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NT-3 growth factor 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 Q16288, Species HUMAN (Homo sapiens, Human), Gene NTRK3, Length 839 aa.

						>NTRK3_HUMAN|Q16288|NTRK3
MDVSLCPAKCSFWRIFLLGSVWLDYVGSVLACPANCVCSKTEINCRRPDDGNLFPLLEGQDSGNSNGNASINITDISRNITSIHIENWRSLHTLNAVDMELYTGLQKLTIKNSGLRSIQPRAFAKNPHLRYINLSSNRLTTLSWQLFQTLSLRELQLEQNFFNCSCDIRWMQLWQEQGEAKLNSQNLYCINADGSQLPLFRMNISQCDLPEISVSHVNLTVREGDNAVITCNGSGSPLPDVDWIVTGLQSINTHQTNLNWTNVHAINLTLVNVTSEDNGFTLTCIAENVVGMSNASVALTVYYPPRVVSLEEPELRLEHCIEFVVRGNPPPTLHWLHNGQPLRESKIIHVEYYQEGEISEGCLLFNKPTHYNNGNYTLIAKNPLGTANQTINGHFLKEPFPESTDNFILFDEVSPTPPITVTHKPEEDTFGVSIAVGLAAFACVLLVVLFVMINKYGRRSKFGMKGPVAVISGEEDSASPLHHINHGITTPSSLDAGPDTVVIGMTRIPVIENPQYFRQGHNCHKPDTYVQHIKRRDIVLKRELGEGAFGKVFLAECYNLSPTKDKMLVAVKALKDPTLAARKDFQREAELLTNLQHEHIVKFYGVCGDGDPLIMVFEYMKHGDLNKFLRAHGPDAMILVDGQPRQAKGELGLSQMLHIASQIASGMVYLASQHFVHRDLATRNCLVGANLLVKIGDFGMSRDVYSTDYYRLFNPSGNDFCIWCEVGGHTMLPIRWMPPESIMYRKFTTESDVWSFGVILWEIFTYGKQPWFQLSNTEVIECITQGRVLERPRVCPKEVYDVMLGCWQREPQQRLNIKEIYKILHALGKATPIYLDILG
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.8	Very low	36.6	Very low	241 Å²	241	138.5 Å²	138.5	100%	1.187	82%	0.815	S	S	*	*				0	103.2	0	-68.4	174.7	-179.9	0	0	106.3
2	D	36.1	Very low	36.2	Very low	157 Å²	157	142.7 Å²	142.7	84%	0.84	82%	0.816	S	S	*	*			trans	2.2	148.9	162.6	-47.1	-26.1	0	0	0	120.3
3	V	36.6	Very low	35.6	Very low	120 Å²	120	146.5 Å²	146.5	73%	0.727	81%	0.81	S	S	*	*			cis	179	134.6	-29.1	125.6	0	0	0	0	106.4
4	S	37.1	Very low	35	Very low	104 Å²	104	150.6 Å²	150.6	73%	0.727	81%	0.807	S	S	*	*			trans	61.4	162.8	161	75.9	0	0	0	0	119.1
5	L	36.3	Very low	35	Very low	166 Å²	166	149.3 Å²	149.3	87%	0.869	80%	0.798	S	S	*	*			cis	-151.4	165	-17.6	-140.4	78.4	0	0	0	109
6	C	30.5	Very low	35	Very low	112 Å²	112	151.1 Å²	151.1	76%	0.757	80%	0.797	S	S	*	*			trans	-99.1	-170.4	172.7	-128.6	0	0	0	0	110.2
7	P	46	Very low	34.7	Very low	113 Å²	113	150 Å²	150	73%	0.734	79%	0.791	S	S	*	*			cis	-140.7	-174.2	-18.5	34.4	-12.4	0	0	0	115.8
8	A	40.5	Very low	34.6	Very low	84 Å²	84	150.9 Å²	150.9	69%	0.694	80%	0.795	S	S	*	*				116.8	107	128.3	0	0	0	0	0	122.9
9	K	36.8	Very low	34.4	Very low	196 Å²	196	147.2 Å²	147.2	85%	0.852	80%	0.797	S	S	*	*				92.7	112.3	128.1	-73.8	-177.4	176.3	-179.5	0	123.5
10	C	33.2	Very low	34.2	Very low	115 Å²	115	145.6 Å²	145.6	78%	0.777	80%	0.797	S	S	*	*			trans	87	62.5	131.8	-61.7	0	0	0	0	122.2
11	S	32.3	Very low	34.2	Very low	115 Å²	115	144.6 Å²	144.6	80%	0.804	80%	0.795	S	S	*	*				18.1	118.2	128.1	171.1	0	0	0	0	120.5
12	F	32.2	Very low	34.1	Very low	189 Å²	189	144.4 Å²	144.4	83%	0.829	78%	0.781	S	S	*	*			trans	-133.5	127.9	146.5	-111.9	-108.3	0	0	0	109.9
13	W	28.2	Very low	33.9	Very low	193 Å²	193	144.8 Å²	144.8	73%	0.731	78%	0.783	S	S	*	*			trans	69.2	136.4	156.1	-79.8	55.7	0	0	0	122.9
14	R	27.7	Very low	33.6	Very low	204 Å²	204	145.6 Å²	145.6	77%	0.77	78%	0.783	S	S	*	*			trans	94.3	137.3	138.8	-100.8	172.8	-171.9	-172.9	3.9	121.6
15	I	34.8	Very low	33.2	Very low	130 Å²	130	150.9 Å²	150.9	67%	0.667	79%	0.788	S	S	*	*			trans	111.2	107.9	137.9	-78.3	159.2	0	0	0	119.7
16	F	34.6	Very low	33.1	Very low	179 Å²	179	149 Å²	149	79%	0.785	78%	0.783	S	S	*	*			trans	68.9	157	143.4	-74.6	-133.6	0	0	0	119.3
17	L	30.3	Very low	33	Very low	132 Å²	132	146.7 Å²	146.7	69%	0.691	78%	0.778	S	S	*	*			cis	-171	156.6	-36.9	-124.6	174	0	0	0	107.7
18	L	32.2	Very low	32.3	Very low	167 Å²	167	146 Å²	146	87%	0.874	78%	0.776	S	S	*	*			trans	71.6	140.3	165.8	-60.3	161.3	0	0	0	119.5
19	G	31.6	Very low	32	Very low	80 Å²	80	147.1 Å²	147.1	83%	0.825	77%	0.774	S	S	*	*			trans	134.7	80.7	164.5	0	0	0	0	0	115.4
20	S	30	Very low	32.4	Very low	115 Å²	115	141.6 Å²	141.6	80%	0.804	75%	0.754	S	S	*	*			trans	-77.6	157.8	177.4	45.4	0	0	0	0	114.3
21	V	35.4	Very low	33.5	Very low	125 Å²	125	138.2 Å²	138.2	76%	0.758	73%	0.734	S	S	*	*				157.4	151.2	129.1	163	0	0	0	0	110.4
22	W	34.3	Very low	35.3	Very low	236 Å²	236	134.7 Å²	134.7	89%	0.894	71%	0.709	S	S	*	*			trans	103	65.6	-177.1	-69.5	93.5	0	0	0	115.6
23	L	30.3	Very low	37.3	Very low	165 Å²	165	127.2 Å²	127.2	86%	0.864	68%	0.679	S	S	*	*			trans	-145	93	161.3	-162.2	142.4	0	0	0	108.5
24	D	31.4	Very low	39.4	Very low	137 Å²	137	122 Å²	122	73%	0.733	68%	0.677	S	S	*	*			trans	-132.6	113.7	175.7	-82.5	-49.9	0	0	0	109
25	Y	29.7	Very low	41.9	Very low	216 Å²	216	114.5 Å²	114.5	85%	0.847	65%	0.653	S	S	*	*				-179.2	114.3	118.6	-116.5	-111.4	0	0	0	111.4
26	V	33.3	Very low	44.3	Very low	126 Å²	126	108.8 Å²	108.8	76%	0.764	62%	0.624	S	S	*	*			trans	59.7	117.6	154.3	-167.7	0	0	0	0	117.6
27	G	27.6	Very low	46.7	Very low	63 Å²	63	104.9 Å²	104.9	65%	0.649	62%	0.615	S	S	*	*			cis	108.7	98	3.6	0	0	0	0	0	114
28	S	31.4	Very low	49.3	Very low	99 Å²	99	100.6 Å²	100.6	69%	0.692	60%	0.595	S	S	*	*				168.5	117	128.4	46.5	0	0	0	0	114.1
29	V	34.6	Very low	51.7	Low	108 Å²	108	95.8 Å²	95.8	66%	0.655	58%	0.576	S	S	*	*			trans	51	97.4	140.2	-165.3	0	0	0	0	119.8
30	L	45.4	Very low	54	Low	79 Å²	79	101 Å²	101	41%	0.414	58%	0.575	S	S	.	*			trans	-151	134.8	144.7	-100.4	146	0	0	0	107.7	C32 L57 I76	L30-C32 PolarHBondContact O-N 3.4Å; L30-C32 VanDerWaalsContact O-N 3.08Å; L30-L57 HydrophobicContact CD2-CB 4.14Å; L30-L57 HydrophobicContact CD2-CD2 4.4Å; L30-I76 HydrophobicContact CD1-CB 4.28Å; L30-I76 HydrophobicContact CD1-CD1 3.7Å; L30-I76 HydrophobicContact CD1-CG1 3.93Å; L30-I76 HydrophobicContact CD1-CG2 3.46Å; L30-I76 VanDerWaalsContact CD1-CG2 3.46Å; L30-I76 HydrophobicContact CD2-CD1 4.06Å; L30-I76 HydrophobicContact CD2-CG2 4.12Å; L30-I76 HydrophobicContact CG-CD1 4.07Å; L30-I76 HydrophobicContact CG-CG2 4.4Å
31	A	55.9	Low	56.7	Low	44 Å²	44	98.8 Å²	98.8	36%	0.364	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-81.4	87.4	173.1	0	0	0	0	0	109.1	E58	A31-E58 HydrophobicContact CB-CB 4.09Å; A31-E58 PolarHBondContact N-O 3.38Å
32	C	70.4	Confident	59.3	Low	41 Å²	41	96.2 Å²	96.2	28%	0.277	54%	0.537	S	S	.	.			trans	-59.4	134.7	166	-174.6	0	0	0	0	109.2	L30 A34 C38	L30-C32 PolarHBondContact O-N 3.4Å; L30-C32 VanDerWaalsContact O-N 3.08Å; C32-A34 PolarHBondContact O-N 2.97Å; C32-C38 VanDerWaalsContact CA-SG 3.58Å; C32-C38 HydrophobicContact CB-CB 3.65Å; C32-C38 WeakPolarHBondContact CB-SG 3.2Å; C32-C38 WeakPolarHBondContact SG-CB 3.35Å; C32-C38 PolarHBondContact SG-N 3.42Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 2.97Å
