				172.8	118.5	114	0	0	0	0	0	113.4
479	S	31.9	Very low	27	Very low	121 Å²	121	132.7 Å²	132.7	85%	0.846	77%	0.772	S	S	*	*			trans	-86.2	145.5	147	-63.4	0	0	0	0	109.1
480	P	26.7	Very low	26.8	Very low	125 Å²	125	134.3 Å²	134.3	81%	0.812	77%	0.773	S	S	*	*			trans	-116.6	120	146.5	14.9	3.6	0	0	0	110.9
481	L	26.3	Very low	27	Very low	152 Å²	152	134.4 Å²	134.4	80%	0.796	78%	0.776	S	S	*	*			trans	-83.8	-177.9	161.5	-120	148.5	0	0	0	109.6
482	H	26.6	Very low	26.4	Very low	150 Å²	150	131.3 Å²	131.3	69%	0.694	77%	0.769	S	S	*	*			trans	86.3	138	179.6	-53.3	-77.3	0	0	0	115.6
483	H	24.2	Very low	26.5	Very low	136 Å²	136	130.5 Å²	130.5	63%	0.63	76%	0.764	S	S	*	*			cis	-151.9	156.6	-9.8	-115.3	-48.2	0	0	0	107.3
484	I	25.1	Very low	26.5	Very low	160 Å²	160	135.2 Å²	135.2	82%	0.821	78%	0.775	S	S	*	*				-169.2	150.2	87	-84.8	165.1	0	0	0	109.1
485	N	25.8	Very low	26.4	Very low	112 Å²	112	132.3 Å²	132.3	60%	0.599	77%	0.766	S	S	*	*			trans	-68.1	171.3	-179.9	-61.7	-34.1	0	0	0	112.8
486	H	25.2	Very low	26.3	Very low	182 Å²	182	128.6 Å²	128.6	84%	0.843	77%	0.767	S	S	*	*			cis	-144.3	159.3	24.7	-59.5	-105.3	0	0	0	108.1
487	G	22	Very low	26.5	Very low	66 Å²	66	124.8 Å²	124.8	68%	0.68	76%	0.763	S	S	*	*			cis	124.3	115.7	19.1	0	0	0	0	0	109.1
488	I	24.1	Very low	27	Very low	164 Å²	164	125.6 Å²	125.6	84%	0.841	77%	0.765	S	S	*	*			trans	-174.1	105.5	154.1	-94.1	149.8	0	0	0	108.7
489	T	24	Very low	27.4	Very low	126 Å²	126	128.7 Å²	128.7	77%	0.773	77%	0.769	S	S	*	*			trans	19.3	121.6	153.8	58.1	0	0	0	0	121.9
490	T	27.7	Very low	27.3	Very low	125 Å²	125	129.3 Å²	129.3	77%	0.767	77%	0.767	S	S	*	*			trans	-79.1	160.2	142.7	48.4	0	0	0	0	111.4
491	P	31.6	Very low	27.5	Very low	129 Å²	129	129.7 Å²	129.7	84%	0.838	77%	0.767	S	S	*	*			trans	-115.1	155.1	136.7	6.9	12.7	0	0	0	111.4
492	S	23.4	Very low	27.9	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	77%	0.768	S	S	*	*			trans	-102.7	164.9	-168.5	-54.6	0	0	0	0	113.5
493	S	27.5	Very low	28.1	Very low	101 Å²	101	129 Å²	129	71%	0.706	77%	0.773	S	S	*	*			trans	57	120.2	148.6	58.7	0	0	0	0	120.1
494	L	27	Very low	28.5	Very low	155 Å²	155	125.5 Å²	125.5	81%	0.812	77%	0.773	S	S	*	*				-174.9	127.9	106.9	-93.6	153.9	0	0	0	112.4
495	D	26.9	Very low	28.8	Very low	142 Å²	142	127.2 Å²	127.2	76%	0.759	78%	0.78	S	S	*	*			trans	43.5	100	150.2	-56.8	-17	0	0	0	123.6
496	A	32.1	Very low	29.1	Very low	109 Å²	109	127.1 Å²	127.1	90%	0.901	78%	0.784	S	S	*	*				53.1	113.6	123	0	0	0	0	0	122.2
497	G	28.7	Very low	29.3	Very low	66 Å²	66	130.4 Å²	130.4	68%	0.68	79%	0.789	S	S	*	*			trans	-131.8	153.6	152.9	0	0	0	0	0	110.8	D499	G497-D499 PolarHBondContact O-N 3.15Å
498	P	37	Very low	29.9	Very low	124 Å²	124	133.3 Å²	133.3	81%	0.805	79%	0.787	S	S	*	*	S	Bend	trans	-100.4	75.4	-155.5	38.8	-35.9	0	0	0	114.9
499	D	30.8	Very low	30	Very low	157 Å²	157	129.9 Å²	129.9	84%	0.84	78%	0.776	S	S	*	*			trans	-141	54.3	173.2	-89.9	-49	0	0	0	113.1	G497	G497-D499 PolarHBondContact O-N 3.15Å
500	T	31.4	Very low	30.4	Very low	134 Å²	134	130.4 Å²	130.4	82%	0.822	78%	0.779	S	S	*	*			trans	-107.7	104.8	172.4	54.6	0	0	0	0	111.6
501	V	30.6	Very low	30.6	Very low	133 Å²	133	129.1 Å²	129.1	81%	0.806	77%	0.766	S	S	*	*			trans	-101.7	130.9	170.9	-177.9	0	0	0	0	110
502	V	33.4	Very low	30.5	Very low	135 Å²	135	131.1 Å²	131.1	82%	0.818	76%	0.764	S	S	*	*			trans	-93.2	120.5	-175	176.9	0	0	0	0	110.8
503	I	32.2	Very low	30.9	Very low	154 Å²	154	132 Å²	132	79%	0.79	76%	0.761	S	S	*	*			trans	-138.9	128.7	160.6	-55.8	-179.4	0	0	0	108.2
504	G	32.5	Very low	31.1	Very low	62 Å²	62	130.9 Å²	130.9	64%	0.639	75%	0.751	S	S	*	*	S	Bend	trans	55.3	79.6	160	0	0	0	0	0	118.5	T506	G504-T506 PolarHBondContact O-N 3.12Å
505	M	31.6	Very low	31.4	Very low	196 Å²	196	129.6 Å²	129.6	97%	0.966	74%	0.741	S	S	*	*	S	Bend	trans	24.9	59.7	157.2	-68.9	-172.4	170.3	0	0	118.7
506	T	31.3	Very low	31.9	Very low	110 Å²	110	129.4 Å²	129.4	68%	0.675	73%	0.731	S	S	*	*			trans	-163.9	138.5	142.6	15	0	0	0	0	109.2	G504 I508	G504-T506 PolarHBondContact O-N 3.12Å; T506-I508 PolarHBondContact O-N 2.87Å
507	R	30.4	Very low	32.4	Very low	251 Å²	251	128 Å²	128	95%	0.947	70%	0.704	S	S	*	*			trans	-77	89.6	171.3	-73.4	-177.7	177.6	171.7	-1.4	108.6	P509	R507-P509 WeakPolarHBondContact O-CD 3.44Å
508	I	33.3	Very low	32.5	Very low	127 Å²	127	134.7 Å²	134.7	65%	0.651	71%	0.709	S	S	*	*			trans	-77.7	116.3	176.8	-58.3	172.8	0	0	0	108.1	T506	T506-I508 PolarHBondContact O-N 2.87Å
509	P	27.5	Very low	32.1	Very low	92 Å²	92	136.8 Å²	136.8	60%	0.597	71%	0.708	S	S	*	*			trans	-65.5	138.7	173.9	27.6	-33.2	0	0	0	109.7	R507 I511	R507-P509 WeakPolarHBondContact O-CD 3.44Å; P509-I511 HydrophobicContact CG-CG1 4.36Å; P509-I511 PolarHBondContact O-N 3.45Å
510	V	31.6	Very low	32.2	Very low	137 Å²	137	133 Å²	133	83%	0.83	71%	0.707	S	S	*	*			trans	-70.3	86.7	170	-178.4	0	0	0	0	108	E512	V510-E512 PolarHBondContact O-N 2.99Å
511	I	32.6	Very low	32.4	Very low	97 Å²	97	134 Å²	134	50%	0.497	70%	0.701	S	S	.	*			trans	-76.3	103.8	162.6	-58.5	177.6	0	0	0	105.4	P509 P514 R731	P509-I511 HydrophobicContact CG-CG1 4.36Å; P509-I511 PolarHBondContact O-N 3.45Å; I511-P514 HydrophobicContact CG2-CB 4.17Å; I511-P514 HydrophobicContact CG2-CG 4.05Å; I511-R731 PolarHBondContact O-NH1 3.05Å
512	E	29.4	Very low	32.7	Very low	171 Å²	171	135.4 Å²	135.4	80%	0.799	70%	0.704	S	S	*	*			trans	-48.3	141.3	164.2	-72.2	-171.2	138.9	0	0	109.4	V510 P514	V510-E512 PolarHBondContact O-N 2.99Å; E512-P514 WeakPolarHBondContact O-CA 3.33Å; E512-P514 WeakPolarHBondContact O-CD 3.42Å
513	N	31.3	Very low	33	Very low	118 Å²	118	132.9 Å²	132.9	63%	0.631	69%	0.692	S	S	*	*			trans	-40.6	99.7	-171.7	-162.7	11.2	0	0	0	111.6	Q515	N513-Q515 PolarHBondContact O-N 3.26Å
514	P	31.1	Very low	33.3	Very low	78 Å²	78	133.3 Å²	133.3	51%	0.506	69%	0.69	S	S	.	*			trans	-76.7	98.1	-166	27.7	-31.3	0	0	0	108	I511 E512	I511-P514 HydrophobicContact CG2-CB 4.17Å; I511-P514 HydrophobicContact CG2-CG 4.05Å; E512-P514 WeakPolarHBondContact O-CA 3.33Å; E512-P514 WeakPolarHBondContact O-CD 3.42Å
515	Q	34.4	Very low	33.7	Very low	129 Å²	129	137.7 Å²	137.7	60%	0.603	69%	0.692	S	S	*	*			trans	11.7	126	162.8	-62.8	179.3	-19.2	0	0	115.5	N513 F517	N513-Q515 PolarHBondContact O-N 3.26Å; Q515-F517 PolarHBondContact O-N 3.3Å
516	Y	37.2	Very low	34.2	Very low	138 Å²	138	134.3 Å²	134.3	54%	0.541	68%	0.684	S	S	.	*	S	Bend	trans	-44.3	-13.7	165.7	-82.2	-98	0	0	0	115.4
517	F	42.9	Very low	35.1	Very low	79 Å²	79	134.7 Å²	134.7	35%	0.346	68%	0.682	S	S	.	*			trans	-138.4	62.7	-164.5	-55.5	-71.8	0	0	0	113.7	Q515 R587	Q515-F517 PolarHBondContact O-N 3.3Å; F517-R587 HydrophobicContact CD2-CB 4.45Å; F517-R587 HydrophobicContact CE1-CB 4.49Å; F517-R587 HydrophobicContact CE2-CB 3.68Å; F517-R587 HydrophobicContact CE2-CG 4.29Å; F517-R587 HydrophobicContact CZ-CB 3.71Å
518	R	30.2	Very low	36.6	Very low	207 Å²	207	124.4 Å²	124.4	78%	0.781	65%	0.647	S	S	*	*			trans	-139.7	28	170.3	-113.1	-169.2	-171	-150.1	2.6	118.1
519	Q	28.6	Very low	38.8	Very low	168 Å²	168	127.8 Å²	127.8	79%	0.785	65%	0.653	S	S	*	*	S	Bend	trans	-119.1	117.1	157.4	-105.8	68.9	32.4	0	0	110.1	H521	Q519-H521 VanDerWaalsContact C-N 3.3Å; Q519-H521 PolarHBondContact O-N 2.98Å
520	G	33.3	Very low	41.5	Very low	78 Å²	78	124.6 Å²	124.6	80%	0.804	63%	0.632	S	S	*	*			trans	-77.7	70.1	-177.1	0	0	0	0	0	113.5
521	H	35.5	Very low	44.3	Very low	153 Å²	153	123 Å²	123	71%	0.708	62%	0.615	S	S	*	*			trans	-115.3	83.1	171.8	-70.5	-47	0	0	0	111.2	Q519 C523	Q519-H521 VanDerWaalsContact C-N 3.3Å; Q519-H521 PolarHBondContact O-N 2.98Å; H521-C523 VanDerWaalsContact C-N 3.34Å; H521-C523 PolarHBondContact O-N 3.47Å
522	N	36.2	Very low	47	Very low	163 Å²	163	124.9 Å²	124.9	87%	0.872	62%	0.622	S	S	*	*	S	Bend	trans	21.8	53.6	154.8	-66.2	-3.7	0	0	0	119.2
523	C	40.2	Very low	50	Low	82 Å²	82	117.4 Å²	117.4	55%	0.554	59%	0.587	S	S	*	*			trans	-101.2	-0.1	160	-63.9	0	0	0	0	112.5	H521 K525	H521-C523 VanDerWaalsContact C-N 3.34Å; H521-C523 PolarHBondContact O-N 3.47Å; C523-K525 PolarHBondContact O-N 2.72Å
524	H	37.5	Very low	52.6	Low	164 Å²	164	116.8 Å²	116.8	76%	0.759	58%	0.579	S	S	*	*			trans	-80.7	95.8	172.7	-63	-54.6	0	0	0	110.7
525	K	41.2	Very low	55.3	Low	154 Å²	154	117.4 Å²	117.4	67%	0.67	57%	0.571	S	S	*	*			trans	-76.7	122.5	152.5	-75	-179.2	179.5	173.1	0	107.8	C523 D527 T528	C523-K525 PolarHBondContact O-N 2.72Å; K525-D527 PolarHBondContact O-N 3.38Å; K525-T528 PolarHBondContact O-OG1 2.93Å
526	P	41.8	Very low	57.8	Low	124 Å²	124	120.3 Å²	120.3	81%	0.805	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-15.1	-175.7	-27.5	36.5	0	0	0	116.1
527	D	50.6	Low	60.3	Low	119 Å²	119	114.7 Å²	114.7	64%	0.636	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.2	39.6	-172.5	-54.2	-62.9	0	0	0	113.2	K525 Y529	K525-D527 PolarHBondContact O-N 3.38Å; D527-Y529 HydrophobicContact CB-CE2 4.21Å; D527-Y529 VanDerWaalsContact O-CD2 3.29Å; D527-Y529 WeakPolarHBondContact O-CD2 3.49Å; D527-Y529 PolarHBondContact O-N 2.89Å; D527-Y529 VanDerWaalsContact O-N 3.08Å
528	T	63.2	Low	62.5	Low	35 Å²	35	111.8 Å²	111.8	22%	0.215	54%	0.544	C	S	.	.			trans	-76.7	94.7	175.5	-54.3	0	0	0	0	110.5	K525 V530 T593 N594	K525-T528 PolarHBondContact O-OG1 2.93Å; T528-V530 PolarHBondContact O-N 2.89Å; T528-T593 HydrophobicContact CG2-CG2 3.7Å; T528-N594 WeakPolarHBondContact CG2-ND2 3.41Å; T528-N594 PolarHBondContact OG1-ND2 3.15Å; T528-N594 VanDerWaalsContact OG1-ND2 3.16Å
529	Y	77.7	Confident	65.3	Low	197 Å²	197	104.5 Å²	104.5	77%	0.773	52%	0.522	S	S	*	.			trans	-75.3	103	174.5	-70.8	-86.6	0	0	0	111.6	D527	D527-Y529 HydrophobicContact CB-CE2 4.21Å; D527-Y529 VanDerWaalsContact O-CD2 3.29Å; D527-Y529 WeakPolarHBondContact O-CD2 3.49Å; D527-Y529 PolarHBondContact O-N 2.89Å; D527-Y529 VanDerWaalsContact O-N 3.08Å
530	V	84.9	Confident	68	Low	26 Å²	26	100.7 Å²	100.7	16%	0.158	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-66.4	130.6	167.4	-176.5	0	0	0	0	108.9	T528 H532 A589 E590 F603 V606	T528-V530 PolarHBondContact O-N 2.89Å; V530-H532 PolarHBondContact O-CD2 3.27Å; V530-H532 PolarHBondContact O-N 3.5Å; V530-A589 HydrophobicContact CG1-CB 4.03Å; V530-A589 HydrophobicContact CG2-CB 4.35Å; V530-E590 HydrophobicContact CG2-CG 3.91Å; V530-F603 HydrophobicContact CG1-CE1 4.3Å; V530-V606 HydrophobicContact CG1-CG1 4.08Å; V530-V606 HydrophobicContact CG1-CG2 3.86Å
531	Q	89.9	Confident	70.3	Confident	102 Å²	102	101 Å²	101	48%	0.477	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-71.3	123.6	176.6	177.7	168.3	-9.5	0	0	110.4	I533 Y604 G605 V606	Q531-I533 HydrophobicContact CG-CG1 4.43Å; Q531-Y604 WeakPolarHBondContact CB-O 3.31Å; Q531-Y604 PolarHBondContact OE1-O 3.06Å; Q531-G605 CarbonylContact O-C 3.59Å; Q531-G605 WeakPolarHBondContact O-CA 3.28Å; Q531-V606 PolarHBondContact O-N 3.4Å
532	H	89.9	Confident	72.3	Confident	138 Å²	138	99.1 Å²	99.1	64%	0.639	47%	0.473	S	S	*	.	B	Isolated β-bridge	trans	-91.5	123	173.2	-77.6	-106.2	0	0	0	110.3	V530 V606	V530-H532 PolarHBondContact O-CD2 3.27Å; V530-H532 PolarHBondContact O-N 3.5Å; H532-V606 CarbonylContact C-O 3.57Å; H532-V606 WeakPolarHBondContact CA-O 3.15Å
533	I	91.6	Very high	74.6	Confident	13 Å²	13	95.3 Å²	95.3	7%	0.067	45%	0.449	C	S	.	.			trans	-105.7	131.8	177.4	-59.1	167.8	0	0	0	107.3	Q531 I538 L560 V606 C607 V616	Q531-I533 HydrophobicContact CG-CG1 4.43Å; I533-I538 HydrophobicContact CG2-CD1 3.85Å; I533-I538 HydrophobicContact CG2-CG1 3.84Å; I533-L560 HydrophobicContact CD1-CD1 3.84Å; I533-L560 HydrophobicContact CG1-CD1 4.23Å; I533-V606 PolarHBondContact N-O 2.96Å; I533-C607 WeakPolarHBondContact O-CA 3.29Å; I533-C607 VanDerWaalsContact O-CB 3.27Å; I533-C607 WeakPolarHBondContact O-CB 3.36Å; I533-V616 HydrophobicContact CD1-CB 3.71Å; I533-V616 HydrophobicContact CD1-CG1 4.13Å; I533-V616 HydrophobicContact CD1-CG2 3.67Å
534	K	87.1	Confident	76.3	Confident	105 Å²	105	95 Å²	95	46%	0.457	44%	0.442	S	S	.	.			trans	-77.9	142.5	-177.7	-53.8	175.3	177.4	175.4	0	109.7	R536 D537	K534-R536 VanDerWaalsContact C-N 3.26Å; K534-R536 HydrophobicContact CB-CG 4.22Å; K534-R536 PolarHBondContact O-N 3.48Å; K534-D537 WeakPolarHBondContact CB-OD2 3.3Å; K534-D537 WeakPolarHBondContact O-CB 3.4Å; K534-D537 PolarHBondContact O-N 2.96Å
535	R	87.3	Confident	77.9	Confident	92 Å²	92	88.4 Å²	88.4	35%	0.347	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-55.1	-39.6	-178	-159.7	178.1	-169.8	95	1.5	113.8	D537 I538 D609 D611 P612	R535-D537 PolarHBondContact O-N 2.7Å; R535-I538 PolarHBondContact O-N 3.49Å; R535-I538 VanDerWaalsContact O-N 3.1Å; R535-D609 HydrophobicContact CB-CB 4.48Å; R535-D609 PolarHBondContact NH1-O 3.44Å; R535-D611 PolarHBondContact NH2-O 3.31Å; R535-P612 PolarHBondContact NH1-O 2.92Å
536	R	86.4	Confident	79.2	Confident	189 Å²	189	83.7 Å²	83.7	71%	0.713	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-64.1	-21.8	178.5	74.1	-174.1	-170.7	179.3	9.1	114.5	K534	K534-R536 VanDerWaalsContact C-N 3.26Å; K534-R536 HydrophobicContact CB-CG 4.22Å; K534-R536 PolarHBondContact O-N 3.48Å
537	D	89.9	Confident	80.1	Confident	20 Å²	20	77.9 Å²	77.9	11%	0.107	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-84.4	-3.1	178.7	-60.3	-45.1	0	0	0	110.8	K534 R535 C557 Y558 N559	K534-D537 WeakPolarHBondContact CB-OD2 3.3Å; K534-D537 WeakPolarHBondContact O-CB 3.4Å; K534-D537 PolarHBondContact O-N 2.96Å; R535-D537 PolarHBondContact O-N 2.7Å; D537-C557 CarbonylContact O-C 3.57Å; D537-C557 VanDerWaalsContact O-CA 3.27Å; D537-C557 WeakPolarHBondContact O-CA 3.4Å; D537-Y558 PolarHBondContact O-N 3.13Å; D537-N559 PolarHBondContact OD1-ND2 2.85Å
538	I	89.6	Confident	80.4	Confident	19 Å²	19	75.1 Å²	75.1	10%	0.097	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	114.8	-178.4	-54.7	174.2	0	0	0	110	I533 R535 L540 A555 V571 C607 I614 V616	I533-I538 HydrophobicContact CG2-CD1 3.85Å; I533-I538 HydrophobicContact CG2-CG1 3.84Å; R535-I538 PolarHBondContact O-N 3.49Å; R535-I538 VanDerWaalsContact O-N 3.1Å; I538-L540 HydrophobicContact CG2-CD2 4.17Å; I538-A555 HydrophobicContact CG2-CB 4.11Å; I538-V571 HydrophobicContact CG2-CG2 3.79Å; I538-C607 HydrophobicContact CD1-CB 3.97Å; I538-I614 HydrophobicContact CD1-CG2 3.97Å; I538-V616 HydrophobicContact CD1-CG2 3.85Å
539	V	88.9	Confident	80.3	Confident	53 Å²	53	77.5 Å²	77.5	32%	0.321	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	109	176.3	179.8	0	0	0	0	109.2	A555 E556 Y558	V539-A555 CarbonylContact O-C 3.59Å; V539-A555 WeakPolarHBondContact O-CA 3.45Å; V539-A555 VanDerWaalsContact O-CB 3.25Å; V539-A555 WeakPolarHBondContact O-CB 3.45Å; V539-E556 PolarHBondContact N-O 3.14Å; V539-E556 PolarHBondContact O-N 3.25Å; V539-Y558 HydrophobicContact CB-CE2 4.47Å; V539-Y558 HydrophobicContact CG2-CD2 4.35Å; V539-Y558 HydrophobicContact CG2-CE2 3.79Å
540	L	85.7	Confident	80	Confident	89 Å²	89	68.2 Å²	68.2	47%	0.466	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	140	177.8	-55	-176.5	0	0	0	110.3	I538 F553 A555 V571	I538-L540 HydrophobicContact CG2-CD2 4.17Å; L540-F553 HydrophobicContact CD1-CD2 4.45Å; L540-F553 HydrophobicContact CD1-CG 4.39Å; L540-F553 HydrophobicContact CD2-CB 4.04Å; L540-F553 HydrophobicContact CD2-CG 4.36Å; L540-A555 HydrophobicContact CD2-CB 3.94Å; L540-V571 HydrophobicContact CD2-CB 4.15Å; L540-V571 HydrophobicContact CD2-CG1 3.83Å; L540-V571 HydrophobicContact CD2-CG2 4.4Å
541	K	81.7	Confident	79.8	Confident	83 Å²	83	69.9 Å²	69.9	36%	0.361	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-53.7	179.8	-74.4	-59.6	-160.2	177.4	0	113.4	E360 L554 E556	E360-K541 IonicContact OE1-NZ 2.94Å; E360-K541 PolarHBondContact OE1-NZ 3.45Å; E360-K541 IonicContact OE2-NZ 2.78Å; E360-K541 PolarHBondContact OE2-NZ 2.84Å; K541-L554 HydrophobicContact CB-CG 4.48Å; K541-L554 PolarHBondContact N-O 3.01Å; K541-E556 HydrophobicContact CG-CG 4.3Å
542	R	78.1	Confident	79.6	Confident	115 Å²	115	65.4 Å²	65.4	43%	0.434	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	156.3	176	64.8	170.5	175.6	-164.3	-6.3	112.5	F553 L554	R542-F553 CarbonylContact O-C 3.58Å; R542-F553 WeakPolarHBondContact O-CA 3.37Å; R542-L554 HydrophobicContact CG-CB 3.88Å; R542-L554 HydrophobicContact CG-CD2 4.21Å; R542-L554 PolarHBondContact N-O 3.49Å; R542-L554 PolarHBondContact O-N 3.39Å
543	E	82.5	Confident	79.5	Confident	82 Å²	82	60.6 Å²	60.6	38%	0.383	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	136.8	168.3	-161.2	168.6	144.1	0	0	110.3	K551 F553	E543-K551 IonicContact OE1-NZ 2.74Å; E543-K551 PolarHBondContact OE1-NZ 2.96Å; E543-K551 WeakPolarHBondContact OE2-CD 3.41Å; E543-K551 IonicContact OE2-NZ 3.75Å; E543-K551 PolarHBondContact OE2-NZ 3.42Å; E543-F553 HydrophobicContact CB-CD1 4.04Å; E543-F553 HydrophobicContact CB-CE1 3.96Å; E543-F553 HydrophobicContact CG-CD1 4.32Å; E543-F553 HydrophobicContact CG-CE1 4.06Å
544	L	77	Confident	79.4	Confident	75 Å²	75	60.8 Å²	60.8	39%	0.393	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	-22.1	175.4	-67	176.6	0	0	0	112.1	V552 L554 Y619	L544-V552 HydrophobicContact CB-CG1 4.4Å; L544-V552 PolarHBondContact N-O 3.01Å; L544-L554 HydrophobicContact CD1-CB 4.06Å; L544-L554 HydrophobicContact CD2-CB 4.08Å; L544-L554 HydrophobicContact CG-CB 4.04Å; L544-Y619 HydrophobicContact CD1-CD2 4.25Å; L544-Y619 HydrophobicContact CD1-CE2 3.96Å; L544-Y619 HydrophobicContact CD2-CE2 4.39Å
545	G	70.5	Confident	79.6	Confident	26 Å²	26	55.8 Å²	55.8	27%	0.268	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	164.2	167.7	176.7	0	0	0	0	0	112.7	V552	G545-V552 PolarHBondContact N-O 3.28Å; G545-V552 PolarHBondContact O-N 3.28Å
546	E	67.9	Low	79.8	Confident	55 Å²	55	52.9 Å²	52.9	26%	0.257	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	143.2	177.3	-168.8	168.9	155.6	0	0	110.1	K551 K575	E546-K551 HydrophobicContact CB-CG 4.27Å; E546-K551 HydrophobicContact CG-CG 3.83Å; E546-K551 WeakPolarHBondContact OE2-CE 3.18Å; E546-K551 IonicContact OE2-NZ 2.79Å; E546-K551 PolarHBondContact OE2-NZ 3.16Å; E546-K575 WeakPolarHBondContact OE1-CE 3.37Å; E546-K575 IonicContact OE1-NZ 2.59Å; E546-K575 PolarHBondContact OE1-NZ 2.79Å
547	G	61.8	Low	80.1	Confident	3 Å²	3	44 Å²	44	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	176.7	176	0	0	0	0	0	112.2	F549 G550	G547-F549 PolarHBondContact O-N 3.17Å; G547-G550 PolarHBondContact N-O 3.17Å; G547-G550 PolarHBondContact O-N 3.13Å; G547-G550 VanDerWaalsContact O-O 3.11Å
548	A	56.7	Low	80.2	Confident	60 Å²	60	46.9 Å²	46.9	50%	0.496	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-11.6	-169.8	0	0	0	0	0	115.7	R702	A548-R702 HydrophobicContact CB-CB 4.27Å; A548-R702 HydrophobicContact CB-CG 4.31Å
549	F	61.1	Low	80	Confident	85 Å²	85	51.9 Å²	51.9	37%	0.373	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-1.3	176.5	-56.5	-81.3	0	0	0	113.5	G547 L574 K575 R702	G547-F549 PolarHBondContact O-N 3.17Å; F549-L574 WeakPolarHBondContact O-CA 3.35Å; F549-K575 PolarHBondContact O-N 3.14Å; F549-R702 VanDerWaalsContact CE2-NH1 3.31Å
550	G	71.5	Confident	79.9	Confident	3 Å²	3	50.4 Å²	50.4	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.6	-171.9	-179.7	0	0	0	0	0	114.5	G547 A573	G547-G550 PolarHBondContact N-O 3.17Å; G547-G550 PolarHBondContact O-N 3.13Å; G547-G550 VanDerWaalsContact O-O 3.11Å; G550-A573 CarbonylContact C-O 3.45Å; G550-A573 VanDerWaalsContact CA-O 3.28Å; G550-A573 WeakPolarHBondContact CA-O 3.47Å
551	K	81.2	Confident	79.5	Confident	61 Å²	61	47.6 Å²	47.6	27%	0.265	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	151.3	-177.9	-75.4	176.6	172	-80.1	0	111.3	E543 E546 F553 A573	E543-K551 IonicContact OE1-NZ 2.74Å; E543-K551 PolarHBondContact OE1-NZ 2.96Å; E543-K551 WeakPolarHBondContact OE2-CD 3.41Å; E543-K551 IonicContact OE2-NZ 3.75Å; E543-K551 PolarHBondContact OE2-NZ 3.42Å; E546-K551 HydrophobicContact CB-CG 4.27Å; E546-K551 HydrophobicContact CG-CG 3.83Å; E546-K551 WeakPolarHBondContact OE2-CE 3.18Å; E546-K551 IonicContact OE2-NZ 2.79Å; E546-K551 PolarHBondContact OE2-NZ 3.16Å; K551-F553 HydrophobicContact CB-CD2 4.39Å; K551-F553 HydrophobicContact CB-CE2 3.51Å; K551-F553 HydrophobicContact CB-CZ 3.73Å; K551-F553 HydrophobicContact CD-CZ 3.94Å; K551-F553 HydrophobicContact CG-CZ 4.47Å; K551-A573 PolarHBondContact N-O 3.31Å; K551-A573 VanDerWaalsContact N-O 3.09Å; K551-A573 PolarHBondContact O-N 3.38Å
552	V	85.6	Confident	79	Confident	7 Å²	7	50 Å²	50	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	130.8	179	-173.2	0	0	0	0	109.1	L544 G545 V571 M700	L544-V552 HydrophobicContact CB-CG1 4.4Å; L544-V552 PolarHBondContact N-O 3.01Å; G545-V552 PolarHBondContact N-O 3.28Å; G545-V552 PolarHBondContact O-N 3.28Å; V552-V571 CarbonylContact C-O 3.52Å; V552-V571 VanDerWaalsContact CA-O 3.31Å; V552-V571 WeakPolarHBondContact CA-O 3.46Å; V552-M700 HydrophobicContact CB-SD 4.34Å; V552-M700 HydrophobicContact CG1-SD 3.81Å; V552-M700 HydrophobicContact CG2-CB 3.81Å; V552-M700 HydrophobicContact CG2-CG 3.62Å; V552-M700 HydrophobicContact CG2-SD 3.59Å; V552-M700 VanDerWaalsContact CG2-SD 3.59Å
553	F	87.1	Confident	78.3	Confident	38 Å²	38	50.3 Å²	50.3	17%	0.167	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147.4	-176.3	-60.2	-88.4	0	0	0	111.3	L540 R542 E543 K551 A570 V571 A573	L540-F553 HydrophobicContact CD1-CD2 4.45Å; L540-F553 HydrophobicContact CD1-CG 4.39Å; L540-F553 HydrophobicContact CD2-CB 4.04Å; L540-F553 HydrophobicContact CD2-CG 4.36Å; R542-F553 CarbonylContact O-C 3.58Å; R542-F553 WeakPolarHBondContact O-CA 3.37Å; E543-F553 HydrophobicContact CB-CD1 4.04Å; E543-F553 HydrophobicContact CB-CE1 3.96Å; E543-F553 HydrophobicContact CG-CD1 4.32Å; E543-F553 HydrophobicContact CG-CE1 4.06Å; K551-F553 HydrophobicContact CB-CD2 4.39Å; K551-F553 HydrophobicContact CB-CE2 3.51Å; K551-F553 HydrophobicContact CB-CZ 3.73Å; K551-F553 HydrophobicContact CD-CZ 3.94Å; K551-F553 HydrophobicContact CG-CZ 4.47Å; F553-A570 CarbonylContact O-C 3.54Å; F553-A570 WeakPolarHBondContact O-CA 3.48Å; F553-V571 HydrophobicContact CB-CB 4.44Å; F553-V571 PolarHBondContact N-O 3.19Å; F553-V571 PolarHBondContact O-N 2.92Å; F553-A573 HydrophobicContact CD2-CB 4.42Å; F553-A573 HydrophobicContact CE2-CB 4.11Å
554	L	88.8	Confident	77.7	Confident	17 Å²	17	52.4 Å²	52.4	9%	0.089	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	133.8	155.5	178.5	58.6	0	0	0	107.2	K541 R542 L544 L568 Y619	K541-L554 HydrophobicContact CB-CG 4.48Å; K541-L554 PolarHBondContact N-O 3.01Å; R542-L554 HydrophobicContact CG-CB 3.88Å; R542-L554 HydrophobicContact CG-CD2 4.21Å; R542-L554 PolarHBondContact N-O 3.49Å; R542-L554 PolarHBondContact O-N 3.39Å; L544-L554 HydrophobicContact CD1-CB 4.06Å; L544-L554 HydrophobicContact CD2-CB 4.08Å; L544-L554 HydrophobicContact CG-CB 4.04Å; L554-L568 HydrophobicContact CD1-CB 4.26Å; L554-L568 HydrophobicContact CD1-CD2 4.06Å; L554-L568 HydrophobicContact CG-CD2 4.46Å; L554-Y619 HydrophobicContact CD1-CD1 3.72Å; L554-Y619 HydrophobicContact CD1-CD2 3.65Å; L554-Y619 HydrophobicContact CD1-CE1 3.82Å; L554-Y619 HydrophobicContact CD1-CE2 3.79Å; L554-Y619 HydrophobicContact CD1-CG 3.63Å; L554-Y619 HydrophobicContact CD2-CE1 4.49Å
555	A	91.9	Very high	77.5	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	158.4	177.2	0	0	0	0	0	111.1	I538 V539 L540 L568 V569 V571	I538-A555 HydrophobicContact CG2-CB 4.11Å; V539-A555 CarbonylContact O-C 3.59Å; V539-A555 WeakPolarHBondContact O-CA 3.45Å; V539-A555 VanDerWaalsContact O-CB 3.25Å; V539-A555 WeakPolarHBondContact O-CB 3.45Å; L540-A555 HydrophobicContact CD2-CB 3.94Å; A555-L568 WeakPolarHBondContact O-CA 3.36Å; A555-V569 HydrophobicContact CB-CG2 3.94Å; A555-V569 PolarHBondContact N-O 3.36Å; A555-V569 WeakPolarHBondContact O-CG2 3.38Å; A555-V569 PolarHBondContact O-N 3.29Å; A555-V571 HydrophobicContact CB-CB 4.35Å; A555-V571 HydrophobicContact CB-CG2 3.71Å
556	E	92.8	Very high	78.2	Confident	31 Å²	31	58.8 Å²	58.8	15%	0.145	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	132.7	161.7	-61.8	-168.7	135.9	0	0	108.8	V539 K541 Y558 K566 M567 L568	V539-E556 PolarHBondContact N-O 3.14Å; V539-E556 PolarHBondContact O-N 3.25Å; K541-E556 HydrophobicContact CG-CG 4.3Å; E556-Y558 HydrophobicContact CB-CE2 4.31Å; E556-Y558 PolarHBondContact OE2-OH 3.35Å; E556-K566 WeakPolarHBondContact OE1-CE 3.34Å; E556-K566 IonicContact OE1-NZ 2.69Å; E556-K566 PolarHBondContact OE1-NZ 3.2Å; E556-K566 IonicContact OE2-NZ 3.59Å; E556-K566 PolarHBondContact OE2-NZ 3.35Å; E556-M567 WeakPolarHBondContact CA-O 3.5Å; E556-L568 HydrophobicContact CG-CD2 4Å
557	C	92.5	Very high	79.2	Confident	1 Å²	1	57.9 Å²	57.9	1%	0.007	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.4	172.9	-162.4	0	0	0	0	110.3	D537 L560 K566 M567 V569	D537-C557 CarbonylContact O-C 3.57Å; D537-C557 VanDerWaalsContact O-CA 3.27Å; D537-C557 WeakPolarHBondContact O-CA 3.4Å; C557-L560 HydrophobicContact CB-CB 4.29Å; C557-L560 HydrophobicContact CB-CD2 3.89Å; C557-K566 WeakPolarHBondContact O-CA 3.37Å; C557-M567 PolarHBondContact N-O 3.21Å; C557-M567 PolarHBondContact O-N 3.3Å; C557-V569 HydrophobicContact CB-CB 4.42Å; C557-V569 HydrophobicContact CB-CG1 3.75Å; C557-V569 HydrophobicContact CB-CG2 3.73Å
558	Y	90.3	Very high	80.7	Confident	81 Å²	81	61.6 Å²	61.6	32%	0.318	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	159.2	175.8	-65.7	-97.4	0	0	0	110.2	D537 V539 E556 L560 D565 K566	D537-Y558 PolarHBondContact O-N 3.13Å; V539-Y558 HydrophobicContact CB-CE2 4.47Å; V539-Y558 HydrophobicContact CG2-CD2 4.35Å; V539-Y558 HydrophobicContact CG2-CE2 3.79Å; E556-Y558 HydrophobicContact CB-CE2 4.31Å; E556-Y558 PolarHBondContact OE2-OH 3.35Å; Y558-L560 PolarHBondContact O-N 3.24Å; Y558-D565 WeakPolarHBondContact CA-O 3.29Å; Y558-D565 WeakPolarHBondContact CD1-O 3.48Å; Y558-K566 HydrophobicContact CD1-CB 3.78Å; Y558-K566 HydrophobicContact CE1-CB 3.69Å; Y558-K566 HydrophobicContact CE1-CD 3.81Å; Y558-K566 HydrophobicContact CE1-CG 4.28Å; Y558-K566 HydrophobicContact CE2-CB 4.4Å; Y558-K566 HydrophobicContact CG-CB 4.19Å; Y558-K566 WeakPolarHBondContact OH-CD 3.41Å