33	P	74.5	Confident	62	Low	32 Å²	32	85 Å²	85	21%	0.208	49%	0.494	C	S	.	.			trans	-54	139.8	179	-27.5	35.1	0	0	0	111.7	N35 C36 P55 L56	P33-N35 PolarHBondContact O-N 3.37Å; P33-C36 HydrophobicContact CB-CB 4.3Å; P33-C36 WeakPolarHBondContact O-CA 3.33Å; P33-C36 WeakPolarHBondContact O-CB 3.37Å; P33-C36 PolarHBondContact O-N 3.04Å; P33-P55 HydrophobicContact CG-CB 3.92Å; P33-L56 WeakPolarHBondContact CG-O 3.48Å
34	A	71.5	Confident	64.8	Low	84 Å²	84	78.4 Å²	78.4	69%	0.694	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-25.9	-166.5	0	0	0	0	0	115.2	C32 R47	C32-A34 PolarHBondContact O-N 2.97Å; A34-R47 PolarHBondContact O-NH1 3.22Å; A34-R47 VanDerWaalsContact O-NH1 3.15Å
35	N	80.9	Confident	67.6	Low	47 Å²	47	71.9 Å²	71.9	25%	0.251	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	4.2	179.4	-66.7	-43.7	0	0	0	114.1	P33 R47 D49 W88	P33-N35 PolarHBondContact O-N 3.37Å; N35-R47 HydrophobicContact CB-CB 4.17Å; N35-R47 WeakPolarHBondContact O-CB 3.3Å; N35-D49 HydrophobicContact CB-CB 4.25Å; N35-D49 PolarHBondContact ND2-OD1 3.07Å; N35-D49 PolarHBondContact ND2-OD2 2.98Å; N35-W88 HydrophobicContact CB-CZ2 4.24Å
36	C	85.4	Confident	70.2	Confident	10 Å²	10	68.5 Å²	68.5	7%	0.068	41%	0.411	C	S	.	.			trans	-117.5	161.7	-177.2	-54.1	0	0	0	0	112.4	P33 I43 N44 C45	P33-C36 HydrophobicContact CB-CB 4.3Å; P33-C36 WeakPolarHBondContact O-CA 3.33Å; P33-C36 WeakPolarHBondContact O-CB 3.37Å; P33-C36 PolarHBondContact O-N 3.04Å; C36-I43 HydrophobicContact CB-CG2 4.32Å; C36-N44 CarbonylContact C-O 3.59Å; C36-N44 WeakPolarHBondContact CA-O 3.32Å; C36-C45 HydrophobicContact CB-CB 4.04Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.43Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.92Å
37	V	85.5	Confident	72.3	Confident	97 Å²	97	69.4 Å²	69.4	59%	0.588	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	119.5	166.5	-179.8	0	0	0	0	107	N44	V37-N44 PolarHBondContact N-O 2.92Å; V37-N44 PolarHBondContact O-N 3.39Å
38	C	84.1	Confident	74.4	Confident	42 Å²	42	70.8 Å²	70.8	28%	0.284	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	139	-176.9	-52.4	0	0	0	0	110.2	C32 E42	C32-C38 VanDerWaalsContact CA-SG 3.58Å; C32-C38 HydrophobicContact CB-CB 3.65Å; C32-C38 WeakPolarHBondContact CB-SG 3.2Å; C32-C38 WeakPolarHBondContact SG-CB 3.35Å; C32-C38 PolarHBondContact SG-N 3.42Å; C32-C38 CovalentContact SG-SG 2.04Å; C32-C38 PolarHBondContact SG-SG 2.97Å; C38-E42 CarbonylContact C-O 3.51Å; C38-E42 WeakPolarHBondContact CA-O 3.3Å
39	S	82.8	Confident	76.2	Confident	66 Å²	66	67.9 Å²	67.9	46%	0.462	38%	0.375	S	S	.	.			trans	-114.3	-172.2	167.8	81.5	0	0	0	0	109.6	T41 E42	S39-T41 PolarHBondContact O-N 2.89Å; S39-T41 PolarHBondContact OG-N 3.48Å; S39-E42 PolarHBondContact N-O 3.18Å; S39-E42 WeakPolarHBondContact OG-CB 3.14Å; S39-E42 PolarHBondContact OG-N 3.35Å
40	K	80.8	Confident	77.5	Confident	188 Å²	188	69.2 Å²	69.2	82%	0.817	38%	0.379	S	S	*	.	S	Bend	trans	-66	-18.5	175.2	-66.4	-172.8	177.2	-174.9	0	113.8
41	T	86.7	Confident	78.4	Confident	69 Å²	69	66.8 Å²	66.8	42%	0.423	37%	0.373	S	S	.	.	S	Bend	trans	-137.2	-7.7	-173.2	59.4	0	0	0	0	114.2	S39 N79 T81 S82	S39-T41 PolarHBondContact O-N 2.89Å; S39-T41 PolarHBondContact OG-N 3.48Å; T41-N79 WeakPolarHBondContact CA-O 3.38Å; T41-T81 PolarHBondContact O-N 2.96Å; T41-T81 PolarHBondContact O-OG1 2.76Å; T41-S82 PolarHBondContact O-N 2.87Å; T41-S82 VanDerWaalsContact O-N 3.1Å
42	E	89.6	Confident	79	Confident	71 Å²	71	69.8 Å²	69.8	33%	0.332	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	136.3	-176.2	-173.1	-174.1	169	0	0	111.6	C38 S39 N44 S82	C38-E42 CarbonylContact C-O 3.51Å; C38-E42 WeakPolarHBondContact CA-O 3.3Å; S39-E42 PolarHBondContact N-O 3.18Å; S39-E42 WeakPolarHBondContact OG-CB 3.14Å; S39-E42 PolarHBondContact OG-N 3.35Å; E42-N44 HydrophobicContact CG-CB 4.43Å; E42-N44 PolarHBondContact OE1-ND2 3.24Å; E42-S82 CarbonylContact C-O 3.57Å; E42-S82 VanDerWaalsContact CA-O 3.27Å; E42-S82 WeakPolarHBondContact CA-O 3.26Å
43	I	89.5	Confident	78.9	Confident	0 Å²	0	74.7 Å²	74.7	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	121.3	166.1	-58.7	175.7	0	0	0	108.1	C36 P55 L57 I80 S82 I83 H84 Y102	C36-I43 HydrophobicContact CB-CG2 4.32Å; I43-P55 HydrophobicContact CG2-CB 4.35Å; I43-P55 HydrophobicContact CG2-CG 4.44Å; I43-L57 HydrophobicContact CD1-CD1 4.35Å; I43-L57 HydrophobicContact CD1-CD2 4.11Å; I43-L57 HydrophobicContact CD1-CG 4.13Å; I43-I80 HydrophobicContact CD1-CD1 4.45Å; I43-I80 HydrophobicContact CD1-CG1 4.2Å; I43-I80 HydrophobicContact CD1-CG2 4.2Å; I43-I80 HydrophobicContact CG1-CD1 4.12Å; I43-I80 HydrophobicContact CG1-CG1 4.35Å; I43-I80 HydrophobicContact CG1-CG2 4.11Å; I43-S82 PolarHBondContact N-O 3.44Å; I43-I83 HydrophobicContact CB-CG1 4.29Å; I43-I83 HydrophobicContact CD1-CG1 4.43Å; I43-I83 WeakPolarHBondContact O-CA 3.47Å; I43-H84 PolarHBondContact O-N 3.16Å; I43-Y102 HydrophobicContact CD1-CE1 3.88Å
44	N	90.8	Very high	79	Confident	28 Å²	28	73.6 Å²	73.6	15%	0.15	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	99	-172.5	-157.2	-30.9	0	0	0	111.8	C36 V37 E42 R46 H84	C36-N44 CarbonylContact C-O 3.59Å; C36-N44 WeakPolarHBondContact CA-O 3.32Å; V37-N44 PolarHBondContact N-O 2.92Å; V37-N44 PolarHBondContact O-N 3.39Å; E42-N44 HydrophobicContact CG-CB 4.43Å; E42-N44 PolarHBondContact OE1-ND2 3.24Å; N44-R46 PolarHBondContact ND2-NH2 3.39Å; N44-R46 WeakPolarHBondContact OD1-CG 3.2Å; N44-R46 PolarHBondContact OD1-NE 3.07Å; N44-H84 CarbonylContact C-O 3.54Å; N44-H84 PolarHBondContact OD1-CD2 2.81Å
45	C	89.4	Confident	78.7	Confident	0 Å²	0	69.8 Å²	69.8	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	81.6	-173.8	-52.2	0	0	0	0	110.8	C36 H84 I85 E86 W88	C36-C45 HydrophobicContact CB-CB 4.04Å; C36-C45 WeakPolarHBondContact CB-SG 3.33Å; C36-C45 WeakPolarHBondContact SG-CB 3.43Å; C36-C45 CovalentContact SG-SG 2.03Å; C36-C45 PolarHBondContact SG-SG 2.92Å; C45-H84 PolarHBondContact N-O 3.29Å; C45-I85 HydrophobicContact CB-CG1 4.23Å; C45-E86 PolarHBondContact O-N 2.92Å; C45-W88 HydrophobicContact CB-CH2 4.24Å; C45-W88 HydrophobicContact CB-CZ2 3.55Å
46	R	83.4	Confident	78	Confident	145 Å²	145	71.1 Å²	71.1	55%	0.547	37%	0.372	S	S	.	.			trans	-102.6	-11	178.4	-67.1	177.6	-162.8	-168.8	2.2	114.6	N44 E86	N44-R46 PolarHBondContact ND2-NH2 3.39Å; N44-R46 WeakPolarHBondContact OD1-CG 3.2Å; N44-R46 PolarHBondContact OD1-NE 3.07Å; R46-E86 HydrophobicContact CG-CB 4.4Å
47	R	78.5	Confident	77	Confident	144 Å²	144	71.5 Å²	71.5	54%	0.543	37%	0.374	S	S	.	.	S	Bend	trans	-71.7	131.7	171.2	-63.4	-179.2	-178.7	153	2.2	107	A34 N35 D49 W88	A34-R47 PolarHBondContact O-NH1 3.22Å; A34-R47 VanDerWaalsContact O-NH1 3.15Å; N35-R47 HydrophobicContact CB-CB 4.17Å; N35-R47 WeakPolarHBondContact O-CB 3.3Å; R47-D49 PolarHBondContact O-N 3.49Å; R47-W88 PolarHBondContact O-NE1 2.93Å
48	P	72.2	Confident	75.6	Confident	93 Å²	93	73.8 Å²	73.8	60%	0.604	38%	0.378	S	S	*	.			trans	-55	127.7	172	-22.4	33	0	0	0	109.2	N87	P48-N87 HydrophobicContact CG-CB 4.4Å
49	D	68.5	Low	73.7	Confident	38 Å²	38	73.5 Å²	73.5	20%	0.203	38%	0.382	C	S	.	.			trans	-115.2	134.2	169.6	-158.3	-24.2	0	0	0	107.6	N35 R47 G51 W88	N35-D49 HydrophobicContact CB-CB 4.25Å; N35-D49 PolarHBondContact ND2-OD1 3.07Å; N35-D49 PolarHBondContact ND2-OD2 2.98Å; R47-D49 PolarHBondContact O-N 3.49Å; D49-G51 VanDerWaalsContact C-N 3.28Å; D49-G51 PolarHBondContact OD1-N 3.39Å; D49-W88 HydrophobicContact CB-CD2 3.85Å; D49-W88 VanDerWaalsContact CB-CE2 3.48Å; D49-W88 HydrophobicContact CB-CE3 4.49Å; D49-W88 HydrophobicContact CB-CG 4.12Å; D49-W88 HydrophobicContact CB-CH2 4.48Å; D49-W88 HydrophobicContact CB-CZ2 3.83Å
50	D	62.3	Low	71.5	Confident	136 Å²	136	77.8 Å²	77.8	73%	0.727	40%	0.395	S	S	*	.			trans	-86.6	-4	172.6	-73.2	-32.9	0	0	0	111.3	S90	D50-S90 WeakPolarHBondContact O-CB 3.3Å; D50-S90 PolarHBondContact O-OG 3.28Å
51	G	63.6	Low	69	Low	28 Å²	28	76.9 Å²	76.9	29%	0.289	40%	0.399	S	S	.	.			trans	-69.9	153.1	175.5	0	0	0	0	0	115	D49	D49-G51 VanDerWaalsContact C-N 3.28Å; D49-G51 PolarHBondContact OD1-N 3.39Å
52	N	68.6	Low	66.4	Low	107 Å²	107	77.9 Å²	77.9	57%	0.572	41%	0.409	S	S	*	.			trans	-95.7	-6.8	-177.3	-60.8	18.5	0	0	0	113.6	S90	N52-S90 WeakPolarHBondContact OD1-CB 3.47Å
53	L	68.9	Low	63.5	Low	144 Å²	144	78.4 Å²	78.4	75%	0.754	43%	0.433	S	S	*	.	S	Bend	trans	-93.2	143.6	-169.8	-66.9	167.4	0	0	0	111	W88	L53-W88 VanDerWaalsContact O-CZ3 3.27Å; L53-W88 WeakPolarHBondContact O-CZ3 3.36Å
54	F	75.6	Confident	60.7	Low	8 Å²	8	86 Å²	86	4%	0.035	47%	0.474	C	S	.	.			trans	-70.1	147.2	170.2	-165.2	-95.7	0	0	0	110.2	L56 I83 I85 L94 D98 M99 Y102 L108 I110	F54-L56 PolarHBondContact O-N 3.25Å; F54-I83 HydrophobicContact CE1-CD1 4.18Å; F54-I83 HydrophobicContact CZ-CD1 4.28Å; F54-I83 HydrophobicContact CZ-CG2 4.02Å; F54-I85 HydrophobicContact CD2-CD1 3.75Å; F54-I85 HydrophobicContact CE2-CD1 3.34Å; F54-I85 HydrophobicContact CZ-CD1 3.86Å; F54-L94 HydrophobicContact CD2-CD1 3.47Å; F54-L94 VanDerWaalsContact CD2-CD1 3.47Å; F54-L94 HydrophobicContact CE2-CD1 3.51Å; F54-L94 HydrophobicContact CG-CD1 4.19Å; F54-L94 HydrophobicContact CZ-CD1 4.27Å; F54-D98 HydrophobicContact CB-CB 3.84Å; F54-D98 HydrophobicContact CD1-CB 3.96Å; F54-D98 HydrophobicContact CG-CB 3.92Å; F54-M99 HydrophobicContact CE1-SD 4.22Å; F54-M99 HydrophobicContact CE2-SD 4.43Å; F54-M99 HydrophobicContact CZ-SD 3.85Å; F54-Y102 HydrophobicContact CD1-CE2 4.42Å; F54-Y102 HydrophobicContact CE1-CD2 4.45Å; F54-Y102 AromaticContact CE1-CE2 3.9Å; F54-Y102 HydrophobicContact CE1-CE2 3.9Å; F54-L108 HydrophobicContact CZ-CD1 4.28Å; F54-I110 HydrophobicContact CE2-CD1 3.96Å
55	P	66.1	Low	57.8	Low	4 Å²	4	89.6 Å²	89.6	3%	0.026	50%	0.501	C	S	.	.			trans	-65.9	111.1	178.3	27.5	-34.7	0	0	0	111	P33 I43 I85 W88 Y102	P33-P55 HydrophobicContact CG-CB 3.92Å; I43-P55 HydrophobicContact CG2-CB 4.35Å; I43-P55 HydrophobicContact CG2-CG 4.44Å; P55-I85 VanDerWaalsContact CD-CD1 3.45Å; P55-I85 HydrophobicContact CG-CD1 3.68Å; P55-I85 HydrophobicContact CG-CG1 4.13Å; P55-W88 HydrophobicContact CB-CH2 4.2Å; P55-W88 HydrophobicContact CG-CH2 4.36Å; P55-W88 HydrophobicContact CG-CZ3 4.42Å; P55-Y102 PolarHBondContact O-OH 3.02Å
56	L	66.8	Low	55.3	Low	76 Å²	76	97.3 Å²	97.3	40%	0.398	54%	0.542	S	S	.	.			trans	-103.8	144.5	170	-71.3	163.9	0	0	0	109.3	P33 F54 E58 L101	P33-L56 WeakPolarHBondContact CG-O 3.48Å; F54-L56 PolarHBondContact O-N 3.25Å; L56-E58 PolarHBondContact O-N 2.83Å; L56-L101 HydrophobicContact CD2-CD1 4.24Å
57	L	64.4	Low	52.8	Low	18 Å²	18	94.1 Å²	94.1	9%	0.094	55%	0.554	C	S	.	*			trans	-80.2	112.1	174.8	-67.1	171.3	0	0	0	109.5	L30 I43 I76 I80 Y102	L30-L57 HydrophobicContact CD2-CB 4.14Å; L30-L57 HydrophobicContact CD2-CD2 4.4Å; I43-L57 HydrophobicContact CD1-CD1 4.35Å; I43-L57 HydrophobicContact CD1-CD2 4.11Å; I43-L57 HydrophobicContact CD1-CG 4.13Å; L57-I76 HydrophobicContact CD1-CG2 3.73Å; L57-I80 HydrophobicContact CD1-CG1 4.29Å; L57-Y102 HydrophobicContact CD1-CE1 4.45Å
58	E	54.5	Low	50.6	Low	145 Å²	145	95.1 Å²	95.1	68%	0.678	57%	0.57	S	S	*	*	B	Isolated β-bridge	trans	-79.9	129.1	174.9	-70.2	-177.2	173.1	0	0	111	A31 L56	A31-E58 HydrophobicContact CB-CB 4.09Å; A31-E58 PolarHBondContact N-O 3.38Å; L56-E58 PolarHBondContact O-N 2.83Å
59	G	44.7	Very low	48.9	Very low	36 Å²	36	95.1 Å²	95.1	37%	0.371	58%	0.578	S	S	.	*			trans	-104	138.1	166.9	0	0	0	0	0	111	D61	G59-D61 PolarHBondContact O-N 2.97Å; G59-D61 VanDerWaalsContact O-N 3.16Å
60	Q	36.2	Very low	47.3	Very low	156 Å²	156	99.1 Å²	99.1	73%	0.729	61%	0.609	S	S	*	*			trans	-80.7	91.8	176.3	-77.2	-172.5	-41.4	0	0	111.4	S62	Q60-S62 VanDerWaalsContact C-N 3.3Å; Q60-S62 PolarHBondContact O-N 2.94Å; Q60-S62 VanDerWaalsContact O-N 3.1Å
61	D	29.2	Very low	46.8	Very low	169 Å²	169	98 Å²	98	90%	0.904	60%	0.602	S	S	*	*			trans	-74.9	86.7	155	-80.4	-29.5	0	0	0	109	G59	G59-D61 PolarHBondContact O-N 2.97Å; G59-D61 VanDerWaalsContact O-N 3.16Å
62	S	32.3	Very low	46.5	Very low	90 Å²	90	100.8 Å²	100.8	63%	0.629	61%	0.61	S	S	*	*			trans	-130.8	105.2	167	59.1	0	0	0	0	110.3	Q60 N64	Q60-S62 VanDerWaalsContact C-N 3.3Å; Q60-S62 PolarHBondContact O-N 2.94Å; Q60-S62 VanDerWaalsContact O-N 3.1Å; S62-N64 PolarHBondContact O-N 2.81Å
63	G	27.6	Very low	46.2	Very low	81 Å²	81	98.3 Å²	98.3	84%	0.835	60%	0.596	S	S	*	*			trans	-65.8	124.7	-172.4	0	0	0	0	0	112.7
64	N	32	Very low	46	Very low	161 Å²	161	93.6 Å²	93.6	86%	0.861	57%	0.574	S	S	*	*			trans	-147.6	136.6	145	-120.1	-24.8	0	0	0	110.4	S62 N66	S62-N64 PolarHBondContact O-N 2.81Å; N64-N66 PolarHBondContact O-N 3.07Å
65	S	29.4	Very low	45.5	Very low	102 Å²	102	95.7 Å²	95.7	71%	0.713	59%	0.585	S	S	*	*			trans	-64.7	113.7	-174.6	51.2	0	0	0	0	112.2