559	N	86.4	Confident	82.5	Confident	124 Å²	124	58.8 Å²	58.8	66%	0.663	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.9	9.6	174.1	-58	-53.4	0	0	0	115.7	D537 D565	D537-N559 PolarHBondContact OD1-ND2 2.85Å; N559-D565 PolarHBondContact N-O 3.43Å
560	L	86.5	Confident	84	Confident	23 Å²	23	55.2 Å²	55.2	12%	0.12	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-26	-175.6	-174.3	61.2	0	0	0	113.3	I533 C557 Y558 M567 V569 Y604 V616	I533-L560 HydrophobicContact CD1-CD1 3.84Å; I533-L560 HydrophobicContact CG1-CD1 4.23Å; C557-L560 HydrophobicContact CB-CB 4.29Å; C557-L560 HydrophobicContact CB-CD2 3.89Å; Y558-L560 PolarHBondContact O-N 3.24Å; L560-M567 HydrophobicContact CB-SD 4.36Å; L560-M567 HydrophobicContact CD2-CG 4.41Å; L560-M567 HydrophobicContact CD2-SD 4.09Å; L560-M567 HydrophobicContact CG-SD 4.24Å; L560-V569 HydrophobicContact CD2-CG1 3.75Å; L560-Y604 HydrophobicContact CD1-CG 4.44Å; L560-Y604 HydrophobicContact CD2-CD1 4.32Å; L560-Y604 HydrophobicContact CD2-CD2 3.76Å; L560-Y604 HydrophobicContact CD2-CE2 4.22Å; L560-Y604 HydrophobicContact CD2-CG 3.83Å; L560-Y604 HydrophobicContact CG-CG 4.45Å; L560-V616 HydrophobicContact CD2-CG1 4.45Å
561	S	78.5	Confident	85	Confident	29 Å²	29	55.1 Å²	55.1	20%	0.203	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	133.3	177.5	-174.4	0	0	0	0	110	T563	S561-T563 PolarHBondContact O-N 3.49Å; S561-T563 PolarHBondContact OG-N 3.23Å; S561-T563 PolarHBondContact OG-OG1 2.99Å
562	P	70.7	Confident	85.3	Confident	133 Å²	133	52.4 Å²	52.4	86%	0.864	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-4.6	175.4	30.6	-35.7	0	0	0	113.4
563	T	63.7	Low	85.3	Confident	122 Å²	122	52.5 Å²	52.5	75%	0.748	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	2.6	-177.6	58.5	0	0	0	0	114	S561	S561-T563 PolarHBondContact O-N 3.49Å; S561-T563 PolarHBondContact OG-N 3.23Å; S561-T563 PolarHBondContact OG-OG1 2.99Å
564	K	68.5	Low	84.9	Confident	126 Å²	126	51.8 Å²	51.8	55%	0.548	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	127.1	178.6	-58.7	-175.1	176	-172.3	0	110.4	K566	K564-K566 PolarHBondContact O-N 2.9Å
565	D	73.6	Confident	83.9	Confident	143 Å²	143	57.7 Å²	57.7	77%	0.765	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.5	-36.1	178.4	-55.6	-38.3	0	0	0	112.2	Y558 N559	Y558-D565 WeakPolarHBondContact CA-O 3.29Å; Y558-D565 WeakPolarHBondContact CD1-O 3.48Å; N559-D565 PolarHBondContact N-O 3.43Å
566	K	84.3	Confident	82.6	Confident	93 Å²	93	62.7 Å²	62.7	40%	0.404	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	155.4	171.3	69	-178.9	-172.4	164.7	0	113	E556 C557 Y558 K564	E556-K566 WeakPolarHBondContact OE1-CE 3.34Å; E556-K566 IonicContact OE1-NZ 2.69Å; E556-K566 PolarHBondContact OE1-NZ 3.2Å; E556-K566 IonicContact OE2-NZ 3.59Å; E556-K566 PolarHBondContact OE2-NZ 3.35Å; C557-K566 WeakPolarHBondContact O-CA 3.37Å; Y558-K566 HydrophobicContact CD1-CB 3.78Å; Y558-K566 HydrophobicContact CE1-CB 3.69Å; Y558-K566 HydrophobicContact CE1-CD 3.81Å; Y558-K566 HydrophobicContact CE1-CG 4.28Å; Y558-K566 HydrophobicContact CE2-CB 4.4Å; Y558-K566 HydrophobicContact CG-CB 4.19Å; Y558-K566 WeakPolarHBondContact OH-CD 3.41Å; K564-K566 PolarHBondContact O-N 2.9Å
567	M	90.2	Very high	81.1	Confident	35 Å²	35	63.2 Å²	63.2	17%	0.172	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	151.2	174.2	63.1	177.7	-73.4	0	0	113	E556 C557 L560 V569 Y604	E556-M567 WeakPolarHBondContact CA-O 3.5Å; C557-M567 PolarHBondContact N-O 3.21Å; C557-M567 PolarHBondContact O-N 3.3Å; L560-M567 HydrophobicContact CB-SD 4.36Å; L560-M567 HydrophobicContact CD2-CG 4.41Å; L560-M567 HydrophobicContact CD2-SD 4.09Å; L560-M567 HydrophobicContact CG-SD 4.24Å; M567-V569 HydrophobicContact CE-CG1 4.33Å; M567-V569 HydrophobicContact CG-CG1 4.28Å; M567-Y604 HydrophobicContact CE-CE1 4.49Å; M567-Y604 HydrophobicContact CE-CE2 3.8Å; M567-Y604 WeakPolarHBondContact CE-OH 3.45Å
568	L	92.1	Very high	80	Confident	82 Å²	82	66.4 Å²	66.4	43%	0.429	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	133	174	-65.6	174.3	0	0	0	111.3	L554 A555 E556 Y619	L554-L568 HydrophobicContact CD1-CB 4.26Å; L554-L568 HydrophobicContact CD1-CD2 4.06Å; L554-L568 HydrophobicContact CG-CD2 4.46Å; A555-L568 WeakPolarHBondContact O-CA 3.36Å; E556-L568 HydrophobicContact CG-CD2 4Å; L568-Y619 HydrophobicContact CB-CD1 4.01Å; L568-Y619 HydrophobicContact CB-CG 4.44Å; L568-Y619 HydrophobicContact CD1-CD1 4.16Å; L568-Y619 HydrophobicContact CD1-CE1 4.4Å
569	V	94.8	Very high	78.9	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	159.8	179.3	-63.3	0	0	0	0	110.6	A555 C557 L560 M567 V571 Y604 V616 F617	A555-V569 HydrophobicContact CB-CG2 3.94Å; A555-V569 PolarHBondContact N-O 3.36Å; A555-V569 WeakPolarHBondContact O-CG2 3.38Å; A555-V569 PolarHBondContact O-N 3.29Å; C557-V569 HydrophobicContact CB-CB 4.42Å; C557-V569 HydrophobicContact CB-CG1 3.75Å; C557-V569 HydrophobicContact CB-CG2 3.73Å; L560-V569 HydrophobicContact CD2-CG1 3.75Å; M567-V569 HydrophobicContact CE-CG1 4.33Å; M567-V569 HydrophobicContact CG-CG1 4.28Å; V569-V571 HydrophobicContact CG2-CG2 4.04Å; V569-Y604 HydrophobicContact CG1-CD2 4.08Å; V569-Y604 HydrophobicContact CG1-CE2 4.01Å; V569-V616 HydrophobicContact CB-CG1 3.75Å; V569-V616 HydrophobicContact CG1-CG1 3.96Å; V569-V616 HydrophobicContact CG2-CG1 3.81Å; V569-F617 WeakPolarHBondContact CA-O 3.43Å; V569-F617 WeakPolarHBondContact CB-O 3.28Å
570	A	93	Very high	78	Confident	11 Å²	11	65.8 Å²	65.8	9%	0.091	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	128.3	165	0	0	0	0	0	109.5	F553 F617	F553-A570 CarbonylContact O-C 3.54Å; F553-A570 WeakPolarHBondContact O-CA 3.48Å; A570-F617 HydrophobicContact CB-CB 4.32Å; A570-F617 PolarHBondContact N-O 2.95Å; A570-F617 PolarHBondContact O-N 3.29Å
571	V	91.7	Very high	77.1	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116.3	-178.2	162.9	0	0	0	0	109.3	I538 L540 V552 F553 A555 V569 I614 M615 V616	I538-V571 HydrophobicContact CG2-CG2 3.79Å; L540-V571 HydrophobicContact CD2-CB 4.15Å; L540-V571 HydrophobicContact CD2-CG1 3.83Å; L540-V571 HydrophobicContact CD2-CG2 4.4Å; V552-V571 CarbonylContact C-O 3.52Å; V552-V571 VanDerWaalsContact CA-O 3.31Å; V552-V571 WeakPolarHBondContact CA-O 3.46Å; F553-V571 HydrophobicContact CB-CB 4.44Å; F553-V571 PolarHBondContact N-O 3.19Å; F553-V571 PolarHBondContact O-N 2.92Å; A555-V571 HydrophobicContact CB-CB 4.35Å; A555-V571 HydrophobicContact CB-CG2 3.71Å; V569-V571 HydrophobicContact CG2-CG2 4.04Å; V571-I614 HydrophobicContact CG1-CD1 4.43Å; V571-I614 HydrophobicContact CG1-CG1 4.1Å; V571-I614 HydrophobicContact CG1-CG2 3.76Å; V571-M615 WeakPolarHBondContact CA-O 3.3Å; V571-V616 HydrophobicContact CG2-CG1 4.48Å; V571-V616 HydrophobicContact CG2-CG2 4.43Å
572	K	87.9	Confident	76.9	Confident	4 Å²	4	69.9 Å²	69.9	2%	0.017	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	115	171.4	172.5	-179.3	163.4	-170.3	0	108.6	L574 E588 I614 M615 F617 F698	K572-L574 HydrophobicContact CG-CD1 4.48Å; K572-E588 IonicContact NZ-OE1 3.72Å; K572-E588 PolarHBondContact NZ-OE1 3.35Å; K572-I614 WeakPolarHBondContact O-CA 3.44Å; K572-M615 HydrophobicContact CB-CB 4.38Å; K572-M615 PolarHBondContact N-O 3.04Å; K572-M615 PolarHBondContact O-N 3.28Å; K572-F617 HydrophobicContact CB-CE2 4.12Å; K572-F698 HydrophobicContact CD-CB 3.79Å; K572-F698 WeakPolarHBondContact CE-O 3.43Å; K572-F698 PolarHBondContact NZ-O 2.69Å
573	A	86.9	Confident	76.9	Confident	10 Å²	10	69.3 Å²	69.3	8%	0.083	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	119.9	179.3	0	0	0	0	0	110.1	G550 K551 F553 P612 L613 I614	G550-A573 CarbonylContact C-O 3.45Å; G550-A573 VanDerWaalsContact CA-O 3.28Å; G550-A573 WeakPolarHBondContact CA-O 3.47Å; K551-A573 PolarHBondContact N-O 3.31Å; K551-A573 VanDerWaalsContact N-O 3.09Å; K551-A573 PolarHBondContact O-N 3.38Å; F553-A573 HydrophobicContact CD2-CB 4.42Å; F553-A573 HydrophobicContact CE2-CB 4.11Å; A573-P612 HydrophobicContact CB-CB 4.12Å; A573-P612 HydrophobicContact CB-CG 3.78Å; A573-L613 WeakPolarHBondContact CA-O 3.42Å; A573-I614 HydrophobicContact CB-CG1 4.23Å
574	L	77.6	Confident	77.2	Confident	23 Å²	23	66.9 Å²	66.9	12%	0.12	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	141.8	-176.3	-81.4	72.8	0	0	0	111.9	F549 K572 F585 P612 L613	F549-L574 WeakPolarHBondContact O-CA 3.35Å; K572-L574 HydrophobicContact CG-CD1 4.48Å; L574-F585 HydrophobicContact CD1-CD2 3.6Å; L574-F585 HydrophobicContact CD1-CE2 3.78Å; L574-F585 HydrophobicContact CD2-CB 4.08Å; L574-F585 HydrophobicContact CD2-CD2 3.62Å; L574-F585 HydrophobicContact CD2-CG 4.29Å; L574-F585 HydrophobicContact CG-CD2 4.25Å; L574-P612 WeakPolarHBondContact O-CB 3.35Å; L574-L613 HydrophobicContact CB-CB 4.49Å; L574-L613 PolarHBondContact N-O 3.34Å
575	K	68.3	Low	77.6	Confident	141 Å²	141	61.6 Å²	61.6	61%	0.613	32%	0.321	S	S	*	.	S	Bend	trans	-83.2	-22.9	-167.7	-132.3	179.2	177.1	-178.2	0	115.9	E546 F549	E546-K575 WeakPolarHBondContact OE1-CE 3.37Å; E546-K575 IonicContact OE1-NZ 2.59Å; E546-K575 PolarHBondContact OE1-NZ 2.79Å; F549-K575 PolarHBondContact O-N 3.14Å
576	D	64.1	Low	77.7	Confident	104 Å²	104	60.2 Å²	60.2	56%	0.556	31%	0.31	S	S	*	.			trans	-152.3	114.8	-172.1	-166.4	-14.5	0	0	0	111.5	T578	D576-T578 PolarHBondContact O-N 3.01Å
577	P	61	Low	77.1	Confident	43 Å²	43	60.2 Å²	60.2	28%	0.279	31%	0.307	S	S	.	.			trans	-86	38	-167.5	36.1	-38.6	0	0	0	114.3	R582	P577-R582 PolarHBondContact O-NE 3.12Å; P577-R582 VanDerWaalsContact O-NE 3.09Å
578	T	69.8	Low	76.5	Confident	68 Å²	68	60.6 Å²	60.6	42%	0.417	31%	0.309	S	S	.	.			trans	-55.1	149.6	178.4	71.7	0	0	0	0	112.1	D576 A580 A581 R582	D576-T578 PolarHBondContact O-N 3.01Å; T578-A580 PolarHBondContact O-N 3.18Å; T578-A580 VanDerWaalsContact O-N 3.1Å; T578-A581 PolarHBondContact O-N 3.14Å; T578-A581 VanDerWaalsContact OG1-CB 3.26Å; T578-A581 WeakPolarHBondContact OG1-CB 3.29Å; T578-A581 PolarHBondContact OG1-N 2.87Å; T578-R582 WeakPolarHBondContact O-CG 3.41Å; T578-R582 PolarHBondContact O-N 2.87Å
579	L	68.3	Low	76.1	Confident	131 Å²	131	56.8 Å²	56.8	69%	0.686	29%	0.289	S	S	*	.	H	α-helix	trans	-65.6	-18.8	-175.3	-154.8	135.1	0	0	0	113.4
580	A	67.2	Low	75.4	Confident	61 Å²	61	59.9 Å²	59.9	50%	0.504	30%	0.304	S	S	.	.	H	α-helix	trans	-75.4	-53.3	167.1	0	0	0	0	0	111.2	T578 R582 K583 D584	T578-A580 PolarHBondContact O-N 3.18Å; T578-A580 VanDerWaalsContact O-N 3.1Å; A580-R582 VanDerWaalsContact C-N 3.26Å; A580-R582 PolarHBondContact O-N 2.85Å; A580-K583 WeakPolarHBondContact O-CA 3.45Å; A580-K583 WeakPolarHBondContact O-CB 3.29Å; A580-K583 PolarHBondContact O-N 3.21Å; A580-D584 PolarHBondContact O-N 3.29Å
581	A	67.6	Low	74.6	Confident	25 Å²	25	61.7 Å²	61.7	21%	0.207	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-35.4	178.9	0	0	0	0	0	113	T578 K583 D584 F585	T578-A581 PolarHBondContact O-N 3.14Å; T578-A581 VanDerWaalsContact OG1-CB 3.26Å; T578-A581 WeakPolarHBondContact OG1-CB 3.29Å; T578-A581 PolarHBondContact OG1-N 2.87Å; A581-K583 VanDerWaalsContact C-N 3.35Å; A581-K583 PolarHBondContact O-N 2.78Å; A581-D584 PolarHBondContact O-N 2.76Å; A581-F585 VanDerWaalsContact O-CB 3.28Å; A581-F585 WeakPolarHBondContact O-CB 3.23Å; A581-F585 PolarHBondContact O-N 3.42Å
582	R	73.4	Confident	74.3	Confident	113 Å²	113	62.4 Å²	62.4	43%	0.426	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-36.9	173.1	-65.6	-169.8	177.8	-121.8	-1	113	P577 T578 A580 Q586 L613	P577-R582 PolarHBondContact O-NE 3.12Å; P577-R582 VanDerWaalsContact O-NE 3.09Å; T578-R582 WeakPolarHBondContact O-CG 3.41Å; T578-R582 PolarHBondContact O-N 2.87Å; A580-R582 VanDerWaalsContact C-N 3.26Å; A580-R582 PolarHBondContact O-N 2.85Å; R582-Q586 PolarHBondContact O-N 3.09Å; R582-Q586 VanDerWaalsContact O-N 3.15Å; R582-L613 HydrophobicContact CG-CD1 3.95Å
583	K	70.6	Confident	74.1	Confident	120 Å²	120	63.5 Å²	63.5	52%	0.522	32%	0.322	S	S	.	.	H	α-helix	trans	-74.4	-34.5	175.9	-72.1	178.1	178.4	179.1	0	112.1	A580 A581 R587	A580-K583 WeakPolarHBondContact O-CA 3.45Å; A580-K583 WeakPolarHBondContact O-CB 3.29Å; A580-K583 PolarHBondContact O-N 3.21Å; A581-K583 VanDerWaalsContact C-N 3.35Å; A581-K583 PolarHBondContact O-N 2.78Å; K583-R587 WeakPolarHBondContact O-CG 3.19Å; K583-R587 PolarHBondContact O-N 2.91Å; K583-R587 PolarHBondContact O-NE 3.24Å
584	D	69.7	Low	73.8	Confident	72 Å²	72	66.1 Å²	66.1	39%	0.385	34%	0.335	S	S	.	.	H	α-helix	trans	-66.1	-48.3	172.2	-69.7	-42.6	0	0	0	111	A580 A581 Q586 R587 E588	A580-D584 PolarHBondContact O-N 3.29Å; A581-D584 PolarHBondContact O-N 2.76Å; D584-Q586 VanDerWaalsContact C-N 3.34Å; D584-Q586 PolarHBondContact O-N 2.85Å; D584-R587 PolarHBondContact O-N 2.7Å; D584-R587 IonicContact OD1-CZ 3.92Å; D584-R587 IonicContact OD1-NE 3.27Å; D584-R587 IonicContact OD1-NH2 2.98Å; D584-R587 PolarHBondContact OD1-NH2 2.77Å; D584-E588 VanDerWaalsContact O-CB 3.29Å; D584-E588 WeakPolarHBondContact O-CB 3.21Å; D584-E588 PolarHBondContact O-N 2.99Å
585	F	77.3	Confident	74.1	Confident	14 Å²	14	65.8 Å²	65.8	6%	0.061	33%	0.333	C	S	.	.	H	α-helix	trans	-52.7	-46.2	175.1	175.3	-87.9	0	0	0	113	L574 A581 E588 A589 V606 L613 M615	L574-F585 HydrophobicContact CD1-CD2 3.6Å; L574-F585 HydrophobicContact CD1-CE2 3.78Å; L574-F585 HydrophobicContact CD2-CB 4.08Å; L574-F585 HydrophobicContact CD2-CD2 3.62Å; L574-F585 HydrophobicContact CD2-CG 4.29Å; L574-F585 HydrophobicContact CG-CD2 4.25Å; A581-F585 VanDerWaalsContact O-CB 3.28Å; A581-F585 WeakPolarHBondContact O-CB 3.23Å; A581-F585 PolarHBondContact O-N 3.42Å; F585-E588 PolarHBondContact O-N 2.8Å; F585-A589 WeakPolarHBondContact O-CB 3.33Å; F585-A589 PolarHBondContact O-N 2.84Å; F585-V606 HydrophobicContact CE1-CB 3.94Å; F585-V606 HydrophobicContact CE1-CG1 3.7Å; F585-V606 HydrophobicContact CZ-CB 3.77Å; F585-V606 HydrophobicContact CZ-CG1 3.6Å; F585-L613 HydrophobicContact CB-CD1 4.49Å; F585-L613 HydrophobicContact CD1-CD1 4.11Å; F585-L613 HydrophobicContact CD2-CB 4.17Å; F585-L613 HydrophobicContact CD2-CD1 4.35Å; F585-L613 HydrophobicContact CE1-CD1 4.4Å; F585-L613 HydrophobicContact CE2-CB 3.8Å; F585-L613 HydrophobicContact CG-CD1 4.08Å; F585-L613 HydrophobicContact CZ-CB 4.01Å; F585-M615 HydrophobicContact CB-CE 4.39Å; F585-M615 HydrophobicContact CD2-CE 3.35Å; F585-M615 HydrophobicContact CD2-CG 4.07Å; F585-M615 HydrophobicContact CE2-CE 3.73Å; F585-M615 HydrophobicContact CE2-CG 3.47Å; F585-M615 VanDerWaalsContact CE2-CG 3.47Å; F585-M615 HydrophobicContact CE2-SD 4.46Å; F585-M615 HydrophobicContact CG-CE 3.88Å; F585-M615 HydrophobicContact CZ-CE 4.5Å; F585-M615 HydrophobicContact CZ-CG 4.1Å; F585-M615 WeakPolarHBondContact O-CE 3.38Å
586	Q	76.2	Confident	75	Confident	115 Å²	115	64.4 Å²	64.4	54%	0.537	33%	0.329	S	S	.	.	H	α-helix	trans	-66.6	-44.2	179.7	-177	175.6	-16.4	0	0	111.8	R582 D584 A589 E590	R582-Q586 PolarHBondContact O-N 3.09Å; R582-Q586 VanDerWaalsContact O-N 3.15Å; D584-Q586 VanDerWaalsContact C-N 3.34Å; D584-Q586 PolarHBondContact O-N 2.85Å; Q586-A589 PolarHBondContact O-N 3.07Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.5Å; Q586-E590 PolarHBondContact NE2-OE1 3.09Å; Q586-E590 WeakPolarHBondContact O-CG 3.29Å; Q586-E590 PolarHBondContact O-N 3.45Å
587	R	71.8	Confident	76.3	Confident	92 Å²	92	62.5 Å²	62.5	35%	0.347	32%	0.317	S	S	.	.	H	α-helix	trans	-65.4	-38.1	176.9	-71.8	-176.1	-68.1	-125.6	2.3	112.7	F517 K583 D584 L591	F517-R587 HydrophobicContact CD2-CB 4.45Å; F517-R587 HydrophobicContact CE1-CB 4.49Å; F517-R587 HydrophobicContact CE2-CB 3.68Å; F517-R587 HydrophobicContact CE2-CG 4.29Å; F517-R587 HydrophobicContact CZ-CB 3.71Å; K583-R587 WeakPolarHBondContact O-CG 3.19Å; K583-R587 PolarHBondContact O-N 2.91Å; K583-R587 PolarHBondContact O-NE 3.24Å; D584-R587 PolarHBondContact O-N 2.7Å; D584-R587 IonicContact OD1-CZ 3.92Å; D584-R587 IonicContact OD1-NE 3.27Å; D584-R587 IonicContact OD1-NH2 2.98Å; D584-R587 PolarHBondContact OD1-NH2 2.77Å; R587-L591 WeakPolarHBondContact O-CB 3.36Å; R587-L591 PolarHBondContact O-N 3.4Å
588	E	77.6	Confident	77.8	Confident	44 Å²	44	66.7 Å²	66.7	21%	0.206	33%	0.332	C	S	.	.	H	α-helix	trans	-60.3	-51.3	172.6	-174.8	-178.6	176.5	0	0	108.9	K572 D584 F585 E590 L591 L592 M615 F698	K572-E588 IonicContact NZ-OE1 3.72Å; K572-E588 PolarHBondContact NZ-OE1 3.35Å; D584-E588 VanDerWaalsContact O-CB 3.29Å; D584-E588 WeakPolarHBondContact O-CB 3.21Å; D584-E588 PolarHBondContact O-N 2.99Å; F585-E588 PolarHBondContact O-N 2.8Å; E588-E590 PolarHBondContact O-N 2.88Å; E588-L591 WeakPolarHBondContact O-CB 3.34Å; E588-L591 PolarHBondContact O-N 3.39Å; E588-L592 HydrophobicContact CG-CD1 4.09Å; E588-L592 WeakPolarHBondContact O-CB 3.41Å; E588-L592 WeakPolarHBondContact O-CG 3.37Å; E588-L592 PolarHBondContact O-N 3.09Å; E588-M615 HydrophobicContact CB-CE 3.86Å; E588-M615 VanDerWaalsContact CD-CE 3.45Å; E588-M615 HydrophobicContact CG-CE 3.69Å; E588-M615 HydrophobicContact CG-SD 4.26Å; E588-M615 WeakPolarHBondContact OE2-CE 3.4Å; E588-F698 WeakPolarHBondContact OE1-CD1 3.31Å
589	A	82.9	Confident	79	Confident	2 Å²	2	64.2 Å²	64.2	2%	0.017	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-40.6	177.3	0	0	0	0	0	114.5	V530 F585 Q586 L592 T593 F603 V606	V530-A589 HydrophobicContact CG1-CB 4.03Å; V530-A589 HydrophobicContact CG2-CB 4.35Å; F585-A589 WeakPolarHBondContact O-CB 3.33Å; F585-A589 PolarHBondContact O-N 2.84Å; Q586-A589 PolarHBondContact O-N 3.07Å; A589-L592 PolarHBondContact O-N 3.38Å; A589-T593 WeakPolarHBondContact O-CB 3.46Å; A589-T593 PolarHBondContact O-N 3.37Å; A589-T593 PolarHBondContact O-OG1 2.83Å; A589-F603 HydrophobicContact CB-CE1 4.23Å; A589-F603 HydrophobicContact CB-CZ 3.89Å; A589-F603 WeakPolarHBondContact O-CE1 3.48Å; A589-V606 HydrophobicContact CB-CG1 3.59Å
590	E	79.9	Confident	80.2	Confident	65 Å²	65	58.8 Å²	58.8	30%	0.304	29%	0.287	S	S	.	.	H	α-helix	trans	-64.8	-42.1	176	-74.8	169.6	-164.6	0	0	112.3	V530 Q586 E588 N594	V530-E590 HydrophobicContact CG2-CG 3.91Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.5Å; Q586-E590 PolarHBondContact NE2-OE1 3.09Å; Q586-E590 WeakPolarHBondContact O-CG 3.29Å; Q586-E590 PolarHBondContact O-N 3.45Å; E588-E590 PolarHBondContact O-N 2.88Å; E590-N594 PolarHBondContact O-ND2 3.32Å
591	L	77.3	Confident	81.4	Confident	48 Å²	48	56.1 Å²	56.1	25%	0.251	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-48.7	174.4	173.8	71	0	0	0	111	R587 E588 T593 N594 L595 F675	R587-L591 WeakPolarHBondContact O-CB 3.36Å; R587-L591 PolarHBondContact O-N 3.4Å; E588-L591 WeakPolarHBondContact O-CB 3.34Å; E588-L591 PolarHBondContact O-N 3.39Å; L591-T593 VanDerWaalsContact C-N 3.35Å; L591-T593 PolarHBondContact O-N 2.92Å; L591-N594 PolarHBondContact O-N 2.91Å; L591-N594 VanDerWaalsContact O-N 3.13Å; L591-L595 HydrophobicContact CD1-CD1 4.08Å; L591-L595 HydrophobicContact CD1-CG 4.47Å; L591-L595 HydrophobicContact CG-CD1 4Å; L591-L595 PolarHBondContact O-N 3.05Å; L591-F675 HydrophobicContact CD1-CD2 4.05Å; L591-F675 HydrophobicContact CD1-CE2 3.9Å; L591-F675 HydrophobicContact CD2-CE2 3.63Å; L591-F675 HydrophobicContact CD2-CZ 4.14Å; L591-F675 HydrophobicContact CG-CE2 4.26Å
592	L	83.9	Confident	82.6	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.079	28%	0.275	C	S	.	.	H	α-helix	trans	-69.5	-30.4	-176.5	-64.3	173.9	0	0	0	114	E588 A589 N594 L595 F603 M615 F617 F698	E588-L592 HydrophobicContact CG-CD1 4.09Å; E588-L592 WeakPolarHBondContact O-CB 3.41Å; E588-L592 WeakPolarHBondContact O-CG 3.37Å; E588-L592 PolarHBondContact O-N 3.09Å; A589-L592 PolarHBondContact O-N 3.38Å; L592-N594 PolarHBondContact O-N 2.82Å; L592-L595 PolarHBondContact O-N 2.82Å; L592-F603 HydrophobicContact CB-CB 3.93Å; L592-F603 HydrophobicContact CB-CD1 3.59Å; L592-F603 HydrophobicContact CB-CD2 4.43Å; L592-F603 HydrophobicContact CB-CE1 4.13Å; L592-F603 HydrophobicContact CB-CG 3.75Å; L592-F603 HydrophobicContact CD1-CD2 4.18Å; L592-F603 HydrophobicContact CD1-CE2 4.43Å; L592-F603 HydrophobicContact CD1-CG 4.28Å; L592-M615 HydrophobicContact CD1-SD 4.46Å; L592-F617 HydrophobicContact CD1-CE1 4.06Å; L592-F617 HydrophobicContact CD1-CZ 4.17Å; L592-F698 HydrophobicContact CD1-CD1 3.98Å; L592-F698 HydrophobicContact CD1-CE1 3.17Å; L592-F698 HydrophobicContact CD1-CZ 3.65Å; L592-F698 HydrophobicContact CD2-CE1 3.47Å; L592-F698 VanDerWaalsContact CD2-CE1 3.47Å; L592-F698 HydrophobicContact CD2-CZ 3.36Å; L592-F698 HydrophobicContact CG-CE1 3.83Å; L592-F698 HydrophobicContact CG-CZ 4.07Å
593	T	84.8	Confident	83.5	Confident	27 Å²	27	54.7 Å²	54.7	17%	0.166	26%	0.257	C	S	.	.	H	α-helix	trans	-60.3	-32.4	172.9	-59	0	0	0	0	111.1	T528 A589 L591 Q596	T528-T593 HydrophobicContact CG2-CG2 3.7Å; A589-T593 WeakPolarHBondContact O-CB 3.46Å; A589-T593 PolarHBondContact O-N 3.37Å; A589-T593 PolarHBondContact O-OG1 2.83Å; L591-T593 VanDerWaalsContact C-N 3.35Å; L591-T593 PolarHBondContact O-N 2.92Å; T593-Q596 PolarHBondContact O-NE2 3.35Å
594	N	81.2	Confident	84.5	Confident	65 Å²	65	50.9 Å²	50.9	35%	0.348	24%	0.24	S	C	.	.	H	α-helix	trans	-86.3	-23.9	178.2	-73	-65.4	0	0	0	114.1	T528 E590 L591 L592 Q596 Y669	T528-N594 WeakPolarHBondContact CG2-ND2 3.41Å; T528-N594 PolarHBondContact OG1-ND2 3.15Å; T528-N594 VanDerWaalsContact OG1-ND2 3.16Å; E590-N594 PolarHBondContact O-ND2 3.32Å; L591-N594 PolarHBondContact O-N 2.91Å; L591-N594 VanDerWaalsContact O-N 3.13Å; L592-N594 PolarHBondContact O-N 2.82Å; N594-Q596 PolarHBondContact O-N 3.06Å; N594-Y669 PolarHBondContact O-OH 3.49Å
595	L	83.9	Confident	85.5	Confident	16 Å²	16	47.5 Å²	47.5	8%	0.084	22%	0.222	C	C	.	.			trans	-89.2	83.3	-180	-67	179	0	0	0	111.8	L591 L592 Y669 L670 Q673 F675	L591-L595 HydrophobicContact CD1-CD1 4.08Å; L591-L595 HydrophobicContact CD1-CG 4.47Å; L591-L595 HydrophobicContact CG-CD1 4Å; L591-L595 PolarHBondContact O-N 3.05Å; L592-L595 PolarHBondContact O-N 2.82Å; L595-Y669 WeakPolarHBondContact CA-OH 3.34Å; L595-Y669 HydrophobicContact CD2-CE1 4.05Å; L595-L670 HydrophobicContact CD1-CD2 4.36Å; L595-L670 HydrophobicContact CD2-CD2 4.18Å; L595-Q673 HydrophobicContact CD2-CB 4.18Å; L595-Q673 HydrophobicContact CD2-CG 4.18Å; L595-F675 HydrophobicContact CD1-CD1 4.4Å; L595-F675 HydrophobicContact CD1-CD2 4.18Å; L595-F675 HydrophobicContact CD1-CE1 4.45Å; L595-F675 HydrophobicContact CD1-CE2 4.27Å; L595-F675 HydrophobicContact CD1-CG 4.24Å; L595-F675 HydrophobicContact CD1-CZ 4.39Å
596	Q	86	Confident	86.2	Confident	112 Å²	112	47.1 Å²	47.1	52%	0.523	22%	0.22	S	C	.	.			trans	-121.4	116.8	179	-61	-171	38.8	0	0	111.9	T593 N594 Y669	T593-Q596 PolarHBondContact O-NE2 3.35Å; N594-Q596 PolarHBondContact O-N 3.06Å; Q596-Y669 PolarHBondContact N-OH 3.45Å; Q596-Y669 PolarHBondContact O-OH 2.96Å
597	H	91.9	Very high	86.8	Confident	65 Å²	65	41.6 Å²	41.6	30%	0.301	20%	0.195	S	C	.	.			trans	-158.1	157.8	178.9	179.8	-108.9	0	0	0	110.5	H599 I600 S665 Y669	H597-H599 VanDerWaalsContact C-N 3.27Å; H597-H599 PolarHBondContact ND1-N 2.93Å; H597-H599 PolarHBondContact O-N 3.4Å; H597-I600 HydrophobicContact CB-CB 4.29Å; H597-I600 HydrophobicContact CB-CG1 3.88Å; H597-I600 PolarHBondContact O-N 3.03Å; H597-I600 VanDerWaalsContact O-N 3.12Å; H597-S665 PolarHBondContact CE1-O 3.25Å; H597-Y669 HydrophobicContact CB-CD1 3.48Å; H597-Y669 VanDerWaalsContact CB-CD1 3.48Å; H597-Y669 HydrophobicContact CB-CD2 3.85Å; H597-Y669 HydrophobicContact CB-CE1 3.75Å; H597-Y669 HydrophobicContact CB-CE2 4.1Å; H597-Y669 HydrophobicContact CB-CG 3.52Å; H597-Y669 AromaticContact CD2-CD2 3.88Å; H597-Y669 AromaticContact CD2-CG 3.86Å; H597-Y669 AromaticContact CG-CD1 3.97Å; H597-Y669 AromaticContact CG-CD2 3.96Å; H597-Y669 AromaticContact CG-CG 3.57Å
598	E	91.4	Very high	87.1	Confident	130 Å²	130	38.9 Å²	38.9	61%	0.607	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-40.4	-176	-174.7	171.6	178.5	0	0	113.1	K694	E598-K694 WeakPolarHBondContact O-CD 3.48Å; E598-K694 WeakPolarHBondContact O-CE 3.28Å; E598-K694 PolarHBondContact O-NZ 3.21Å
599	H	96.1	Very high	86.8	Confident	17 Å²	17	41.4 Å²	41.4	8%	0.079	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100	21.1	-179.5	-59	-60.7	0	0	0	114.5	H597 Q662 S665 V693 K694 I695	H597-H599 VanDerWaalsContact C-N 3.27Å; H597-H599 PolarHBondContact ND1-N 2.93Å; H597-H599 PolarHBondContact O-N 3.4Å; H599-Q662 VanDerWaalsContact CB-O 3.29Å; H599-Q662 WeakPolarHBondContact CB-O 3.2Å; H599-Q662 VanDerWaalsContact CE1-CG 3.42Å; H599-Q662 WeakPolarHBondContact CE1-CG 3.45Å; H599-Q662 PolarHBondContact CE1-OE1 2.98Å; H599-S665 PolarHBondContact CD2-OG 3.26Å; H599-V693 PolarHBondContact ND1-O 3.02Å; H599-K694 CarbonylContact O-C 3.4Å; H599-K694 WeakPolarHBondContact O-CA 3.37Å; H599-I695 PolarHBondContact O-N 3.29Å
600	I	93.1	Very high	86.1	Confident	16 Å²	16	43.9 Å²	43.9	8%	0.082	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-115.5	136	168.4	-58.8	-59.8	0	0	0	107.8	H597 K602 Y669 L670 I695	H597-I600 HydrophobicContact CB-CB 4.29Å; H597-I600 HydrophobicContact CB-CG1 3.88Å; H597-I600 PolarHBondContact O-N 3.03Å; H597-I600 VanDerWaalsContact O-N 3.12Å; I600-K602 PolarHBondContact O-N 3.23Å; I600-K602 VanDerWaalsContact O-N 3.15Å; I600-Y669 HydrophobicContact CG1-CD1 3.83Å; I600-Y669 HydrophobicContact CG1-CE1 4.24Å; I600-L670 HydrophobicContact CD1-CD1 4.01Å; I600-L670 HydrophobicContact CD1-CD2 3.79Å; I600-L670 HydrophobicContact CD1-CG 3.82Å; I600-L670 HydrophobicContact CG1-CD2 4.35Å; I600-I695 HydrophobicContact CD1-CB 3.94Å; I600-I695 HydrophobicContact CD1-CD1 4.17Å; I600-I695 HydrophobicContact CD1-CG1 4.41Å
601	V	92.7	Very high	85.8	Confident	6 Å²	6	45.1 Å²	45.1	4%	0.036	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-60.8	118.1	-179.6	174.2	0	0	0	0	109.3	F603 F617 E618 L686 K694 I695	V601-F603 PolarHBondContact O-N 2.94Å; V601-F617 HydrophobicContact CG1-CB 4.39Å; V601-F617 HydrophobicContact CG1-CD1 4.32Å; V601-E618 WeakPolarHBondContact CA-OE1 3.44Å; V601-E618 HydrophobicContact CG1-CG 4.22Å; V601-L686 HydrophobicContact CG1-CD1 4.33Å; V601-L686 HydrophobicContact CG2-CB 4.22Å; V601-L686 HydrophobicContact CG2-CD1 3.85Å; V601-L686 HydrophobicContact CG2-CG 4.18Å; V601-K694 HydrophobicContact CG2-CB 3.78Å; V601-I695 WeakPolarHBondContact CG2-O 3.41Å; V601-I695 PolarHBondContact N-O 3.08Å
602	K	91.8	Very high	86.1	Confident	95 Å²	95	45 Å²	45	41%	0.413	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-67.2	117.3	-175.1	-176.1	169.2	-176.6	171.7	0	110.6	I600 Y604 F617 E618	I600-K602 PolarHBondContact O-N 3.23Å; I600-K602 VanDerWaalsContact O-N 3.15Å; K602-Y604 HydrophobicContact CD-CD1 4.32Å; K602-Y604 HydrophobicContact CD-CE1 3.67Å; K602-Y604 HydrophobicContact CG-CD1 4.31Å; K602-Y604 HydrophobicContact CG-CE1 4.01Å; K602-F617 CarbonylContact O-C 3.56Å; K602-F617 WeakPolarHBondContact O-CA 3.46Å; K602-E618 HydrophobicContact CB-CB 4.25Å; K602-E618 HydrophobicContact CB-CG 4.11Å; K602-E618 WeakPolarHBondContact CB-OE1 3.35Å; K602-E618 PolarHBondContact N-OE1 2.94Å; K602-E618 PolarHBondContact O-N 3.4Å
603	F	92.4	Very high	86.1	Confident	13 Å²	13	45 Å²	45	6%	0.057	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	137.7	165.2	179.4	-120.2	0	0	0	110.1	V530 A589 L592 V601 G605 V606 M615 V616 F617	V530-F603 HydrophobicContact CG1-CE1 4.3Å; A589-F603 HydrophobicContact CB-CE1 4.23Å; A589-F603 HydrophobicContact CB-CZ 3.89Å; A589-F603 WeakPolarHBondContact O-CE1 3.48Å; L592-F603 HydrophobicContact CB-CB 3.93Å; L592-F603 HydrophobicContact CB-CD1 3.59Å; L592-F603 HydrophobicContact CB-CD2 4.43Å; L592-F603 HydrophobicContact CB-CE1 4.13Å; L592-F603 HydrophobicContact CB-CG 3.75Å; L592-F603 HydrophobicContact CD1-CD2 4.18Å; L592-F603 HydrophobicContact CD1-CE2 4.43Å; L592-F603 HydrophobicContact CD1-CG 4.28Å; V601-F603 PolarHBondContact O-N 2.94Å; F603-G605 WeakPolarHBondContact CE2-O 3.42Å; F603-G605 WeakPolarHBondContact CZ-O 3.47Å; F603-V606 HydrophobicContact CE2-CG1 4.46Å; F603-V606 HydrophobicContact CZ-CG1 3.8Å; F603-M615 HydrophobicContact CE2-CB 4.09Å; F603-M615 HydrophobicContact CE2-CG 4.35Å; F603-V616 WeakPolarHBondContact CD2-O 3.47Å; F603-F617 HydrophobicContact CB-CD1 4.16Å; F603-F617 HydrophobicContact CB-CE1 4.09Å; F603-F617 AromaticContact CD2-CD1 3.94Å; F603-F617 HydrophobicContact CD2-CD1 3.94Å; F603-F617 AromaticContact CD2-CE1 3.53Å; F603-F617 HydrophobicContact CD2-CE1 3.53Å; F603-F617 AromaticContact CD2-CZ 3.92Å; F603-F617 HydrophobicContact CD2-CZ 3.92Å; F603-F617 HydrophobicContact CE2-CE1 4.4Å; F603-F617 HydrophobicContact CE2-CZ 4.37Å; F603-F617 HydrophobicContact CG-CE1 4.24Å
604	Y	92.2	Very high	86.4	Confident	40 Å²	40	44 Å²	44	16%	0.157	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	-25.2	179.7	-72.4	-53.2	0	0	0	113.8	Q531 L560 M567 V569 K602 V616 F617 E618	Q531-Y604 WeakPolarHBondContact CB-O 3.31Å; Q531-Y604 PolarHBondContact OE1-O 3.06Å; L560-Y604 HydrophobicContact CD1-CG 4.44Å; L560-Y604 HydrophobicContact CD2-CD1 4.32Å; L560-Y604 HydrophobicContact CD2-CD2 3.76Å; L560-Y604 HydrophobicContact CD2-CE2 4.22Å; L560-Y604 HydrophobicContact CD2-CG 3.83Å; L560-Y604 HydrophobicContact CG-CG 4.45Å; M567-Y604 HydrophobicContact CE-CE1 4.49Å; M567-Y604 HydrophobicContact CE-CE2 3.8Å; M567-Y604 WeakPolarHBondContact CE-OH 3.45Å; V569-Y604 HydrophobicContact CG1-CD2 4.08Å; V569-Y604 HydrophobicContact CG1-CE2 4.01Å; K602-Y604 HydrophobicContact CD-CD1 4.32Å; K602-Y604 HydrophobicContact CD-CE1 3.67Å; K602-Y604 HydrophobicContact CG-CD1 4.31Å; K602-Y604 HydrophobicContact CG-CE1 4.01Å; Y604-V616 HydrophobicContact CD2-CG1 4.27Å; Y604-V616 PolarHBondContact N-O 2.89Å; Y604-F617 VanDerWaalsContact CD2-C 3.46Å; Y604-E618 HydrophobicContact CE2-CB 3.94Å
605	G	91.7	Very high	86.8	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.5	-171.4	-178.1	0	0	0	0	0	114.2	Q531 F603 V616	Q531-G605 CarbonylContact O-C 3.59Å; Q531-G605 WeakPolarHBondContact O-CA 3.28Å; F603-G605 WeakPolarHBondContact CE2-O 3.42Å; F603-G605 WeakPolarHBondContact CZ-O 3.47Å; G605-V616 PolarHBondContact O-N 3.27Å
606	V	92	Very high	87.2	Confident	6 Å²	6	40.1 Å²	40.1	4%	0.036	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	148.2	-178.2	-60.4	0	0	0	0	112.1	V530 Q531 H532 I533 F585 A589 F603 I614	V530-V606 HydrophobicContact CG1-CG1 4.08Å; V530-V606 HydrophobicContact CG1-CG2 3.86Å; Q531-V606 PolarHBondContact O-N 3.4Å; H532-V606 CarbonylContact C-O 3.57Å; H532-V606 WeakPolarHBondContact CA-O 3.15Å; I533-V606 PolarHBondContact N-O 2.96Å; F585-V606 HydrophobicContact CE1-CB 3.94Å; F585-V606 HydrophobicContact CE1-CG1 3.7Å; F585-V606 HydrophobicContact CZ-CB 3.77Å; F585-V606 HydrophobicContact CZ-CG1 3.6Å; A589-V606 HydrophobicContact CB-CG1 3.59Å; F603-V606 HydrophobicContact CE2-CG1 4.46Å; F603-V606 HydrophobicContact CZ-CG1 3.8Å; V606-I614 CarbonylContact C-O 3.57Å; V606-I614 VanDerWaalsContact CA-O 3.29Å; V606-I614 WeakPolarHBondContact CA-O 3.3Å
607	C	89.1	Confident	87.6	Confident	0 Å²	0	35 Å²	35	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	106.7	158.4	167.7	0	0	0	0	108	I533 I538 I614	I533-C607 WeakPolarHBondContact O-CA 3.29Å; I533-C607 VanDerWaalsContact O-CB 3.27Å; I533-C607 WeakPolarHBondContact O-CB 3.36Å; I538-C607 HydrophobicContact CD1-CB 3.97Å; C607-I614 HydrophobicContact CB-CB 3.97Å; C607-I614 HydrophobicContact CB-CG2 4.05Å; C607-I614 PolarHBondContact N-O 3.44Å; C607-I614 PolarHBondContact O-N 2.94Å
608	G	77.9	Confident	87.6	Confident	34 Å²	34	33.3 Å²	33.3	35%	0.351	19%	0.188	S	C	.	.			trans	-89.7	-4.7	173.9	0	0	0	0	0	114.1	G610	G608-G610 PolarHBondContact O-N 3.18Å
609	D	71.3	Confident	87.6	Confident	97 Å²	97	29.8 Å²	29.8	52%	0.519	17%	0.169	S	C	.	.	S	Bend	trans	-79.8	114.6	-179.2	-64.8	-23	0	0	0	110.5	R535	R535-D609 HydrophobicContact CB-CB 4.48Å; R535-D609 PolarHBondContact NH1-O 3.44Å
610	G	66.6	Low	87.3	Confident	54 Å²	54	29.5 Å²	29.5	56%	0.557	17%	0.168	S	C	*	.	S	Bend	trans	78	-160.2	179.1	0	0	0	0	0	114.3	G608	G608-G610 PolarHBondContact O-N 3.18Å
611	D	73.6	Confident	86.8	Confident	92 Å²	92	33.8 Å²	33.8	49%	0.492	19%	0.186	S	C	.	.	S	Bend	trans	-132.8	142.8	-179	-157.8	42.1	0	0	0	108.6	R535	R535-D611 PolarHBondContact NH2-O 3.31Å
612	P	83.5	Confident	86.3	Confident	46 Å²	46	37.2 Å²	37.2	30%	0.299	20%	0.202	S	C	.	.	S	Bend	cis	-63	158	-9.4	27.9	-38	0	0	0	113.6	R535 A573 L574	R535-P612 PolarHBondContact NH1-O 2.92Å; A573-P612 HydrophobicContact CB-CB 4.12Å; A573-P612 HydrophobicContact CB-CG 3.78Å; L574-P612 WeakPolarHBondContact O-CB 3.35Å
613	L	85.5	Confident	86.1	Confident	13 Å²	13	34.3 Å²	34.3	7%	0.068	20%	0.198	C	C	.	.			trans	-66.2	138.1	163	-71	-179.8	0	0	0	110.3	A573 L574 R582 F585	A573-L613 WeakPolarHBondContact CA-O 3.42Å; L574-L613 HydrophobicContact CB-CB 4.49Å; L574-L613 PolarHBondContact N-O 3.34Å; R582-L613 HydrophobicContact CG-CD1 3.95Å; F585-L613 HydrophobicContact CB-CD1 4.49Å; F585-L613 HydrophobicContact CD1-CD1 4.11Å; F585-L613 HydrophobicContact CD2-CB 4.17Å; F585-L613 HydrophobicContact CD2-CD1 4.35Å; F585-L613 HydrophobicContact CE1-CD1 4.4Å; F585-L613 HydrophobicContact CE2-CB 3.8Å; F585-L613 HydrophobicContact CG-CD1 4.08Å; F585-L613 HydrophobicContact CZ-CB 4.01Å
614	I	90.1	Very high	85.9	Confident	7 Å²	7	34.4 Å²	34.4	4%	0.036	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132.4	-170.3	-78.7	161.2	0	0	0	111.3	I538 V571 K572 A573 V606 C607 V616	I538-I614 HydrophobicContact CD1-CG2 3.97Å; V571-I614 HydrophobicContact CG1-CD1 4.43Å; V571-I614 HydrophobicContact CG1-CG1 4.1Å; V571-I614 HydrophobicContact CG1-CG2 3.76Å; K572-I614 WeakPolarHBondContact O-CA 3.44Å; A573-I614 HydrophobicContact CB-CG1 4.23Å; V606-I614 CarbonylContact C-O 3.57Å; V606-I614 VanDerWaalsContact CA-O 3.29Å; V606-I614 WeakPolarHBondContact CA-O 3.3Å; C607-I614 HydrophobicContact CB-CB 3.97Å; C607-I614 HydrophobicContact CB-CG2 4.05Å; C607-I614 PolarHBondContact N-O 3.44Å; C607-I614 PolarHBondContact O-N 2.94Å; I614-V616 HydrophobicContact CG2-CG2 3.84Å
615	M	90.2	Very high	85.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	139.5	163.6	-63.6	-169.9	176.4	0	0	110.3	V571 K572 F585 E588 L592 F603 F617	V571-M615 WeakPolarHBondContact CA-O 3.3Å; K572-M615 HydrophobicContact CB-CB 4.38Å; K572-M615 PolarHBondContact N-O 3.04Å; K572-M615 PolarHBondContact O-N 3.28Å; F585-M615 HydrophobicContact CB-CE 4.39Å; F585-M615 HydrophobicContact CD2-CE 3.35Å; F585-M615 HydrophobicContact CD2-CG 4.07Å; F585-M615 HydrophobicContact CE2-CE 3.73Å; F585-M615 HydrophobicContact CE2-CG 3.47Å; F585-M615 VanDerWaalsContact CE2-CG 3.47Å; F585-M615 HydrophobicContact CE2-SD 4.46Å; F585-M615 HydrophobicContact CG-CE 3.88Å; F585-M615 HydrophobicContact CZ-CE 4.5Å; F585-M615 HydrophobicContact CZ-CG 4.1Å; F585-M615 WeakPolarHBondContact O-CE 3.38Å; E588-M615 HydrophobicContact CB-CE 3.86Å; E588-M615 VanDerWaalsContact CD-CE 3.45Å; E588-M615 HydrophobicContact CG-CE 3.69Å; E588-M615 HydrophobicContact CG-SD 4.26Å; E588-M615 WeakPolarHBondContact OE2-CE 3.4Å; L592-M615 HydrophobicContact CD1-SD 4.46Å; F603-M615 HydrophobicContact CE2-CB 4.09Å; F603-M615 HydrophobicContact CE2-CG 4.35Å; M615-F617 HydrophobicContact CB-CD2 4.36Å; M615-F617 HydrophobicContact CB-CE2 3.49Å; M615-F617 VanDerWaalsContact CB-CE2 3.49Å; M615-F617 HydrophobicContact CB-CZ 3.91Å; M615-F617 HydrophobicContact SD-CE2 4.42Å; M615-F617 HydrophobicContact SD-CZ 4.06Å
616	V	92.9	Very high	85.9	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.8	-177.3	-167.8	0	0	0	0	110.5	I533 I538 L560 V569 V571 F603 Y604 G605 I614	I533-V616 HydrophobicContact CD1-CB 3.71Å; I533-V616 HydrophobicContact CD1-CG1 4.13Å; I533-V616 HydrophobicContact CD1-CG2 3.67Å; I538-V616 HydrophobicContact CD1-CG2 3.85Å; L560-V616 HydrophobicContact CD2-CG1 4.45Å; V569-V616 HydrophobicContact CB-CG1 3.75Å; V569-V616 HydrophobicContact CG1-CG1 3.96Å; V569-V616 HydrophobicContact CG2-CG1 3.81Å; V571-V616 HydrophobicContact CG2-CG1 4.48Å; V571-V616 HydrophobicContact CG2-CG2 4.43Å; F603-V616 WeakPolarHBondContact CD2-O 3.47Å; Y604-V616 HydrophobicContact CD2-CG1 4.27Å; Y604-V616 PolarHBondContact N-O 2.89Å; G605-V616 PolarHBondContact O-N 3.27Å; I614-V616 HydrophobicContact CG2-CG2 3.84Å
617	F	92.9	Very high	85.7	Confident	5 Å²	5	37.3 Å²	37.3	2%	0.022	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	164.5	-175.3	-60.6	-85.3	0	0	0	111.8	V569 A570 K572 L592 V601 K602 F603 Y604 M615 F698	V569-F617 WeakPolarHBondContact CA-O 3.43Å; V569-F617 WeakPolarHBondContact CB-O 3.28Å; A570-F617 HydrophobicContact CB-CB 4.32Å; A570-F617 PolarHBondContact N-O 2.95Å; A570-F617 PolarHBondContact O-N 3.29Å; K572-F617 HydrophobicContact CB-CE2 4.12Å; L592-F617 HydrophobicContact CD1-CE1 4.06Å; L592-F617 HydrophobicContact CD1-CZ 4.17Å; V601-F617 HydrophobicContact CG1-CB 4.39Å; V601-F617 HydrophobicContact CG1-CD1 4.32Å; K602-F617 CarbonylContact O-C 3.56Å; K602-F617 WeakPolarHBondContact O-CA 3.46Å; F603-F617 HydrophobicContact CB-CD1 4.16Å; F603-F617 HydrophobicContact CB-CE1 4.09Å; F603-F617 AromaticContact CD2-CD1 3.94Å; F603-F617 HydrophobicContact CD2-CD1 3.94Å; F603-F617 AromaticContact CD2-CE1 3.53Å; F603-F617 HydrophobicContact CD2-CE1 3.53Å; F603-F617 AromaticContact CD2-CZ 3.92Å; F603-F617 HydrophobicContact CD2-CZ 3.92Å; F603-F617 HydrophobicContact CE2-CE1 4.4Å; F603-F617 HydrophobicContact CE2-CZ 4.37Å; F603-F617 HydrophobicContact CG-CE1 4.24Å; Y604-F617 VanDerWaalsContact CD2-C 3.46Å; M615-F617 HydrophobicContact CB-CD2 4.36Å; M615-F617 HydrophobicContact CB-CE2 3.49Å; M615-F617 VanDerWaalsContact CB-CE2 3.49Å; M615-F617 HydrophobicContact CB-CZ 3.91Å; M615-F617 HydrophobicContact SD-CE2 4.42Å; M615-F617 HydrophobicContact SD-CZ 4.06Å; F617-F698 HydrophobicContact CD1-CD2 4.08Å; F617-F698 AromaticContact CD1-CE2 3.86Å; F617-F698 HydrophobicContact CD1-CE2 3.86Å; F617-F698 HydrophobicContact CD1-CZ 4.5Å; F617-F698 HydrophobicContact CE1-CD1 4.06Å; F617-F698 AromaticContact CE1-CD2 3.46Å; F617-F698 HydrophobicContact CE1-CD2 3.46Å; F617-F698 VanDerWaalsContact CE1-CD2 3.46Å; F617-F698 AromaticContact CE1-CE1 3.95Å; F617-F698 HydrophobicContact CE1-CE1 3.95Å; F617-F698 AromaticContact CE1-CE2 3.23Å; F617-F698 HydrophobicContact CE1-CE2 3.23Å; F617-F698 AromaticContact CE1-CG 3.92Å; F617-F698 HydrophobicContact CE1-CG 3.92Å; F617-F698 AromaticContact CE1-CZ 3.55Å; F617-F698 HydrophobicContact CE1-CZ 3.55Å; F617-F698 HydrophobicContact CE2-CD2 4.13Å; F617-F698 HydrophobicContact CE2-CG 4.11Å; F617-F698 HydrophobicContact CZ-CB 4.42Å; F617-F698 AromaticContact CZ-CD1 3.62Å; F617-F698 HydrophobicContact CZ-CD1 3.62Å; F617-F698 AromaticContact CZ-CD2 3.5Å; F617-F698 HydrophobicContact CZ-CD2 3.5Å; F617-F698 AromaticContact CZ-CE1 3.94Å; F617-F698 HydrophobicContact CZ-CE1 3.94Å; F617-F698 AromaticContact CZ-CE2 3.75Å; F617-F698 HydrophobicContact CZ-CE2 3.75Å; F617-F698 AromaticContact CZ-CG 3.48Å; F617-F698 HydrophobicContact CZ-CG 3.48Å; F617-F698 VanDerWaalsContact CZ-CG 3.48Å; F617-F698 HydrophobicContact CZ-CZ 4Å
618	E	92.1	Very high	85.7	Confident	29 Å²	29	38.3 Å²	38.3	14%	0.136	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	141	168.4	74.5	-173.7	141.9	0	0	112.4	V601 K602 Y604 M620 K694	V601-E618 WeakPolarHBondContact CA-OE1 3.44Å; V601-E618 HydrophobicContact CG1-CG 4.22Å; K602-E618 HydrophobicContact CB-CB 4.25Å; K602-E618 HydrophobicContact CB-CG 4.11Å; K602-E618 WeakPolarHBondContact CB-OE1 3.35Å; K602-E618 PolarHBondContact N-OE1 2.94Å; K602-E618 PolarHBondContact O-N 3.4Å; Y604-E618 HydrophobicContact CE2-CB 3.94Å; E618-M620 HydrophobicContact CG-CG 4.29Å; E618-M620 HydrophobicContact CG-SD 4.11Å; E618-M620 PolarHBondContact O-N 2.88Å; E618-K694 WeakPolarHBondContact OE1-CD 3.48Å; E618-K694 VanDerWaalsContact OE1-CE 3.31Å; E618-K694 WeakPolarHBondContact OE1-CE 3.2Å; E618-K694 IonicContact OE1-NZ 3.86Å; E618-K694 PolarHBondContact OE1-NZ 3.39Å; E618-K694 IonicContact OE2-NZ 2.66Å; E618-K694 PolarHBondContact OE2-NZ 3.24Å
619	Y	92.3	Very high	86.3	Confident	56 Å²	56	36.7 Å²	36.7	22%	0.22	20%	0.2	C	C	.	.			trans	-81.8	114.6	178	177.1	-127.8	0	0	0	111.7	L544 L554 L568 K621	L544-Y619 HydrophobicContact CD1-CD2 4.25Å; L544-Y619 HydrophobicContact CD1-CE2 3.96Å; L544-Y619 HydrophobicContact CD2-CE2 4.39Å; L554-Y619 HydrophobicContact CD1-CD1 3.72Å; L554-Y619 HydrophobicContact CD1-CD2 3.65Å; L554-Y619 HydrophobicContact CD1-CE1 3.82Å; L554-Y619 HydrophobicContact CD1-CE2 3.79Å; L554-Y619 HydrophobicContact CD1-CG 3.63Å; L554-Y619 HydrophobicContact CD2-CE1 4.49Å; L568-Y619 HydrophobicContact CB-CD1 4.01Å; L568-Y619 HydrophobicContact CB-CG 4.44Å; L568-Y619 HydrophobicContact CD1-CD1 4.16Å; L568-Y619 HydrophobicContact CD1-CE1 4.4Å; Y619-K621 HydrophobicContact CD1-CB 4.43Å; Y619-K621 HydrophobicContact CE1-CB 3.85Å
620	M	88.9	Confident	87.2	Confident	10 Å²	10	37.9 Å²	37.9	5%	0.049	20%	0.198	C	C	.	.			trans	-96.6	94	178.2	-63.2	-65.7	-79.4	0	0	110	E618 H622 G623 L686 V687 G688 K694	E618-M620 HydrophobicContact CG-CG 4.29Å; E618-M620 HydrophobicContact CG-SD 4.11Å; E618-M620 PolarHBondContact O-N 2.88Å; M620-H622 PolarHBondContact O-N 3.14Å; M620-G623 PolarHBondContact O-N 3.24Å; M620-L686 HydrophobicContact CB-CB 3.68Å; M620-L686 HydrophobicContact CB-CD1 4.05Å; M620-L686 HydrophobicContact CB-CG 4.46Å; M620-L686 HydrophobicContact CE-CB 4.06Å; M620-L686 VanDerWaalsContact CE-O 3.3Å; M620-L686 WeakPolarHBondContact CE-O 3.46Å; M620-L686 HydrophobicContact CG-CB 3.71Å; M620-L686 HydrophobicContact CG-CD1 3.9Å; M620-L686 HydrophobicContact CG-CG 4.48Å; M620-V687 CarbonylContact C-O 3.56Å; M620-V687 VanDerWaalsContact C-O 3.3Å; M620-G688 VanDerWaalsContact CE-N 3.35Å; M620-K694 HydrophobicContact CE-CB 3.97Å; M620-K694 HydrophobicContact CE-CD 3.92Å; M620-K694 HydrophobicContact CE-CG 3.67Å; M620-K694 HydrophobicContact SD-CD 4.19Å
621	K	82.2	Confident	88	Confident	107 Å²	107	37.7 Å²	37.7	47%	0.465	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.4	-163.7	69.6	166.2	-179.9	173.5	0	117.4	Y619	Y619-K621 HydrophobicContact CD1-CB 4.43Å; Y619-K621 HydrophobicContact CE1-CB 3.85Å
622	H	83.1	Confident	88.6	Confident	78 Å²	78	34.1 Å²	34.1	36%	0.361	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	5.8	179.7	-66.3	-38.2	0	0	0	113.4	M620 F628 V687 G688	M620-H622 PolarHBondContact O-N 3.14Å; H622-F628 HydrophobicContact CB-CD2 3.89Å; H622-F628 HydrophobicContact CB-CE2 4.14Å; H622-V687 WeakPolarHBondContact CA-O 3.44Å; H622-V687 HydrophobicContact CB-CB 3.84Å; H622-V687 HydrophobicContact CB-CG1 3.92Å; H622-V687 WeakPolarHBondContact CB-O 3.49Å; H622-V687 PolarHBondContact N-O 3.22Å; H622-G688 PolarHBondContact CD2-O 2.88Å
623	G	87.4	Confident	88.5	Confident	33 Å²	33	32.2 Å²	32.2	34%	0.34	16%	0.159	S	C	.	.			trans	73.1	-149.7	175.7	0	0	0	0	0	112.9	M620 L686 V687	M620-G623 PolarHBondContact O-N 3.24Å; G623-L686 CarbonylContact O-C 3.5Å; G623-L686 WeakPolarHBondContact O-CA 3.16Å; G623-V687 PolarHBondContact O-N 2.93Å
624	D	88.5	Confident	88	Confident	16 Å²	16	35.2 Å²	35.2	9%	0.086	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-78.8	147.1	-179.7	70.9	86.7	0	0	0	113.3	N626 K627 F628 C685 L686 Y705	D624-N626 VanDerWaalsContact C-N 3.29Å; D624-N626 PolarHBondContact O-N 3.14Å; D624-N626 PolarHBondContact OD1-N 3.01Å; D624-K627 PolarHBondContact O-N 3.35Å; D624-K627 PolarHBondContact OD1-N 2.62Å; D624-K627 WeakPolarHBondContact OD2-CD 3.48Å; D624-K627 WeakPolarHBondContact OD2-CE 3.4Å; D624-K627 IonicContact OD2-NZ 3.7Å; D624-K627 PolarHBondContact OD2-NZ 2.91Å; D624-F628 PolarHBondContact O-N 3.27Å; D624-F628 VanDerWaalsContact O-N 3.07Å; D624-C685 CarbonylContact C-O 3.58Å; D624-C685 WeakPolarHBondContact CA-O 3.48Å; D624-L686 HydrophobicContact CB-CD2 4.27Å; D624-Y705 PolarHBondContact OD1-OH 3.1Å; D624-Y705 PolarHBondContact OD2-OH 3.45Å
625	L	93.3	Very high	86.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.5	-26.7	-175	178.2	65.6	0	0	0	112.3	F628 L629 I659 I663 T682 C685 V687 V693	L625-F628 HydrophobicContact CD1-CB 4.49Å; L625-F628 HydrophobicContact CD1-CD1 4.21Å; L625-F628 PolarHBondContact O-N 3.06Å; L625-L629 HydrophobicContact CD1-CD1 4.24Å; L625-L629 HydrophobicContact CD1-CD2 4.39Å; L625-L629 HydrophobicContact CD1-CG 3.91Å; L625-L629 HydrophobicContact CD2-CD1 4.47Å; L625-L629 HydrophobicContact CG-CD1 3.88Å; L625-L629 HydrophobicContact CG-CG 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.4Å; L625-L629 WeakPolarHBondContact O-CG 3.34Å; L625-L629 PolarHBondContact O-N 2.96Å; L625-I659 HydrophobicContact CD1-CD1 4.43Å; L625-I659 HydrophobicContact CD1-CG2 4.01Å; L625-I659 HydrophobicContact CD2-CG2 3.76Å; L625-I663 HydrophobicContact CD2-CD1 3.65Å; L625-T682 WeakPolarHBondContact CB-O 3.33Å; L625-T682 HydrophobicContact CD2-CG2 3.99Å; L625-T682 HydrophobicContact CG-CG2 4.3Å; L625-T682 PolarHBondContact N-O 3.3Å; L625-C685 HydrophobicContact CB-CB 3.87Å; L625-C685 HydrophobicContact CD2-CB 3.93Å; L625-C685 PolarHBondContact N-O 3.02Å; L625-V687 HydrophobicContact CB-CG2 3.89Å; L625-V687 HydrophobicContact CD1-CG2 3.68Å; L625-V687 HydrophobicContact CG-CG2 4.39Å; L625-V693 HydrophobicContact CD2-CG1 4.15Å
626	N	91.2	Very high	85.5	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.016	22%	0.218	C	C	.	.	H	α-helix	trans	-65.7	-49.9	177.5	-165.8	-89.3	0	0	0	111.3	D624 F628 L629 R630 T682 R683 Y705 E748 G753	D624-N626 VanDerWaalsContact C-N 3.29Å; D624-N626 PolarHBondContact O-N 3.14Å; D624-N626 PolarHBondContact OD1-N 3.01Å; N626-F628 VanDerWaalsContact C-N 3.31Å; N626-F628 PolarHBondContact O-N 3.41Å; N626-L629 PolarHBondContact O-N 2.93Å; N626-R630 WeakPolarHBondContact O-CG 3.4Å; N626-R630 PolarHBondContact O-N 2.95Å; N626-R630 WeakPolarHBondContact OD1-CD 3.5Å; N626-R630 PolarHBondContact OD1-NE 3.49Å; N626-T682 WeakPolarHBondContact CA-OG1 3.28Å; N626-T682 VanDerWaalsContact CB-OG1 3.25Å; N626-T682 WeakPolarHBondContact CB-OG1 3.4Å; N626-T682 PolarHBondContact N-O 2.81Å; N626-T682 PolarHBondContact ND2-OG1 3.33Å; N626-R683 HydrophobicContact CB-CB 4.34Å; N626-Y705 HydrophobicContact CB-CE1 4.46Å; N626-E748 PolarHBondContact ND2-OE1 3.14Å; N626-G753 PolarHBondContact ND2-O 2.85Å; N626-G753 VanDerWaalsContact ND2-O 3.07Å; N626-G753 PolarHBondContact OD1-O 2.97Å
627	K	87	Confident	83.3	Confident	103 Å²	103	49.1 Å²	49.1	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-59.9	-41.8	171.8	-81.3	172.3	-154.9	134.7	0	112.1	D624 L629 R630 A631 Y705	D624-K627 PolarHBondContact O-N 3.35Å; D624-K627 PolarHBondContact OD1-N 2.62Å; D624-K627 WeakPolarHBondContact OD2-CD 3.48Å; D624-K627 WeakPolarHBondContact OD2-CE 3.4Å; D624-K627 IonicContact OD2-NZ 3.7Å; D624-K627 PolarHBondContact OD2-NZ 2.91Å; K627-L629 PolarHBondContact O-N 2.83Å; K627-R630 PolarHBondContact O-N 3.08Å; K627-A631 WeakPolarHBondContact O-CB 3.44Å; K627-A631 PolarHBondContact O-N 3.25Å; K627-Y705 WeakPolarHBondContact CE-OH 3.37Å; K627-Y705 WeakPolarHBondContact CG-OH 3.42Å
628	F	89.3	Confident	80.9	Confident	21 Å²	21	55 Å²	55	9%	0.092	29%	0.286	C	S	.	.	H	α-helix	trans	-59.6	-47.1	178.3	-173	-92	0	0	0	111.8	H622 D624 L625 N626 A631 H632 L651 V687 L691	H622-F628 HydrophobicContact CB-CD2 3.89Å; H622-F628 HydrophobicContact CB-CE2 4.14Å; D624-F628 PolarHBondContact O-N 3.27Å; D624-F628 VanDerWaalsContact O-N 3.07Å; L625-F628 HydrophobicContact CD1-CB 4.49Å; L625-F628 HydrophobicContact CD1-CD1 4.21Å; L625-F628 PolarHBondContact O-N 3.06Å; N626-F628 VanDerWaalsContact C-N 3.31Å; N626-F628 PolarHBondContact O-N 3.41Å; F628-A631 PolarHBondContact O-N 3.37Å; F628-H632 AromaticContact CD2-CE1 3.96Å; F628-H632 AromaticContact CE1-CE1 3.69Å; F628-H632 AromaticContact CE1-ND1 3.91Å; F628-H632 AromaticContact CE2-CE1 3.5Å; F628-H632 AromaticContact CZ-CE1 3.33Å; F628-H632 WeakPolarHBondContact CZ-CE1 3.36Å; F628-H632 AromaticContact CZ-NE2 3.87Å; F628-H632 PolarHBondContact O-ND1 2.79Å; F628-L651 HydrophobicContact CE1-CD1 4.26Å; F628-L651 HydrophobicContact CE1-CD2 4.3Å; F628-V687 HydrophobicContact CB-CG2 4.04Å; F628-V687 HydrophobicContact CD1-CG2 4.39Å; F628-V687 HydrophobicContact CD2-CB 4.43Å; F628-V687 HydrophobicContact CD2-CG1 4.14Å; F628-V687 HydrophobicContact CE2-CG1 4.16Å; F628-V687 HydrophobicContact CG-CB 4.45Å; F628-V687 HydrophobicContact CG-CG1 4.32Å; F628-V687 HydrophobicContact CG-CG2 4.07Å; F628-V687 HydrophobicContact CZ-CG1 4.4Å; F628-L691 HydrophobicContact CE1-CD2 3.68Å; F628-L691 HydrophobicContact CZ-CD2 3.46Å; F628-L691 VanDerWaalsContact CZ-CD2 3.46Å
629	L	90.8	Very high	78.1	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-48.3	177.2	-74.5	168.4	0	0	0	111.6	L625 N626 K627 A631 H632 G633 L651 T682 I749 Y752	L625-L629 HydrophobicContact CD1-CD1 4.24Å; L625-L629 HydrophobicContact CD1-CD2 4.39Å; L625-L629 HydrophobicContact CD1-CG 3.91Å; L625-L629 HydrophobicContact CD2-CD1 4.47Å; L625-L629 HydrophobicContact CG-CD1 3.88Å; L625-L629 HydrophobicContact CG-CG 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.4Å; L625-L629 WeakPolarHBondContact O-CG 3.34Å; L625-L629 PolarHBondContact O-N 2.96Å; N626-L629 PolarHBondContact O-N 2.93Å; K627-L629 PolarHBondContact O-N 2.83Å; L629-A631 PolarHBondContact O-N 3.14Å; L629-H632 PolarHBondContact O-N 2.95Å; L629-G633 PolarHBondContact O-N 2.72Å; L629-L651 HydrophobicContact CD2-CD1 3.87Å; L629-T682 HydrophobicContact CD1-CG2 3.81Å; L629-I749 HydrophobicContact CD1-CG1 4.07Å; L629-I749 HydrophobicContact CD2-CG2 4.39Å; L629-Y752 CarbonylContact C-O 3.57Å
630	R	89	Confident	75.5	Confident	123 Å²	123	60.5 Å²	60.5	46%	0.464	32%	0.321	S	S	.	.	H	α-helix	trans	-57.8	-36.7	178.5	-73.2	174.4	179.3	-94.7	1.4	112.9	N626 K627 H632 G633 Y752 G753	N626-R630 WeakPolarHBondContact O-CG 3.4Å; N626-R630 PolarHBondContact O-N 2.95Å; N626-R630 WeakPolarHBondContact OD1-CD 3.5Å; N626-R630 PolarHBondContact OD1-NE 3.49Å; K627-R630 PolarHBondContact O-N 3.08Å; R630-H632 PolarHBondContact O-N 3.47Å; R630-G633 PolarHBondContact O-N 2.81Å; R630-Y752 VanDerWaalsContact CA-O 3.32Å; R630-Y752 WeakPolarHBondContact CA-O 3.48Å; R630-Y752 VanDerWaalsContact CG-O 3.31Å; R630-Y752 WeakPolarHBondContact CG-O 3.33Å; R630-Y752 PolarHBondContact N-O 3.22Å; R630-G753 PolarHBondContact NE-O 2.83Å; R630-G753 VanDerWaalsContact NE-O 3.1Å; R630-G753 PolarHBondContact NH2-O 2.81Å
631	A	83.9	Confident	72.8	Confident	49 Å²	49	65.3 Å²	65.3	41%	0.405	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.7	178.1	0	0	0	0	0	114.8	K627 F628 L629	K627-A631 WeakPolarHBondContact O-CB 3.44Å; K627-A631 PolarHBondContact O-N 3.25Å; F628-A631 PolarHBondContact O-N 3.37Å; L629-A631 PolarHBondContact O-N 3.14Å
632	H	85.5	Confident	70.4	Confident	18 Å²	18	63 Å²	63	8%	0.083	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	8.2	177.2	-61.1	80	0	0	0	113	F628 L629 R630 K648 L651 Y752	F628-H632 AromaticContact CD2-CE1 3.96Å; F628-H632 AromaticContact CE1-CE1 3.69Å; F628-H632 AromaticContact CE1-ND1 3.91Å; F628-H632 AromaticContact CE2-CE1 3.5Å; F628-H632 AromaticContact CZ-CE1 3.33Å; F628-H632 WeakPolarHBondContact CZ-CE1 3.36Å; F628-H632 AromaticContact CZ-NE2 3.87Å; F628-H632 PolarHBondContact O-ND1 2.79Å; L629-H632 PolarHBondContact O-N 2.95Å; R630-H632 PolarHBondContact O-N 3.47Å; H632-K648 VanDerWaalsContact CD2-CB 3.48Å; H632-K648 WeakPolarHBondContact CD2-CB 3.36Å; H632-K648 PolarHBondContact CD2-O 3.4Å; H632-K648 VanDerWaalsContact CD2-O 3.24Å; H632-K648 WeakPolarHBondContact NE2-CB 3.07Å; H632-L651 HydrophobicContact CB-CD1 4.17Å; H632-L651 HydrophobicContact CB-CG 3.82Å; H632-Y752 HydrophobicContact CB-CD1 4.48Å; H632-Y752 HydrophobicContact CB-CE1 4.38Å; H632-Y752 WeakPolarHBondContact O-CD1 3.36Å; H632-Y752 WeakPolarHBondContact O-CE1 3.32Å