66	N	37.7	Very low	45.7	Very low	163 Å²	163	97 Å²	97	87%	0.872	59%	0.591	S	S	*	*			trans	-171.3	126.4	137	-88.8	-31.1	0	0	0	108.7	N64 N68	N64-N66 PolarHBondContact O-N 3.07Å; N66-N68 PolarHBondContact O-N 2.98Å
67	G	29.7	Very low	46.1	Very low	77 Å²	77	93.5 Å²	93.5	79%	0.794	57%	0.573	S	S	*	*			trans	-70.3	121.1	-167.1	0	0	0	0	0	114.1
68	N	32.5	Very low	46.9	Very low	165 Å²	165	97.1 Å²	97.1	88%	0.882	59%	0.586	S	S	*	*	S	Bend	trans	-164.8	120.8	146.2	-96.2	-29.3	0	0	0	110.2	N66	N66-N68 PolarHBondContact O-N 2.98Å
69	A	36	Very low	48.3	Very low	93 Å²	93	94.8 Å²	94.8	77%	0.769	58%	0.578	S	S	*	*			trans	33.2	92	165.5	0	0	0	0	0	118.5	I71	A69-I71 PolarHBondContact O-N 3.38Å
70	S	36.2	Very low	50.4	Low	123 Å²	123	93.2 Å²	93.2	86%	0.86	56%	0.561	S	S	*	*			trans	-65.7	111.2	160.3	51.8	0	0	0	0	110.4	N72	S70-N72 PolarHBondContact O-N 3.11Å
71	I	50.7	Low	53	Low	111 Å²	111	87.8 Å²	87.8	57%	0.569	54%	0.539	S	S	*	.			trans	-74.7	118.8	175.5	-54.5	174.5	0	0	0	108.4	A69 I76	A69-I71 PolarHBondContact O-N 3.38Å; I71-I76 HydrophobicContact CG2-CD1 3.57Å; I71-I76 HydrophobicContact CG2-CG1 4.14Å
72	N	57.4	Low	56.1	Low	87 Å²	87	80.8 Å²	80.8	47%	0.465	50%	0.503	S	S	.	.			trans	-79.1	123.7	-173.2	-169.2	4.6	0	0	0	111.5	S70 T74 D75	S70-N72 PolarHBondContact O-N 3.11Å; N72-T74 VanDerWaalsContact CG-OG1 3.25Å; N72-T74 PolarHBondContact ND2-OG1 2.92Å; N72-T74 PolarHBondContact O-N 3.01Å; N72-T74 VanDerWaalsContact O-N 3.14Å; N72-T74 PolarHBondContact OD1-OG1 3.47Å; N72-D75 PolarHBondContact O-N 3.3Å
73	I	61.6	Low	59	Low	56 Å²	56	76.5 Å²	76.5	29%	0.287	47%	0.473	S	S	.	.	H	α-helix	trans	-53.6	-37.7	-177.6	-59.7	170.4	0	0	0	111.2	D75 I76 S77	I73-D75 VanDerWaalsContact C-N 3.28Å; I73-D75 PolarHBondContact O-N 3.23Å; I73-I76 WeakPolarHBondContact O-CB 3.42Å; I73-I76 PolarHBondContact O-N 3.07Å; I73-S77 PolarHBondContact O-N 3.39Å
74	T	65.4	Low	62.2	Low	45 Å²	45	73.8 Å²	73.8	28%	0.276	44%	0.439	S	S	.	.	H	α-helix	trans	-62.1	-33.9	-178.9	60.7	0	0	0	0	113	N72 I76 S77 R78	N72-T74 VanDerWaalsContact CG-OG1 3.25Å; N72-T74 PolarHBondContact ND2-OG1 2.92Å; N72-T74 PolarHBondContact O-N 3.01Å; N72-T74 VanDerWaalsContact O-N 3.14Å; N72-T74 PolarHBondContact OD1-OG1 3.47Å; T74-I76 VanDerWaalsContact C-N 3.33Å; T74-S77 PolarHBondContact O-OG 3.22Å; T74-S77 VanDerWaalsContact O-OG 3.07Å; T74-R78 WeakPolarHBondContact O-CB 3.41Å; T74-R78 VanDerWaalsContact O-CD 3.23Å; T74-R78 WeakPolarHBondContact O-CD 3.44Å; T74-R78 WeakPolarHBondContact O-CG 3.49Å; T74-R78 PolarHBondContact O-N 2.92Å
75	D	66.2	Low	65.1	Low	51 Å²	51	66.1 Å²	66.1	27%	0.273	40%	0.398	S	S	.	.	H	α-helix	trans	-79.5	-23.4	-177.8	-60.7	-29.7	0	0	0	111.5	N72 I73 R78 N79	N72-D75 PolarHBondContact O-N 3.3Å; I73-D75 VanDerWaalsContact C-N 3.28Å; I73-D75 PolarHBondContact O-N 3.23Å; D75-R78 IonicContact OD1-CZ 3.45Å; D75-R78 IonicContact OD1-NH1 2.71Å; D75-R78 PolarHBondContact OD1-NH1 3.36Å; D75-N79 PolarHBondContact O-ND2 3.4Å
76	I	68.8	Low	68	Low	31 Å²	31	62.7 Å²	62.7	16%	0.159	37%	0.37	C	S	.	.	H	α-helix	trans	-75.6	-48.6	170.1	-62.5	144.8	0	0	0	110	L30 L57 I71 I73 T74 R78 N79	L30-I76 HydrophobicContact CD1-CB 4.28Å; L30-I76 HydrophobicContact CD1-CD1 3.7Å; L30-I76 HydrophobicContact CD1-CG1 3.93Å; L30-I76 HydrophobicContact CD1-CG2 3.46Å; L30-I76 VanDerWaalsContact CD1-CG2 3.46Å; L30-I76 HydrophobicContact CD2-CD1 4.06Å; L30-I76 HydrophobicContact CD2-CG2 4.12Å; L30-I76 HydrophobicContact CG-CD1 4.07Å; L30-I76 HydrophobicContact CG-CG2 4.4Å; L57-I76 HydrophobicContact CD1-CG2 3.73Å; I71-I76 HydrophobicContact CG2-CD1 3.57Å; I71-I76 HydrophobicContact CG2-CG1 4.14Å; I73-I76 WeakPolarHBondContact O-CB 3.42Å; I73-I76 PolarHBondContact O-N 3.07Å; T74-I76 VanDerWaalsContact C-N 3.33Å; I76-R78 VanDerWaalsContact C-N 3.28Å; I76-R78 PolarHBondContact O-N 3.03Å; I76-N79 WeakPolarHBondContact O-CB 3.35Å; I76-N79 PolarHBondContact O-N 2.81Å
77	S	76.6	Confident	70.6	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-63.4	-34.7	-178.6	67.7	0	0	0	0	112.2	I73 T74 N79 I80 L101	I73-S77 PolarHBondContact O-N 3.39Å; T74-S77 PolarHBondContact O-OG 3.22Å; T74-S77 VanDerWaalsContact O-OG 3.07Å; S77-N79 VanDerWaalsContact C-N 3.25Å; S77-N79 PolarHBondContact O-N 3.05Å; S77-I80 PolarHBondContact O-N 3.47Å; S77-L101 CarbonylContact C-O 3.52Å; S77-L101 VanDerWaalsContact CB-O 3.23Å; S77-L101 WeakPolarHBondContact CB-O 3.44Å; S77-L101 PolarHBondContact OG-O 3.43Å
78	R	79.9	Confident	73.4	Confident	95 Å²	95	54.2 Å²	54.2	36%	0.358	31%	0.307	S	S	.	.	H	α-helix	trans	-57.5	-32	170	-79	164.8	178.4	173.5	-7.2	113.9	T74 D75 I76 G104	T74-R78 WeakPolarHBondContact O-CB 3.41Å; T74-R78 VanDerWaalsContact O-CD 3.23Å; T74-R78 WeakPolarHBondContact O-CD 3.44Å; T74-R78 WeakPolarHBondContact O-CG 3.49Å; T74-R78 PolarHBondContact O-N 2.92Å; D75-R78 IonicContact OD1-CZ 3.45Å; D75-R78 IonicContact OD1-NH1 2.71Å; D75-R78 PolarHBondContact OD1-NH1 3.36Å; I76-R78 VanDerWaalsContact C-N 3.28Å; I76-R78 PolarHBondContact O-N 3.03Å; R78-G104 WeakPolarHBondContact O-CA 3.44Å
79	N	84.7	Confident	76	Confident	96 Å²	96	55.4 Å²	55.4	51%	0.513	30%	0.299	S	S	.	.	H	α-helix	trans	-84.3	-10.4	-178.1	-76.7	-42.7	0	0	0	113.9	T41 D75 I76 S77 T81	T41-N79 WeakPolarHBondContact CA-O 3.38Å; D75-N79 PolarHBondContact O-ND2 3.4Å; I76-N79 WeakPolarHBondContact O-CB 3.35Å; I76-N79 PolarHBondContact O-N 2.81Å; S77-N79 VanDerWaalsContact C-N 3.25Å; S77-N79 PolarHBondContact O-N 3.05Å; N79-T81 PolarHBondContact O-N 3.23Å
80	I	87.8	Confident	78.5	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.01	27%	0.271	C	S	.	.			trans	-74	110.9	176.4	-58.1	-57.3	0	0	0	109.6	I43 L57 S77 I83 Y102 G104 L105	I43-I80 HydrophobicContact CD1-CD1 4.45Å; I43-I80 HydrophobicContact CD1-CG1 4.2Å; I43-I80 HydrophobicContact CD1-CG2 4.2Å; I43-I80 HydrophobicContact CG1-CD1 4.12Å; I43-I80 HydrophobicContact CG1-CG1 4.35Å; I43-I80 HydrophobicContact CG1-CG2 4.11Å; L57-I80 HydrophobicContact CD1-CG1 4.29Å; S77-I80 PolarHBondContact O-N 3.47Å; I80-I83 HydrophobicContact CG2-CD1 4.29Å; I80-I83 HydrophobicContact CG2-CG1 3.76Å; I80-Y102 HydrophobicContact CB-CD1 4.03Å; I80-Y102 HydrophobicContact CB-CE1 4.4Å; I80-Y102 HydrophobicContact CG1-CD1 4.32Å; I80-Y102 HydrophobicContact CG1-CE1 4.26Å; I80-Y102 HydrophobicContact CG2-CD1 4.32Å; I80-G104 CarbonylContact O-C 3.6Å; I80-L105 HydrophobicContact CG2-CD1 4.33Å; I80-L105 WeakPolarHBondContact O-CA 3.46Å; I80-L105 PolarHBondContact O-N 3.22Å