633	G	81.9	Confident	67.8	Low	5 Å²	5	67.8 Å²	67.8	5%	0.052	38%	0.377	C	S	.	.	S	Bend	trans	-86.2	163.6	-176	0	0	0	0	0	115.2	L629 R630 D635 A636 Y752	L629-G633 PolarHBondContact O-N 2.72Å; R630-G633 PolarHBondContact O-N 2.81Å; G633-D635 VanDerWaalsContact C-N 3.28Å; G633-D635 PolarHBondContact O-N 3.01Å; G633-A636 WeakPolarHBondContact O-CB 3.42Å; G633-A636 PolarHBondContact O-N 3.5Å; G633-Y752 VanDerWaalsContact CA-CD1 3.42Å
634	P	74.5	Confident	65.3	Low	77 Å²	77	71.9 Å²	71.9	50%	0.5	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-31.8	175.7	28.1	-35.3	0	0	0	111.7	A636 Y752	P634-A636 PolarHBondContact O-N 3.04Å; P634-Y752 HydrophobicContact CG-CD2 4.27Å; P634-Y752 HydrophobicContact CG-CE2 4.31Å
635	D	66.3	Low	63	Low	109 Å²	109	78.2 Å²	78.2	58%	0.583	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	17.3	172	-59.4	-46.8	0	0	0	112.6	G633 M637 K754	G633-D635 VanDerWaalsContact C-N 3.28Å; G633-D635 PolarHBondContact O-N 3.01Å; D635-M637 PolarHBondContact O-N 3.44Å; D635-K754 WeakPolarHBondContact OD2-CE 3.45Å; D635-K754 IonicContact OD2-NZ 3.95Å; D635-K754 PolarHBondContact OD2-NZ 2.92Å
636	A	62.5	Low	60.4	Low	32 Å²	32	87.6 Å²	87.6	26%	0.264	46%	0.464	S	S	.	.			trans	-72	47.7	168.9	0	0	0	0	0	112	G633 P634 I638 A647	G633-A636 WeakPolarHBondContact O-CB 3.42Å; G633-A636 PolarHBondContact O-N 3.5Å; P634-A636 PolarHBondContact O-N 3.04Å; A636-I638 PolarHBondContact O-N 3.41Å; A636-A647 HydrophobicContact CB-CB 4.19Å
637	M	45.8	Very low	58.3	Low	157 Å²	157	89.3 Å²	89.3	77%	0.773	48%	0.479	S	S	*	.			trans	-65.9	86.8	150.3	-81.7	-161.1	158.8	0	0	108.2	D635 L639	D635-M637 PolarHBondContact O-N 3.44Å; M637-L639 PolarHBondContact O-N 3.28Å
638	I	42.8	Very low	56.7	Low	129 Å²	129	90.4 Å²	90.4	66%	0.662	48%	0.483	S	S	*	.			trans	-68.3	87.2	154	-63.4	170.1	0	0	0	105.7	A636 V640	A636-I638 PolarHBondContact O-N 3.41Å; I638-V640 HydrophobicContact CG2-CB 4.41Å; I638-V640 HydrophobicContact CG2-CG2 4.08Å; I638-V640 PolarHBondContact O-N 3.29Å
639	L	34.7	Very low	55.4	Low	139 Å²	139	92.2 Å²	92.2	73%	0.728	51%	0.508	S	S	*	.			trans	-72.6	79.9	168.4	-108.4	175.2	0	0	0	108.5	M637	M637-L639 PolarHBondContact O-N 3.28Å
640	V	36.1	Very low	54.7	Low	61 Å²	61	97.2 Å²	97.2	37%	0.37	53%	0.531	S	S	.	.	S	Bend	trans	-136.9	127	156.8	-170.9	0	0	0	0	106.4	K367 I638 G642	K367-V640 HydrophobicContact CD-CB 3.51Å; K367-V640 HydrophobicContact CD-CG1 3.56Å; K367-V640 HydrophobicContact CD-CG2 4.17Å; I638-V640 HydrophobicContact CG2-CB 4.41Å; I638-V640 HydrophobicContact CG2-CG2 4.08Å; I638-V640 PolarHBondContact O-N 3.29Å; V640-G642 VanDerWaalsContact C-N 3.32Å; V640-G642 PolarHBondContact O-N 3.02Å
641	D	33.1	Very low	54.5	Low	111 Å²	111	91.8 Å²	91.8	59%	0.594	51%	0.511	S	S	*	.	S	Bend	trans	58.8	31.4	-179.5	-55.7	-17.7	0	0	0	116.9	Q643	D641-Q643 VanDerWaalsContact C-N 3.33Å; D641-Q643 PolarHBondContact O-N 3.27Å
642	G	31.8	Very low	54.6	Low	60 Å²	60	91 Å²	91	62%	0.619	51%	0.509	S	S	*	.	S	Bend	trans	75	-2	138.4	0	0	0	0	0	119	V640	V640-G642 VanDerWaalsContact C-N 3.32Å; V640-G642 PolarHBondContact O-N 3.02Å
643	Q	29.2	Very low	54.7	Low	178 Å²	178	91.8 Å²	91.8	83%	0.832	51%	0.513	S	S	*	.			trans	-140.7	149.5	165.2	-78.6	-149.3	2.4	0	0	114.1	D641	D641-Q643 VanDerWaalsContact C-N 3.33Å; D641-Q643 PolarHBondContact O-N 3.27Å
644	P	34.5	Very low	54.9	Low	119 Å²	119	94.5 Å²	94.5	77%	0.773	53%	0.531	S	S	*	.			trans	-89	134.5	-166.7	34.1	-33.9	0	0	0	113.1
645	R	40.7	Very low	55.6	Low	149 Å²	149	94.7 Å²	94.7	56%	0.562	53%	0.525	S	S	*	.			trans	-122.3	147.5	156.1	-87.2	-169.3	176.3	-174.3	5.8	110	L396 K397 A647	L396-R645 VanDerWaalsContact CD2-NH1 3.35Å; K397-R645 PolarHBondContact O-NH2 3.24Å; R645-A647 PolarHBondContact O-N 3.03Å
646	Q	38.2	Very low	56.9	Low	196 Å²	196	89.8 Å²	89.8	92%	0.916	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-55	134.5	-169	-77.3	169.8	-42.6	0	0	112.3
647	A	47.1	Very low	58.4	Low	40 Å²	40	88.2 Å²	88.2	33%	0.331	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-51.6	158.3	165.2	0	0	0	0	0	110.6	A636 R645 G649	A636-A647 HydrophobicContact CB-CB 4.19Å; R645-A647 PolarHBondContact O-N 3.03Å; A647-G649 PolarHBondContact O-N 3.31Å
648	K	52.7	Low	60.5	Low	125 Å²	125	85.1 Å²	85.1	54%	0.543	47%	0.47	S	S	.	.	S	Bend	trans	-51.7	117.9	157	-71.5	176.2	179.5	173.8	0	105.6	H632	H632-K648 VanDerWaalsContact CD2-CB 3.48Å; H632-K648 WeakPolarHBondContact CD2-CB 3.36Å; H632-K648 PolarHBondContact CD2-O 3.4Å; H632-K648 VanDerWaalsContact CD2-O 3.24Å; H632-K648 WeakPolarHBondContact NE2-CB 3.07Å
649	G	62.7	Low	63.1	Low	59 Å²	59	79 Å²	79	61%	0.608	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-49.3	144.5	-157.8	0	0	0	0	0	113.2	A647 L651	A647-G649 PolarHBondContact O-N 3.31Å; G649-L651 PolarHBondContact O-N 3.01Å
650	E	75	Confident	66.1	Low	106 Å²	106	72.3 Å²	72.3	50%	0.495	40%	0.403	S	S	.	.			trans	-42	133.5	-178.2	-83.1	-164.4	-134.8	0	0	112.4	G652 Y752	E650-G652 PolarHBondContact O-N 2.84Å; E650-G652 VanDerWaalsContact O-N 3.09Å; E650-Y752 VanDerWaalsContact CB-OH 3.3Å; E650-Y752 WeakPolarHBondContact CB-OH 3.01Å; E650-Y752 WeakPolarHBondContact CG-OH 3.5Å; E650-Y752 PolarHBondContact OE2-OH 3.49Å
651	L	85.3	Confident	68.9	Low	8 Å²	8	69.8 Å²	69.8	4%	0.042	39%	0.388	C	S	.	.			trans	-64.5	115.2	-178.2	-68.7	171.3	0	0	0	109	F628 L629 H632 G649 Q655 M656 I659 Y752	F628-L651 HydrophobicContact CE1-CD1 4.26Å; F628-L651 HydrophobicContact CE1-CD2 4.3Å; L629-L651 HydrophobicContact CD2-CD1 3.87Å; H632-L651 HydrophobicContact CB-CD1 4.17Å; H632-L651 HydrophobicContact CB-CG 3.82Å; G649-L651 PolarHBondContact O-N 3.01Å; L651-Q655 HydrophobicContact CD2-CB 4.41Å; L651-M656 HydrophobicContact CB-CE 4.21Å; L651-M656 HydrophobicContact CB-CG 4.07Å; L651-I659 HydrophobicContact CD1-CD1 4.14Å; L651-Y752 HydrophobicContact CB-CE1 4.05Å; L651-Y752 HydrophobicContact CD1-CE1 4.44Å; L651-Y752 HydrophobicContact CG-CE1 4.36Å; L651-Y752 PolarHBondContact N-OH 3.36Å
652	G	85.8	Confident	72	Confident	34 Å²	34	65 Å²	65	35%	0.351	36%	0.362	S	S	.	.			trans	-60.3	151.1	177.3	0	0	0	0	0	111.1	E650 S654 Q655 M656	E650-G652 PolarHBondContact O-N 2.84Å; E650-G652 VanDerWaalsContact O-N 3.09Å; G652-S654 PolarHBondContact O-N 3Å; G652-Q655 WeakPolarHBondContact O-CA 3.33Å; G652-Q655 WeakPolarHBondContact O-CB 3.45Å; G652-Q655 PolarHBondContact O-N 3.4Å; G652-M656 PolarHBondContact O-N 3.45Å
653	L	87.1	Confident	75.1	Confident	34 Å²	34	62.1 Å²	62.1	18%	0.178	33%	0.333	C	S	.	.	H	α-helix	trans	-49.8	-38.9	-178.7	175.8	58.4	0	0	0	113.1	Q655 M656 L657 F750 P782 T817	L653-Q655 PolarHBondContact O-N 2.64Å; L653-M656 PolarHBondContact O-N 3.16Å; L653-L657 HydrophobicContact CD1-CD1 3.9Å; L653-L657 HydrophobicContact CD1-CG 4.04Å; L653-L657 HydrophobicContact CG-CD1 3.9Å; L653-L657 HydrophobicContact CG-CG 4.48Å; L653-L657 WeakPolarHBondContact O-CB 3.4Å; L653-L657 VanDerWaalsContact O-CG 3.28Å; L653-L657 WeakPolarHBondContact O-CG 3.09Å; L653-L657 PolarHBondContact O-N 3.37Å; L653-F750 HydrophobicContact CD1-CE1 3.51Å; L653-F750 HydrophobicContact CD1-CZ 3.76Å; L653-P782 HydrophobicContact CD1-CG 3.58Å; L653-P782 HydrophobicContact CD2-CG 3.6Å; L653-P782 HydrophobicContact CG-CG 4.27Å; L653-T817 HydrophobicContact CB-CG2 4.02Å; L653-T817 HydrophobicContact CD2-CG2 3.61Å; L653-T817 HydrophobicContact CG-CG2 3.7Å
654	S	86.7	Confident	78.4	Confident	62 Å²	62	53.7 Å²	53.7	43%	0.434	29%	0.293	S	S	.	.	H	α-helix	trans	-62.2	-39.5	175.2	-172.6	0	0	0	0	112.8	G652 H658	G652-S654 PolarHBondContact O-N 3Å; S654-H658 VanDerWaalsContact O-CB 3.29Å; S654-H658 WeakPolarHBondContact O-CB 3.48Å; S654-H658 PolarHBondContact O-N 3.01Å
655	Q	89.9	Confident	81.4	Confident	81 Å²	81	48.9 Å²	48.9	38%	0.379	26%	0.263	S	S	.	.	H	α-helix	trans	-69.6	-41.8	176.6	-64.6	170.9	-50.5	0	0	111.5	L651 G652 L653 H658 I659 L691	L651-Q655 HydrophobicContact CD2-CB 4.41Å; G652-Q655 WeakPolarHBondContact O-CA 3.33Å; G652-Q655 WeakPolarHBondContact O-CB 3.45Å; G652-Q655 PolarHBondContact O-N 3.4Å; L653-Q655 PolarHBondContact O-N 2.64Å; Q655-H658 WeakPolarHBondContact O-CB 3.32Å; Q655-H658 PolarHBondContact O-N 3.34Å; Q655-I659 WeakPolarHBondContact O-CG1 3.4Å; Q655-I659 PolarHBondContact O-N 3.37Å; Q655-L691 HydrophobicContact CB-CD1 4.15Å; Q655-L691 HydrophobicContact CG-CD1 3.96Å
656	M	93.9	Very high	84	Confident	5 Å²	5	41.8 Å²	41.8	3%	0.025	24%	0.236	C	C	.	.	H	α-helix	trans	-60.1	-46.6	173.6	-69.8	-173.1	173.2	0	0	112.1	L651 G652 L653 H658 I659 A660 I749 F750 Y752	L651-M656 HydrophobicContact CB-CE 4.21Å; L651-M656 HydrophobicContact CB-CG 4.07Å; G652-M656 PolarHBondContact O-N 3.45Å; L653-M656 PolarHBondContact O-N 3.16Å; M656-H658 VanDerWaalsContact C-N 3.31Å; M656-H658 PolarHBondContact O-N 3.02Å; M656-I659 PolarHBondContact O-N 3.22Å; M656-A660 WeakPolarHBondContact O-CB 3.5Å; M656-A660 PolarHBondContact O-N 2.9Å; M656-I749 HydrophobicContact CB-CG2 3.76Å; M656-I749 HydrophobicContact CG-CG2 3.96Å; M656-I749 HydrophobicContact SD-CG2 4.44Å; M656-F750 HydrophobicContact CB-CE1 4.3Å; M656-F750 HydrophobicContact CB-CE2 4.21Å; M656-F750 HydrophobicContact CB-CZ 3.9Å; M656-F750 HydrophobicContact SD-CD1 3.72Å; M656-F750 HydrophobicContact SD-CE1 3.73Å; M656-F750 HydrophobicContact SD-CG 4.23Å; M656-F750 HydrophobicContact SD-CZ 4.23Å; M656-Y752 HydrophobicContact CE-CD1 4.09Å; M656-Y752 HydrophobicContact CE-CD2 4.21Å; M656-Y752 HydrophobicContact CE-CE1 3.41Å; M656-Y752 VanDerWaalsContact CE-CE1 3.41Å; M656-Y752 HydrophobicContact CE-CE2 3.58Å; M656-Y752 HydrophobicContact CE-CG 4.48Å; M656-Y752 WeakPolarHBondContact CE-OH 3.29Å
657	L	92.9	Very high	86.8	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-34.3	175.9	-72.2	168.8	0	0	0	112.2	L653 S661 F750 V785 L810 L813	L653-L657 HydrophobicContact CD1-CD1 3.9Å; L653-L657 HydrophobicContact CD1-CG 4.04Å; L653-L657 HydrophobicContact CG-CD1 3.9Å; L653-L657 HydrophobicContact CG-CG 4.48Å; L653-L657 WeakPolarHBondContact O-CB 3.4Å; L653-L657 VanDerWaalsContact O-CG 3.28Å; L653-L657 WeakPolarHBondContact O-CG 3.09Å; L653-L657 PolarHBondContact O-N 3.37Å; L657-S661 VanDerWaalsContact O-CB 3.29Å; L657-S661 WeakPolarHBondContact O-CB 3.34Å; L657-S661 PolarHBondContact O-N 3.1Å; L657-S661 PolarHBondContact O-OG 3.16Å; L657-F750 HydrophobicContact CD2-CZ 4.33Å; L657-F750 HydrophobicContact CG-CZ 4.46Å; L657-V785 HydrophobicContact CD2-CG2 3.82Å; L657-L810 HydrophobicContact CD2-CD2 4.03Å; L657-L813 HydrophobicContact CD1-CB 3.96Å; L657-L813 HydrophobicContact CD2-CB 4.13Å
658	H	91	Very high	89.2	Confident	91 Å²	91	32.5 Å²	32.5	42%	0.421	19%	0.188	S	C	.	.	H	α-helix	trans	-66	-46.9	174.1	-176.3	55.2	0	0	0	111.7	S654 Q655 M656 A660 S661 Q662	S654-H658 VanDerWaalsContact O-CB 3.29Å; S654-H658 WeakPolarHBondContact O-CB 3.48Å; S654-H658 PolarHBondContact O-N 3.01Å; Q655-H658 WeakPolarHBondContact O-CB 3.32Å; Q655-H658 PolarHBondContact O-N 3.34Å; M656-H658 VanDerWaalsContact C-N 3.31Å; M656-H658 PolarHBondContact O-N 3.02Å; H658-A660 PolarHBondContact O-N 2.93Å; H658-S661 PolarHBondContact O-N 3.22Å; H658-Q662 PolarHBondContact CD2-NE2 2.55Å; H658-Q662 PolarHBondContact NE2-NE2 3.34Å; H658-Q662 VanDerWaalsContact O-CG 3.3Å; H658-Q662 WeakPolarHBondContact O-CG 3.25Å; H658-Q662 PolarHBondContact O-N 3.4Å; H658-Q662 PolarHBondContact O-NE2 2.85Å
659	I	96.1	Very high	91.2	Very high	0 Å²	0	28 Å²	28	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-55.9	-50.9	173.1	-70.1	165.6	0	0	0	110.5	L625 L651 Q655 M656 S661 Q662 I663 V693 I749	L625-I659 HydrophobicContact CD1-CD1 4.43Å; L625-I659 HydrophobicContact CD1-CG2 4.01Å; L625-I659 HydrophobicContact CD2-CG2 3.76Å; L651-I659 HydrophobicContact CD1-CD1 4.14Å; Q655-I659 WeakPolarHBondContact O-CG1 3.4Å; Q655-I659 PolarHBondContact O-N 3.37Å; M656-I659 PolarHBondContact O-N 3.22Å; I659-S661 VanDerWaalsContact C-N 3.35Å; I659-S661 PolarHBondContact O-N 3.19Å; I659-Q662 PolarHBondContact O-N 2.97Å; I659-I663 HydrophobicContact CG2-CD1 4.14Å; I659-I663 WeakPolarHBondContact O-CG1 3.47Å; I659-I663 PolarHBondContact O-N 2.96Å; I659-V693 HydrophobicContact CB-CG2 4.4Å; I659-V693 HydrophobicContact CG1-CG2 3.99Å; I659-V693 HydrophobicContact CG2-CG2 4.14Å; I659-I749 HydrophobicContact CG2-CD1 3.81Å; I659-I749 HydrophobicContact CG2-CG1 4.17Å
660	A	97.6	Very high	92.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.2	-41.7	179.3	0	0	0	0	0	112.8	M656 H658 Q662 I663 A664 L746 I749 L810	M656-A660 WeakPolarHBondContact O-CB 3.5Å; M656-A660 PolarHBondContact O-N 2.9Å; H658-A660 PolarHBondContact O-N 2.93Å; A660-Q662 PolarHBondContact O-N 2.83Å; A660-I663 PolarHBondContact O-N 3.39Å; A660-A664 WeakPolarHBondContact O-CB 3.36Å; A660-A664 PolarHBondContact O-N 3.12Å; A660-L746 HydrophobicContact CB-CD2 3.56Å; A660-I749 HydrophobicContact CB-CD1 4.01Å; A660-L810 HydrophobicContact CB-CD1 4.11Å
661	S	96.3	Very high	93.1	Very high	8 Å²	8	21.7 Å²	21.7	6%	0.056	13%	0.126	C	C	.	.	H	α-helix	trans	-64.8	-38.1	178.4	-61	0	0	0	0	112.4	L657 H658 I659 A664 S665 Y807	L657-S661 VanDerWaalsContact O-CB 3.29Å; L657-S661 WeakPolarHBondContact O-CB 3.34Å; L657-S661 PolarHBondContact O-N 3.1Å; L657-S661 PolarHBondContact O-OG 3.16Å; H658-S661 PolarHBondContact O-N 3.22Å; I659-S661 VanDerWaalsContact C-N 3.35Å; I659-S661 PolarHBondContact O-N 3.19Å; S661-A664 PolarHBondContact O-N 3.42Å; S661-S665 WeakPolarHBondContact O-CB 3.26Å; S661-S665 PolarHBondContact O-N 2.78Å; S661-Y807 WeakPolarHBondContact O-CD2 3.46Å; S661-Y807 WeakPolarHBondContact O-CE2 3.42Å
662	Q	97.1	Very high	93.2	Very high	10 Å²	10	23.8 Å²	23.8	5%	0.047	14%	0.142	C	C	.	.	H	α-helix	trans	-65.7	-45.3	177.1	-71	-179.2	84.3	0	0	111.8	H599 H658 I659 A660 S665 G666 L691 V693	H599-Q662 VanDerWaalsContact CB-O 3.29Å; H599-Q662 WeakPolarHBondContact CB-O 3.2Å; H599-Q662 VanDerWaalsContact CE1-CG 3.42Å; H599-Q662 WeakPolarHBondContact CE1-CG 3.45Å; H599-Q662 PolarHBondContact CE1-OE1 2.98Å; H658-Q662 PolarHBondContact CD2-NE2 2.55Å; H658-Q662 PolarHBondContact NE2-NE2 3.34Å; H658-Q662 VanDerWaalsContact O-CG 3.3Å; H658-Q662 WeakPolarHBondContact O-CG 3.25Å; H658-Q662 PolarHBondContact O-N 3.4Å; H658-Q662 PolarHBondContact O-NE2 2.85Å; I659-Q662 PolarHBondContact O-N 2.97Å; A660-Q662 PolarHBondContact O-N 2.83Å; Q662-S665 WeakPolarHBondContact O-CB 3.34Å; Q662-S665 PolarHBondContact O-N 3.19Å; Q662-G666 PolarHBondContact O-N 3.05Å; Q662-L691 PolarHBondContact NE2-O 2.75Å; Q662-V693 HydrophobicContact CB-CB 4.28Å
663	I	98.1	Very high	93.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-63	-45.6	175.8	-60.2	167.9	0	0	0	110.2	L625 I659 A660 S665 G666 M667 V693 I695 F742 I745 I749	L625-I663 HydrophobicContact CD2-CD1 3.65Å; I659-I663 HydrophobicContact CG2-CD1 4.14Å; I659-I663 WeakPolarHBondContact O-CG1 3.47Å; I659-I663 PolarHBondContact O-N 2.96Å; A660-I663 PolarHBondContact O-N 3.39Å; I663-S665 VanDerWaalsContact C-N 3.29Å; I663-S665 PolarHBondContact O-N 3.48Å; I663-G666 PolarHBondContact O-N 3.27Å; I663-G666 VanDerWaalsContact O-N 3.14Å; I663-M667 WeakPolarHBondContact O-CG 3.29Å; I663-M667 PolarHBondContact O-N 2.92Å; I663-V693 HydrophobicContact CD1-CG1 4.1Å; I663-V693 HydrophobicContact CG1-CG1 3.72Å; I663-I695 HydrophobicContact CG2-CD1 4.24Å; I663-I695 HydrophobicContact CG2-CG1 4.24Å; I663-F742 HydrophobicContact CB-CE2 4.01Å; I663-F742 HydrophobicContact CG2-CD2 3.9Å; I663-F742 HydrophobicContact CG2-CE2 3.77Å; I663-I745 HydrophobicContact CD1-CG2 3.79Å; I663-I745 HydrophobicContact CG2-CD1 4.32Å; I663-I749 HydrophobicContact CD1-CD1 4.26Å
664	A	98	Very high	93	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-40.2	175.8	0	0	0	0	0	112.2	A660 S661 M667 V668 F742 I803 Y807 L810	A660-A664 WeakPolarHBondContact O-CB 3.36Å; A660-A664 PolarHBondContact O-N 3.12Å; S661-A664 PolarHBondContact O-N 3.42Å; A664-M667 PolarHBondContact O-N 3.21Å; A664-V668 WeakPolarHBondContact O-CG2 3.47Å; A664-V668 PolarHBondContact O-N 3.47Å; A664-F742 HydrophobicContact CB-CE1 4.47Å; A664-F742 HydrophobicContact CB-CE2 3.98Å; A664-F742 HydrophobicContact CB-CZ 3.75Å; A664-I803 HydrophobicContact CB-CD1 4.32Å; A664-Y807 HydrophobicContact CB-CD2 4.2Å; A664-L810 HydrophobicContact CB-CD1 4.3Å
665	S	97.6	Very high	92.8	Very high	18 Å²	18	31 Å²	31	13%	0.126	16%	0.158	C	C	.	.	H	α-helix	trans	-62.1	-44.1	174.3	-173.3	0	0	0	0	112.3	H597 H599 S661 Q662 I663 M667 V668 Y669	H597-S665 PolarHBondContact CE1-O 3.25Å; H599-S665 PolarHBondContact CD2-OG 3.26Å; S661-S665 WeakPolarHBondContact O-CB 3.26Å; S661-S665 PolarHBondContact O-N 2.78Å; Q662-S665 WeakPolarHBondContact O-CB 3.34Å; Q662-S665 PolarHBondContact O-N 3.19Å; I663-S665 VanDerWaalsContact C-N 3.29Å; I663-S665 PolarHBondContact O-N 3.48Å; S665-M667 VanDerWaalsContact C-N 3.34Å; S665-M667 PolarHBondContact O-N 3.42Å; S665-V668 PolarHBondContact O-N 3.44Å; S665-Y669 PolarHBondContact O-N 2.87Å
666	G	95.8	Very high	92.5	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-43.7	172.3	0	0	0	0	0	112.7	Q662 I663 Y669 L670	Q662-G666 PolarHBondContact O-N 3.05Å; I663-G666 PolarHBondContact O-N 3.27Å; I663-G666 VanDerWaalsContact O-N 3.14Å; G666-Y669 WeakPolarHBondContact O-CB 3.44Å; G666-Y669 PolarHBondContact O-N 2.88Å; G666-L670 PolarHBondContact O-N 3.32Å
667	M	96.4	Very high	92.3	Very high	9 Å²	9	28.8 Å²	28.8	4%	0.044	15%	0.149	C	C	.	.	H	α-helix	trans	-70	-34.6	177.1	-67.2	-179.7	66	0	0	114.1	I663 A664 S665 Y669 L670 A671 L680 I695 D738 F742 I803	I663-M667 WeakPolarHBondContact O-CG 3.29Å; I663-M667 PolarHBondContact O-N 2.92Å; A664-M667 PolarHBondContact O-N 3.21Å; S665-M667 VanDerWaalsContact C-N 3.34Å; S665-M667 PolarHBondContact O-N 3.42Å; M667-Y669 PolarHBondContact O-N 3.33Å; M667-L670 PolarHBondContact O-N 3.3Å; M667-A671 WeakPolarHBondContact O-CB 3.3Å; M667-A671 PolarHBondContact O-N 3.09Å; M667-L680 HydrophobicContact CE-CD2 3.77Å; M667-L680 HydrophobicContact CG-CD1 4.4Å; M667-L680 HydrophobicContact CG-CD2 4.17Å; M667-L680 HydrophobicContact SD-CD2 3.35Å; M667-L680 WeakPolarHBondContact SD-CD2 3.47Å; M667-I695 HydrophobicContact CG-CD1 3.74Å; M667-D738 HydrophobicContact CE-CB 3.79Å; M667-D738 WeakPolarHBondContact CE-O 3.32Å; M667-F742 HydrophobicContact CE-CB 3.91Å; M667-F742 HydrophobicContact SD-CB 3.61Å; M667-F742 HydrophobicContact SD-CD2 3.38Å; M667-F742 WeakPolarHBondContact SD-CD2 3.43Å; M667-F742 HydrophobicContact SD-CE2 4.33Å; M667-F742 HydrophobicContact SD-CG 3.71Å; M667-I803 HydrophobicContact CB-CD1 4.04Å; M667-I803 HydrophobicContact CB-CG1 3.61Å; M667-I803 HydrophobicContact CE-CD1 3.83Å; M667-I803 HydrophobicContact CE-CG1 4.12Å; M667-I803 HydrophobicContact SD-CD1 3.75Å; M667-I803 HydrophobicContact SD-CG1 4.31Å
668	V	96.7	Very high	91.9	Very high	32 Å²	32	33.6 Å²	33.6	19%	0.194	17%	0.168	C	C	.	.	H	α-helix	trans	-56.6	-40.4	171.7	165	0	0	0	0	110.2	A664 S665 S672 I803 K804	A664-V668 WeakPolarHBondContact O-CG2 3.47Å; A664-V668 PolarHBondContact O-N 3.47Å; S665-V668 PolarHBondContact O-N 3.44Å; V668-S672 WeakPolarHBondContact O-CB 3.49Å; V668-S672 PolarHBondContact O-N 2.06Å; V668-S672 VanDerWaalsContact O-N 3.14Å; V668-I803 HydrophobicContact CG2-CG1 4.2Å; V668-I803 HydrophobicContact CG2-CG2 4.05Å; V668-K804 HydrophobicContact CB-CG 4.46Å; V668-K804 HydrophobicContact CG1-CG 3.87Å; V668-K804 HydrophobicContact CG2-CB 4.39Å; V668-K804 HydrophobicContact CG2-CG 3.85Å
669	Y	95.2	Very high	91.7	Very high	32 Å²	32	30.3 Å²	30.3	13%	0.125	15%	0.153	C	C	.	.	H	α-helix	trans	-65.9	-51.8	173.4	172	-99.2	0	0	0	112.1	N594 L595 Q596 H597 I600 S665 G666 M667 A671 S672 Q673	N594-Y669 PolarHBondContact O-OH 3.49Å; L595-Y669 WeakPolarHBondContact CA-OH 3.34Å; L595-Y669 HydrophobicContact CD2-CE1 4.05Å; Q596-Y669 PolarHBondContact N-OH 3.45Å; Q596-Y669 PolarHBondContact O-OH 2.96Å; H597-Y669 HydrophobicContact CB-CD1 3.48Å; H597-Y669 VanDerWaalsContact CB-CD1 3.48Å; H597-Y669 HydrophobicContact CB-CD2 3.85Å; H597-Y669 HydrophobicContact CB-CE1 3.75Å; H597-Y669 HydrophobicContact CB-CE2 4.1Å; H597-Y669 HydrophobicContact CB-CG 3.52Å; H597-Y669 AromaticContact CD2-CD2 3.88Å; H597-Y669 AromaticContact CD2-CG 3.86Å; H597-Y669 AromaticContact CG-CD1 3.97Å; H597-Y669 AromaticContact CG-CD2 3.96Å; H597-Y669 AromaticContact CG-CG 3.57Å; I600-Y669 HydrophobicContact CG1-CD1 3.83Å; I600-Y669 HydrophobicContact CG1-CE1 4.24Å; S665-Y669 PolarHBondContact O-N 2.87Å; G666-Y669 WeakPolarHBondContact O-CB 3.44Å; G666-Y669 PolarHBondContact O-N 2.88Å; M667-Y669 PolarHBondContact O-N 3.33Å; Y669-A671 VanDerWaalsContact C-N 3.34Å; Y669-A671 PolarHBondContact O-N 3.32Å; Y669-S672 WeakPolarHBondContact O-CA 3.32Å; Y669-S672 WeakPolarHBondContact O-CB 3.37Å; Y669-S672 PolarHBondContact O-N 3.33Å; Y669-S672 PolarHBondContact O-OG 2.66Å; Y669-Q673 HydrophobicContact CD2-CG 4.43Å; Y669-Q673 HydrophobicContact CE1-CG 4.12Å; Y669-Q673 HydrophobicContact CE2-CG 3.93Å; Y669-Q673 PolarHBondContact O-N 3.31Å; Y669-Q673 VanDerWaalsContact O-N 3.14Å
670	L	89.1	Confident	91.5	Very high	7 Å²	7	30.4 Å²	30.4	4%	0.037	15%	0.154	C	C	.	.	H	α-helix	trans	-56.6	-46.1	179.4	-64.7	179.3	0	0	0	112.4	L595 I600 G666 M667 S672 Q673 H674 F675 I695	L595-L670 HydrophobicContact CD1-CD2 4.36Å; L595-L670 HydrophobicContact CD2-CD2 4.18Å; I600-L670 HydrophobicContact CD1-CD1 4.01Å; I600-L670 HydrophobicContact CD1-CD2 3.79Å; I600-L670 HydrophobicContact CD1-CG 3.82Å; I600-L670 HydrophobicContact CG1-CD2 4.35Å; G666-L670 PolarHBondContact O-N 3.32Å; M667-L670 PolarHBondContact O-N 3.3Å; L670-S672 VanDerWaalsContact C-N 3.26Å; L670-S672 PolarHBondContact O-N 3.4Å; L670-Q673 CarbonylContact O-C 3.58Å; L670-Q673 WeakPolarHBondContact O-CA 3.49Å; L670-Q673 PolarHBondContact O-N 2.88Å; L670-H674 PolarHBondContact O-N 2.75Å; L670-F675 HydrophobicContact CB-CB 4.3Å; L670-F675 HydrophobicContact CB-CD1 4.33Å; L670-F675 HydrophobicContact CD1-CD1 4.23Å; L670-F675 HydrophobicContact CD2-CB 4.41Å; L670-F675 HydrophobicContact CD2-CD1 3.82Å; L670-F675 HydrophobicContact CD2-CG 4.38Å; L670-F675 HydrophobicContact CG-CD1 4.33Å; L670-F675 PolarHBondContact O-N 3.37Å; L670-I695 HydrophobicContact CD1-CD1 4.27Å
671	A	87.8	Confident	91.3	Very high	24 Å²	24	30.4 Å²	30.4	20%	0.198	15%	0.154	C	C	.	.	H	α-helix	trans	-61.3	-32.9	175.6	0	0	0	0	0	112.7	M667 Y669 Q673 H674 T735 I803	M667-A671 WeakPolarHBondContact O-CB 3.3Å; M667-A671 PolarHBondContact O-N 3.09Å; Y669-A671 VanDerWaalsContact C-N 3.34Å; Y669-A671 PolarHBondContact O-N 3.32Å; A671-Q673 VanDerWaalsContact C-N 3.3Å; A671-Q673 PolarHBondContact O-N 3.3Å; A671-H674 PolarHBondContact O-N 3.38Å; A671-T735 HydrophobicContact CB-CG2 3.68Å; A671-I803 HydrophobicContact CB-CG2 4.17Å
672	S	89.3	Confident	91.2	Very high	53 Å²	53	30 Å²	30	37%	0.371	15%	0.151	S	C	.	.	H	α-helix	trans	-69.8	-25.1	174.2	81.6	0	0	0	0	113.7	V668 Y669 L670 H674	V668-S672 WeakPolarHBondContact O-CB 3.49Å; V668-S672 PolarHBondContact O-N 2.06Å; V668-S672 VanDerWaalsContact O-N 3.14Å; Y669-S672 WeakPolarHBondContact O-CA 3.32Å; Y669-S672 WeakPolarHBondContact O-CB 3.37Å; Y669-S672 PolarHBondContact O-N 3.33Å; Y669-S672 PolarHBondContact O-OG 2.66Å; L670-S672 VanDerWaalsContact C-N 3.26Å; L670-S672 PolarHBondContact O-N 3.4Å; S672-H674 VanDerWaalsContact C-N 3.3Å
673	Q	85.5	Confident	90.9	Very high	82 Å²	82	29.7 Å²	29.7	38%	0.383	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	10.1	174	-55.6	-50.5	-71.4	0	0	112	L595 Y669 L670 A671 F675	L595-Q673 HydrophobicContact CD2-CB 4.18Å; L595-Q673 HydrophobicContact CD2-CG 4.18Å; Y669-Q673 HydrophobicContact CD2-CG 4.43Å; Y669-Q673 HydrophobicContact CE1-CG 4.12Å; Y669-Q673 HydrophobicContact CE2-CG 3.93Å; Y669-Q673 PolarHBondContact O-N 3.31Å; Y669-Q673 VanDerWaalsContact O-N 3.14Å; L670-Q673 CarbonylContact O-C 3.58Å; L670-Q673 WeakPolarHBondContact O-CA 3.49Å; L670-Q673 PolarHBondContact O-N 2.88Å; A671-Q673 VanDerWaalsContact C-N 3.3Å; A671-Q673 PolarHBondContact O-N 3.3Å; Q673-F675 PolarHBondContact O-N 2.95Å; Q673-F675 VanDerWaalsContact O-N 3.14Å
674	H	82.5	Confident	90.5	Very high	161 Å²	161	30.3 Å²	30.3	75%	0.745	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	27.6	-172.5	-58.5	-68.2	0	0	0	114	L670 A671 S672	L670-H674 PolarHBondContact O-N 2.75Å; A671-H674 PolarHBondContact O-N 3.38Å; S672-H674 VanDerWaalsContact C-N 3.3Å
675	F	82.4	Confident	90.3	Very high	37 Å²	37	30.3 Å²	30.3	16%	0.162	15%	0.152	C	C	.	.			trans	-91.4	136.2	178.8	-169.4	-96.6	0	0	0	111	L591 L595 L670 Q673	L591-F675 HydrophobicContact CD1-CD2 4.05Å; L591-F675 HydrophobicContact CD1-CE2 3.9Å; L591-F675 HydrophobicContact CD2-CE2 3.63Å; L591-F675 HydrophobicContact CD2-CZ 4.14Å; L591-F675 HydrophobicContact CG-CE2 4.26Å; L595-F675 HydrophobicContact CD1-CD1 4.4Å; L595-F675 HydrophobicContact CD1-CD2 4.18Å; L595-F675 HydrophobicContact CD1-CE1 4.45Å; L595-F675 HydrophobicContact CD1-CE2 4.27Å; L595-F675 HydrophobicContact CD1-CG 4.24Å; L595-F675 HydrophobicContact CD1-CZ 4.39Å; L670-F675 HydrophobicContact CB-CB 4.3Å; L670-F675 HydrophobicContact CB-CD1 4.33Å; L670-F675 HydrophobicContact CD1-CD1 4.23Å; L670-F675 HydrophobicContact CD2-CB 4.41Å; L670-F675 HydrophobicContact CD2-CD1 3.82Å; L670-F675 HydrophobicContact CD2-CG 4.38Å; L670-F675 HydrophobicContact CG-CD1 4.33Å; L670-F675 PolarHBondContact O-N 3.37Å; Q673-F675 PolarHBondContact O-N 2.95Å; Q673-F675 VanDerWaalsContact O-N 3.14Å
676	V	84.4	Confident	90.1	Very high	29 Å²	29	30.7 Å²	30.7	18%	0.176	15%	0.153	C	C	.	.			trans	-121.9	121	179	-177.1	0	0	0	0	108.3	R678 F733 T734 D738	V676-R678 HydrophobicContact CG1-CG 3.92Å; V676-F733 HydrophobicContact CG1-CB 4.24Å; V676-T734 WeakPolarHBondContact CG1-O 3.48Å; V676-D738 VanDerWaalsContact CA-OD2 3.3Å; V676-D738 WeakPolarHBondContact CA-OD2 3.32Å; V676-D738 WeakPolarHBondContact CG1-OD2 3.41Å
677	H	87.7	Confident	89.9	Confident	11 Å²	11	30.7 Å²	30.7	5%	0.051	15%	0.153	C	C	.	.			trans	-76.8	-41.6	-171.6	-170.8	-55.3	0	0	0	112.8	D679 L680 N684 I695 G696 D697 D738	H677-D679 PolarHBondContact CE1-O 2.88Å; H677-D679 VanDerWaalsContact ND1-C 3.29Å; H677-D679 PolarHBondContact ND1-N 2.96Å; H677-D679 PolarHBondContact O-N 2.93Å; H677-L680 HydrophobicContact CB-CB 4.35Å; H677-L680 HydrophobicContact CB-CD1 4.3Å; H677-L680 PolarHBondContact ND1-N 3.34Å; H677-N684 PolarHBondContact CE1-ND2 3.34Å; H677-I695 VanDerWaalsContact CD2-CG2 3.49Å; H677-I695 WeakPolarHBondContact CD2-CG2 3.34Å; H677-I695 WeakPolarHBondContact NE2-CG2 2.81Å; H677-G696 PolarHBondContact NE2-O 3.24Å; H677-D697 IonicContact CE1-OD1 2.75Å; H677-D697 VanDerWaalsContact NE2-CB 3.32Å; H677-D697 WeakPolarHBondContact NE2-CB 3.38Å; H677-D738 PolarHBondContact N-OD2 3.2Å
678	R	85.5	Confident	89.2	Confident	101 Å²	101	30.4 Å²	30.4	38%	0.381	15%	0.153	S	C	.	.	S	Bend	trans	67.9	-19.6	176.2	-41.9	179	-175.6	-175.4	-1.2	117	V676 F733 D738	V676-R678 HydrophobicContact CG1-CG 3.92Å; R678-F733 HydrophobicContact CB-CD1 3.83Å; R678-F733 HydrophobicContact CB-CE1 4.14Å; R678-F733 HydrophobicContact CB-CG 4.42Å; R678-F733 HydrophobicContact CG-CB 3.99Å; R678-F733 HydrophobicContact CG-CD1 3.9Å; R678-F733 HydrophobicContact CG-CG 4.02Å; R678-D738 PolarHBondContact N-OD1 2.78Å
679	D	87.1	Confident	88.4	Confident	23 Å²	23	31.1 Å²	31.1	12%	0.123	16%	0.162	C	C	.	.			trans	-129.8	43.4	173.6	-168.8	16.9	0	0	0	110.9	H677 A681 R683 N684 Y709 P719	H677-D679 PolarHBondContact CE1-O 2.88Å; H677-D679 VanDerWaalsContact ND1-C 3.29Å; H677-D679 PolarHBondContact ND1-N 2.96Å; H677-D679 PolarHBondContact O-N 2.93Å; D679-A681 PolarHBondContact O-N 2.88Å; D679-A681 VanDerWaalsContact O-N 3.16Å; D679-R683 IonicContact OD1-CZ 2.65Å; D679-R683 IonicContact OD1-NE 2.89Å; D679-R683 IonicContact OD1-NH2 2.69Å; D679-R683 PolarHBondContact OD1-NH2 2.81Å; D679-N684 VanDerWaalsContact CG-ND2 3.29Å; D679-N684 PolarHBondContact O-ND2 3.18Å; D679-N684 PolarHBondContact OD2-ND2 3.47Å; D679-N684 VanDerWaalsContact OD2-ND2 3.16Å; D679-Y709 WeakPolarHBondContact OD2-CE1 3.24Å; D679-Y709 PolarHBondContact OD2-OH 3.12Å; D679-P719 HydrophobicContact CB-CG 4.29Å; D679-P719 VanDerWaalsContact OD1-CB 3.25Å; D679-P719 WeakPolarHBondContact OD1-CB 3.43Å; D679-P719 WeakPolarHBondContact OD1-CG 3.35Å
680	L	91.9	Very high	87.7	Confident	1 Å²	1	37 Å²	37	1%	0.005	20%	0.195	C	C	.	.			trans	-74.9	105.1	-179.2	-167.5	87.7	0	0	0	110.4	M667 H677 I695 F742 I745	M667-L680 HydrophobicContact CE-CD2 3.77Å; M667-L680 HydrophobicContact CG-CD1 4.4Å; M667-L680 HydrophobicContact CG-CD2 4.17Å; M667-L680 HydrophobicContact SD-CD2 3.35Å; M667-L680 WeakPolarHBondContact SD-CD2 3.47Å; H677-L680 HydrophobicContact CB-CB 4.35Å; H677-L680 HydrophobicContact CB-CD1 4.3Å; H677-L680 PolarHBondContact ND1-N 3.34Å; L680-I695 HydrophobicContact CD1-CD1 4.17Å; L680-I695 HydrophobicContact CD1-CG2 3.88Å; L680-F742 HydrophobicContact CD2-CB 4.11Å; L680-I745 HydrophobicContact CD2-CD1 3.91Å; L680-I745 HydrophobicContact CG-CD1 3.69Å
681	A	93.8	Very high	87.5	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.202	C	C	.	.	S	Bend	trans	-146.6	163.3	179.3	0	0	0	0	0	110.9	D679 R683 N684 C685 W722	D679-A681 PolarHBondContact O-N 2.88Å; D679-A681 VanDerWaalsContact O-N 3.16Å; A681-R683 HydrophobicContact CB-CG 3.88Å; A681-R683 PolarHBondContact O-N 2.62Å; A681-N684 PolarHBondContact O-N 3.1Å; A681-C685 PolarHBondContact O-N 2.79Å; A681-W722 HydrophobicContact CB-CD2 4.1Å; A681-W722 HydrophobicContact CB-CG 4.13Å; A681-W722 HydrophobicContact CB-CZ2 4.28Å
682	T	94.4	Very high	87.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-62.6	-27.8	179.1	65.1	0	0	0	0	113.2	L625 N626 L629 N684 C685 I745 E748	L625-T682 WeakPolarHBondContact CB-O 3.33Å; L625-T682 HydrophobicContact CD2-CG2 3.99Å; L625-T682 HydrophobicContact CG-CG2 4.3Å; L625-T682 PolarHBondContact N-O 3.3Å; N626-T682 WeakPolarHBondContact CA-OG1 3.28Å; N626-T682 VanDerWaalsContact CB-OG1 3.25Å; N626-T682 WeakPolarHBondContact CB-OG1 3.4Å; N626-T682 PolarHBondContact N-O 2.81Å; N626-T682 PolarHBondContact ND2-OG1 3.33Å; L629-T682 HydrophobicContact CD1-CG2 3.81Å; T682-N684 PolarHBondContact O-N 3.23Å; T682-C685 PolarHBondContact O-N 3.04Å; T682-C685 VanDerWaalsContact O-N 3.12Å; T682-I745 HydrophobicContact CG2-CG1 4.29Å; T682-I745 HydrophobicContact CG2-CG2 4.14Å; T682-E748 HydrophobicContact CG2-CB 3.6Å; T682-E748 HydrophobicContact CG2-CG 4.26Å; T682-E748 PolarHBondContact N-OE2 2.56Å; T682-E748 VanDerWaalsContact N-OE2 3.09Å; T682-E748 VanDerWaalsContact OG1-CD 3.3Å; T682-E748 PolarHBondContact OG1-OE1 2.91Å
683	R	89.8	Confident	87.8	Confident	4 Å²	4	37 Å²	37	2%	0.015	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-62.1	-18.7	172.1	62.1	171.4	176.2	-75.7	-18.3	114.6	N626 D679 A681 Y705 D708 Y709 W722	N626-R683 HydrophobicContact CB-CB 4.34Å; D679-R683 IonicContact OD1-CZ 2.65Å; D679-R683 IonicContact OD1-NE 2.89Å; D679-R683 IonicContact OD1-NH2 2.69Å; D679-R683 PolarHBondContact OD1-NH2 2.81Å; A681-R683 HydrophobicContact CB-CG 3.88Å; A681-R683 PolarHBondContact O-N 2.62Å; R683-Y705 HydrophobicContact CB-CD2 3.67Å; R683-Y705 HydrophobicContact CB-CE2 3.56Å; R683-Y705 HydrophobicContact CB-CG 4.21Å; R683-Y705 HydrophobicContact CG-CD2 4.39Å; R683-D708 IonicContact CZ-OD2 3.16Å; R683-D708 IonicContact NH1-OD2 3.72Å; R683-D708 PolarHBondContact NH1-OD2 2.91Å; R683-Y709 PolarHBondContact NE-OH 3.13Å; R683-W722 VanDerWaalsContact NH1-CZ2 3.26Å
684	N	90.4	Very high	88.3	Confident	12 Å²	12	34 Å²	34	6%	0.064	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-107.6	4.1	178.6	-69.2	-23.2	0	0	0	112.3	H677 D679 A681 T682 G696	H677-N684 PolarHBondContact CE1-ND2 3.34Å; D679-N684 VanDerWaalsContact CG-ND2 3.29Å; D679-N684 PolarHBondContact O-ND2 3.18Å; D679-N684 PolarHBondContact OD2-ND2 3.47Å; D679-N684 VanDerWaalsContact OD2-ND2 3.16Å; A681-N684 PolarHBondContact O-N 3.1Å; T682-N684 PolarHBondContact O-N 3.23Å; N684-G696 CarbonylContact O-C 3.48Å; N684-G696 PolarHBondContact O-N 3.49Å
685	C	93.8	Very high	88.8	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140.8	166.9	-61.6	0	0	0	0	109.2	D624 L625 A681 T682 V693 K694	D624-C685 CarbonylContact C-O 3.58Å; D624-C685 WeakPolarHBondContact CA-O 3.48Å; L625-C685 HydrophobicContact CB-CB 3.87Å; L625-C685 HydrophobicContact CD2-CB 3.93Å; L625-C685 PolarHBondContact N-O 3.02Å; A681-C685 PolarHBondContact O-N 2.79Å; T682-C685 PolarHBondContact O-N 3.04Å; T682-C685 VanDerWaalsContact O-N 3.12Å; C685-V693 HydrophobicContact CB-CG1 4.23Å; C685-K694 CarbonylContact C-O 3.5Å; C685-K694 WeakPolarHBondContact CA-O 3.45Å
686	L	93	Very high	88.9	Confident	26 Å²	26	25.2 Å²	25.2	14%	0.136	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	149.8	178.8	-60.8	-175.3	0	0	0	111.6	V601 M620 G623 D624 V693 K694 M700	V601-L686 HydrophobicContact CG1-CD1 4.33Å; V601-L686 HydrophobicContact CG2-CB 4.22Å; V601-L686 HydrophobicContact CG2-CD1 3.85Å; V601-L686 HydrophobicContact CG2-CG 4.18Å; M620-L686 HydrophobicContact CB-CB 3.68Å; M620-L686 HydrophobicContact CB-CD1 4.05Å; M620-L686 HydrophobicContact CB-CG 4.46Å; M620-L686 HydrophobicContact CE-CB 4.06Å; M620-L686 VanDerWaalsContact CE-O 3.3Å; M620-L686 WeakPolarHBondContact CE-O 3.46Å; M620-L686 HydrophobicContact CG-CB 3.71Å; M620-L686 HydrophobicContact CG-CD1 3.9Å; M620-L686 HydrophobicContact CG-CG 4.48Å; G623-L686 CarbonylContact O-C 3.5Å; G623-L686 WeakPolarHBondContact O-CA 3.16Å; D624-L686 HydrophobicContact CB-CD2 4.27Å; L686-V693 WeakPolarHBondContact O-CA 3.3Å; L686-K694 PolarHBondContact N-O 3.22Å; L686-K694 PolarHBondContact O-N 3.07Å; L686-M700 HydrophobicContact CD1-CE 4.19Å
687	V	91.3	Very high	88.1	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.5	-177.1	-171	0	0	0	0	110.9	M620 H622 G623 L625 F628 V693	M620-V687 CarbonylContact C-O 3.56Å; M620-V687 VanDerWaalsContact C-O 3.3Å; H622-V687 WeakPolarHBondContact CA-O 3.44Å; H622-V687 HydrophobicContact CB-CB 3.84Å; H622-V687 HydrophobicContact CB-CG1 3.92Å; H622-V687 WeakPolarHBondContact CB-O 3.49Å; H622-V687 PolarHBondContact N-O 3.22Å; G623-V687 PolarHBondContact O-N 2.93Å; L625-V687 HydrophobicContact CB-CG2 3.89Å; L625-V687 HydrophobicContact CD1-CG2 3.68Å; L625-V687 HydrophobicContact CG-CG2 4.39Å; F628-V687 HydrophobicContact CB-CG2 4.04Å; F628-V687 HydrophobicContact CD1-CG2 4.39Å; F628-V687 HydrophobicContact CD2-CB 4.43Å; F628-V687 HydrophobicContact CD2-CG1 4.14Å; F628-V687 HydrophobicContact CE2-CG1 4.16Å; F628-V687 HydrophobicContact CG-CB 4.45Å; F628-V687 HydrophobicContact CG-CG1 4.32Å; F628-V687 HydrophobicContact CG-CG2 4.07Å; F628-V687 HydrophobicContact CZ-CG1 4.4Å; V687-V693 HydrophobicContact CG2-CG2 4.29Å
688	G	82.1	Confident	86.4	Confident	4 Å²	4	26 Å²	26	4%	0.041	14%	0.139	C	C	.	.			trans	-101.8	-159.2	-179.5	0	0	0	0	0	112.7	M620 H622 L692	M620-G688 VanDerWaalsContact CE-N 3.35Å; H622-G688 PolarHBondContact CD2-O 2.88Å; G688-L692 PolarHBondContact N-O 3.34Å
689	A	78.6	Confident	84.8	Confident	47 Å²	47	21.5 Å²	21.5	39%	0.388	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-66.1	153.6	171.9	0	0	0	0	0	112	L691 L692	A689-L691 VanDerWaalsContact C-N 3.27Å; A689-L691 PolarHBondContact O-N 2.58Å; A689-L692 WeakPolarHBondContact O-CB 3.46Å; A689-L692 PolarHBondContact O-N 2.79Å
690	N	80.4	Confident	82.9	Confident	154 Å²	154	22.8 Å²	22.8	82%	0.824	13%	0.129	S	C	*	.	G	3₁₀ helix	trans	55.1	36.2	172.5	-53.7	-8.8	0	0	0	114.4	L692	N690-L692 PolarHBondContact O-N 3.01Å
691	L	85.3	Confident	80.8	Confident	34 Å²	34	23.4 Å²	23.4	18%	0.178	13%	0.133	C	C	.	.	G	3₁₀ helix	trans	57.7	24.4	-174.6	-63	174.8	0	0	0	114.5	F628 Q655 Q662 A689 V693	F628-L691 HydrophobicContact CE1-CD2 3.68Å; F628-L691 HydrophobicContact CZ-CD2 3.46Å; F628-L691 VanDerWaalsContact CZ-CD2 3.46Å; Q655-L691 HydrophobicContact CB-CD1 4.15Å; Q655-L691 HydrophobicContact CG-CD1 3.96Å; Q662-L691 PolarHBondContact NE2-O 2.75Å; A689-L691 VanDerWaalsContact C-N 3.27Å; A689-L691 PolarHBondContact O-N 2.58Å; L691-V693 PolarHBondContact O-N 3.28Å
692	L	89.6	Confident	79	Confident	51 Å²	51	26.6 Å²	26.6	27%	0.267	15%	0.146	S	C	.	.			trans	-63.2	116.3	169.5	178.1	59.3	0	0	0	109.7	G688 A689 N690 K694	G688-L692 PolarHBondContact N-O 3.34Å; A689-L692 WeakPolarHBondContact O-CB 3.46Å; A689-L692 PolarHBondContact O-N 2.79Å; N690-L692 PolarHBondContact O-N 3.01Å; L692-K694 HydrophobicContact CG-CG 4.33Å
693	V	95.3	Very high	76.9	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.3	178	-179.8	0	0	0	0	110	H599 L625 I659 Q662 I663 C685 L686 V687 L691	H599-V693 PolarHBondContact ND1-O 3.02Å; L625-V693 HydrophobicContact CD2-CG1 4.15Å; I659-V693 HydrophobicContact CB-CG2 4.4Å; I659-V693 HydrophobicContact CG1-CG2 3.99Å; I659-V693 HydrophobicContact CG2-CG2 4.14Å; Q662-V693 HydrophobicContact CB-CB 4.28Å; I663-V693 HydrophobicContact CD1-CG1 4.1Å; I663-V693 HydrophobicContact CG1-CG1 3.72Å; C685-V693 HydrophobicContact CB-CG1 4.23Å; L686-V693 WeakPolarHBondContact O-CA 3.3Å; V687-V693 HydrophobicContact CG2-CG2 4.29Å; L691-V693 PolarHBondContact O-N 3.28Å
694	K	95.4	Very high	75.2	Confident	19 Å²	19	35.6 Å²	35.6	8%	0.083	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	144.6	179.2	-53	-169.9	178.3	-160.6	0	111.3	E598 H599 V601 E618 M620 C685 L686 L692	E598-K694 WeakPolarHBondContact O-CD 3.48Å; E598-K694 WeakPolarHBondContact O-CE 3.28Å; E598-K694 PolarHBondContact O-NZ 3.21Å; H599-K694 CarbonylContact O-C 3.4Å; H599-K694 WeakPolarHBondContact O-CA 3.37Å; V601-K694 HydrophobicContact CG2-CB 3.78Å; E618-K694 WeakPolarHBondContact OE1-CD 3.48Å; E618-K694 VanDerWaalsContact OE1-CE 3.31Å; E618-K694 WeakPolarHBondContact OE1-CE 3.2Å; E618-K694 IonicContact OE1-NZ 3.86Å; E618-K694 PolarHBondContact OE1-NZ 3.39Å; E618-K694 IonicContact OE2-NZ 2.66Å; E618-K694 PolarHBondContact OE2-NZ 3.24Å; M620-K694 HydrophobicContact CE-CB 3.97Å; M620-K694 HydrophobicContact CE-CD 3.92Å; M620-K694 HydrophobicContact CE-CG 3.67Å; M620-K694 HydrophobicContact SD-CD 4.19Å; C685-K694 CarbonylContact C-O 3.5Å; C685-K694 WeakPolarHBondContact CA-O 3.45Å; L686-K694 PolarHBondContact N-O 3.22Å; L686-K694 PolarHBondContact O-N 3.07Å; L692-K694 HydrophobicContact CG-CG 4.33Å
695	I	93.4	Very high	73.7	Confident	3 Å²	3	35.9 Å²	35.9	2%	0.015	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	131	173	-50.3	171.9	0	0	0	108.5	H599 I600 V601 I663 M667 L670 H677 L680	H599-I695 PolarHBondContact O-N 3.29Å; I600-I695 HydrophobicContact CD1-CB 3.94Å; I600-I695 HydrophobicContact CD1-CD1 4.17Å; I600-I695 HydrophobicContact CD1-CG1 4.41Å; V601-I695 WeakPolarHBondContact CG2-O 3.41Å; V601-I695 PolarHBondContact N-O 3.08Å; I663-I695 HydrophobicContact CG2-CD1 4.24Å; I663-I695 HydrophobicContact CG2-CG1 4.24Å; M667-I695 HydrophobicContact CG-CD1 3.74Å; L670-I695 HydrophobicContact CD1-CD1 4.27Å; H677-I695 VanDerWaalsContact CD2-CG2 3.49Å; H677-I695 WeakPolarHBondContact CD2-CG2 3.34Å; H677-I695 WeakPolarHBondContact NE2-CG2 2.81Å; L680-I695 HydrophobicContact CD1-CD1 4.17Å; L680-I695 HydrophobicContact CD1-CG2 3.88Å
696	G	82.9	Confident	72.4	Confident	10 Å²	10	39.2 Å²	39.2	10%	0.103	22%	0.221	C	C	.	.			trans	-121.6	170.3	167.9	0	0	0	0	0	111.3	H677 N684	H677-G696 PolarHBondContact NE2-O 3.24Å; N684-G696 CarbonylContact O-C 3.48Å; N684-G696 PolarHBondContact O-N 3.49Å
697	D	68.7	Low	71.2	Confident	40 Å²	40	42.5 Å²	42.5	21%	0.214	24%	0.242	C	C	.	.			trans	-158.3	78.4	171.3	-178.6	21.7	0	0	0	111.9	H677	H677-D697 IonicContact CE1-OD1 2.75Å; H677-D697 VanDerWaalsContact NE2-CB 3.32Å; H677-D697 WeakPolarHBondContact NE2-CB 3.38Å
698	F	51.5	Low	70.2	Confident	18 Å²	18	42.8 Å²	42.8	8%	0.079	24%	0.244	C	C	.	.	S	Bend	trans	-127.9	20.5	-180	-55	-58.7	0	0	0	114.1	K572 E588 L592 F617 M700	K572-F698 HydrophobicContact CD-CB 3.79Å; K572-F698 WeakPolarHBondContact CE-O 3.43Å; K572-F698 PolarHBondContact NZ-O 2.69Å; E588-F698 WeakPolarHBondContact OE1-CD1 3.31Å; L592-F698 HydrophobicContact CD1-CD1 3.98Å; L592-F698 HydrophobicContact CD1-CE1 3.17Å; L592-F698 HydrophobicContact CD1-CZ 3.65Å; L592-F698 HydrophobicContact CD2-CE1 3.47Å; L592-F698 VanDerWaalsContact CD2-CE1 3.47Å; L592-F698 HydrophobicContact CD2-CZ 3.36Å; L592-F698 HydrophobicContact CG-CE1 3.83Å; L592-F698 HydrophobicContact CG-CZ 4.07Å; F617-F698 HydrophobicContact CD1-CD2 4.08Å; F617-F698 AromaticContact CD1-CE2 3.86Å; F617-F698 HydrophobicContact CD1-CE2 3.86Å; F617-F698 HydrophobicContact CD1-CZ 4.5Å; F617-F698 HydrophobicContact CE1-CD1 4.06Å; F617-F698 AromaticContact CE1-CD2 3.46Å; F617-F698 HydrophobicContact CE1-CD2 3.46Å; F617-F698 VanDerWaalsContact CE1-CD2 3.46Å; F617-F698 AromaticContact CE1-CE1 3.95Å; F617-F698 HydrophobicContact CE1-CE1 3.95Å; F617-F698 AromaticContact CE1-CE2 3.23Å; F617-F698 HydrophobicContact CE1-CE2 3.23Å; F617-F698 AromaticContact CE1-CG 3.92Å; F617-F698 HydrophobicContact CE1-CG 3.92Å; F617-F698 AromaticContact CE1-CZ 3.55Å; F617-F698 HydrophobicContact CE1-CZ 3.55Å; F617-F698 HydrophobicContact CE2-CD2 4.13Å; F617-F698 HydrophobicContact CE2-CG 4.11Å; F617-F698 HydrophobicContact CZ-CB 4.42Å; F617-F698 AromaticContact CZ-CD1 3.62Å; F617-F698 HydrophobicContact CZ-CD1 3.62Å; F617-F698 AromaticContact CZ-CD2 3.5Å; F617-F698 HydrophobicContact CZ-CD2 3.5Å; F617-F698 AromaticContact CZ-CE1 3.94Å; F617-F698 HydrophobicContact CZ-CE1 3.94Å; F617-F698 AromaticContact CZ-CE2 3.75Å; F617-F698 HydrophobicContact CZ-CE2 3.75Å; F617-F698 AromaticContact CZ-CG 3.48Å; F617-F698 HydrophobicContact CZ-CG 3.48Å; F617-F698 VanDerWaalsContact CZ-CG 3.48Å; F617-F698 HydrophobicContact CZ-CZ 4Å; F698-M700 HydrophobicContact CB-CG 3.86Å; F698-M700 HydrophobicContact CB-SD 4.16Å; F698-M700 WeakPolarHBondContact O-CG 3.32Å; F698-M700 PolarHBondContact O-N 3.22Å; F698-M700 VanDerWaalsContact O-N 3.16Å
699	G	52.6	Low	69.9	Low	5 Å²	5	43.3 Å²	43.3	5%	0.052	25%	0.245	C	C	.	.			trans	54.5	33.6	173.8	0	0	0	0	0	115.1	S701	G699-S701 VanDerWaalsContact C-N 3.29Å; G699-S701 PolarHBondContact O-N 3.01Å
700	M	46.8	Very low	69.6	Low	50 Å²	50	44.9 Å²	44.9	25%	0.246	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.9	-170.8	-57.8	-164.8	-54.3	0	0	114.4	V552 L686 F698	V552-M700 HydrophobicContact CB-SD 4.34Å; V552-M700 HydrophobicContact CG1-SD 3.81Å; V552-M700 HydrophobicContact CG2-CB 3.81Å; V552-M700 HydrophobicContact CG2-CG 3.62Å; V552-M700 HydrophobicContact CG2-SD 3.59Å; V552-M700 VanDerWaalsContact CG2-SD 3.59Å; L686-M700 HydrophobicContact CD1-CE 4.19Å; F698-M700 HydrophobicContact CB-CG 3.86Å; F698-M700 HydrophobicContact CB-SD 4.16Å; F698-M700 WeakPolarHBondContact O-CG 3.32Å; F698-M700 PolarHBondContact O-N 3.22Å; F698-M700 VanDerWaalsContact O-N 3.16Å
701	S	48.2	Very low	69.3	Low	14 Å²	14	45 Å²	45	10%	0.098	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.8	4.7	-155.8	61.6	0	0	0	0	115	G699 D703 Y705	G699-S701 VanDerWaalsContact C-N 3.29Å; G699-S701 PolarHBondContact O-N 3.01Å; S701-D703 PolarHBondContact O-N 3.48Å; S701-Y705 WeakPolarHBondContact O-CD2 3.42Å; S701-Y705 PolarHBondContact O-N 2.84Å
702	R	54.7	Low	68.1	Low	67 Å²	67	45.8 Å²	45.8	25%	0.253	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-26.7	-166.3	-68.7	-158.4	-177.9	139.4	-0.3	115.8	A548 F549 S706 Y709	A548-R702 HydrophobicContact CB-CB 4.27Å; A548-R702 HydrophobicContact CB-CG 4.31Å; F549-R702 VanDerWaalsContact CE2-NH1 3.31Å; R702-S706 WeakPolarHBondContact O-CA 3.23Å; R702-S706 PolarHBondContact O-N 2.76Å; R702-Y709 HydrophobicContact CG-CE2 4.49Å
703	D	52.2	Low	66.5	Low	94 Å²	94	46.6 Å²	46.6	50%	0.503	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-41.1	-174.7	-62.3	-22.5	0	0	0	111.6	S701 S706	S701-D703 PolarHBondContact O-N 3.48Å; D703-S706 PolarHBondContact O-OG 3.16Å
704	V	52.1	Low	64.5	Low	100 Å²	100	48.4 Å²	48.4	61%	0.606	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-35.7	176.1	-179	0	0	0	0	112.1
705	Y	59.2	Low	62.3	Low	18 Å²	18	55.9 Å²	55.9	7%	0.071	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	27.2	-179.8	-59.2	-63.2	0	0	0	113.3	D624 N626 K627 R683 S701 T707 D708 Y709	D624-Y705 PolarHBondContact OD1-OH 3.1Å; D624-Y705 PolarHBondContact OD2-OH 3.45Å; N626-Y705 HydrophobicContact CB-CE1 4.46Å; K627-Y705 WeakPolarHBondContact CE-OH 3.37Å; K627-Y705 WeakPolarHBondContact CG-OH 3.42Å; R683-Y705 HydrophobicContact CB-CD2 3.67Å; R683-Y705 HydrophobicContact CB-CE2 3.56Å; R683-Y705 HydrophobicContact CB-CG 4.21Å; R683-Y705 HydrophobicContact CG-CD2 4.39Å; S701-Y705 WeakPolarHBondContact O-CD2 3.42Å; S701-Y705 PolarHBondContact O-N 2.84Å; Y705-T707 PolarHBondContact O-N 2.98Å; Y705-T707 VanDerWaalsContact O-N 3.1Å; Y705-D708 WeakPolarHBondContact O-CB 3.41Å; Y705-D708 PolarHBondContact O-N 2.85Å; Y705-Y709 WeakPolarHBondContact O-CD2 3.36Å
706	S	66.6	Low	61	Low	69 Å²	69	56.9 Å²	56.9	48%	0.483	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-57.8	-27.6	-175.6	50.9	0	0	0	0	114.2	R702 D703 D708	R702-S706 WeakPolarHBondContact O-CA 3.23Å; R702-S706 PolarHBondContact O-N 2.76Å; D703-S706 PolarHBondContact O-OG 3.16Å; S706-D708 VanDerWaalsContact C-N 3.33Å; S706-D708 PolarHBondContact O-N 3.02Å
707	T	68.8	Low	60.4	Low	95 Å²	95	59.7 Å²	59.7	58%	0.583	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-72.8	-17.7	175.5	52.7	0	0	0	0	114.7	Y705 Y709	Y705-T707 PolarHBondContact O-N 2.98Å; Y705-T707 VanDerWaalsContact O-N 3.1Å; T707-Y709 VanDerWaalsContact C-N 3.27Å; T707-Y709 PolarHBondContact O-N 2.75Å
708	D	70.6	Confident	60.9	Low	7 Å²	7	59.2 Å²	59.2	4%	0.037	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-77.3	-14.9	177.7	-74.6	-9.6	0	0	0	112.9	R683 Y705 S706 W722 Q755	R683-D708 IonicContact CZ-OD2 3.16Å; R683-D708 IonicContact NH1-OD2 3.72Å; R683-D708 PolarHBondContact NH1-OD2 2.91Å; Y705-D708 WeakPolarHBondContact O-CB 3.41Å; Y705-D708 PolarHBondContact O-N 2.85Å; S706-D708 VanDerWaalsContact C-N 3.33Å; S706-D708 PolarHBondContact O-N 3.02Å; D708-W722 HydrophobicContact CB-CH2 4.02Å; D708-W722 HydrophobicContact CB-CZ3 3.7Å; D708-W722 VanDerWaalsContact CG-CH2 3.44Å; D708-W722 WeakPolarHBondContact OD2-CH2 3.36Å; D708-Q755 PolarHBondContact OD1-NE2 2.89Å
709	Y	74.1	Confident	62.7	Low	14 Å²	14	58.8 Å²	58.8	6%	0.055	32%	0.324	C	S	.	.			trans	-110.4	130	-175.3	-65.1	-85.7	0	0	0	111.9	D679 R683 R702 Y705 T707 M717 L718 P719	D679-Y709 WeakPolarHBondContact OD2-CE1 3.24Å; D679-Y709 PolarHBondContact OD2-OH 3.12Å; R683-Y709 PolarHBondContact NE-OH 3.13Å; R702-Y709 HydrophobicContact CG-CE2 4.49Å; Y705-Y709 WeakPolarHBondContact O-CD2 3.36Å; T707-Y709 VanDerWaalsContact C-N 3.27Å; T707-Y709 PolarHBondContact O-N 2.75Å; Y709-M717 HydrophobicContact CD1-CB 4.38Å; Y709-M717 HydrophobicContact CG-CE 4.49Å; Y709-L718 WeakPolarHBondContact CA-O 3.48Å; Y709-P719 HydrophobicContact CD1-CB 4.19Å; Y709-P719 HydrophobicContact CE1-CB 3.98Å
710	Y	74.4	Confident	64.5	Low	81 Å²	81	58.8 Å²	58.8	32%	0.318	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	133.2	171.4	179	-120.1	0	0	0	110.7	V712 M717 L718 I720 N762 I766	Y710-V712 HydrophobicContact CD1-CG2 3.67Å; Y710-V712 HydrophobicContact CE1-CG2 3.68Å; Y710-M717 WeakPolarHBondContact O-CA 3.46Å; Y710-L718 PolarHBondContact N-O 2.9Å; Y710-L718 PolarHBondContact O-N 3.27Å; Y710-I720 HydrophobicContact CD1-CD1 4.45Å; Y710-I720 HydrophobicContact CD1-CG2 4.19Å; Y710-I720 HydrophobicContact CG-CD1 4.11Å; Y710-N762 HydrophobicContact CD2-CB 3.76Å; Y710-N762 HydrophobicContact CE2-CB 4.38Å; Y710-N762 HydrophobicContact CG-CB 4.26Å; Y710-I766 HydrophobicContact CD1-CD1 4.12Å; Y710-I766 HydrophobicContact CE1-CD1 3.96Å
711	R	72.5	Confident	66.7	Low	157 Å²	157	56.9 Å²	56.9	59%	0.592	31%	0.313	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.5	111.1	-179.6	-172.1	-179.1	-86.6	-144.2	13.5	110.5	G714 T716 M717	R711-G714 VanDerWaalsContact CD-O 3.29Å; R711-G714 WeakPolarHBondContact CD-O 3.31Å; R711-G714 PolarHBondContact NH1-O 3.04Å; R711-T716 CarbonylContact C-O 3.57Å; R711-T716 WeakPolarHBondContact CA-O 3.46Å; R711-M717 HydrophobicContact CB-SD 3.68Å; R711-M717 HydrophobicContact CG-SD 3.92Å
712	V	61.6	Low	69	Low	49 Å²	49	56.3 Å²	56.3	30%	0.297	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	127.9	175	-176.2	0	0	0	0	109.9	Y710 G714 T716 L718	Y710-V712 HydrophobicContact CD1-CG2 3.67Å; Y710-V712 HydrophobicContact CE1-CG2 3.68Å; V712-G714 VanDerWaalsContact C-N 3.35Å; V712-G714 PolarHBondContact O-N 3.16Å; V712-T716 PolarHBondContact N-O 3.36Å; V712-T716 PolarHBondContact O-N 3.33Å; V712-L718 HydrophobicContact CG2-CD1 3.83Å
713	G	56.1	Low	70.9	Confident	69 Å²	69	53.2 Å²	53.2	71%	0.711	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.7	41.1	172.3	0	0	0	0	0	114	H715	G713-H715 PolarHBondContact O-CD2 3.11Å; G713-H715 VanDerWaalsContact O-CD2 3.3Å; G713-H715 PolarHBondContact O-N 3.03Å
714	G	52.4	Low	72.9	Confident	38 Å²	38	48.8 Å²	48.8	39%	0.392	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-28.7	176.3	0	0	0	0	0	116.4	R711 V712	R711-G714 VanDerWaalsContact CD-O 3.29Å; R711-G714 WeakPolarHBondContact CD-O 3.31Å; R711-G714 PolarHBondContact NH1-O 3.04Å; V712-G714 VanDerWaalsContact C-N 3.35Å; V712-G714 PolarHBondContact O-N 3.16Å
715	H	49.5	Very low	74.8	Confident	175 Å²	175	44.4 Å²	44.4	81%	0.81	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.2	-27.7	-164.8	-62.1	-78.1	0	0	0	116.2	G713	G713-H715 PolarHBondContact O-CD2 3.11Å; G713-H715 VanDerWaalsContact O-CD2 3.3Å; G713-H715 PolarHBondContact O-N 3.03Å
716	T	65.2	Low	76.3	Confident	24 Å²	24	44.3 Å²	44.3	15%	0.147	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.6	-175.4	-53	0	0	0	0	111.5	R711 V712 L718	R711-T716 CarbonylContact C-O 3.57Å; R711-T716 WeakPolarHBondContact CA-O 3.46Å; V712-T716 PolarHBondContact N-O 3.36Å; V712-T716 PolarHBondContact O-N 3.33Å; T716-L718 HydrophobicContact CG2-CD2 4.01Å; T716-L718 HydrophobicContact CG2-CG 4.2Å
717	M	70.4	Confident	77.4	Confident	69 Å²	69	41.1 Å²	41.1	34%	0.34	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	127	175.9	-61.6	-67.7	-80.6	0	0	109.8	Y709 Y710 R711	Y709-M717 HydrophobicContact CD1-CB 4.38Å; Y709-M717 HydrophobicContact CG-CE 4.49Å; Y710-M717 WeakPolarHBondContact O-CA 3.46Å; R711-M717 HydrophobicContact CB-SD 3.68Å; R711-M717 HydrophobicContact CG-SD 3.92Å
718	L	80.5	Confident	78.2	Confident	31 Å²	31	38.2 Å²	38.2	16%	0.162	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.6	-176.7	-65.6	179.3	0	0	0	111.8	Y709 Y710 V712 T716 I720 M723	Y709-L718 WeakPolarHBondContact CA-O 3.48Å; Y710-L718 PolarHBondContact N-O 2.9Å; Y710-L718 PolarHBondContact O-N 3.27Å; V712-L718 HydrophobicContact CG2-CD1 3.83Å; T716-L718 HydrophobicContact CG2-CD2 4.01Å; T716-L718 HydrophobicContact CG2-CG 4.2Å; L718-I720 HydrophobicContact CB-CG2 3.96Å; L718-I720 PolarHBondContact O-N 3.17Å; L718-M723 HydrophobicContact CB-SD 3.93Å; L718-M723 HydrophobicContact CD1-CE 4.48Å