81	T	92.5	Very high	81	Confident	43 Å²	43	46.4 Å²	46.4	26%	0.264	23%	0.23	S	C	.	.			trans	-96	-18.4	177.8	61.4	0	0	0	0	113	T41 N79 Q106 K107	T41-T81 PolarHBondContact O-N 2.96Å; T41-T81 PolarHBondContact O-OG1 2.76Å; N79-T81 PolarHBondContact O-N 3.23Å; T81-Q106 WeakPolarHBondContact O-CA 3.35Å; T81-Q106 PolarHBondContact O-N 3.26Å; T81-K107 PolarHBondContact O-N 3.2Å
82	S	94.3	Very high	82.9	Confident	22 Å²	22	44.5 Å²	44.5	15%	0.154	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	134.7	178.6	-173.4	0	0	0	0	113.5	T41 E42 I43 K107	T41-S82 PolarHBondContact O-N 2.87Å; T41-S82 VanDerWaalsContact O-N 3.1Å; E42-S82 CarbonylContact C-O 3.57Å; E42-S82 VanDerWaalsContact CA-O 3.27Å; E42-S82 WeakPolarHBondContact CA-O 3.26Å; I43-S82 PolarHBondContact N-O 3.44Å; S82-K107 VanDerWaalsContact CA-O 3.31Å; S82-K107 WeakPolarHBondContact CA-O 3.38Å
83	I	93.2	Very high	84.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	125.9	171.2	-63.6	170.5	0	0	0	108.7	I43 F54 I80 I85 Y102 L105 K107 L108 T109	I43-I83 HydrophobicContact CB-CG1 4.29Å; I43-I83 HydrophobicContact CD1-CG1 4.43Å; I43-I83 WeakPolarHBondContact O-CA 3.47Å; F54-I83 HydrophobicContact CE1-CD1 4.18Å; F54-I83 HydrophobicContact CZ-CD1 4.28Å; F54-I83 HydrophobicContact CZ-CG2 4.02Å; I80-I83 HydrophobicContact CG2-CD1 4.29Å; I80-I83 HydrophobicContact CG2-CG1 3.76Å; I83-I85 HydrophobicContact CG2-CD1 4.09Å; I83-I85 HydrophobicContact CG2-CG1 4.06Å; I83-Y102 HydrophobicContact CD1-CD1 4.04Å; I83-Y102 HydrophobicContact CD1-CD2 3.74Å; I83-Y102 HydrophobicContact CD1-CE1 4.17Å; I83-Y102 HydrophobicContact CD1-CE2 3.87Å; I83-Y102 HydrophobicContact CD1-CG 3.82Å; I83-L105 HydrophobicContact CB-CD1 4.17Å; I83-L105 HydrophobicContact CD1-CD1 3.8Å; I83-L105 HydrophobicContact CD1-CD2 4.21Å; I83-L105 HydrophobicContact CG1-CD1 3.64Å; I83-K107 PolarHBondContact N-O 2.72Å; I83-L108 HydrophobicContact CB-CD1 4.05Å; I83-L108 HydrophobicContact CG2-CD1 4.13Å; I83-L108 CarbonylContact O-C 3.56Å; I83-T109 PolarHBondContact O-N 3.43Å
84	H	94.2	Very high	86	Confident	24 Å²	24	40.1 Å²	40.1	11%	0.111	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	117	177.7	-178	99.5	0	0	0	110.2	I43 N44 C45 E86 T109	I43-H84 PolarHBondContact O-N 3.16Å; N44-H84 CarbonylContact C-O 3.54Å; N44-H84 PolarHBondContact OD1-CD2 2.81Å; C45-H84 PolarHBondContact N-O 3.29Å; H84-E86 IonicContact CE1-OE2 3.57Å; H84-E86 IonicContact NE2-OE2 3.66Å; H84-E86 PolarHBondContact NE2-OE2 3.46Å; H84-T109 CarbonylContact C-O 3.58Å; H84-T109 WeakPolarHBondContact CA-O 3.45Å; H84-T109 WeakPolarHBondContact ND1-CG2 3.42Å
85	I	91.8	Very high	87.1	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.1	178.3	-60.2	170.1	0	0	0	108.3	C45 F54 P55 I83 W88 L91 T109 I110 K111	C45-I85 HydrophobicContact CB-CG1 4.23Å; F54-I85 HydrophobicContact CD2-CD1 3.75Å; F54-I85 HydrophobicContact CE2-CD1 3.34Å; F54-I85 HydrophobicContact CZ-CD1 3.86Å; P55-I85 VanDerWaalsContact CD-CD1 3.45Å; P55-I85 HydrophobicContact CG-CD1 3.68Å; P55-I85 HydrophobicContact CG-CG1 4.13Å; I83-I85 HydrophobicContact CG2-CD1 4.09Å; I83-I85 HydrophobicContact CG2-CG1 4.06Å; I85-W88 HydrophobicContact CG2-CB 3.9Å; I85-W88 HydrophobicContact CG2-CD2 3.55Å; I85-W88 HydrophobicContact CG2-CE3 3.82Å; I85-W88 HydrophobicContact CG2-CG 3.57Å; I85-L91 HydrophobicContact CD1-CD2 4.45Å; I85-L91 HydrophobicContact CG2-CD2 4.24Å; I85-T109 PolarHBondContact N-O 2.91Å; I85-I110 HydrophobicContact CB-CG1 4.44Å; I85-I110 HydrophobicContact CB-CG2 4.44Å; I85-I110 HydrophobicContact CD1-CG1 4.35Å; I85-I110 HydrophobicContact CG2-CG2 4.42Å; I85-I110 WeakPolarHBondContact O-CA 3.39Å; I85-K111 PolarHBondContact O-N 2.89Å
86	E	91.8	Very high	88.1	Confident	30 Å²	30	39.2 Å²	39.2	14%	0.14	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	137.1	-175.9	-175.3	168.6	-170.2	0	0	112.1	C45 R46 H84 W88 K111 N112	C45-E86 PolarHBondContact O-N 2.92Å; R46-E86 HydrophobicContact CG-CB 4.4Å; H84-E86 IonicContact CE1-OE2 3.57Å; H84-E86 IonicContact NE2-OE2 3.66Å; H84-E86 PolarHBondContact NE2-OE2 3.46Å; E86-W88 VanDerWaalsContact C-N 3.35Å; E86-W88 VanDerWaalsContact O-CD1 3.31Å; E86-W88 PolarHBondContact O-N 2.68Å; E86-K111 WeakPolarHBondContact CA-O 3.37Å; E86-K111 HydrophobicContact CG-CG 4.24Å; E86-K111 WeakPolarHBondContact OE1-CE 3.47Å; E86-K111 IonicContact OE1-NZ 2.71Å; E86-K111 PolarHBondContact OE1-NZ 3.19Å; E86-K111 WeakPolarHBondContact OE2-CE 3.49Å; E86-K111 IonicContact OE2-NZ 3.69Å; E86-N112 HydrophobicContact CG-CB 4.46Å; E86-N112 PolarHBondContact OE1-ND2 2.83Å
87	N	90.4	Very high	88.9	Confident	58 Å²	58	42.8 Å²	42.8	31%	0.31	22%	0.217	S	C	.	.	S	Bend	trans	67.5	20.7	-179.7	-54.1	-50	0	0	0	116.1	P48 R89 K111 N112 S113	P48-N87 HydrophobicContact CG-CB 4.4Å; N87-R89 PolarHBondContact O-N 3.14Å; N87-K111 PolarHBondContact N-O 3.1Å; N87-N112 WeakPolarHBondContact CA-O 3.4Å; N87-N112 WeakPolarHBondContact OD1-CB 3.36Å; N87-S113 PolarHBondContact N-OG 3.35Å
88	W	89.2	Confident	89.3	Confident	4 Å²	4	43.4 Å²	43.4	2%	0.015	22%	0.221	C	C	.	.			trans	-87.8	89.2	-179.5	-76.5	25.7	0	0	0	110.5	N35 C45 R47 D49 L53 P55 I85 E86 S90 L91 S113 G114	N35-W88 HydrophobicContact CB-CZ2 4.24Å; C45-W88 HydrophobicContact CB-CH2 4.24Å; C45-W88 HydrophobicContact CB-CZ2 3.55Å; R47-W88 PolarHBondContact O-NE1 2.93Å; D49-W88 HydrophobicContact CB-CD2 3.85Å; D49-W88 VanDerWaalsContact CB-CE2 3.48Å; D49-W88 HydrophobicContact CB-CE3 4.49Å; D49-W88 HydrophobicContact CB-CG 4.12Å; D49-W88 HydrophobicContact CB-CH2 4.48Å; D49-W88 HydrophobicContact CB-CZ2 3.83Å; L53-W88 VanDerWaalsContact O-CZ3 3.27Å; L53-W88 WeakPolarHBondContact O-CZ3 3.36Å; P55-W88 HydrophobicContact CB-CH2 4.2Å; P55-W88 HydrophobicContact CG-CH2 4.36Å; P55-W88 HydrophobicContact CG-CZ3 4.42Å; I85-W88 HydrophobicContact CG2-CB 3.9Å; I85-W88 HydrophobicContact CG2-CD2 3.55Å; I85-W88 HydrophobicContact CG2-CE3 3.82Å; I85-W88 HydrophobicContact CG2-CG 3.57Å; E86-W88 VanDerWaalsContact C-N 3.35Å; E86-W88 VanDerWaalsContact O-CD1 3.31Å; E86-W88 PolarHBondContact O-N 2.68Å; W88-S90 VanDerWaalsContact C-N 3.33Å; W88-S90 PolarHBondContact O-N 3.48Å; W88-L91 HydrophobicContact CB-CB 4.16Å; W88-L91 HydrophobicContact CE3-CD2 4.44Å; W88-S113 PolarHBondContact N-OG 3.1Å; W88-S113 CarbonylContact O-C 3.59Å; W88-S113 WeakPolarHBondContact O-CA 3.48Å; W88-S113 VanDerWaalsContact O-CB 3.32Å; W88-S113 WeakPolarHBondContact O-CB 3.39Å; W88-G114 PolarHBondContact O-N 3.24Å