719	P	88.9	Confident	78.7	Confident	9 Å²	9	42 Å²	42	6%	0.058	22%	0.224	C	C	.	.			trans	-80.6	56.6	-179.7	35.7	-37.7	0	0	0	111.8	D679 Y709 R721 W722 M723	D679-P719 HydrophobicContact CB-CG 4.29Å; D679-P719 VanDerWaalsContact OD1-CB 3.25Å; D679-P719 WeakPolarHBondContact OD1-CB 3.43Å; D679-P719 WeakPolarHBondContact OD1-CG 3.35Å; Y709-P719 HydrophobicContact CD1-CB 4.19Å; Y709-P719 HydrophobicContact CE1-CB 3.98Å; P719-R721 PolarHBondContact O-N 2.82Å; P719-W722 HydrophobicContact CB-CE3 4.39Å; P719-W722 PolarHBondContact O-N 2.73Å; P719-M723 HydrophobicContact CG-CG 4.24Å; P719-M723 HydrophobicContact CG-SD 4.3Å; P719-M723 PolarHBondContact O-N 3.22Å
720	I	88.8	Confident	79	Confident	4 Å²	4	48.4 Å²	48.4	2%	0.021	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.6	-165.3	56.7	157.6	0	0	0	115.6	Y710 L718 W722 M723 N762 V765 I766	Y710-I720 HydrophobicContact CD1-CD1 4.45Å; Y710-I720 HydrophobicContact CD1-CG2 4.19Å; Y710-I720 HydrophobicContact CG-CD1 4.11Å; L718-I720 HydrophobicContact CB-CG2 3.96Å; L718-I720 PolarHBondContact O-N 3.17Å; I720-W722 PolarHBondContact O-N 3.11Å; I720-M723 HydrophobicContact CG2-SD 4.14Å; I720-M723 PolarHBondContact O-N 3.32Å; I720-N762 HydrophobicContact CD1-CB 3.57Å; I720-N762 VanDerWaalsContact CD1-O 3.24Å; I720-N762 WeakPolarHBondContact CD1-O 3.32Å; I720-V765 HydrophobicContact CD1-CG1 4.45Å; I720-I766 HydrophobicContact CD1-CD1 4.09Å; I720-I766 HydrophobicContact CD1-CG1 4.01Å
721	R	94.9	Very high	79.2	Confident	10 Å²	10	49.1 Å²	49.1	4%	0.038	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.9	178.7	-70.5	166.4	-174.8	-82.3	-7.5	113.3	P719 P756 W757 L760 N762 V765	P719-R721 PolarHBondContact O-N 2.82Å; R721-P756 HydrophobicContact CB-CB 4.29Å; R721-P756 WeakPolarHBondContact CD-O 3.47Å; R721-P756 PolarHBondContact NH1-O 3.09Å; R721-W757 VanDerWaalsContact NH1-C 3.27Å; R721-W757 PolarHBondContact NH1-O 2.8Å; R721-L760 PolarHBondContact NH1-O 3.19Å; R721-L760 PolarHBondContact NH2-O 2.96Å; R721-N762 PolarHBondContact NE-OD1 3.3Å; R721-N762 PolarHBondContact NH2-OD1 3.25Å; R721-V765 HydrophobicContact CG-CG1 4.02Å; R721-V765 HydrophobicContact CG-CG2 4.34Å
722	W	95.7	Very high	79.6	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.008	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-12.1	174.4	-70.9	-101.1	0	0	0	112.9	A681 R683 D708 P719 I720 W740 S741 V744 E748 P756	A681-W722 HydrophobicContact CB-CD2 4.1Å; A681-W722 HydrophobicContact CB-CG 4.13Å; A681-W722 HydrophobicContact CB-CZ2 4.28Å; R683-W722 VanDerWaalsContact NH1-CZ2 3.26Å; D708-W722 HydrophobicContact CB-CH2 4.02Å; D708-W722 HydrophobicContact CB-CZ3 3.7Å; D708-W722 VanDerWaalsContact CG-CH2 3.44Å; D708-W722 WeakPolarHBondContact OD2-CH2 3.36Å; P719-W722 HydrophobicContact CB-CE3 4.39Å; P719-W722 PolarHBondContact O-N 2.73Å; I720-W722 PolarHBondContact O-N 3.11Å; W722-W740 VanDerWaalsContact O-CD1 3.27Å; W722-S741 PolarHBondContact O-OG 2.6Å; W722-V744 HydrophobicContact CD2-CG1 4.43Å; W722-V744 HydrophobicContact CG-CB 4.43Å; W722-V744 HydrophobicContact CG-CG1 4.01Å; W722-E748 HydrophobicContact CZ2-CG 4.49Å; W722-E748 PolarHBondContact NE1-OE2 2.71Å; W722-P756 HydrophobicContact CD2-CG 4.44Å; W722-P756 VanDerWaalsContact CH2-CD 3.5Å; W722-P756 HydrophobicContact CH2-CG 4.05Å; W722-P756 VanDerWaalsContact CZ2-CD 3.45Å; W722-P756 HydrophobicContact CZ2-CG 3.65Å
723	M	93.7	Very high	80.7	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.015	25%	0.248	C	C	.	.			trans	-83.9	143.3	-172.3	-69.5	170.8	63.5	0	0	112.8	L718 P719 I720 S727 I728 F733 W740	L718-M723 HydrophobicContact CB-SD 3.93Å; L718-M723 HydrophobicContact CD1-CE 4.48Å; P719-M723 HydrophobicContact CG-CG 4.24Å; P719-M723 HydrophobicContact CG-SD 4.3Å; P719-M723 PolarHBondContact O-N 3.22Å; I720-M723 HydrophobicContact CG2-SD 4.14Å; I720-M723 PolarHBondContact O-N 3.32Å; M723-S727 WeakPolarHBondContact CE-O 3.41Å; M723-I728 HydrophobicContact CB-CD1 4.18Å; M723-I728 HydrophobicContact CB-CG1 3.74Å; M723-I728 HydrophobicContact CE-CG1 4.2Å; M723-F733 HydrophobicContact CE-CE1 4.11Å; M723-F733 HydrophobicContact CE-CZ 3.93Å; M723-W740 PolarHBondContact O-NE1 3.01Å
724	P	95.8	Very high	82.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.006	23%	0.229	C	C	.	.			trans	-77.8	167.7	171.3	33.8	-38.7	0	0	0	112.9	E726 S727 I728 W740	P724-E726 VanDerWaalsContact C-N 3.32Å; P724-E726 WeakPolarHBondContact CB-OE1 3.46Å; P724-E726 WeakPolarHBondContact CB-OE2 3.44Å; P724-E726 WeakPolarHBondContact CG-OE1 3.22Å; P724-E726 PolarHBondContact O-N 2.8Å; P724-S727 WeakPolarHBondContact CD-OG 3.25Å; P724-S727 VanDerWaalsContact CG-OG 3.22Å; P724-S727 WeakPolarHBondContact CG-OG 3.4Å; P724-S727 PolarHBondContact O-N 3.08Å; P724-S727 VanDerWaalsContact O-N 3.14Å; P724-I728 WeakPolarHBondContact O-CG1 3.5Å; P724-I728 PolarHBondContact O-N 3.18Å; P724-I728 VanDerWaalsContact O-N 3.11Å; P724-W740 HydrophobicContact CB-CB 3.81Å; P724-W740 HydrophobicContact CB-CD2 3.53Å; P724-W740 HydrophobicContact CB-CE3 3.85Å; P724-W740 HydrophobicContact CB-CG 3.5Å; P724-W740 HydrophobicContact CG-CB 4.26Å; P724-W740 HydrophobicContact CG-CG 4.29Å
725	P	92.1	Very high	84.1	Confident	7 Å²	7	47.8 Å²	47.8	5%	0.045	22%	0.224	C	C	.	.	H	α-helix	trans	-53.1	-42.4	-179.9	-25.3	33	0	0	0	113.9	S727 I728 M729 W740 I769	P725-S727 PolarHBondContact O-N 3.07Å; P725-I728 PolarHBondContact O-N 3.5Å; P725-M729 WeakPolarHBondContact O-CB 3.2Å; P725-M729 VanDerWaalsContact O-CG 3.29Å; P725-M729 WeakPolarHBondContact O-CG 3.37Å; P725-M729 PolarHBondContact O-N 3.16Å; P725-W740 HydrophobicContact CG-CH2 4.13Å; P725-W740 HydrophobicContact CG-CZ3 4.32Å; P725-I769 HydrophobicContact CB-CG2 4.45Å; P725-I769 HydrophobicContact CG-CG2 3.78Å
726	E	90.2	Very high	86.2	Confident	17 Å²	17	41.8 Å²	41.8	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-71.6	-27.2	-178	73.6	-74.2	176.7	0	0	114	P724 Y730 R731 K732 P797 R800	P724-E726 VanDerWaalsContact C-N 3.32Å; P724-E726 WeakPolarHBondContact CB-OE1 3.46Å; P724-E726 WeakPolarHBondContact CB-OE2 3.44Å; P724-E726 WeakPolarHBondContact CG-OE1 3.22Å; P724-E726 PolarHBondContact O-N 2.8Å; E726-Y730 HydrophobicContact CB-CD2 4.09Å; E726-Y730 CarbonylContact O-C 3.42Å; E726-Y730 WeakPolarHBondContact O-CA 3.42Å; E726-Y730 WeakPolarHBondContact O-CB 3.34Å; E726-Y730 PolarHBondContact O-N 3.29Å; E726-R731 PolarHBondContact O-N 2.97Å; E726-K732 HydrophobicContact CB-CB 4.39Å; E726-K732 HydrophobicContact CG-CB 4.13Å; E726-K732 PolarHBondContact O-N 3.41Å; E726-P797 HydrophobicContact CG-CG 4.09Å; E726-R800 IonicContact OE1-CZ 3.43Å; E726-R800 IonicContact OE1-NH1 2.71Å; E726-R800 PolarHBondContact OE1-NH1 2.88Å; E726-R800 IonicContact OE1-NH2 3.27Å; E726-R800 PolarHBondContact OE1-NH2 3.48Å; E726-R800 IonicContact OE2-CZ 3.72Å; E726-R800 IonicContact OE2-NH1 3.75Å; E726-R800 IonicContact OE2-NH2 2.79Å; E726-R800 PolarHBondContact OE2-NH2 3.47Å
727	S	89.1	Confident	87.6	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.014	19%	0.19	C	C	.	.	H	α-helix	trans	-76	-36.5	173.1	-54	0	0	0	0	111.2	M723 P724 P725 R731 K732	M723-S727 WeakPolarHBondContact CE-O 3.41Å; P724-S727 WeakPolarHBondContact CD-OG 3.25Å; P724-S727 VanDerWaalsContact CG-OG 3.22Å; P724-S727 WeakPolarHBondContact CG-OG 3.4Å; P724-S727 PolarHBondContact O-N 3.08Å; P724-S727 VanDerWaalsContact O-N 3.14Å; P725-S727 PolarHBondContact O-N 3.07Å; S727-R731 VanDerWaalsContact O-CA 3.27Å; S727-R731 WeakPolarHBondContact O-CA 3.38Å; S727-R731 PolarHBondContact O-N 3.39Å; S727-K732 VanDerWaalsContact CA-O 3.26Å; S727-K732 WeakPolarHBondContact CA-O 3.39Å; S727-K732 WeakPolarHBondContact CB-O 3.41Å; S727-K732 PolarHBondContact OG-O 3.15Å
728	I	85.4	Confident	88.7	Confident	33 Å²	33	37.8 Å²	37.8	17%	0.169	18%	0.175	C	C	.	.	H	α-helix	trans	-70.4	-50.2	176.5	-64.7	173.6	0	0	0	110.9	M723 P724 P725 I766 I769 T770	M723-I728 HydrophobicContact CB-CD1 4.18Å; M723-I728 HydrophobicContact CB-CG1 3.74Å; M723-I728 HydrophobicContact CE-CG1 4.2Å; P724-I728 WeakPolarHBondContact O-CG1 3.5Å; P724-I728 PolarHBondContact O-N 3.18Å; P724-I728 VanDerWaalsContact O-N 3.11Å; P725-I728 PolarHBondContact O-N 3.5Å; I728-I766 HydrophobicContact CG2-CG1 4.17Å; I728-I766 HydrophobicContact CG2-CG2 3.91Å; I728-I769 HydrophobicContact CD1-CB 4.1Å; I728-I769 HydrophobicContact CD1-CD1 3.89Å; I728-I769 HydrophobicContact CD1-CG2 3.8Å; I728-T770 HydrophobicContact CG2-CG2 4.35Å
729	M	81.4	Confident	89.6	Confident	86 Å²	86	36.7 Å²	36.7	42%	0.424	17%	0.17	S	C	.	.	H	α-helix	trans	-81.7	-37.6	-173	-63.3	177.9	72.8	0	0	113.5	P725 T770	P725-M729 WeakPolarHBondContact O-CB 3.2Å; P725-M729 VanDerWaalsContact O-CG 3.29Å; P725-M729 WeakPolarHBondContact O-CG 3.37Å; P725-M729 PolarHBondContact O-N 3.16Å; M729-T770 HydrophobicContact CG-CG2 3.57Å; M729-T770 HydrophobicContact SD-CG2 3.71Å
730	Y	80.9	Confident	90	Very high	149 Å²	149	36.8 Å²	36.8	58%	0.584	17%	0.169	S	C	*	.	H	α-helix	trans	-124.2	4.2	-168.3	-46.5	-58.1	0	0	0	113.7	E726 K732	E726-Y730 HydrophobicContact CB-CD2 4.09Å; E726-Y730 CarbonylContact O-C 3.42Å; E726-Y730 WeakPolarHBondContact O-CA 3.42Å; E726-Y730 WeakPolarHBondContact O-CB 3.34Å; E726-Y730 PolarHBondContact O-N 3.29Å; Y730-K732 PolarHBondContact O-N 2.92Å; Y730-K732 VanDerWaalsContact O-N 3.12Å
731	R	79.1	Confident	90.5	Very high	97 Å²	97	36.8 Å²	36.8	37%	0.366	17%	0.169	S	C	.	.			trans	50.3	30.8	-174.3	-62.9	-172.8	176.6	-175.8	0.7	113.9	I511 E726 S727 F733	I511-R731 PolarHBondContact O-NH1 3.05Å; E726-R731 PolarHBondContact O-N 2.97Å; S727-R731 VanDerWaalsContact O-CA 3.27Å; S727-R731 WeakPolarHBondContact O-CA 3.38Å; S727-R731 PolarHBondContact O-N 3.39Å; R731-F733 HydrophobicContact CB-CE2 4.48Å; R731-F733 WeakPolarHBondContact O-CD2 3.49Å
732	K	80.8	Confident	90.6	Very high	131 Å²	131	36.3 Å²	36.3	57%	0.57	17%	0.168	S	C	*	.			trans	-83.6	130.4	174.7	-69.8	-176.3	178.4	-179	0	109.8	E726 S727 Y730	E726-K732 HydrophobicContact CB-CB 4.39Å; E726-K732 HydrophobicContact CG-CB 4.13Å; E726-K732 PolarHBondContact O-N 3.41Å; S727-K732 VanDerWaalsContact CA-O 3.26Å; S727-K732 WeakPolarHBondContact CA-O 3.39Å; S727-K732 WeakPolarHBondContact CB-O 3.41Å; S727-K732 PolarHBondContact OG-O 3.15Å; Y730-K732 PolarHBondContact O-N 2.92Å; Y730-K732 VanDerWaalsContact O-N 3.12Å
733	F	84.7	Confident	90.8	Very high	58 Å²	58	36.2 Å²	36.2	25%	0.254	17%	0.167	S	C	.	.			trans	-129.7	126.2	175.9	-62.2	-87.9	0	0	0	109.1	V676 R678 M723 R731 S737	V676-F733 HydrophobicContact CG1-CB 4.24Å; R678-F733 HydrophobicContact CB-CD1 3.83Å; R678-F733 HydrophobicContact CB-CE1 4.14Å; R678-F733 HydrophobicContact CB-CG 4.42Å; R678-F733 HydrophobicContact CG-CB 3.99Å; R678-F733 HydrophobicContact CG-CD1 3.9Å; R678-F733 HydrophobicContact CG-CG 4.02Å; M723-F733 HydrophobicContact CE-CE1 4.11Å; M723-F733 HydrophobicContact CE-CZ 3.93Å; R731-F733 HydrophobicContact CB-CE2 4.48Å; R731-F733 WeakPolarHBondContact O-CD2 3.49Å; F733-S737 WeakPolarHBondContact CA-OG 3.47Å
734	T	88.4	Confident	91	Very high	50 Å²	50	36.2 Å²	36.2	31%	0.307	17%	0.167	S	C	.	.			trans	-145.8	175.8	-177.3	68.6	0	0	0	0	110.4	V676 E736 S737 D738	V676-T734 WeakPolarHBondContact CG1-O 3.48Å; T734-E736 WeakPolarHBondContact CB-OE2 3.41Å; T734-E736 PolarHBondContact O-N 3.47Å; T734-E736 PolarHBondContact OG1-N 3.46Å; T734-E736 PolarHBondContact OG1-OE2 3.29Å; T734-S737 PolarHBondContact N-OG 3.18Å; T734-S737 PolarHBondContact O-N 3.08Å; T734-S737 PolarHBondContact O-OG 3.45Å; T734-S737 PolarHBondContact OG1-N 3.43Å; T734-D738 PolarHBondContact O-N 3.02Å
735	T	89.6	Confident	91.1	Very high	45 Å²	45	36.1 Å²	36.1	28%	0.276	17%	0.167	S	C	.	.	H	α-helix	trans	-55.3	-31.5	171	30.7	0	0	0	0	112.7	A671 D738 V739	A671-T735 HydrophobicContact CB-CG2 3.68Å; T735-D738 PolarHBondContact O-N 2.84Å; T735-V739 WeakPolarHBondContact O-CG2 3.28Å; T735-V739 PolarHBondContact O-N 2.86Å; T735-V739 VanDerWaalsContact O-N 3.08Å
736	E	94.9	Very high	91.4	Very high	50 Å²	50	35.8 Å²	35.8	23%	0.234	17%	0.165	C	C	.	.	H	α-helix	trans	-76.6	-25.6	178.1	-54.9	67.3	-121	0	0	112	T734 W740 P797 R800	T734-E736 WeakPolarHBondContact CB-OE2 3.41Å; T734-E736 PolarHBondContact O-N 3.47Å; T734-E736 PolarHBondContact OG1-N 3.46Å; T734-E736 PolarHBondContact OG1-OE2 3.29Å; E736-W740 PolarHBondContact O-N 3.2Å; E736-P797 HydrophobicContact CB-CB 3.78Å; E736-P797 HydrophobicContact CG-CB 4.27Å; E736-R800 WeakPolarHBondContact O-CD 3.26Å; E736-R800 PolarHBondContact O-NH1 3.3Å
737	S	93.7	Very high	91.8	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.014	16%	0.164	C	C	.	.	H	α-helix	trans	-74.1	-35.4	170.7	67.2	0	0	0	0	111.9	F733 T734 V739 W740 S741	F733-S737 WeakPolarHBondContact CA-OG 3.47Å; T734-S737 PolarHBondContact N-OG 3.18Å; T734-S737 PolarHBondContact O-N 3.08Å; T734-S737 PolarHBondContact O-OG 3.45Å; T734-S737 PolarHBondContact OG1-N 3.43Å; S737-V739 VanDerWaalsContact C-N 3.33Å; S737-W740 WeakPolarHBondContact O-CB 3.49Å; S737-W740 PolarHBondContact O-N 2.63Å; S737-S741 PolarHBondContact O-N 3.29Å; S737-S741 PolarHBondContact O-OG 3.26Å; S737-S741 VanDerWaalsContact O-OG 3.09Å
738	D	94.8	Very high	92.2	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.037	16%	0.164	C	C	.	.	H	α-helix	trans	-67.7	-33.7	172	-72.5	-15.6	0	0	0	111.6	M667 V676 H677 R678 T734 T735 W740 S741 F742	M667-D738 HydrophobicContact CE-CB 3.79Å; M667-D738 WeakPolarHBondContact CE-O 3.32Å; V676-D738 VanDerWaalsContact CA-OD2 3.3Å; V676-D738 WeakPolarHBondContact CA-OD2 3.32Å; V676-D738 WeakPolarHBondContact CG1-OD2 3.41Å; H677-D738 PolarHBondContact N-OD2 3.2Å; R678-D738 PolarHBondContact N-OD1 2.78Å; T734-D738 PolarHBondContact O-N 3.02Å; T735-D738 PolarHBondContact O-N 2.84Å; D738-W740 VanDerWaalsContact C-N 3.33Å; D738-W740 PolarHBondContact O-N 2.7Å; D738-S741 CarbonylContact O-C 3.57Å; D738-S741 WeakPolarHBondContact O-CB 3.1Å; D738-S741 PolarHBondContact O-N 3.25Å; D738-F742 PolarHBondContact O-N 3.19Å
739	V	98.3	Very high	92.7	Very high	8 Å²	8	34.2 Å²	34.2	5%	0.048	16%	0.155	C	C	.	.	H	α-helix	trans	-59.6	-41.2	171.7	164.3	0	0	0	0	111.9	T735 S737 F742 G743 C792 R800 L801 I803 I806	T735-V739 WeakPolarHBondContact O-CG2 3.28Å; T735-V739 PolarHBondContact O-N 2.86Å; T735-V739 VanDerWaalsContact O-N 3.08Å; S737-V739 VanDerWaalsContact C-N 3.33Å; V739-F742 WeakPolarHBondContact O-CB 3.39Å; V739-F742 PolarHBondContact O-N 3.49Å; V739-G743 PolarHBondContact O-N 3.1Å; V739-C792 HydrophobicContact CG1-CB 4.12Å; V739-C792 WeakPolarHBondContact O-CB 3.38Å; V739-R800 HydrophobicContact CG1-CB 4.02Å; V739-L801 WeakPolarHBondContact CG1-O 3.42Å; V739-I803 HydrophobicContact CG2-CB 4.04Å; V739-I806 HydrophobicContact CG1-CD1 3.86Å
740	W	98.4	Very high	93.4	Very high	11 Å²	11	30.1 Å²	30.1	4%	0.042	14%	0.135	C	C	.	.	H	α-helix	trans	-60.5	-48.2	173.2	177.2	-73.4	0	0	0	111.2	W722 M723 P724 P725 E736 S737 D738 F742 G743 V744 I769 W793	W722-W740 VanDerWaalsContact O-CD1 3.27Å; M723-W740 PolarHBondContact O-NE1 3.01Å; P724-W740 HydrophobicContact CB-CB 3.81Å; P724-W740 HydrophobicContact CB-CD2 3.53Å; P724-W740 HydrophobicContact CB-CE3 3.85Å; P724-W740 HydrophobicContact CB-CG 3.5Å; P724-W740 HydrophobicContact CG-CB 4.26Å; P724-W740 HydrophobicContact CG-CG 4.29Å; P725-W740 HydrophobicContact CG-CH2 4.13Å; P725-W740 HydrophobicContact CG-CZ3 4.32Å; E736-W740 PolarHBondContact O-N 3.2Å; S737-W740 WeakPolarHBondContact O-CB 3.49Å; S737-W740 PolarHBondContact O-N 2.63Å; D738-W740 VanDerWaalsContact C-N 3.33Å; D738-W740 PolarHBondContact O-N 2.7Å; W740-F742 PolarHBondContact O-N 2.97Å; W740-G743 WeakPolarHBondContact O-CA 3.37Å; W740-G743 PolarHBondContact O-N 3.18Å; W740-V744 PolarHBondContact O-N 3.2Å; W740-V744 VanDerWaalsContact O-N 3.16Å; W740-I769 HydrophobicContact CH2-CG2 4.43Å; W740-I769 HydrophobicContact CZ2-CG2 3.96Å; W740-W793 AromaticContact CD2-CD1 3.62Å; W740-W793 HydrophobicContact CD2-CG 4.43Å; W740-W793 AromaticContact CE2-CD1 3.75Å; W740-W793 HydrophobicContact CE3-CB 4.14Å; W740-W793 AromaticContact CE3-CD1 3.99Å; W740-W793 HydrophobicContact CE3-CG 4.46Å; W740-W793 AromaticContact CG-CD1 3.91Å; W740-W793 HydrophobicContact CH2-CB 4.14Å; W740-W793 HydrophobicContact CZ3-CB 3.91Å; W740-W793 WeakPolarHBondContact CZ3-O 3.45Å; W740-W793 PolarHBondContact O-NE1 2.93Å
741	S	97.8	Very high	94	Very high	4 Å²	4	23.9 Å²	23.9	3%	0.028	11%	0.113	C	C	.	.	H	α-helix	trans	-58.5	-36.4	176.2	-50.8	0	0	0	0	112.1	W722 S737 D738 V744 I745	W722-S741 PolarHBondContact O-OG 2.6Å; S737-S741 PolarHBondContact O-N 3.29Å; S737-S741 PolarHBondContact O-OG 3.26Å; S737-S741 VanDerWaalsContact O-OG 3.09Å; D738-S741 CarbonylContact O-C 3.57Å; D738-S741 WeakPolarHBondContact O-CB 3.1Å; D738-S741 PolarHBondContact O-N 3.25Å; S741-V744 CarbonylContact O-C 3.55Å; S741-V744 WeakPolarHBondContact O-CA 3.41Å; S741-V744 WeakPolarHBondContact O-CB 3.45Å; S741-V744 PolarHBondContact O-N 3.38Å; S741-V744 VanDerWaalsContact O-N 3.11Å; S741-I745 PolarHBondContact O-N 3.39Å
742	F	98.5	Very high	94.7	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-65.4	-38	173.3	-177.8	-96.3	0	0	0	112.8	I663 A664 M667 L680 D738 V739 W740 V744 I745 L746 I803 I806 L810	I663-F742 HydrophobicContact CB-CE2 4.01Å; I663-F742 HydrophobicContact CG2-CD2 3.9Å; I663-F742 HydrophobicContact CG2-CE2 3.77Å; A664-F742 HydrophobicContact CB-CE1 4.47Å; A664-F742 HydrophobicContact CB-CE2 3.98Å; A664-F742 HydrophobicContact CB-CZ 3.75Å; M667-F742 HydrophobicContact CE-CB 3.91Å; M667-F742 HydrophobicContact SD-CB 3.61Å; M667-F742 HydrophobicContact SD-CD2 3.38Å; M667-F742 WeakPolarHBondContact SD-CD2 3.43Å; M667-F742 HydrophobicContact SD-CE2 4.33Å; M667-F742 HydrophobicContact SD-CG 3.71Å; L680-F742 HydrophobicContact CD2-CB 4.11Å; D738-F742 PolarHBondContact O-N 3.19Å; V739-F742 WeakPolarHBondContact O-CB 3.39Å; V739-F742 PolarHBondContact O-N 3.49Å; W740-F742 PolarHBondContact O-N 2.97Å; F742-V744 PolarHBondContact O-N 2.78Å; F742-I745 WeakPolarHBondContact O-CB 3.32Å; F742-I745 PolarHBondContact O-N 2.9Å; F742-I745 VanDerWaalsContact O-N 3.13Å; F742-L746 HydrophobicContact CD1-CD1 4.22Å; F742-L746 HydrophobicContact CD1-CG 4.17Å; F742-L746 HydrophobicContact CE1-CD1 3.72Å; F742-L746 HydrophobicContact CE1-CD2 3.85Å; F742-L746 HydrophobicContact CE1-CG 3.65Å; F742-L746 HydrophobicContact CZ-CD2 3.81Å; F742-L746 HydrophobicContact CZ-CG 4.05Å; F742-L746 PolarHBondContact O-N 2.93Å; F742-I803 HydrophobicContact CD1-CD1 4.23Å; F742-I803 HydrophobicContact CG-CD1 4.2Å; F742-I806 HydrophobicContact CD1-CG2 3.92Å; F742-I806 HydrophobicContact CE1-CG2 3.36Å; F742-I806 HydrophobicContact CZ-CG2 4.2Å; F742-L810 HydrophobicContact CE1-CD1 3.8Å; F742-L810 HydrophobicContact CZ-CD1 3.62Å
743	G	98.4	Very high	95.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-56.7	-39	169.2	0	0	0	0	0	112	V739 W740 L746 W747 W793	V739-G743 PolarHBondContact O-N 3.1Å; W740-G743 WeakPolarHBondContact O-CA 3.37Å; W740-G743 PolarHBondContact O-N 3.18Å; G743-L746 WeakPolarHBondContact O-CB 3.16Å; G743-L746 PolarHBondContact O-N 2.84Å; G743-W747 PolarHBondContact O-N 3.3Å; G743-W747 VanDerWaalsContact O-N 3.12Å; G743-W793 VanDerWaalsContact C-CZ2 3.43Å; G743-W793 VanDerWaalsContact O-CZ2 3.22Å; G743-W793 WeakPolarHBondContact O-CZ2 3.42Å
744	V	98.4	Very high	95.6	Very high	2 Å²	2	14.5 Å²	14.5	1%	0.012	7%	0.074	C	C	.	.	H	α-helix	trans	-69.3	-38.6	174	-173.3	0	0	0	0	111.8	W722 W740 S741 F742 L746 W747 E748 P756 L775 W793	W722-V744 HydrophobicContact CD2-CG1 4.43Å; W722-V744 HydrophobicContact CG-CB 4.43Å; W722-V744 HydrophobicContact CG-CG1 4.01Å; W740-V744 PolarHBondContact O-N 3.2Å; W740-V744 VanDerWaalsContact O-N 3.16Å; S741-V744 CarbonylContact O-C 3.55Å; S741-V744 WeakPolarHBondContact O-CA 3.41Å; S741-V744 WeakPolarHBondContact O-CB 3.45Å; S741-V744 PolarHBondContact O-N 3.38Å; S741-V744 VanDerWaalsContact O-N 3.11Å; F742-V744 PolarHBondContact O-N 2.78Å; V744-L746 VanDerWaalsContact C-N 3.35Å; V744-L746 PolarHBondContact O-N 2.87Å; V744-W747 CarbonylContact O-C 3.57Å; V744-W747 WeakPolarHBondContact O-CA 3.39Å; V744-W747 WeakPolarHBondContact O-CB 3.49Å; V744-W747 PolarHBondContact O-N 2.81Å; V744-W747 VanDerWaalsContact O-N 3.1Å; V744-E748 WeakPolarHBondContact O-CG 3.42Å; V744-E748 PolarHBondContact O-N 2.79Å; V744-P756 HydrophobicContact CG1-CB 3.87Å; V744-P756 HydrophobicContact CG1-CG 3.38Å; V744-L775 HydrophobicContact CG1-CD1 4.24Å; V744-L775 HydrophobicContact CG2-CD1 4.36Å; V744-W793 HydrophobicContact CG2-CZ2 4.26Å
745	I	98.3	Very high	95.8	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-59.8	-42	171.2	-77.2	-175.5	0	0	0	112.1	I663 L680 T682 S741 F742 W747 E748 I749	I663-I745 HydrophobicContact CD1-CG2 3.79Å; I663-I745 HydrophobicContact CG2-CD1 4.32Å; L680-I745 HydrophobicContact CD2-CD1 3.91Å; L680-I745 HydrophobicContact CG-CD1 3.69Å; T682-I745 HydrophobicContact CG2-CG1 4.29Å; T682-I745 HydrophobicContact CG2-CG2 4.14Å; S741-I745 PolarHBondContact O-N 3.39Å; F742-I745 WeakPolarHBondContact O-CB 3.32Å; F742-I745 PolarHBondContact O-N 2.9Å; F742-I745 VanDerWaalsContact O-N 3.13Å; I745-W747 VanDerWaalsContact C-N 3.27Å; I745-W747 PolarHBondContact O-N 2.91Å; I745-E748 WeakPolarHBondContact O-CB 3.33Å; I745-E748 PolarHBondContact O-N 3.45Å; I745-I749 HydrophobicContact CG2-CD1 3.75Å; I745-I749 HydrophobicContact CG2-CG1 4.35Å; I745-I749 VanDerWaalsContact O-CG1 3.32Å; I745-I749 WeakPolarHBondContact O-CG1 3.13Å; I745-I749 PolarHBondContact O-N 3.27Å
746	L	98.3	Very high	96.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-58.2	-44.8	173.5	-69.4	179.1	0	0	0	110.1	A660 F742 G743 V744 E748 I749 F750 V788 M789 L810	A660-L746 HydrophobicContact CB-CD2 3.56Å; F742-L746 HydrophobicContact CD1-CD1 4.22Å; F742-L746 HydrophobicContact CD1-CG 4.17Å; F742-L746 HydrophobicContact CE1-CD1 3.72Å; F742-L746 HydrophobicContact CE1-CD2 3.85Å; F742-L746 HydrophobicContact CE1-CG 3.65Å; F742-L746 HydrophobicContact CZ-CD2 3.81Å; F742-L746 HydrophobicContact CZ-CG 4.05Å; F742-L746 PolarHBondContact O-N 2.93Å; G743-L746 WeakPolarHBondContact O-CB 3.16Å; G743-L746 PolarHBondContact O-N 2.84Å; V744-L746 VanDerWaalsContact C-N 3.35Å; V744-L746 PolarHBondContact O-N 2.87Å; L746-E748 PolarHBondContact O-N 2.95Å; L746-I749 PolarHBondContact O-N 2.64Å; L746-F750 WeakPolarHBondContact O-CD2 3.49Å; L746-F750 PolarHBondContact O-N 3.12Å; L746-V788 HydrophobicContact CD1-CB 4.38Å; L746-V788 HydrophobicContact CD1-CG1 3.75Å; L746-M789 HydrophobicContact CB-CE 3.87Å; L746-M789 HydrophobicContact CB-CG 3.86Å; L746-M789 HydrophobicContact CB-SD 4.42Å; L746-M789 HydrophobicContact CD1-CG 4.07Å; L746-L810 HydrophobicContact CD2-CD1 4.12Å; L746-L810 HydrophobicContact CD2-CD2 4.25Å
747	W	98.2	Very high	96	Very high	18 Å²	18	10.4 Å²	10.4	7%	0.068	5%	0.048	C	C	.	.	H	α-helix	trans	-61.7	-42	175.8	-169.1	93.5	0	0	0	112.4	G743 V744 I745 F750 T751 K754 P756 L775 E776 P778 M789 W793	G743-W747 PolarHBondContact O-N 3.3Å; G743-W747 VanDerWaalsContact O-N 3.12Å; V744-W747 CarbonylContact O-C 3.57Å; V744-W747 WeakPolarHBondContact O-CA 3.39Å; V744-W747 WeakPolarHBondContact O-CB 3.49Å; V744-W747 PolarHBondContact O-N 2.81Å; V744-W747 VanDerWaalsContact O-N 3.1Å; I745-W747 VanDerWaalsContact C-N 3.27Å; I745-W747 PolarHBondContact O-N 2.91Å; W747-F750 PolarHBondContact O-N 2.84Å; W747-T751 HydrophobicContact CD2-CG2 3.87Å; W747-T751 HydrophobicContact CE3-CG2 4.02Å; W747-T751 HydrophobicContact CH2-CG2 3.93Å; W747-T751 HydrophobicContact CZ2-CG2 3.76Å; W747-T751 HydrophobicContact CZ3-CG2 4.05Å; W747-T751 WeakPolarHBondContact CZ3-OG1 3.26Å; W747-T751 WeakPolarHBondContact O-CB 3.46Å; W747-T751 VanDerWaalsContact O-CG2 3.31Å; W747-T751 WeakPolarHBondContact O-CG2 3.22Å; W747-T751 PolarHBondContact O-N 3.46Å; W747-T751 PolarHBondContact O-OG1 3.24Å; W747-K754 HydrophobicContact CH2-CB 4.16Å; W747-K754 HydrophobicContact CZ3-CB 4.01Å; W747-P756 HydrophobicContact CE3-CB 4.44Å; W747-P756 HydrophobicContact CE3-CG 4.42Å; W747-P756 HydrophobicContact CZ3-CB 4.38Å; W747-P756 HydrophobicContact CZ3-CG 4.47Å; W747-L775 HydrophobicContact CB-CD1 4.2Å; W747-L775 HydrophobicContact CD2-CB 4.44Å; W747-L775 HydrophobicContact CD2-CD1 3.99Å; W747-L775 HydrophobicContact CD2-CD2 4.45Å; W747-L775 HydrophobicContact CE3-CD1 4.41Å; W747-L775 HydrophobicContact CG-CB 4.19Å; W747-L775 HydrophobicContact CG-CD1 3.88Å; W747-L775 HydrophobicContact CZ2-CD2 4.23Å; W747-E776 PolarHBondContact NE1-O 3.27Å; W747-P778 HydrophobicContact CG-CG 4.32Å; W747-M789 HydrophobicContact CB-SD 4.08Å; W747-W793 HydrophobicContact CB-CH2 4.07Å; W747-W793 HydrophobicContact CB-CZ2 4.2Å; W747-W793 HydrophobicContact CG-CH2 4.35Å
748	E	97.3	Very high	95.9	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.8	-46.2	173.9	-69.7	-178.5	86.1	0	0	111.9	N626 T682 W722 V744 I745 L746 F750 T751 Y752 G753 P756	N626-E748 PolarHBondContact ND2-OE1 3.14Å; T682-E748 HydrophobicContact CG2-CB 3.6Å; T682-E748 HydrophobicContact CG2-CG 4.26Å; T682-E748 PolarHBondContact N-OE2 2.56Å; T682-E748 VanDerWaalsContact N-OE2 3.09Å; T682-E748 VanDerWaalsContact OG1-CD 3.3Å; T682-E748 PolarHBondContact OG1-OE1 2.91Å; W722-E748 HydrophobicContact CZ2-CG 4.49Å; W722-E748 PolarHBondContact NE1-OE2 2.71Å; V744-E748 WeakPolarHBondContact O-CG 3.42Å; V744-E748 PolarHBondContact O-N 2.79Å; I745-E748 WeakPolarHBondContact O-CB 3.33Å; I745-E748 PolarHBondContact O-N 3.45Å; L746-E748 PolarHBondContact O-N 2.95Å; E748-F750 PolarHBondContact O-N 3.5Å; E748-T751 WeakPolarHBondContact CA-OG1 3.49Å; E748-T751 CarbonylContact O-C 3.59Å; E748-T751 PolarHBondContact O-N 3.39Å; E748-T751 PolarHBondContact O-OG1 2.87Å; E748-Y752 PolarHBondContact O-N 3.5Å; E748-G753 PolarHBondContact O-N 3.14Å; E748-P756 HydrophobicContact CG-CG 4.33Å