89	R	87.7	Confident	89.7	Confident	190 Å²	190	38.9 Å²	38.9	72%	0.717	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-20.4	-166.8	-68.9	-177.8	174.4	-173.9	-0.6	114.7	N87 H92 G114	N87-R89 PolarHBondContact O-N 3.14Å; R89-H92 PolarHBondContact O-CE1 3.11Å; R89-H92 VanDerWaalsContact O-CE1 3.26Å; R89-G114 VanDerWaalsContact O-CA 3.26Å; R89-G114 WeakPolarHBondContact O-CA 3.29Å
90	S	88.1	Confident	89.8	Confident	26 Å²	26	38.9 Å²	38.9	18%	0.182	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-7.2	-177.8	-37.7	0	0	0	0	113.6	D50 N52 W88 H92	D50-S90 WeakPolarHBondContact O-CB 3.3Å; D50-S90 PolarHBondContact O-OG 3.28Å; N52-S90 WeakPolarHBondContact OD1-CB 3.47Å; W88-S90 VanDerWaalsContact C-N 3.33Å; W88-S90 PolarHBondContact O-N 3.48Å; S90-H92 PolarHBondContact O-CD2 3.45Å; S90-H92 PolarHBondContact O-N 3.44Å
91	L	89	Confident	89.6	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.217	C	C	.	.			trans	-70.3	91.7	170.9	-178.5	67.4	0	0	0	109.4	I85 W88 I110 G114 L115	I85-L91 HydrophobicContact CD1-CD2 4.45Å; I85-L91 HydrophobicContact CG2-CD2 4.24Å; W88-L91 HydrophobicContact CB-CB 4.16Å; W88-L91 HydrophobicContact CE3-CD2 4.44Å; L91-I110 HydrophobicContact CD2-CG2 3.96Å; L91-G114 CarbonylContact O-C 3.58Å; L91-G114 WeakPolarHBondContact O-CA 3.44Å; L91-L115 VanDerWaalsContact O-CA 3.27Å; L91-L115 WeakPolarHBondContact O-CA 3.39Å; L91-L115 PolarHBondContact O-N 2.88Å
92	H	91.2	Very high	89.4	Confident	70 Å²	70	40 Å²	40	32%	0.324	21%	0.205	S	C	.	.			trans	-94	-27.2	-173.4	-66.6	-33.3	0	0	0	115	R89 S90 G114 R116 S117	R89-H92 PolarHBondContact O-CE1 3.11Å; R89-H92 VanDerWaalsContact O-CE1 3.26Å; S90-H92 PolarHBondContact O-CD2 3.45Å; S90-H92 PolarHBondContact O-N 3.44Å; H92-G114 PolarHBondContact ND1-O 2.97Å; H92-R116 PolarHBondContact O-N 3.42Å; H92-S117 PolarHBondContact O-N 3.45Å
93	T	91.1	Very high	89.2	Confident	50 Å²	50	41.2 Å²	41.2	31%	0.307	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	137.8	-175.6	-54.4	0	0	0	0	109.6	S117 Q119	T93-S117 WeakPolarHBondContact CA-O 3.37Å; T93-S117 PolarHBondContact OG1-OG 3.25Å; T93-Q119 HydrophobicContact CG2-CG 4.49Å
94	L	92.2	Very high	88.9	Confident	1 Å²	1	42 Å²	42	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	118.3	167	-176.4	64.3	0	0	0	109.2	F54 D98 M99 L108 I110 L115 S117 I118 Q119 F123	F54-L94 HydrophobicContact CD2-CD1 3.47Å; F54-L94 VanDerWaalsContact CD2-CD1 3.47Å; F54-L94 HydrophobicContact CE2-CD1 3.51Å; F54-L94 HydrophobicContact CG-CD1 4.19Å; F54-L94 HydrophobicContact CZ-CD1 4.27Å; L94-D98 HydrophobicContact CD1-CB 4.27Å; L94-M99 HydrophobicContact CD1-CG 4.02Å; L94-M99 HydrophobicContact CD1-SD 3.97Å; L94-M99 HydrophobicContact CD2-CG 4.18Å; L94-M99 HydrophobicContact CD2-SD 4.18Å; L94-M99 HydrophobicContact CG-CG 4.14Å; L94-M99 HydrophobicContact CG-SD 4.46Å; L94-L108 HydrophobicContact CD2-CD2 4.21Å; L94-I110 HydrophobicContact CD1-CD1 4.43Å; L94-I110 HydrophobicContact CD2-CD1 4.15Å; L94-L115 HydrophobicContact CB-CD1 4.15Å; L94-S117 PolarHBondContact N-O 2.96Å; L94-S117 VanDerWaalsContact N-O 3.13Å; L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.3Å; L94-I118 HydrophobicContact CD2-CG2 4.28Å; L94-Q119 PolarHBondContact O-N 3.07Å; L94-F123 HydrophobicContact CD2-CE1 3.78Å; L94-F123 HydrophobicContact CD2-CZ 4.04Å
95	N	89.4	Confident	88.9	Confident	52 Å²	52	40.8 Å²	40.8	28%	0.278	21%	0.213	S	C	.	.			trans	-95.1	156.7	-177.5	-45.9	-77	0	0	0	111.1	V97 D98 Q119	N95-V97 VanDerWaalsContact C-N 3.31Å; N95-V97 PolarHBondContact O-N 2.88Å; N95-D98 WeakPolarHBondContact CA-OD2 3.11Å; N95-D98 VanDerWaalsContact CB-OD2 3.22Å; N95-D98 WeakPolarHBondContact CB-OD2 3.25Å; N95-D98 PolarHBondContact N-OD2 3.3Å; N95-D98 PolarHBondContact ND2-OD2 3.05Å; N95-D98 WeakPolarHBondContact O-CB 3.29Å; N95-D98 PolarHBondContact O-N 3.11Å; N95-Q119 PolarHBondContact OD1-NE2 3.21Å
96	A	85.8	Confident	89.1	Confident	26 Å²	26	44.3 Å²	44.3	22%	0.215	23%	0.229	C	C	.	.	H	α-helix	trans	-65.6	-34.7	178.3	0	0	0	0	0	113.1	D98 M99 E100 R121	A96-D98 VanDerWaalsContact C-N 3.27Å; A96-D98 PolarHBondContact O-N 3.48Å; A96-M99 PolarHBondContact O-N 2.95Å; A96-E100 PolarHBondContact O-N 3.33Å; A96-E100 VanDerWaalsContact O-N 3.08Å; A96-R121 HydrophobicContact CB-CB 4.48Å
97	V	85.6	Confident	89.3	Confident	105 Å²	105	47.6 Å²	47.6	64%	0.636	24%	0.243	S	C	*	.	H	α-helix	trans	-62.9	-34.1	176.5	-175.3	0	0	0	0	111.8	N95 M99	N95-V97 VanDerWaalsContact C-N 3.31Å; N95-V97 PolarHBondContact O-N 2.88Å; V97-M99 PolarHBondContact O-N 3.37Å
98	D	85.6	Confident	89.6	Confident	17 Å²	17	44.8 Å²	44.8	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-65	-26.5	179.8	-55	-32.5	0	0	0	112.3	F54 L94 N95 A96 Y102	F54-D98 HydrophobicContact CB-CB 3.84Å; F54-D98 HydrophobicContact CD1-CB 3.96Å; F54-D98 HydrophobicContact CG-CB 3.92Å; L94-D98 HydrophobicContact CD1-CB 4.27Å; N95-D98 WeakPolarHBondContact CA-OD2 3.11Å; N95-D98 VanDerWaalsContact CB-OD2 3.22Å; N95-D98 WeakPolarHBondContact CB-OD2 3.25Å; N95-D98 PolarHBondContact N-OD2 3.3Å; N95-D98 PolarHBondContact ND2-OD2 3.05Å; N95-D98 WeakPolarHBondContact O-CB 3.29Å; N95-D98 PolarHBondContact O-N 3.11Å; A96-D98 VanDerWaalsContact C-N 3.27Å; A96-D98 PolarHBondContact O-N 3.48Å; D98-Y102 WeakPolarHBondContact O-CD2 3.49Å; D98-Y102 VanDerWaalsContact O-CE2 3.31Å; D98-Y102 WeakPolarHBondContact O-CE2 3.25Å
99	M	88.4	Confident	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-104	-21.5	-173.2	-66	-61.7	-58.9	0	0	113.6	F54 L94 A96 V97 L101 Y102 L105 L108 A122 F123 N126	F54-M99 HydrophobicContact CE1-SD 4.22Å; F54-M99 HydrophobicContact CE2-SD 4.43Å; F54-M99 HydrophobicContact CZ-SD 3.85Å; L94-M99 HydrophobicContact CD1-CG 4.02Å; L94-M99 HydrophobicContact CD1-SD 3.97Å; L94-M99 HydrophobicContact CD2-CG 4.18Å; L94-M99 HydrophobicContact CD2-SD 4.18Å; L94-M99 HydrophobicContact CG-CG 4.14Å; L94-M99 HydrophobicContact CG-SD 4.46Å; A96-M99 PolarHBondContact O-N 2.95Å; V97-M99 PolarHBondContact O-N 3.37Å; M99-L101 VanDerWaalsContact C-N 3.27Å; M99-L101 PolarHBondContact O-N 2.95Å; M99-Y102 PolarHBondContact O-N 2.89Å; M99-L105 HydrophobicContact CE-CD2 3.45Å; M99-L105 VanDerWaalsContact CE-CD2 3.45Å; M99-L108 HydrophobicContact CE-CD2 4.05Å; M99-L108 HydrophobicContact SD-CD2 4.41Å; M99-A122 WeakPolarHBondContact CB-O 3.22Å; M99-A122 WeakPolarHBondContact CG-O 3.44Å; M99-F123 HydrophobicContact CE-CD1 4.06Å; M99-F123 HydrophobicContact CE-CE1 4.11Å; M99-N126 PolarHBondContact O-ND2 3.42Å
100	E	86.3	Confident	90.3	Very high	95 Å²	95	35.9 Å²	35.9	44%	0.444	20%	0.196	S	C	.	.	H	α-helix	trans	-58.2	-33.8	-173.1	174.6	155.3	-133.5	0	0	113.9	A96 Y102 T103 K125	A96-E100 PolarHBondContact O-N 3.33Å; A96-E100 VanDerWaalsContact O-N 3.08Å; E100-Y102 VanDerWaalsContact C-N 3.33Å; E100-Y102 PolarHBondContact O-N 3.04Å; E100-T103 WeakPolarHBondContact O-CG2 3.37Å; E100-K125 HydrophobicContact CB-CG 4.44Å; E100-K125 HydrophobicContact CG-CG 4.12Å; E100-K125 WeakPolarHBondContact OE1-CE 3.45Å
101	L	83.9	Confident	90.5	Very high	69 Å²	69	37.1 Å²	37.1	36%	0.361	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-21	179.5	-66.9	176	0	0	0	113.9	L56 S77 M99 T103	L56-L101 HydrophobicContact CD2-CD1 4.24Å; S77-L101 CarbonylContact C-O 3.52Å; S77-L101 VanDerWaalsContact CB-O 3.23Å; S77-L101 WeakPolarHBondContact CB-O 3.44Å; S77-L101 PolarHBondContact OG-O 3.43Å; M99-L101 VanDerWaalsContact C-N 3.27Å; M99-L101 PolarHBondContact O-N 2.95Å; L101-T103 PolarHBondContact O-N 3.46Å
102	Y	88.7	Confident	90.7	Very high	1 Å²	1	40 Å²	40	0%	0.004	21%	0.213	C	C	.	.			trans	-97.2	50.9	-171.3	-59.3	-65.2	0	0	0	112.1	I43 F54 P55 L57 I80 I83 D98 M99 E100 G104 L105 N126	I43-Y102 HydrophobicContact CD1-CE1 3.88Å; F54-Y102 HydrophobicContact CD1-CE2 4.42Å; F54-Y102 HydrophobicContact CE1-CD2 4.45Å; F54-Y102 AromaticContact CE1-CE2 3.9Å; F54-Y102 HydrophobicContact CE1-CE2 3.9Å; P55-Y102 PolarHBondContact O-OH 3.02Å; L57-Y102 HydrophobicContact CD1-CE1 4.45Å; I80-Y102 HydrophobicContact CB-CD1 4.03Å; I80-Y102 HydrophobicContact CB-CE1 4.4Å; I80-Y102 HydrophobicContact CG1-CD1 4.32Å; I80-Y102 HydrophobicContact CG1-CE1 4.26Å; I80-Y102 HydrophobicContact CG2-CD1 4.32Å; I83-Y102 HydrophobicContact CD1-CD1 4.04Å; I83-Y102 HydrophobicContact CD1-CD2 3.74Å; I83-Y102 HydrophobicContact CD1-CE1 4.17Å; I83-Y102 HydrophobicContact CD1-CE2 3.87Å; I83-Y102 HydrophobicContact CD1-CG 3.82Å; D98-Y102 WeakPolarHBondContact O-CD2 3.49Å; D98-Y102 VanDerWaalsContact O-CE2 3.31Å; D98-Y102 WeakPolarHBondContact O-CE2 3.25Å; M99-Y102 PolarHBondContact O-N 2.89Å; E100-Y102 VanDerWaalsContact C-N 3.33Å; E100-Y102 PolarHBondContact O-N 3.04Å; Y102-G104 PolarHBondContact O-N 2.62Å; Y102-G104 VanDerWaalsContact O-N 3.17Å; Y102-L105 WeakPolarHBondContact O-CB 3.27Å; Y102-L105 PolarHBondContact O-N 3.21Å; Y102-N126 PolarHBondContact O-ND2 3.39Å
103	T	89	Confident	90.8	Very high	47 Å²	47	37 Å²	37	29%	0.288	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-26.6	-172	61.7	0	0	0	0	114.1	E100 L101 L105 K125	E100-T103 WeakPolarHBondContact O-CG2 3.37Å; L101-T103 PolarHBondContact O-N 3.46Å; T103-L105 VanDerWaalsContact C-N 3.33Å; T103-K125 WeakPolarHBondContact CA-O 3.21Å
104	G	88.6	Confident	90.8	Very high	15 Å²	15	34.7 Å²	34.7	16%	0.155	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	2.7	175.8	0	0	0	0	0	115.4	R78 I80 Y102 Q106	R78-G104 WeakPolarHBondContact O-CA 3.44Å; I80-G104 CarbonylContact O-C 3.6Å; Y102-G104 PolarHBondContact O-N 2.62Å; Y102-G104 VanDerWaalsContact O-N 3.17Å; G104-Q106 PolarHBondContact O-N 3.31Å
105	L	93.4	Very high	90.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.186	C	C	.	.			trans	-65.1	126.9	-174.1	-168.5	72.9	0	0	0	112	I80 I83 M99 Y102 T103 L108 H128 L129	I80-L105 HydrophobicContact CG2-CD1 4.33Å; I80-L105 WeakPolarHBondContact O-CA 3.46Å; I80-L105 PolarHBondContact O-N 3.22Å; I83-L105 HydrophobicContact CB-CD1 4.17Å; I83-L105 HydrophobicContact CD1-CD1 3.8Å; I83-L105 HydrophobicContact CD1-CD2 4.21Å; I83-L105 HydrophobicContact CG1-CD1 3.64Å; M99-L105 HydrophobicContact CE-CD2 3.45Å; M99-L105 VanDerWaalsContact CE-CD2 3.45Å; Y102-L105 WeakPolarHBondContact O-CB 3.27Å; Y102-L105 PolarHBondContact O-N 3.21Å; T103-L105 VanDerWaalsContact C-N 3.33Å; L105-L108 HydrophobicContact CD2-CB 4.22Å; L105-L108 HydrophobicContact CD2-CD1 4.47Å; L105-H128 CarbonylContact O-C 3.52Å; L105-H128 VanDerWaalsContact O-C 3.25Å; L105-L129 HydrophobicContact CD2-CD1 4.07Å; L105-L129 HydrophobicContact CG-CD1 4.1Å; L105-L129 WeakPolarHBondContact O-CA 3.44Å; L105-L129 PolarHBondContact O-N 3.23Å; L105-L129 VanDerWaalsContact O-N 3.1Å
106	Q	95.6	Very high	91.1	Very high	73 Å²	73	38.3 Å²	38.3	34%	0.341	20%	0.196	S	C	.	.			trans	-110.2	-27.9	179.8	-60.8	177.7	11.7	0	0	112.7	T81 G104 H128 R130 Y131	T81-Q106 WeakPolarHBondContact O-CA 3.35Å; T81-Q106 PolarHBondContact O-N 3.26Å; G104-Q106 PolarHBondContact O-N 3.31Å; Q106-H128 WeakPolarHBondContact CA-O 3.3Å; Q106-H128 HydrophobicContact CG-CB 4.22Å; Q106-R130 PolarHBondContact O-N 3.32Å; Q106-Y131 PolarHBondContact O-N 2.9Å; Q106-Y131 VanDerWaalsContact O-N 3.16Å
107	K	96.7	Very high	91.4	Very high	99 Å²	99	39.6 Å²	39.6	43%	0.43	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123	-178.6	-178.2	172.6	-178.8	179	0	112.1	T81 S82 I83 Y131	T81-K107 PolarHBondContact O-N 3.2Å; S82-K107 VanDerWaalsContact CA-O 3.31Å; S82-K107 WeakPolarHBondContact CA-O 3.38Å; I83-K107 PolarHBondContact N-O 2.72Å; K107-Y131 CarbonylContact C-O 3.51Å; K107-Y131 WeakPolarHBondContact CA-O 3.42Å
108	L	96.1	Very high	91.8	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	133.7	170.7	-178.1	61.9	0	0	0	109.5	F54 I83 L94 M99 L105 I110 F123 L129 Y131 I132 N133	F54-L108 HydrophobicContact CZ-CD1 4.28Å; I83-L108 HydrophobicContact CB-CD1 4.05Å; I83-L108 HydrophobicContact CG2-CD1 4.13Å; I83-L108 CarbonylContact O-C 3.56Å; L94-L108 HydrophobicContact CD2-CD2 4.21Å; M99-L108 HydrophobicContact CE-CD2 4.05Å; M99-L108 HydrophobicContact SD-CD2 4.41Å; L105-L108 HydrophobicContact CD2-CB 4.22Å; L105-L108 HydrophobicContact CD2-CD1 4.47Å; L108-I110 HydrophobicContact CD1-CD1 4.21Å; L108-I110 HydrophobicContact CD1-CG1 4Å; L108-I110 HydrophobicContact CD2-CD1 4.26Å; L108-I110 HydrophobicContact CG-CD1 4.38Å; L108-I110 HydrophobicContact CG-CG1 4.19Å; L108-F123 HydrophobicContact CD2-CE1 3.64Å; L108-F123 HydrophobicContact CD2-CZ 4.08Å; L108-L129 HydrophobicContact CB-CD1 3.96Å; L108-Y131 PolarHBondContact N-O 3.47Å; L108-I132 CarbonylContact O-C 3.53Å; L108-I132 WeakPolarHBondContact O-CA 3.36Å; L108-N133 PolarHBondContact O-N 2.87Å