749	I	96.6	Very high	95.6	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.6	-49.9	178.5	-68.8	162.5	0	0	0	110.3	L629 M656 I659 A660 I663 I745 L746 T751 Y752	L629-I749 HydrophobicContact CD1-CG1 4.07Å; L629-I749 HydrophobicContact CD2-CG2 4.39Å; M656-I749 HydrophobicContact CB-CG2 3.76Å; M656-I749 HydrophobicContact CG-CG2 3.96Å; M656-I749 HydrophobicContact SD-CG2 4.44Å; I659-I749 HydrophobicContact CG2-CD1 3.81Å; I659-I749 HydrophobicContact CG2-CG1 4.17Å; A660-I749 HydrophobicContact CB-CD1 4.01Å; I663-I749 HydrophobicContact CD1-CD1 4.26Å; I745-I749 HydrophobicContact CG2-CD1 3.75Å; I745-I749 HydrophobicContact CG2-CG1 4.35Å; I745-I749 VanDerWaalsContact O-CG1 3.32Å; I745-I749 WeakPolarHBondContact O-CG1 3.13Å; I745-I749 PolarHBondContact O-N 3.27Å; L746-I749 PolarHBondContact O-N 2.64Å; I749-T751 PolarHBondContact O-N 3.2Å; I749-Y752 PolarHBondContact O-N 3Å
750	F	95.6	Very high	95.2	Very high	1 Å²	1	22.7 Å²	22.7	0%	0.004	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	2.7	-178.1	-76.9	-89.8	0	0	0	114.4	L653 M656 L657 L746 W747 E748 P778 V780 C781 V785 M789	L653-F750 HydrophobicContact CD1-CE1 3.51Å; L653-F750 HydrophobicContact CD1-CZ 3.76Å; M656-F750 HydrophobicContact CB-CE1 4.3Å; M656-F750 HydrophobicContact CB-CE2 4.21Å; M656-F750 HydrophobicContact CB-CZ 3.9Å; M656-F750 HydrophobicContact SD-CD1 3.72Å; M656-F750 HydrophobicContact SD-CE1 3.73Å; M656-F750 HydrophobicContact SD-CG 4.23Å; M656-F750 HydrophobicContact SD-CZ 4.23Å; L657-F750 HydrophobicContact CD2-CZ 4.33Å; L657-F750 HydrophobicContact CG-CZ 4.46Å; L746-F750 WeakPolarHBondContact O-CD2 3.49Å; L746-F750 PolarHBondContact O-N 3.12Å; W747-F750 PolarHBondContact O-N 2.84Å; E748-F750 PolarHBondContact O-N 3.5Å; F750-P778 HydrophobicContact CB-CB 4.24Å; F750-P778 HydrophobicContact CB-CG 4.08Å; F750-P778 VanDerWaalsContact O-CB 3.23Å; F750-P778 WeakPolarHBondContact O-CB 3.39Å; F750-V780 VanDerWaalsContact O-CG2 3.3Å; F750-V780 WeakPolarHBondContact O-CG2 3.48Å; F750-C781 HydrophobicContact CB-CB 4.06Å; F750-C781 HydrophobicContact CD1-CB 3.93Å; F750-C781 HydrophobicContact CG-CB 4.17Å; F750-V785 HydrophobicContact CD2-CG1 4.03Å; F750-V785 HydrophobicContact CE2-CG1 3.61Å; F750-V785 HydrophobicContact CZ-CB 4.46Å; F750-V785 HydrophobicContact CZ-CG1 3.92Å; F750-V785 HydrophobicContact CZ-CG2 4.13Å; F750-M789 HydrophobicContact CB-CE 4.28Å; F750-M789 HydrophobicContact CD2-CE 4.29Å; F750-M789 HydrophobicContact CG-CE 4.46Å
751	T	94.2	Very high	94.8	Very high	18 Å²	18	24.8 Å²	24.8	11%	0.11	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	9.5	168.9	56.5	0	0	0	0	112.9	W747 E748 I749 G753 K754 P778	W747-T751 HydrophobicContact CD2-CG2 3.87Å; W747-T751 HydrophobicContact CE3-CG2 4.02Å; W747-T751 HydrophobicContact CH2-CG2 3.93Å; W747-T751 HydrophobicContact CZ2-CG2 3.76Å; W747-T751 HydrophobicContact CZ3-CG2 4.05Å; W747-T751 WeakPolarHBondContact CZ3-OG1 3.26Å; W747-T751 WeakPolarHBondContact O-CB 3.46Å; W747-T751 VanDerWaalsContact O-CG2 3.31Å; W747-T751 WeakPolarHBondContact O-CG2 3.22Å; W747-T751 PolarHBondContact O-N 3.46Å; W747-T751 PolarHBondContact O-OG1 3.24Å; E748-T751 WeakPolarHBondContact CA-OG1 3.49Å; E748-T751 CarbonylContact O-C 3.59Å; E748-T751 PolarHBondContact O-N 3.39Å; E748-T751 PolarHBondContact O-OG1 2.87Å; I749-T751 PolarHBondContact O-N 3.2Å; T751-G753 PolarHBondContact O-N 3.49Å; T751-K754 WeakPolarHBondContact O-CG 3.42Å; T751-P778 HydrophobicContact CG2-CB 3.69Å; T751-P778 HydrophobicContact CG2-CG 3.58Å
752	Y	92.9	Very high	94.2	Very high	14 Å²	14	26.3 Å²	26.3	6%	0.055	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	45.9	-177.6	-63.2	-87	0	0	0	114	L629 R630 H632 G633 P634 E650 L651 M656 E748 I749 V780	L629-Y752 CarbonylContact C-O 3.57Å; R630-Y752 VanDerWaalsContact CA-O 3.32Å; R630-Y752 WeakPolarHBondContact CA-O 3.48Å; R630-Y752 VanDerWaalsContact CG-O 3.31Å; R630-Y752 WeakPolarHBondContact CG-O 3.33Å; R630-Y752 PolarHBondContact N-O 3.22Å; H632-Y752 HydrophobicContact CB-CD1 4.48Å; H632-Y752 HydrophobicContact CB-CE1 4.38Å; H632-Y752 WeakPolarHBondContact O-CD1 3.36Å; H632-Y752 WeakPolarHBondContact O-CE1 3.32Å; G633-Y752 VanDerWaalsContact CA-CD1 3.42Å; P634-Y752 HydrophobicContact CG-CD2 4.27Å; P634-Y752 HydrophobicContact CG-CE2 4.31Å; E650-Y752 VanDerWaalsContact CB-OH 3.3Å; E650-Y752 WeakPolarHBondContact CB-OH 3.01Å; E650-Y752 WeakPolarHBondContact CG-OH 3.5Å; E650-Y752 PolarHBondContact OE2-OH 3.49Å; L651-Y752 HydrophobicContact CB-CE1 4.05Å; L651-Y752 HydrophobicContact CD1-CE1 4.44Å; L651-Y752 HydrophobicContact CG-CE1 4.36Å; L651-Y752 PolarHBondContact N-OH 3.36Å; M656-Y752 HydrophobicContact CE-CD1 4.09Å; M656-Y752 HydrophobicContact CE-CD2 4.21Å; M656-Y752 HydrophobicContact CE-CE1 3.41Å; M656-Y752 VanDerWaalsContact CE-CE1 3.41Å; M656-Y752 HydrophobicContact CE-CE2 3.58Å; M656-Y752 HydrophobicContact CE-CG 4.48Å; M656-Y752 WeakPolarHBondContact CE-OH 3.29Å; E748-Y752 PolarHBondContact O-N 3.5Å; I749-Y752 PolarHBondContact O-N 3Å; Y752-V780 HydrophobicContact CE2-CG2 4.46Å
753	G	91.7	Very high	93.7	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	80.4	15.9	172	0	0	0	0	0	115.1	N626 R630 E748 T751	N626-G753 PolarHBondContact ND2-O 2.85Å; N626-G753 VanDerWaalsContact ND2-O 3.07Å; N626-G753 PolarHBondContact OD1-O 2.97Å; R630-G753 PolarHBondContact NE-O 2.83Å; R630-G753 VanDerWaalsContact NE-O 3.1Å; R630-G753 PolarHBondContact NH2-O 2.81Å; E748-G753 PolarHBondContact O-N 3.14Å; T751-G753 PolarHBondContact O-N 3.49Å
754	K	92.3	Very high	93.3	Very high	74 Å²	74	35 Å²	35	32%	0.322	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-55.1	148.6	171.8	-76.4	-178.5	-173	-175.1	0	111.2	D635 W747 T751	D635-K754 WeakPolarHBondContact OD2-CE 3.45Å; D635-K754 IonicContact OD2-NZ 3.95Å; D635-K754 PolarHBondContact OD2-NZ 2.92Å; W747-K754 HydrophobicContact CH2-CB 4.16Å; W747-K754 HydrophobicContact CZ3-CB 4.01Å; T751-K754 WeakPolarHBondContact O-CG 3.42Å
755	Q	93.2	Very high	92.9	Very high	36 Å²	36	35 Å²	35	17%	0.168	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-67.8	129.1	173.4	-172.4	179.3	68.8	0	0	109.1	D708 W757 F758	D708-Q755 PolarHBondContact OD1-NE2 2.89Å; Q755-W757 PolarHBondContact O-N 2.95Å; Q755-F758 HydrophobicContact CB-CB 4.2Å; Q755-F758 WeakPolarHBondContact O-CB 3.44Å; Q755-F758 PolarHBondContact O-N 3.39Å
756	P	95.8	Very high	92.4	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	132.9	173.5	-19.4	30.7	0	0	0	110	R721 W722 V744 W747 E748 F758 L775	R721-P756 HydrophobicContact CB-CB 4.29Å; R721-P756 WeakPolarHBondContact CD-O 3.47Å; R721-P756 PolarHBondContact NH1-O 3.09Å; W722-P756 HydrophobicContact CD2-CG 4.44Å; W722-P756 VanDerWaalsContact CH2-CD 3.5Å; W722-P756 HydrophobicContact CH2-CG 4.05Å; W722-P756 VanDerWaalsContact CZ2-CD 3.45Å; W722-P756 HydrophobicContact CZ2-CG 3.65Å; V744-P756 HydrophobicContact CG1-CB 3.87Å; V744-P756 HydrophobicContact CG1-CG 3.38Å; W747-P756 HydrophobicContact CE3-CB 4.44Å; W747-P756 HydrophobicContact CE3-CG 4.42Å; W747-P756 HydrophobicContact CZ3-CB 4.38Å; W747-P756 HydrophobicContact CZ3-CG 4.47Å; E748-P756 HydrophobicContact CG-CG 4.33Å; P756-F758 VanDerWaalsContact C-N 3.3Å; P756-F758 PolarHBondContact O-N 3.2Å; P756-L775 HydrophobicContact CB-CD1 4.01Å; P756-L775 HydrophobicContact CB-CD2 4.17Å
757	W	93.9	Very high	91.9	Very high	24 Å²	24	41.6 Å²	41.6	9%	0.091	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	35.2	-175.9	-44	97.8	0	0	0	114.4	R721 Q755 Q759 L760 V765 C768 I769 R773 V774 L775	R721-W757 VanDerWaalsContact NH1-C 3.27Å; R721-W757 PolarHBondContact NH1-O 2.8Å; Q755-W757 PolarHBondContact O-N 2.95Å; W757-Q759 VanDerWaalsContact C-OE1 3.24Å; W757-Q759 PolarHBondContact O-N 2.79Å; W757-L760 HydrophobicContact CB-CB 4.32Å; W757-L760 HydrophobicContact CB-CD1 4.3Å; W757-L760 HydrophobicContact CB-CG 4.48Å; W757-L760 HydrophobicContact CD2-CD1 4.44Å; W757-L760 HydrophobicContact CE3-CD1 3.8Å; W757-L760 PolarHBondContact O-N 2.88Å; W757-V765 HydrophobicContact CB-CG2 3.55Å; W757-V765 HydrophobicContact CG-CG1 4.41Å; W757-V765 HydrophobicContact CG-CG2 3.94Å; W757-C768 HydrophobicContact CH2-CB 4.26Å; W757-C768 HydrophobicContact CZ3-CB 4.27Å; W757-I769 HydrophobicContact CZ2-CG1 4.25Å; W757-R773 HydrophobicContact CH2-CB 4.28Å; W757-V774 WeakPolarHBondContact CH2-O 3.49Å; W757-L775 HydrophobicContact CD2-CD2 3.54Å; W757-L775 HydrophobicContact CD2-CG 4.27Å; W757-L775 HydrophobicContact CE3-CD2 4.05Å; W757-L775 HydrophobicContact CG-CD2 3.78Å; W757-L775 HydrophobicContact CZ2-CD2 4.09Å; W757-L775 HydrophobicContact CZ2-CG 3.9Å
758	F	90.3	Very high	91.6	Very high	125 Å²	125	40.8 Å²	40.8	55%	0.548	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-24.7	-176.3	66.7	-87.4	0	0	0	115.1	Q755 P756	Q755-F758 HydrophobicContact CB-CB 4.2Å; Q755-F758 WeakPolarHBondContact O-CB 3.44Å; Q755-F758 PolarHBondContact O-N 3.39Å; P756-F758 VanDerWaalsContact C-N 3.3Å; P756-F758 PolarHBondContact O-N 3.2Å
759	Q	89.8	Confident	91.3	Very high	112 Å²	112	40.9 Å²	40.9	52%	0.523	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-4.6	178.6	74	-82	36.5	0	0	114.7	W757	W757-Q759 VanDerWaalsContact C-OE1 3.24Å; W757-Q759 PolarHBondContact O-N 2.79Å
760	L	90.2	Very high	90.9	Very high	38 Å²	38	42.4 Å²	42.4	20%	0.199	21%	0.213	C	C	.	.	S	Bend	trans	-117.6	144.9	-175.8	-58.9	-175.8	0	0	0	112	R721 W757 E764 V765 C768	R721-L760 PolarHBondContact NH1-O 3.19Å; R721-L760 PolarHBondContact NH2-O 2.96Å; W757-L760 HydrophobicContact CB-CB 4.32Å; W757-L760 HydrophobicContact CB-CD1 4.3Å; W757-L760 HydrophobicContact CB-CG 4.48Å; W757-L760 HydrophobicContact CD2-CD1 4.44Å; W757-L760 HydrophobicContact CE3-CD1 3.8Å; W757-L760 PolarHBondContact O-N 2.88Å; L760-E764 HydrophobicContact CB-CB 4.07Å; L760-E764 HydrophobicContact CD2-CB 4.41Å; L760-V765 HydrophobicContact CB-CG2 3.87Å; L760-C768 HydrophobicContact CD1-CB 4.45Å; L760-C768 WeakPolarHBondContact CD1-SG 3.39Å
761	S	89.4	Confident	90.6	Very high	55 Å²	55	47.3 Å²	47.3	39%	0.385	24%	0.236	S	C	.	.			trans	-69.6	162.7	168.2	72	0	0	0	0	112.1	T763 E764 V765	S761-T763 PolarHBondContact O-N 2.86Å; S761-E764 WeakPolarHBondContact CA-OE2 3.24Å; S761-E764 WeakPolarHBondContact CB-OE2 3.38Å; S761-E764 PolarHBondContact N-OE2 3.47Å; S761-E764 PolarHBondContact O-N 2.86Å; S761-E764 VanDerWaalsContact O-N 3.13Å; S761-E764 WeakPolarHBondContact OG-CG 3.47Å; S761-E764 PolarHBondContact OG-N 3.2Å; S761-E764 PolarHBondContact OG-OE2 2.88Å; S761-V765 WeakPolarHBondContact O-CG2 3.36Å; S761-V765 PolarHBondContact O-N 2.83Å
762	N	85.1	Confident	90.4	Very high	36 Å²	36	48.3 Å²	48.3	19%	0.193	25%	0.25	C	S	.	.	H	α-helix	trans	-59	-31.5	-179.5	-74.9	-9.7	0	0	0	113.3	Y710 I720 R721 I766	Y710-N762 HydrophobicContact CD2-CB 3.76Å; Y710-N762 HydrophobicContact CE2-CB 4.38Å; Y710-N762 HydrophobicContact CG-CB 4.26Å; I720-N762 HydrophobicContact CD1-CB 3.57Å; I720-N762 VanDerWaalsContact CD1-O 3.24Å; I720-N762 WeakPolarHBondContact CD1-O 3.32Å; R721-N762 PolarHBondContact NE-OD1 3.3Å; R721-N762 PolarHBondContact NH2-OD1 3.25Å; N762-I766 WeakPolarHBondContact O-CG1 3.39Å; N762-I766 PolarHBondContact O-N 3.14Å
763	T	87.2	Confident	90.4	Very high	92 Å²	92	53.5 Å²	53.5	56%	0.564	27%	0.269	S	S	*	.	H	α-helix	trans	-71.4	-43.8	175.3	-49.6	0	0	0	0	111.9	S761 V765 I766 E767	S761-T763 PolarHBondContact O-N 2.86Å; T763-V765 VanDerWaalsContact C-N 3.32Å; T763-V765 PolarHBondContact O-N 3.46Å; T763-I766 WeakPolarHBondContact O-CB 3.27Å; T763-I766 PolarHBondContact O-N 3.24Å; T763-E767 PolarHBondContact O-N 3.32Å; T763-E767 VanDerWaalsContact O-N 3.09Å
764	E	90.4	Very high	90.6	Very high	91 Å²	91	55.8 Å²	55.8	43%	0.425	28%	0.283	S	S	.	.	H	α-helix	trans	-67.3	-32.8	177.8	-68.1	161.8	126	0	0	111.9	L760 S761 E767 C768	L760-E764 HydrophobicContact CB-CB 4.07Å; L760-E764 HydrophobicContact CD2-CB 4.41Å; S761-E764 WeakPolarHBondContact CA-OE2 3.24Å; S761-E764 WeakPolarHBondContact CB-OE2 3.38Å; S761-E764 PolarHBondContact N-OE2 3.47Å; S761-E764 PolarHBondContact O-N 2.86Å; S761-E764 VanDerWaalsContact O-N 3.13Å; S761-E764 WeakPolarHBondContact OG-CG 3.47Å; S761-E764 PolarHBondContact OG-N 3.2Å; S761-E764 PolarHBondContact OG-OE2 2.88Å; E764-E767 PolarHBondContact O-N 3.11Å; E764-C768 WeakPolarHBondContact O-CB 3.29Å; E764-C768 PolarHBondContact O-N 3.25Å; E764-C768 PolarHBondContact O-SG 2.88Å; E764-C768 VanDerWaalsContact O-SG 3.37Å
765	V	90.2	Very high	90.8	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-62.1	-45	172	170.1	0	0	0	0	111.5	I720 R721 W757 L760 S761 T763 E767 C768 I769	I720-V765 HydrophobicContact CD1-CG1 4.45Å; R721-V765 HydrophobicContact CG-CG1 4.02Å; R721-V765 HydrophobicContact CG-CG2 4.34Å; W757-V765 HydrophobicContact CB-CG2 3.55Å; W757-V765 HydrophobicContact CG-CG1 4.41Å; W757-V765 HydrophobicContact CG-CG2 3.94Å; L760-V765 HydrophobicContact CB-CG2 3.87Å; S761-V765 WeakPolarHBondContact O-CG2 3.36Å; S761-V765 PolarHBondContact O-N 2.83Å; T763-V765 VanDerWaalsContact C-N 3.32Å; T763-V765 PolarHBondContact O-N 3.46Å; V765-E767 VanDerWaalsContact C-N 3.31Å; V765-E767 PolarHBondContact O-N 2.99Å; V765-C768 PolarHBondContact O-N 2.94Å; V765-I769 HydrophobicContact CG1-CD1 3.66Å; V765-I769 HydrophobicContact CG1-CG1 4.44Å; V765-I769 WeakPolarHBondContact O-CG1 3.37Å; V765-I769 PolarHBondContact O-N 3.3Å
766	I	87.5	Confident	90.8	Very high	44 Å²	44	58.1 Å²	58.1	23%	0.226	30%	0.295	C	S	.	.	H	α-helix	trans	-59.4	-44.5	175.4	-71.2	164	0	0	0	110.1	Y710 I720 I728 N762 T763 T770	Y710-I766 HydrophobicContact CD1-CD1 4.12Å; Y710-I766 HydrophobicContact CE1-CD1 3.96Å; I720-I766 HydrophobicContact CD1-CD1 4.09Å; I720-I766 HydrophobicContact CD1-CG1 4.01Å; I728-I766 HydrophobicContact CG2-CG1 4.17Å; I728-I766 HydrophobicContact CG2-CG2 3.91Å; N762-I766 WeakPolarHBondContact O-CG1 3.39Å; N762-I766 PolarHBondContact O-N 3.14Å; T763-I766 WeakPolarHBondContact O-CB 3.27Å; T763-I766 PolarHBondContact O-N 3.24Å; I766-T770 HydrophobicContact CG2-CG2 4.49Å; I766-T770 WeakPolarHBondContact O-CB 3.33Å; I766-T770 VanDerWaalsContact O-CG2 3.26Å; I766-T770 WeakPolarHBondContact O-CG2 3.37Å; I766-T770 PolarHBondContact O-N 2.84Å; I766-T770 PolarHBondContact O-OG1 3.23Å
767	E	87.9	Confident	90.8	Very high	95 Å²	95	62.8 Å²	62.8	44%	0.444	31%	0.313	S	S	.	.	H	α-helix	trans	-63.5	-47.2	176.7	-173.9	178.2	170.1	0	0	112.3	T763 E764 V765 I769 T770 Q771	T763-E767 PolarHBondContact O-N 3.32Å; T763-E767 VanDerWaalsContact O-N 3.09Å; E764-E767 PolarHBondContact O-N 3.11Å; V765-E767 VanDerWaalsContact C-N 3.31Å; V765-E767 PolarHBondContact O-N 2.99Å; E767-I769 PolarHBondContact O-N 3.25Å; E767-T770 PolarHBondContact O-N 2.8Å; E767-T770 PolarHBondContact O-OG1 3.45Å; E767-Q771 HydrophobicContact CG-CG 4.34Å; E767-Q771 VanDerWaalsContact O-CB 3.29Å; E767-Q771 WeakPolarHBondContact O-CB 3.36Å; E767-Q771 VanDerWaalsContact O-CG 3.24Å; E767-Q771 WeakPolarHBondContact O-CG 3.42Å; E767-Q771 PolarHBondContact O-N 2.58Å; E767-Q771 PolarHBondContact OE1-NE2 3.32Å
768	C	91.3	Very high	90.8	Very high	2 Å²	2	62.2 Å²	62.2	1%	0.014	31%	0.312	C	S	.	.	H	α-helix	trans	-53.5	-54.6	175.8	-80.8	0	0	0	0	112.4	W757 L760 E764 V765 Q771 G772 R773	W757-C768 HydrophobicContact CH2-CB 4.26Å; W757-C768 HydrophobicContact CZ3-CB 4.27Å; L760-C768 HydrophobicContact CD1-CB 4.45Å; L760-C768 WeakPolarHBondContact CD1-SG 3.39Å; E764-C768 WeakPolarHBondContact O-CB 3.29Å; E764-C768 PolarHBondContact O-N 3.25Å; E764-C768 PolarHBondContact O-SG 2.88Å; E764-C768 VanDerWaalsContact O-SG 3.37Å; V765-C768 PolarHBondContact O-N 2.94Å; C768-Q771 PolarHBondContact O-N 3.13Å; C768-G772 PolarHBondContact O-N 3.2Å; C768-R773 HydrophobicContact CB-CB 4.25Å; C768-R773 WeakPolarHBondContact O-CB 3.14Å; C768-R773 PolarHBondContact O-N 3.33Å; C768-R773 PolarHBondContact SG-NH1 3.45Å; C768-R773 VanDerWaalsContact SG-NH1 3.45Å
769	I	91.2	Very high	90.6	Very high	1 Å²	1	65.9 Å²	65.9	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-66.2	-43.1	-175.1	-65.6	169.7	0	0	0	110.3	P725 I728 W740 W757 V765 E767 Q771 G772	P725-I769 HydrophobicContact CB-CG2 4.45Å; P725-I769 HydrophobicContact CG-CG2 3.78Å; I728-I769 HydrophobicContact CD1-CB 4.1Å; I728-I769 HydrophobicContact CD1-CD1 3.89Å; I728-I769 HydrophobicContact CD1-CG2 3.8Å; W740-I769 HydrophobicContact CH2-CG2 4.43Å; W740-I769 HydrophobicContact CZ2-CG2 3.96Å; W757-I769 HydrophobicContact CZ2-CG1 4.25Å; V765-I769 HydrophobicContact CG1-CD1 3.66Å; V765-I769 HydrophobicContact CG1-CG1 4.44Å; V765-I769 WeakPolarHBondContact O-CG1 3.37Å; V765-I769 PolarHBondContact O-N 3.3Å; E767-I769 PolarHBondContact O-N 3.25Å; I769-Q771 VanDerWaalsContact C-N 3.34Å; I769-Q771 PolarHBondContact O-N 2.83Å; I769-G772 PolarHBondContact O-N 3.37Å
770	T	88.2	Confident	90.4	Very high	32 Å²	32	63.4 Å²	63.4	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-68.8	-30.5	179	55.4	0	0	0	0	113.1	I728 M729 I766 E767 G772 R795	I728-T770 HydrophobicContact CG2-CG2 4.35Å; M729-T770 HydrophobicContact CG-CG2 3.57Å; M729-T770 HydrophobicContact SD-CG2 3.71Å; I766-T770 HydrophobicContact CG2-CG2 4.49Å; I766-T770 WeakPolarHBondContact O-CB 3.33Å; I766-T770 VanDerWaalsContact O-CG2 3.26Å; I766-T770 WeakPolarHBondContact O-CG2 3.37Å; I766-T770 PolarHBondContact O-N 2.84Å; I766-T770 PolarHBondContact O-OG1 3.23Å; E767-T770 PolarHBondContact O-N 2.8Å; E767-T770 PolarHBondContact O-OG1 3.45Å; T770-G772 PolarHBondContact O-N 3.09Å; T770-R795 PolarHBondContact O-NH1 3.29Å; T770-R795 PolarHBondContact O-NH2 3.47Å
771	Q	90.8	Very high	90.4	Very high	105 Å²	105	61.6 Å²	61.6	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-74	-9.6	169.4	-72	169.8	-6.1	0	0	113.7	E767 C768 I769	E767-Q771 HydrophobicContact CG-CG 4.34Å; E767-Q771 VanDerWaalsContact O-CB 3.29Å; E767-Q771 WeakPolarHBondContact O-CB 3.36Å; E767-Q771 VanDerWaalsContact O-CG 3.24Å; E767-Q771 WeakPolarHBondContact O-CG 3.42Å; E767-Q771 PolarHBondContact O-N 2.58Å; E767-Q771 PolarHBondContact OE1-NE2 3.32Å; C768-Q771 PolarHBondContact O-N 3.13Å; I769-Q771 VanDerWaalsContact C-N 3.34Å; I769-Q771 PolarHBondContact O-N 2.83Å
772	G	88.9	Confident	90.6	Very high	39 Å²	39	59 Å²	59	40%	0.402	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	19.4	179.9	0	0	0	0	0	114.5	C768 I769 T770	C768-G772 PolarHBondContact O-N 3.2Å; I769-G772 PolarHBondContact O-N 3.37Å; T770-G772 PolarHBondContact O-N 3.09Å
773	R	92.9	Very high	91	Very high	122 Å²	122	62.3 Å²	62.3	46%	0.46	30%	0.3	S	S	.	.			trans	-73.9	140.6	167.5	-66.7	-174.3	-92	167.3	-2.8	109.3	W757 C768	W757-R773 HydrophobicContact CH2-CB 4.28Å; C768-R773 HydrophobicContact CB-CB 4.25Å; C768-R773 WeakPolarHBondContact O-CB 3.14Å; C768-R773 PolarHBondContact O-N 3.33Å; C768-R773 PolarHBondContact SG-NH1 3.45Å; C768-R773 VanDerWaalsContact SG-NH1 3.45Å
774	V	95.3	Very high	91.2	Very high	48 Å²	48	61.8 Å²	61.8	29%	0.291	29%	0.292	S	S	.	.			trans	-119	162.4	179.4	-62	0	0	0	0	110.9	W757 L790 W793	W757-V774 WeakPolarHBondContact CH2-O 3.49Å; V774-L790 HydrophobicContact CG2-CD2 4.06Å; V774-W793 HydrophobicContact CB-CD2 4.48Å; V774-W793 HydrophobicContact CB-CE3 3.84Å; V774-W793 HydrophobicContact CB-CZ3 4.44Å; V774-W793 HydrophobicContact CG1-CB 3.83Å; V774-W793 HydrophobicContact CG1-CE3 4.32Å; V774-W793 HydrophobicContact CG1-CG 4.47Å; V774-W793 HydrophobicContact CG2-CE3 4.44Å
775	L	96.4	Very high	91.5	Very high	7 Å²	7	57.5 Å²	57.5	4%	0.037	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-66	141.1	179.4	-69.5	159.5	0	0	0	111	V744 W747 P756 W757 Y786 W793	V744-L775 HydrophobicContact CG1-CD1 4.24Å; V744-L775 HydrophobicContact CG2-CD1 4.36Å; W747-L775 HydrophobicContact CB-CD1 4.2Å; W747-L775 HydrophobicContact CD2-CB 4.44Å; W747-L775 HydrophobicContact CD2-CD1 3.99Å; W747-L775 HydrophobicContact CD2-CD2 4.45Å; W747-L775 HydrophobicContact CE3-CD1 4.41Å; W747-L775 HydrophobicContact CG-CB 4.19Å; W747-L775 HydrophobicContact CG-CD1 3.88Å; W747-L775 HydrophobicContact CZ2-CD2 4.23Å; P756-L775 HydrophobicContact CB-CD1 4.01Å; P756-L775 HydrophobicContact CB-CD2 4.17Å; W757-L775 HydrophobicContact CD2-CD2 3.54Å; W757-L775 HydrophobicContact CD2-CG 4.27Å; W757-L775 HydrophobicContact CE3-CD2 4.05Å; W757-L775 HydrophobicContact CG-CD2 3.78Å; W757-L775 HydrophobicContact CZ2-CD2 4.09Å; W757-L775 HydrophobicContact CZ2-CG 3.9Å; L775-Y786 PolarHBondContact O-OH 2.91Å; L775-W793 HydrophobicContact CB-CH2 3.68Å; L775-W793 HydrophobicContact CB-CZ2 4.34Å; L775-W793 HydrophobicContact CB-CZ3 4.01Å; L775-W793 HydrophobicContact CD1-CH2 3.99Å; L775-W793 HydrophobicContact CD1-CZ2 3.84Å; L775-W793 HydrophobicContact CG-CH2 4.38Å
776	E	94.6	Very high	91.8	Very high	152 Å²	152	59.3 Å²	59.3	71%	0.71	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-68	152.5	178.6	-63.5	178.1	-179.7	0	0	112.4	W747 P778	W747-E776 PolarHBondContact NE1-O 3.27Å; E776-P778 WeakPolarHBondContact O-CD 3.42Å
777	R	96.1	Very high	92.3	Very high	98 Å²	98	60.4 Å²	60.4	37%	0.37	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-63	122.3	177.2	-179.2	171.5	167.2	-161.8	-9.3	110.9	C781 Y786	R777-C781 HydrophobicContact CG-CB 4.3Å; R777-C781 PolarHBondContact NE-O 2.93Å; R777-C781 PolarHBondContact NH2-O 3.17Å; R777-Y786 HydrophobicContact CB-CD1 3.9Å; R777-Y786 HydrophobicContact CB-CD2 3.62Å; R777-Y786 HydrophobicContact CB-CE1 3.91Å; R777-Y786 HydrophobicContact CB-CE2 3.65Å; R777-Y786 HydrophobicContact CB-CG 3.74Å; R777-Y786 HydrophobicContact CG-CD1 4.13Å; R777-Y786 HydrophobicContact CG-CD2 3.84Å; R777-Y786 HydrophobicContact CG-CE2 4.39Å; R777-Y786 HydrophobicContact CG-CG 3.69Å
778	P	93.6	Very high	92.8	Very high	12 Å²	12	56.1 Å²	56.1	8%	0.078	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-62.3	144.5	173.2	-20.5	32.5	0	0	0	111.4	W747 F750 T751 E776 V780 C781	W747-P778 HydrophobicContact CG-CG 4.32Å; F750-P778 HydrophobicContact CB-CB 4.24Å; F750-P778 HydrophobicContact CB-CG 4.08Å; F750-P778 VanDerWaalsContact O-CB 3.23Å; F750-P778 WeakPolarHBondContact O-CB 3.39Å; T751-P778 HydrophobicContact CG2-CB 3.69Å; T751-P778 HydrophobicContact CG2-CG 3.58Å; E776-P778 WeakPolarHBondContact O-CD 3.42Å; P778-V780 PolarHBondContact O-N 3Å; P778-C781 HydrophobicContact CB-CB 3.9Å; P778-C781 HydrophobicContact CG-CB 4.09Å; P778-C781 WeakPolarHBondContact O-CB 3.4Å; P778-C781 PolarHBondContact O-N 3.34Å
779	R	85.8	Confident	93.1	Very high	202 Å²	202	56 Å²	56	76%	0.762	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-49.4	-177.5	-66.6	-173	-177.3	-173.3	-0.5	112.4	C781 Y820	R779-C781 PolarHBondContact O-N 3.35Å; R779-Y820 PolarHBondContact O-OH 3.46Å
780	V	84.4	Confident	93.4	Very high	60 Å²	60	58.8 Å²	58.8	36%	0.364	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	3.5	-179.5	-58.3	0	0	0	0	114.5	F750 Y752 P778	F750-V780 VanDerWaalsContact O-CG2 3.3Å; F750-V780 WeakPolarHBondContact O-CG2 3.48Å; Y752-V780 HydrophobicContact CE2-CG2 4.46Å; P778-V780 PolarHBondContact O-N 3Å
781	C	91.9	Very high	93.9	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.274	C	S	.	.			trans	-88.4	123.1	-177.3	-173.7	0	0	0	0	111.3	F750 R777 P778 R779 M789	F750-C781 HydrophobicContact CB-CB 4.06Å; F750-C781 HydrophobicContact CD1-CB 3.93Å; F750-C781 HydrophobicContact CG-CB 4.17Å; R777-C781 HydrophobicContact CG-CB 4.3Å; R777-C781 PolarHBondContact NE-O 2.93Å; R777-C781 PolarHBondContact NH2-O 3.17Å; P778-C781 HydrophobicContact CB-CB 3.9Å; P778-C781 HydrophobicContact CG-CB 4.09Å; P778-C781 WeakPolarHBondContact O-CB 3.4Å; P778-C781 PolarHBondContact O-N 3.34Å; R779-C781 PolarHBondContact O-N 3.35Å; C781-M789 VanDerWaalsContact SG-CE 3.51Å
782	P	92.4	Very high	94.3	Very high	2 Å²	2	52.7 Å²	52.7	1%	0.013	25%	0.251	C	S	.	.			trans	-60.3	156.4	170.7	-21.5	33	0	0	0	112.3	L653 E784 V785 Y786	L653-P782 HydrophobicContact CD1-CG 3.58Å; L653-P782 HydrophobicContact CD2-CG 3.6Å; L653-P782 HydrophobicContact CG-CG 4.27Å; P782-E784 VanDerWaalsContact C-N 3.27Å; P782-E784 VanDerWaalsContact CB-OE2 3.24Å; P782-E784 WeakPolarHBondContact CB-OE2 3.24Å; P782-E784 PolarHBondContact O-N 3.45Å; P782-V785 HydrophobicContact CB-CG2 4.21Å; P782-V785 HydrophobicContact CG-CG2 4.18Å; P782-V785 PolarHBondContact O-N 2.72Å; P782-Y786 PolarHBondContact O-N 2.83Å; P782-Y786 VanDerWaalsContact O-N 3.16Å
783	K	92.8	Very high	94.7	Very high	104 Å²	104	51.5 Å²	51.5	45%	0.452	23%	0.234	S	C	.	.	H	α-helix	trans	-63.6	-40.8	-176.5	-171.4	-157.5	174.9	-61	0	110.3	V785 Y786 D787	K783-V785 VanDerWaalsContact C-N 3.25Å; K783-V785 PolarHBondContact O-N 3.03Å; K783-Y786 CarbonylContact O-C 3.38Å; K783-Y786 PolarHBondContact O-N 3.41Å; K783-Y786 VanDerWaalsContact O-N 3.11Å; K783-D787 IonicContact NZ-OD1 2.7Å; K783-D787 PolarHBondContact NZ-OD1 2.83Å; K783-D787 IonicContact NZ-OD2 2.63Å; K783-D787 PolarHBondContact NZ-OD2 2.89Å; K783-D787 PolarHBondContact O-N 3.17Å
784	E	93.2	Very high	94.9	Very high	82 Å²	82	49.1 Å²	49.1	38%	0.383	23%	0.229	S	C	.	.	H	α-helix	trans	-60.9	-35.8	-177.3	-56.4	67.9	-148.6	0	0	111.2	P782 V788 L813	P782-E784 VanDerWaalsContact C-N 3.27Å; P782-E784 VanDerWaalsContact CB-OE2 3.24Å; P782-E784 WeakPolarHBondContact CB-OE2 3.24Å; P782-E784 PolarHBondContact O-N 3.45Å; E784-V788 WeakPolarHBondContact O-CG2 3.45Å; E784-V788 PolarHBondContact O-N 3.45Å; E784-L813 HydrophobicContact CB-CD1 4.12Å; E784-L813 HydrophobicContact CB-CD2 4.03Å; E784-L813 HydrophobicContact CG-CD2 4.38Å
785	V	95.3	Very high	94.8	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.006	24%	0.236	C	C	.	.	H	α-helix	trans	-76.6	-40	176.2	-175.5	0	0	0	0	110.8	L657 F750 P782 K783 D787 V788 M789 L813	L657-V785 HydrophobicContact CD2-CG2 3.82Å; F750-V785 HydrophobicContact CD2-CG1 4.03Å; F750-V785 HydrophobicContact CE2-CG1 3.61Å; F750-V785 HydrophobicContact CZ-CB 4.46Å; F750-V785 HydrophobicContact CZ-CG1 3.92Å; F750-V785 HydrophobicContact CZ-CG2 4.13Å; P782-V785 HydrophobicContact CB-CG2 4.21Å; P782-V785 HydrophobicContact CG-CG2 4.18Å; P782-V785 PolarHBondContact O-N 2.72Å; K783-V785 VanDerWaalsContact C-N 3.25Å; K783-V785 PolarHBondContact O-N 3.03Å; V785-D787 VanDerWaalsContact C-N 3.33Å; V785-D787 PolarHBondContact O-N 2.99Å; V785-V788 WeakPolarHBondContact O-CB 3.38Å; V785-V788 PolarHBondContact O-N 2.77Å; V785-M789 HydrophobicContact CG1-CE 4.13Å; V785-M789 PolarHBondContact O-N 3.34Å; V785-L813 HydrophobicContact CG2-CD1 4.2Å
786	Y	97.8	Very high	94.7	Very high	38 Å²	38	57 Å²	57	15%	0.149	26%	0.257	C	S	.	.	H	α-helix	trans	-66.9	-33.8	175.2	-171.2	-110.2	0	0	0	112.5	L775 R777 P782 K783 V788 M789 L790 W793	L775-Y786 PolarHBondContact O-OH 2.91Å; R777-Y786 HydrophobicContact CB-CD1 3.9Å; R777-Y786 HydrophobicContact CB-CD2 3.62Å; R777-Y786 HydrophobicContact CB-CE1 3.91Å; R777-Y786 HydrophobicContact CB-CE2 3.65Å; R777-Y786 HydrophobicContact CB-CG 3.74Å; R777-Y786 HydrophobicContact CG-CD1 4.13Å; R777-Y786 HydrophobicContact CG-CD2 3.84Å; R777-Y786 HydrophobicContact CG-CE2 4.39Å; R777-Y786 HydrophobicContact CG-CG 3.69Å; P782-Y786 PolarHBondContact O-N 2.83Å; P782-Y786 VanDerWaalsContact O-N 3.16Å; K783-Y786 CarbonylContact O-C 3.38Å; K783-Y786 PolarHBondContact O-N 3.41Å; K783-Y786 VanDerWaalsContact O-N 3.11Å; Y786-V788 VanDerWaalsContact C-N 3.26Å; Y786-V788 PolarHBondContact O-N 3.03Å; Y786-M789 HydrophobicContact CD2-CB 4.33Å; Y786-M789 HydrophobicContact CD2-SD 3.74Å; Y786-M789 HydrophobicContact CE2-SD 4.35Å; Y786-M789 WeakPolarHBondContact O-CA 3.37Å; Y786-M789 WeakPolarHBondContact O-CB 3.4Å; Y786-M789 PolarHBondContact O-N 3.36Å; Y786-M789 VanDerWaalsContact O-N 3.08Å; Y786-L790 HydrophobicContact CD1-CD1 3.88Å; Y786-L790 HydrophobicContact CD1-CG 4.1Å; Y786-L790 HydrophobicContact CE1-CD1 3.68Å; Y786-L790 HydrophobicContact CE1-CD2 3.98Å; Y786-L790 HydrophobicContact CE1-CG 3.83Å; Y786-L790 WeakPolarHBondContact O-CG 3.29Å; Y786-L790 PolarHBondContact O-N 3.48Å; Y786-W793 HydrophobicContact CE2-CZ3 4.15Å
787	D	97.4	Very high	94.7	Very high	66 Å²	66	51 Å²	51	35%	0.353	23%	0.231	S	C	.	.	H	α-helix	trans	-61.2	-36.4	171.9	-65.6	-25.9	0	0	0	111.2	K783 V785 L790 G791	K783-D787 IonicContact NZ-OD1 2.7Å; K783-D787 PolarHBondContact NZ-OD1 2.83Å; K783-D787 IonicContact NZ-OD2 2.63Å; K783-D787 PolarHBondContact NZ-OD2 2.89Å; K783-D787 PolarHBondContact O-N 3.17Å; V785-D787 VanDerWaalsContact C-N 3.33Å; V785-D787 PolarHBondContact O-N 2.99Å; D787-L790 PolarHBondContact O-N 3.46Å; D787-G791 PolarHBondContact O-N 3.44Å
788	V	97.9	Very high	94.6	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.03	25%	0.251	C	S	.	.	H	α-helix	trans	-65.6	-42.6	170.7	175.6	0	0	0	0	111.2	L746 E784 V785 Y786 L790 G791 C792 I806 I809	L746-V788 HydrophobicContact CD1-CB 4.38Å; L746-V788 HydrophobicContact CD1-CG1 3.75Å; E784-V788 WeakPolarHBondContact O-CG2 3.45Å; E784-V788 PolarHBondContact O-N 3.45Å; V785-V788 WeakPolarHBondContact O-CB 3.38Å; V785-V788 PolarHBondContact O-N 2.77Å; Y786-V788 VanDerWaalsContact C-N 3.26Å; Y786-V788 PolarHBondContact O-N 3.03Å; V788-L790 PolarHBondContact O-N 2.95Å; V788-G791 CarbonylContact O-C 3.46Å; V788-G791 WeakPolarHBondContact O-CA 3.26Å; V788-G791 PolarHBondContact O-N 3.49Å; V788-G791 VanDerWaalsContact O-N 3.15Å; V788-C792 PolarHBondContact O-N 3.15Å; V788-C792 PolarHBondContact O-SG 2.97Å; V788-I806 HydrophobicContact CG1-CG1 4.26Å; V788-I806 HydrophobicContact CG1-CG2 3.96Å; V788-I809 HydrophobicContact CG2-CB 4.43Å; V788-I809 HydrophobicContact CG2-CD1 4.45Å; V788-I809 HydrophobicContact CG2-CG2 3.66Å
789	M	98.4	Very high	94.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-45.8	174.6	-59.1	-179.4	-163.9	0	0	111.6	L746 W747 F750 C781 V785 Y786 G791 C792 W793	L746-M789 HydrophobicContact CB-CE 3.87Å; L746-M789 HydrophobicContact CB-CG 3.86Å; L746-M789 HydrophobicContact CB-SD 4.42Å; L746-M789 HydrophobicContact CD1-CG 4.07Å; W747-M789 HydrophobicContact CB-SD 4.08Å; F750-M789 HydrophobicContact CB-CE 4.28Å; F750-M789 HydrophobicContact CD2-CE 4.29Å; F750-M789 HydrophobicContact CG-CE 4.46Å; C781-M789 VanDerWaalsContact SG-CE 3.51Å; V785-M789 HydrophobicContact CG1-CE 4.13Å; V785-M789 PolarHBondContact O-N 3.34Å; Y786-M789 HydrophobicContact CD2-CB 4.33Å; Y786-M789 HydrophobicContact CD2-SD 3.74Å; Y786-M789 HydrophobicContact CE2-SD 4.35Å; Y786-M789 WeakPolarHBondContact O-CA 3.37Å; Y786-M789 WeakPolarHBondContact O-CB 3.4Å; Y786-M789 PolarHBondContact O-N 3.36Å; Y786-M789 VanDerWaalsContact O-N 3.08Å; M789-G791 VanDerWaalsContact C-N 3.29Å; M789-G791 PolarHBondContact O-N 3.35Å; M789-C792 WeakPolarHBondContact O-CA 3.47Å; M789-C792 WeakPolarHBondContact O-CB 3.49Å; M789-C792 PolarHBondContact O-N 2.94Å; M789-W793 HydrophobicContact CB-CD2 4.46Å; M789-W793 HydrophobicContact CB-CE3 4.04Å; M789-W793 HydrophobicContact CB-CH2 3.75Å; M789-W793 HydrophobicContact CB-CZ2 4.19Å; M789-W793 HydrophobicContact CB-CZ3 3.69Å; M789-W793 HydrophobicContact CG-CH2 4.25Å; M789-W793 VanDerWaalsContact O-CD2 3.31Å; M789-W793 PolarHBondContact O-N 3.5Å; M789-W793 HydrophobicContact SD-CH2 3.89Å; M789-W793 HydrophobicContact SD-CZ3 4.4Å
790	L	98.1	Very high	95.3	Very high	59 Å²	59	51 Å²	51	31%	0.309	24%	0.242	S	C	.	.	H	α-helix	trans	-62.1	-36.3	175.1	-67.2	175.9	0	0	0	112.1	V774 Y786 D787 V788 C792 W793 Q794	V774-L790 HydrophobicContact CG2-CD2 4.06Å; Y786-L790 HydrophobicContact CD1-CD1 3.88Å; Y786-L790 HydrophobicContact CD1-CG 4.1Å; Y786-L790 HydrophobicContact CE1-CD1 3.68Å; Y786-L790 HydrophobicContact CE1-CD2 3.98Å; Y786-L790 HydrophobicContact CE1-CG 3.83Å; Y786-L790 WeakPolarHBondContact O-CG 3.29Å; Y786-L790 PolarHBondContact O-N 3.48Å; D787-L790 PolarHBondContact O-N 3.46Å; V788-L790 PolarHBondContact O-N 2.95Å; L790-C792 VanDerWaalsContact C-N 3.32Å; L790-W793 PolarHBondContact O-N 3.04Å; L790-Q794 PolarHBondContact O-N 2.94Å; L790-Q794 PolarHBondContact O-NE2 3.41Å
791	G	97.9	Very high	95.9	Very high	10 Å²	10	50.7 Å²	50.7	10%	0.103	24%	0.238	C	C	.	.	H	α-helix	trans	-66.7	-28.4	171.8	0	0	0	0	0	114	D787 V788 M789 R800 L801	D787-G791 PolarHBondContact O-N 3.44Å; V788-G791 CarbonylContact O-C 3.46Å; V788-G791 WeakPolarHBondContact O-CA 3.26Å; V788-G791 PolarHBondContact O-N 3.49Å; V788-G791 VanDerWaalsContact O-N 3.15Å; M789-G791 VanDerWaalsContact C-N 3.29Å; M789-G791 PolarHBondContact O-N 3.35Å; G791-R800 VanDerWaalsContact O-CA 3.28Å; G791-R800 WeakPolarHBondContact O-CA 3.38Å; G791-L801 PolarHBondContact O-N 3.3Å
792	C	98.4	Very high	95.9	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-75.8	-32.4	170.1	-63.8	0	0	0	0	112.6	V739 V788 M789 L790 Q794 R800 I806	V739-C792 HydrophobicContact CG1-CB 4.12Å; V739-C792 WeakPolarHBondContact O-CB 3.38Å; V788-C792 PolarHBondContact O-N 3.15Å; V788-C792 PolarHBondContact O-SG 2.97Å; M789-C792 WeakPolarHBondContact O-CA 3.47Å; M789-C792 WeakPolarHBondContact O-CB 3.49Å; M789-C792 PolarHBondContact O-N 2.94Å; L790-C792 VanDerWaalsContact C-N 3.32Å; C792-Q794 PolarHBondContact O-N 3.47Å; C792-R800 VanDerWaalsContact O-CD 3.26Å; C792-R800 WeakPolarHBondContact O-CD 3.42Å; C792-R800 WeakPolarHBondContact O-CG 3.38Å; C792-I806 VanDerWaalsContact SG-CD1 3.58Å
793	W	98.3	Very high	96.1	Very high	13 Å²	13	54.9 Å²	54.9	5%	0.049	26%	0.26	C	S	.	.			trans	-95.1	25.9	-174.7	-57.4	-34.6	0	0	0	114.9	W740 G743 V744 W747 V774 L775 Y786 M789 L790 R795	W740-W793 AromaticContact CD2-CD1 3.62Å; W740-W793 HydrophobicContact CD2-CG 4.43Å; W740-W793 AromaticContact CE2-CD1 3.75Å; W740-W793 HydrophobicContact CE3-CB 4.14Å; W740-W793 AromaticContact CE3-CD1 3.99Å; W740-W793 HydrophobicContact CE3-CG 4.46Å; W740-W793 AromaticContact CG-CD1 3.91Å; W740-W793 HydrophobicContact CH2-CB 4.14Å; W740-W793 HydrophobicContact CZ3-CB 3.91Å; W740-W793 WeakPolarHBondContact CZ3-O 3.45Å; W740-W793 PolarHBondContact O-NE1 2.93Å; G743-W793 VanDerWaalsContact C-CZ2 3.43Å; G743-W793 VanDerWaalsContact O-CZ2 3.22Å; G743-W793 WeakPolarHBondContact O-CZ2 3.42Å; V744-W793 HydrophobicContact CG2-CZ2 4.26Å; W747-W793 HydrophobicContact CB-CH2 4.07Å; W747-W793 HydrophobicContact CB-CZ2 4.2Å; W747-W793 HydrophobicContact CG-CH2 4.35Å; V774-W793 HydrophobicContact CB-CD2 4.48Å; V774-W793 HydrophobicContact CB-CE3 3.84Å; V774-W793 HydrophobicContact CB-CZ3 4.44Å; V774-W793 HydrophobicContact CG1-CB 3.83Å; V774-W793 HydrophobicContact CG1-CE3 4.32Å; V774-W793 HydrophobicContact CG1-CG 4.47Å; V774-W793 HydrophobicContact CG2-CE3 4.44Å; L775-W793 HydrophobicContact CB-CH2 3.68Å; L775-W793 HydrophobicContact CB-CZ2 4.34Å; L775-W793 HydrophobicContact CB-CZ3 4.01Å; L775-W793 HydrophobicContact CD1-CH2 3.99Å; L775-W793 HydrophobicContact CD1-CZ2 3.84Å; L775-W793 HydrophobicContact CG-CH2 4.38Å; Y786-W793 HydrophobicContact CE2-CZ3 4.15Å; M789-W793 HydrophobicContact CB-CD2 4.46Å; M789-W793 HydrophobicContact CB-CE3 4.04Å; M789-W793 HydrophobicContact CB-CH2 3.75Å; M789-W793 HydrophobicContact CB-CZ2 4.19Å; M789-W793 HydrophobicContact CB-CZ3 3.69Å; M789-W793 HydrophobicContact CG-CH2 4.25Å; M789-W793 VanDerWaalsContact O-CD2 3.31Å; M789-W793 PolarHBondContact O-N 3.5Å; M789-W793 HydrophobicContact SD-CH2 3.89Å; M789-W793 HydrophobicContact SD-CZ3 4.4Å; L790-W793 PolarHBondContact O-N 3.04Å; W793-R795 PolarHBondContact O-N 3.45Å
794	Q	97.8	Very high	96.3	Very high	73 Å²	73	55 Å²	55	34%	0.341	26%	0.261	S	S	.	.			trans	-63	135.2	168.5	-62.5	-58.3	-55.2	0	0	110.3	L790 C792 E796 Q799 R800	L790-Q794 PolarHBondContact O-N 2.94Å; L790-Q794 PolarHBondContact O-NE2 3.41Å; C792-Q794 PolarHBondContact O-N 3.47Å; Q794-E796 PolarHBondContact O-N 3.48Å; Q794-Q799 HydrophobicContact CB-CB 3.93Å; Q794-Q799 HydrophobicContact CG-CB 4.25Å; Q794-Q799 WeakPolarHBondContact CG-O 3.37Å; Q794-R800 HydrophobicContact CB-CG 3.89Å; Q794-R800 PolarHBondContact O-NE 3.48Å; Q794-R800 PolarHBondContact O-NH2 3.38Å
795	R	92.5	Very high	96.4	Very high	116 Å²	116	55.8 Å²	55.8	44%	0.438	27%	0.265	S	S	.	.	S	Bend	trans	-60.4	-49.4	-176	-172.2	178.9	-175.5	94.7	5.9	110.9	T770 W793 R800	T770-R795 PolarHBondContact O-NH1 3.29Å; T770-R795 PolarHBondContact O-NH2 3.47Å; W793-R795 PolarHBondContact O-N 3.45Å; R795-R800 PolarHBondContact O-NH2 3Å
796	E	94.2	Very high	96.5	Very high	105 Å²	105	55.8 Å²	55.8	49%	0.491	26%	0.264	S	S	.	.	S	Bend	trans	-77.3	123.3	175.3	-62.8	-51.1	131	0	0	110.6	Q794 Q798 Q799	Q794-E796 PolarHBondContact O-N 3.48Å; E796-Q798 PolarHBondContact O-N 3.04Å; E796-Q798 VanDerWaalsContact O-N 3.14Å; E796-Q799 HydrophobicContact CB-CB 4.39Å; E796-Q799 HydrophobicContact CB-CG 4.03Å; E796-Q799 PolarHBondContact O-N 2.99Å
797	P	94.1	Very high	96.4	Very high	26 Å²	26	57.3 Å²	57.3	17%	0.169	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-55.9	-35.7	-176.5	-27.6	34.9	0	0	0	114	E726 E736 Q799 R800	E726-P797 HydrophobicContact CG-CG 4.09Å; E736-P797 HydrophobicContact CB-CB 3.78Å; E736-P797 HydrophobicContact CG-CB 4.27Å; P797-Q799 PolarHBondContact O-N 3.35Å; P797-R800 WeakPolarHBondContact O-CB 3.33Å; P797-R800 PolarHBondContact O-N 2.99Å
798	Q	93.7	Very high	96.3	Very high	165 Å²	165	61.2 Å²	61.2	77%	0.771	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-73	-10.3	-178.7	-53.1	-58.1	-24.9	0	0	114.1	E796	E796-Q798 PolarHBondContact O-N 3.04Å; E796-Q798 VanDerWaalsContact O-N 3.14Å
799	Q	96.4	Very high	96.1	Very high	126 Å²	126	64.1 Å²	64.1	59%	0.589	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-96.1	-7.6	176	-66.4	177.4	-8.2	0	0	112.4	Q794 E796 P797	Q794-Q799 HydrophobicContact CB-CB 3.93Å; Q794-Q799 HydrophobicContact CG-CB 4.25Å; Q794-Q799 WeakPolarHBondContact CG-O 3.37Å; E796-Q799 HydrophobicContact CB-CB 4.39Å; E796-Q799 HydrophobicContact CB-CG 4.03Å; E796-Q799 PolarHBondContact O-N 2.99Å; P797-Q799 PolarHBondContact O-N 3.35Å
800	R	97.9	Very high	95.9	Very high	19 Å²	19	64.1 Å²	64.1	7%	0.072	30%	0.299	C	S	.	.	S	Bend	trans	-70.4	145.2	179.2	-61.2	176.2	-170.7	151.8	12.2	110.4	E726 E736 V739 G791 C792 Q794 R795 P797	E726-R800 IonicContact OE1-CZ 3.43Å; E726-R800 IonicContact OE1-NH1 2.71Å; E726-R800 PolarHBondContact OE1-NH1 2.88Å; E726-R800 IonicContact OE1-NH2 3.27Å; E726-R800 PolarHBondContact OE1-NH2 3.48Å; E726-R800 IonicContact OE2-CZ 3.72Å; E726-R800 IonicContact OE2-NH1 3.75Å; E726-R800 IonicContact OE2-NH2 2.79Å; E726-R800 PolarHBondContact OE2-NH2 3.47Å; E736-R800 WeakPolarHBondContact O-CD 3.26Å; E736-R800 PolarHBondContact O-NH1 3.3Å; V739-R800 HydrophobicContact CG1-CB 4.02Å; G791-R800 VanDerWaalsContact O-CA 3.28Å; G791-R800 WeakPolarHBondContact O-CA 3.38Å; C792-R800 VanDerWaalsContact O-CD 3.26Å; C792-R800 WeakPolarHBondContact O-CD 3.42Å; C792-R800 WeakPolarHBondContact O-CG 3.38Å; Q794-R800 HydrophobicContact CB-CG 3.89Å; Q794-R800 PolarHBondContact O-NE 3.48Å; Q794-R800 PolarHBondContact O-NH2 3.38Å; R795-R800 PolarHBondContact O-NH2 3Å; P797-R800 WeakPolarHBondContact O-CB 3.33Å; P797-R800 PolarHBondContact O-N 2.99Å
801	L	96.5	Very high	95.4	Very high	54 Å²	54	64.6 Å²	64.6	28%	0.283	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-58.1	141.4	176.6	-68.9	175.1	0	0	0	111.3	V739 G791 I806	V739-L801 WeakPolarHBondContact CG1-O 3.42Å; G791-L801 PolarHBondContact O-N 3.3Å; L801-I806 HydrophobicContact CB-CD1 3.86Å; L801-I806 HydrophobicContact CB-CG1 3.67Å; L801-I806 HydrophobicContact CD1-CG1 4.27Å
802	N	93.1	Very high	95	Very high	80 Å²	80	67 Å²	67	43%	0.428	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-69.9	138.1	176.8	-167.7	-65.6	0	0	0	110.2	K804 E805 I806	N802-K804 PolarHBondContact O-N 2.96Å; N802-K804 VanDerWaalsContact O-N 3.08Å; N802-K804 WeakPolarHBondContact OD1-CB 3.49Å; N802-K804 PolarHBondContact OD1-N 3.36Å; N802-E805 HydrophobicContact CB-CB 4.34Å; N802-E805 HydrophobicContact CB-CG 3.98Å; N802-E805 VanDerWaalsContact CB-OE2 3.28Å; N802-E805 WeakPolarHBondContact CB-OE2 3.3Å; N802-E805 PolarHBondContact N-OE2 3.37Å; N802-E805 WeakPolarHBondContact O-CA 3.35Å; N802-E805 WeakPolarHBondContact O-CB 3.32Å; N802-E805 PolarHBondContact O-N 2.95Å; N802-I806 WeakPolarHBondContact O-CG1 3.31Å; N802-I806 PolarHBondContact O-N 3.48Å
803	I	96.8	Very high	94.5	Very high	10 Å²	10	68.2 Å²	68.2	5%	0.051	33%	0.325	C	S	.	.	H	α-helix	trans	-57.3	-28.7	179.1	-165.6	61	0	0	0	113.6	A664 M667 V668 A671 V739 F742 E805 I806 Y807	A664-I803 HydrophobicContact CB-CD1 4.32Å; M667-I803 HydrophobicContact CB-CD1 4.04Å; M667-I803 HydrophobicContact CB-CG1 3.61Å; M667-I803 HydrophobicContact CE-CD1 3.83Å; M667-I803 HydrophobicContact CE-CG1 4.12Å; M667-I803 HydrophobicContact SD-CD1 3.75Å; M667-I803 HydrophobicContact SD-CG1 4.31Å; V668-I803 HydrophobicContact CG2-CG1 4.2Å; V668-I803 HydrophobicContact CG2-CG2 4.05Å; A671-I803 HydrophobicContact CB-CG2 4.17Å; V739-I803 HydrophobicContact CG2-CB 4.04Å; F742-I803 HydrophobicContact CD1-CD1 4.23Å; F742-I803 HydrophobicContact CG-CD1 4.2Å; I803-E805 VanDerWaalsContact C-N 3.35Å; I803-I806 HydrophobicContact CD1-CB 4.36Å; I803-I806 HydrophobicContact CD1-CD1 4.25Å; I803-I806 HydrophobicContact CD1-CG2 4.32Å; I803-Y807 WeakPolarHBondContact O-CB 3.3Å; I803-Y807 PolarHBondContact O-N 3.38Å
804	K	95.8	Very high	93.6	Very high	108 Å²	108	68.5 Å²	68.5	47%	0.47	33%	0.332	S	S	.	.	H	α-helix	trans	-69.9	-29.4	173.1	-66.6	175.6	179.6	175.7	0	113.1	V668 N802 K808	V668-K804 HydrophobicContact CB-CG 4.46Å; V668-K804 HydrophobicContact CG1-CG 3.87Å; V668-K804 HydrophobicContact CG2-CB 4.39Å; V668-K804 HydrophobicContact CG2-CG 3.85Å; N802-K804 PolarHBondContact O-N 2.96Å; N802-K804 VanDerWaalsContact O-N 3.08Å; N802-K804 WeakPolarHBondContact OD1-CB 3.49Å; N802-K804 PolarHBondContact OD1-N 3.36Å; K804-K808 WeakPolarHBondContact O-CG 3.29Å; K804-K808 PolarHBondContact O-N 3.36Å
805	E	95.3	Very high	92.6	Very high	98 Å²	98	72.7 Å²	72.7	46%	0.458	35%	0.349	S	S	.	.	H	α-helix	trans	-80.7	-44.9	176.2	-64.6	168.2	156.7	0	0	110	N802 I803 Y807 K808 I809	N802-E805 HydrophobicContact CB-CB 4.34Å; N802-E805 HydrophobicContact CB-CG 3.98Å; N802-E805 VanDerWaalsContact CB-OE2 3.28Å; N802-E805 WeakPolarHBondContact CB-OE2 3.3Å; N802-E805 PolarHBondContact N-OE2 3.37Å; N802-E805 WeakPolarHBondContact O-CA 3.35Å; N802-E805 WeakPolarHBondContact O-CB 3.32Å; N802-E805 PolarHBondContact O-N 2.95Å; I803-E805 VanDerWaalsContact C-N 3.35Å; E805-Y807 VanDerWaalsContact C-N 3.32Å; E805-Y807 PolarHBondContact O-N 2.86Å; E805-K808 WeakPolarHBondContact O-CB 3.47Å; E805-K808 PolarHBondContact O-N 2.89Å; E805-I809 WeakPolarHBondContact O-CG1 3.46Å; E805-I809 PolarHBondContact O-N 3.34Å
806	I	97.3	Very high	91.4	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-52	-50	171.7	-66.5	168	0	0	0	110.6	V739 F742 V788 C792 L801 N802 I803 K808 I809 L810	V739-I806 HydrophobicContact CG1-CD1 3.86Å; F742-I806 HydrophobicContact CD1-CG2 3.92Å; F742-I806 HydrophobicContact CE1-CG2 3.36Å; F742-I806 HydrophobicContact CZ-CG2 4.2Å; V788-I806 HydrophobicContact CG1-CG1 4.26Å; V788-I806 HydrophobicContact CG1-CG2 3.96Å; C792-I806 VanDerWaalsContact SG-CD1 3.58Å; L801-I806 HydrophobicContact CB-CD1 3.86Å; L801-I806 HydrophobicContact CB-CG1 3.67Å; L801-I806 HydrophobicContact CD1-CG1 4.27Å; N802-I806 WeakPolarHBondContact O-CG1 3.31Å; N802-I806 PolarHBondContact O-N 3.48Å; I803-I806 HydrophobicContact CD1-CB 4.36Å; I803-I806 HydrophobicContact CD1-CD1 4.25Å; I803-I806 HydrophobicContact CD1-CG2 4.32Å; I806-K808 PolarHBondContact O-N 2.98Å; I806-I809 PolarHBondContact O-N 3.34Å; I806-L810 HydrophobicContact CG2-CD1 3.74Å; I806-L810 HydrophobicContact CG2-CG 4.37Å; I806-L810 WeakPolarHBondContact O-CG 3.39Å; I806-L810 PolarHBondContact O-N 2.98Å
807	Y	97	Very high	89.8	Confident	70 Å²	70	68.4 Å²	68.4	28%	0.275	35%	0.35	S	S	.	.	H	α-helix	trans	-56.5	-45.3	175.7	171.8	-110.2	0	0	0	112.6	S661 A664 I803 E805 H811	S661-Y807 WeakPolarHBondContact O-CD2 3.46Å; S661-Y807 WeakPolarHBondContact O-CE2 3.42Å; A664-Y807 HydrophobicContact CB-CD2 4.2Å; I803-Y807 WeakPolarHBondContact O-CB 3.3Å; I803-Y807 PolarHBondContact O-N 3.38Å; E805-Y807 VanDerWaalsContact C-N 3.32Å; E805-Y807 PolarHBondContact O-N 2.86Å; Y807-H811 HydrophobicContact CE2-CB 4.43Å; Y807-H811 WeakPolarHBondContact O-CB 3.3Å; Y807-H811 PolarHBondContact O-N 3.42Å
808	K	94.6	Very high	88.2	Confident	148 Å²	148	68.9 Å²	68.9	64%	0.643	35%	0.354	S	S	*	.	H	α-helix	trans	-62.8	-42.7	177.7	-73.9	171.8	-179	-180	0	112.2	K804 E805 I806 A812	K804-K808 WeakPolarHBondContact O-CG 3.29Å; K804-K808 PolarHBondContact O-N 3.36Å; E805-K808 WeakPolarHBondContact O-CB 3.47Å; E805-K808 PolarHBondContact O-N 2.89Å; I806-K808 PolarHBondContact O-N 2.98Å; K808-A812 WeakPolarHBondContact O-CB 3.22Å; K808-A812 PolarHBondContact O-N 2.9Å
809	I	94.9	Very high	86.3	Confident	66 Å²	66	68.7 Å²	68.7	34%	0.338	36%	0.356	S	S	.	.	H	α-helix	trans	-63.5	-51.8	179.1	-65	161.2	0	0	0	109.9	V788 E805 I806 H811 A812 L813	V788-I809 HydrophobicContact CG2-CB 4.43Å; V788-I809 HydrophobicContact CG2-CD1 4.45Å; V788-I809 HydrophobicContact CG2-CG2 3.66Å; E805-I809 WeakPolarHBondContact O-CG1 3.46Å; E805-I809 PolarHBondContact O-N 3.34Å; I806-I809 PolarHBondContact O-N 3.34Å; I809-H811 PolarHBondContact O-N 2.89Å; I809-A812 PolarHBondContact O-N 3.38Å; I809-L813 HydrophobicContact CG2-CD1 3.99Å; I809-L813 WeakPolarHBondContact O-CG 3.45Å; I809-L813 PolarHBondContact O-N 3.32Å
810	L	93.3	Very high	84	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-62.9	-40.5	179.8	-66.5	171.5	0	0	0	112.3	L657 A660 A664 F742 L746 I806 A812 L813 G814	L657-L810 HydrophobicContact CD2-CD2 4.03Å; A660-L810 HydrophobicContact CB-CD1 4.11Å; A664-L810 HydrophobicContact CB-CD1 4.3Å; F742-L810 HydrophobicContact CE1-CD1 3.8Å; F742-L810 HydrophobicContact CZ-CD1 3.62Å; L746-L810 HydrophobicContact CD2-CD1 4.12Å; L746-L810 HydrophobicContact CD2-CD2 4.25Å; I806-L810 HydrophobicContact CG2-CD1 3.74Å; I806-L810 HydrophobicContact CG2-CG 4.37Å; I806-L810 WeakPolarHBondContact O-CG 3.39Å; I806-L810 PolarHBondContact O-N 2.98Å; L810-A812 VanDerWaalsContact C-N 3.35Å; L810-A812 PolarHBondContact O-N 2.82Å; L810-L813 PolarHBondContact O-N 3.23Å; L810-G814 PolarHBondContact O-N 3.47Å
811	H	88.2	Confident	81.6	Confident	70 Å²	70	72.2 Å²	72.2	32%	0.324	37%	0.374	S	S	.	.	H	α-helix	trans	-67.4	-34.6	177.3	-171.8	51.5	0	0	0	112.5	Y807 I809 K815	Y807-H811 HydrophobicContact CE2-CB 4.43Å; Y807-H811 WeakPolarHBondContact O-CB 3.3Å; Y807-H811 PolarHBondContact O-N 3.42Å; I809-H811 PolarHBondContact O-N 2.89Å; H811-K815 WeakPolarHBondContact CE1-CE 3.48Å; H811-K815 WeakPolarHBondContact NE2-CE 3.42Å; H811-K815 PolarHBondContact NE2-NZ 3.32Å; H811-K815 PolarHBondContact O-N 2.94Å
812	A	89.1	Confident	79.1	Confident	60 Å²	60	74.2 Å²	74.2	50%	0.496	39%	0.385	S	S	.	.	H	α-helix	trans	-67.5	-47.7	173.2	0	0	0	0	0	111.7	K808 I809 L810 G814 K815 A816	K808-A812 WeakPolarHBondContact O-CB 3.22Å; K808-A812 PolarHBondContact O-N 2.9Å; I809-A812 PolarHBondContact O-N 3.38Å; L810-A812 VanDerWaalsContact C-N 3.35Å; L810-A812 PolarHBondContact O-N 2.82Å; A812-G814 VanDerWaalsContact C-N 3.26Å; A812-G814 PolarHBondContact O-N 3.03Å; A812-K815 PolarHBondContact O-N 2.88Å; A812-K815 VanDerWaalsContact O-N 3.13Å; A812-A816 PolarHBondContact O-N 3.48Å
813	L	87.6	Confident	76.6	Confident	25 Å²	25	77.4 Å²	77.4	13%	0.131	40%	0.4	C	S	.	.	H	α-helix	trans	-59.8	-35.7	174.3	-67.7	171.4	0	0	0	111.9	L657 E784 V785 I809 L810 K815 A816 T817 P818	L657-L813 HydrophobicContact CD1-CB 3.96Å; L657-L813 HydrophobicContact CD2-CB 4.13Å; E784-L813 HydrophobicContact CB-CD1 4.12Å; E784-L813 HydrophobicContact CB-CD2 4.03Å; E784-L813 HydrophobicContact CG-CD2 4.38Å; V785-L813 HydrophobicContact CG2-CD1 4.2Å; I809-L813 HydrophobicContact CG2-CD1 3.99Å; I809-L813 WeakPolarHBondContact O-CG 3.45Å; I809-L813 PolarHBondContact O-N 3.32Å; L810-L813 PolarHBondContact O-N 3.23Å; L813-K815 VanDerWaalsContact C-N 3.35Å; L813-K815 PolarHBondContact O-N 2.87Å; L813-A816 CarbonylContact O-C 3.55Å; L813-A816 VanDerWaalsContact O-C 3.25Å; L813-T817 VanDerWaalsContact O-CA 3.23Å; L813-T817 WeakPolarHBondContact O-CA 3.07Å; L813-T817 PolarHBondContact O-N 3.47Å; L813-P818 HydrophobicContact CD2-CG 3.85Å
814	G	79.9	Confident	73.8	Confident	20 Å²	20	84.2 Å²	84.2	21%	0.206	44%	0.436	C	S	.	.	H	α-helix	trans	-65.4	-33.4	175.5	0	0	0	0	0	113.8	L810 A812	L810-G814 PolarHBondContact O-N 3.47Å; A812-G814 VanDerWaalsContact C-N 3.26Å; A812-G814 PolarHBondContact O-N 3.03Å
815	K	76.1	Confident	70.8	Confident	160 Å²	160	85.2 Å²	85.2	70%	0.696	48%	0.477	S	S	*	.	H	α-helix	trans	-82.3	-31	176.6	-72.7	-176.8	-177.1	170.4	0	113.8	H811 A812 L813	H811-K815 WeakPolarHBondContact CE1-CE 3.48Å; H811-K815 WeakPolarHBondContact NE2-CE 3.42Å; H811-K815 PolarHBondContact NE2-NZ 3.32Å; H811-K815 PolarHBondContact O-N 2.94Å; A812-K815 PolarHBondContact O-N 2.88Å; A812-K815 VanDerWaalsContact O-N 3.13Å; L813-K815 VanDerWaalsContact C-N 3.35Å; L813-K815 PolarHBondContact O-N 2.87Å
816	A	68.8	Low	69.6	Low	74 Å²	74	84.6 Å²	84.6	61%	0.612	48%	0.478	S	S	*	.	S	Bend	trans	-124.9	71	179	0	0	0	0	0	109.1	A812 L813 P818	A812-A816 PolarHBondContact O-N 3.48Å; L813-A816 CarbonylContact O-C 3.55Å; L813-A816 VanDerWaalsContact O-C 3.25Å; A816-P818 WeakPolarHBondContact O-CD 3.28Å
817	T	60.4	Low	68.1	Low	57 Å²	57	89.1 Å²	89.1	35%	0.35	50%	0.503	S	S	.	.			trans	-60.5	120	-173.1	-55.2	0	0	0	0	111.3	L653 L813	L653-T817 HydrophobicContact CB-CG2 4.02Å; L653-T817 HydrophobicContact CD2-CG2 3.61Å; L653-T817 HydrophobicContact CG-CG2 3.7Å; L813-T817 VanDerWaalsContact O-CA 3.23Å; L813-T817 WeakPolarHBondContact O-CA 3.07Å; L813-T817 PolarHBondContact O-N 3.47Å
818	P	58.9	Low	66.5	Low	37 Å²	37	90.1 Å²	90.1	24%	0.24	52%	0.516	C	S	.	.			trans	-61.1	142.1	179	-23.8	33.8	0	0	0	112.3	L813 A816 Y820	L813-P818 HydrophobicContact CD2-CG 3.85Å; A816-P818 WeakPolarHBondContact O-CD 3.28Å; P818-Y820 PolarHBondContact O-N 2.87Å; P818-Y820 VanDerWaalsContact O-N 3.08Å
819	I	54.6	Low	64.9	Low	160 Å²	160	86.7 Å²	86.7	82%	0.821	51%	0.508	S	S	*	.			trans	-75.6	98.1	170.9	-58.2	174.7	0	0	0	107.8	L821	I819-L821 HydrophobicContact CG2-CD1 4.29Å; I819-L821 HydrophobicContact CG2-CG 4.16Å
820	Y	47.6	Very low	63	Low	93 Å²	93	88 Å²	88	37%	0.365	52%	0.519	S	S	.	.			trans	-92.2	118.3	169.1	-173.1	-106.2	0	0	0	109.4	R779 P818 D822	R779-Y820 PolarHBondContact O-OH 3.46Å; P818-Y820 PolarHBondContact O-N 2.87Å; P818-Y820 VanDerWaalsContact O-N 3.08Å; Y820-D822 HydrophobicContact CE1-CB 4.49Å
821	L	47.8	Very low	61	Low	126 Å²	126	93.9 Å²	93.9	66%	0.66	55%	0.554	S	S	*	*			trans	-115.2	124.3	171.1	-74.9	167.1	0	0	0	107.8	I819 I823	I819-L821 HydrophobicContact CG2-CD1 4.29Å; I819-L821 HydrophobicContact CG2-CG 4.16Å; L821-I823 HydrophobicContact CB-CG1 4.4Å; L821-I823 PolarHBondContact O-N 2.85Å
822	D	43.6	Very low	59	Low	97 Å²	97	95.6 Å²	95.6	52%	0.519	57%	0.57	S	S	.	*			trans	-77.4	107.7	169.2	-163.1	-10.5	0	0	0	108.4	Y820 L824	Y820-D822 HydrophobicContact CE1-CB 4.49Å; D822-L824 VanDerWaalsContact C-N 3.34Å; D822-L824 PolarHBondContact OD1-N 2.9Å
823	I	41.6	Very low	56.7	Low	147 Å²	147	98.3 Å²	98.3	75%	0.754	58%	0.576	S	S	*	*	S	Bend	trans	-88.9	-7.5	-174.6	-66.9	164.8	0	0	0	110.8	L821	L821-I823 HydrophobicContact CB-CG1 4.4Å; L821-I823 PolarHBondContact O-N 2.85Å
824	L	36.6	Very low	54.2	Low	153 Å²	153	104.4 Å²	104.4	80%	0.801	61%	0.613	S	S	*	*			trans	-141	73.3	-173.3	-65.1	173.6	0	0	0	111	D822	D822-L824 VanDerWaalsContact C-N 3.34Å; D822-L824 PolarHBondContact OD1-N 2.9Å
825	G	34	Very low	51.8	Low	129 Å²	129	112.1 Å²	112.1	100%	1.33	65%	0.65	S	S	*	*			trans	-64.7	0	174.7	0	0	0	0	0	114.6

Retrieved 825 of 825 residues in 548.1 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).