109	T	96.3	Very high	92.1	Very high	7 Å²	7	38.3 Å²	38.3	4%	0.043	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	119.7	170.8	-64.3	0	0	0	0	108.4	I83 H84 I85 K111 N133	I83-T109 PolarHBondContact O-N 3.43Å; H84-T109 CarbonylContact C-O 3.58Å; H84-T109 WeakPolarHBondContact CA-O 3.45Å; H84-T109 WeakPolarHBondContact ND1-CG2 3.42Å; I85-T109 PolarHBondContact N-O 2.91Å; T109-K111 HydrophobicContact CG2-CB 4.47Å; T109-K111 HydrophobicContact CG2-CD 4.34Å; T109-K111 HydrophobicContact CG2-CG 4.01Å; T109-N133 CarbonylContact C-O 3.49Å; T109-N133 WeakPolarHBondContact CA-O 3.48Å; T109-N133 HydrophobicContact CG2-CB 4Å
110	I	94.4	Very high	92.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	97.7	171.9	-51.5	176.1	0	0	0	105.1	F54 I85 L91 L94 L108 L115 N133 L134 N137	F54-I110 HydrophobicContact CE2-CD1 3.96Å; I85-I110 HydrophobicContact CB-CG1 4.44Å; I85-I110 HydrophobicContact CB-CG2 4.44Å; I85-I110 HydrophobicContact CD1-CG1 4.35Å; I85-I110 HydrophobicContact CG2-CG2 4.42Å; I85-I110 WeakPolarHBondContact O-CA 3.39Å; L91-I110 HydrophobicContact CD2-CG2 3.96Å; L94-I110 HydrophobicContact CD1-CD1 4.43Å; L94-I110 HydrophobicContact CD2-CD1 4.15Å; L108-I110 HydrophobicContact CD1-CD1 4.21Å; L108-I110 HydrophobicContact CD1-CG1 4Å; L108-I110 HydrophobicContact CD2-CD1 4.26Å; L108-I110 HydrophobicContact CG-CD1 4.38Å; L108-I110 HydrophobicContact CG-CG1 4.19Å; I110-L115 HydrophobicContact CD1-CD2 4.49Å; I110-L115 HydrophobicContact CG2-CD2 4.49Å; I110-N133 PolarHBondContact N-O 2.94Å; I110-L134 HydrophobicContact CB-CD2 4.09Å; I110-L134 HydrophobicContact CD1-CD2 4.37Å; I110-L134 HydrophobicContact CG1-CD2 4.43Å; I110-L134 WeakPolarHBondContact O-CA 3.34Å; I110-N137 PolarHBondContact O-ND2 3.32Å
111	K	93.8	Very high	92.1	Very high	51 Å²	51	48 Å²	48	22%	0.222	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	163	-174.7	67.2	164.2	-165.4	153.5	0	112.9	I85 E86 N87 T109 S113 S135	I85-K111 PolarHBondContact O-N 2.89Å; E86-K111 WeakPolarHBondContact CA-O 3.37Å; E86-K111 HydrophobicContact CG-CG 4.24Å; E86-K111 WeakPolarHBondContact OE1-CE 3.47Å; E86-K111 IonicContact OE1-NZ 2.71Å; E86-K111 PolarHBondContact OE1-NZ 3.19Å; E86-K111 WeakPolarHBondContact OE2-CE 3.49Å; E86-K111 IonicContact OE2-NZ 3.69Å; N87-K111 PolarHBondContact N-O 3.1Å; T109-K111 HydrophobicContact CG2-CB 4.47Å; T109-K111 HydrophobicContact CG2-CD 4.34Å; T109-K111 HydrophobicContact CG2-CG 4.01Å; K111-S113 PolarHBondContact O-N 3.07Å; K111-S113 VanDerWaalsContact O-N 3.07Å; K111-S113 PolarHBondContact O-OG 3.24Å; K111-S135 WeakPolarHBondContact CA-O 3.43Å; K111-S135 VanDerWaalsContact CB-O 3.28Å; K111-S135 WeakPolarHBondContact CB-O 3.43Å
112	N	93.1	Very high	92.5	Very high	62 Å²	62	44.7 Å²	44.7	33%	0.332	22%	0.218	S	C	.	.	S	Bend	trans	52.7	27.6	-176.8	-66.5	-35.7	0	0	0	113.4	E86 N87 S135 S136	E86-N112 HydrophobicContact CG-CB 4.46Å; E86-N112 PolarHBondContact OE1-ND2 2.83Å; N87-N112 WeakPolarHBondContact CA-O 3.4Å; N87-N112 WeakPolarHBondContact OD1-CB 3.36Å; N112-S135 PolarHBondContact N-O 3.32Å; N112-S136 CarbonylContact C-O 3.51Å; N112-S136 WeakPolarHBondContact CA-O 3.45Å; N112-S136 PolarHBondContact N-O 3.23Å; N112-S136 WeakPolarHBondContact OD1-CB 3.34Å
113	S	92	Very high	92.7	Very high	7 Å²	7	44.8 Å²	44.8	5%	0.049	22%	0.219	C	C	.	.	S	Bend	trans	-119.6	-179.4	-164.4	-66.8	0	0	0	0	112	N87 W88 K111 L115 S136 N137	N87-S113 PolarHBondContact N-OG 3.35Å; W88-S113 PolarHBondContact N-OG 3.1Å; W88-S113 CarbonylContact O-C 3.59Å; W88-S113 WeakPolarHBondContact O-CA 3.48Å; W88-S113 VanDerWaalsContact O-CB 3.32Å; W88-S113 WeakPolarHBondContact O-CB 3.39Å; K111-S113 PolarHBondContact O-N 3.07Å; K111-S113 VanDerWaalsContact O-N 3.07Å; K111-S113 PolarHBondContact O-OG 3.24Å; S113-L115 VanDerWaalsContact C-N 3.3Å; S113-L115 PolarHBondContact O-N 2.95Å; S113-S136 PolarHBondContact N-O 2.87Å; S113-N137 WeakPolarHBondContact CA-OD1 3.38Å; S113-N137 VanDerWaalsContact CB-OD1 3.26Å; S113-N137 WeakPolarHBondContact CB-OD1 3.33Å; S113-N137 PolarHBondContact N-OD1 3.39Å; S113-N137 PolarHBondContact O-OD1 2.97Å
114	G	91.3	Very high	92.7	Very high	2 Å²	2	45.5 Å²	45.5	2%	0.021	23%	0.23	C	C	.	.			trans	-82.1	5.4	-171.8	0	0	0	0	0	116.2	W88 R89 L91 H92 R116	W88-G114 PolarHBondContact O-N 3.24Å; R89-G114 VanDerWaalsContact O-CA 3.26Å; R89-G114 WeakPolarHBondContact O-CA 3.29Å; L91-G114 CarbonylContact O-C 3.58Å; L91-G114 WeakPolarHBondContact O-CA 3.44Å; H92-G114 PolarHBondContact ND1-O 2.97Å; G114-R116 PolarHBondContact O-N 3.33Å
115	L	93.8	Very high	92.8	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.246	C	C	.	.			trans	-69.5	127.2	-160.2	-166.6	70.9	0	0	0	111.7	L91 L94 I110 S113 I118 L134 N137 R138 L139	L91-L115 VanDerWaalsContact O-CA 3.27Å; L91-L115 WeakPolarHBondContact O-CA 3.39Å; L91-L115 PolarHBondContact O-N 2.88Å; L94-L115 HydrophobicContact CB-CD1 4.15Å; I110-L115 HydrophobicContact CD1-CD2 4.49Å; I110-L115 HydrophobicContact CG2-CD2 4.49Å; S113-L115 VanDerWaalsContact C-N 3.3Å; S113-L115 PolarHBondContact O-N 2.95Å; L115-I118 HydrophobicContact CD2-CD1 4.02Å; L115-I118 HydrophobicContact CD2-CG1 4.05Å; L115-L134 HydrophobicContact CD2-CD2 3.98Å; L115-N137 HydrophobicContact CB-CB 4.04Å; L115-N137 WeakPolarHBondContact CB-OD1 3.25Å; L115-N137 PolarHBondContact N-OD1 3.41Å; L115-R138 CarbonylContact O-C 3.45Å; L115-R138 VanDerWaalsContact O-CA 3.26Å; L115-R138 WeakPolarHBondContact O-CA 3.36Å; L115-R138 PolarHBondContact O-N 3.1Å; L115-L139 HydrophobicContact CD2-CD2 4.34Å; L115-L139 HydrophobicContact CG-CD2 4.18Å; L115-L139 PolarHBondContact O-N 3.2Å
116	R	93.9	Very high	92.8	Very high	129 Å²	129	50.2 Å²	50.2	49%	0.487	25%	0.246	S	C	.	.			trans	-118.6	-29	-177.1	-66.5	169.9	-176.4	-99.7	12	113	H92 G114 R138	H92-R116 PolarHBondContact O-N 3.42Å; G114-R116 PolarHBondContact O-N 3.33Å; R116-R138 HydrophobicContact CG-CB 3.99Å
117	S	93.5	Very high	92.6	Very high	53 Å²	53	49.4 Å²	49.4	37%	0.371	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	158.2	179.6	58.5	0	0	0	0	112.5	H92 T93 L94	H92-S117 PolarHBondContact O-N 3.45Å; T93-S117 WeakPolarHBondContact CA-O 3.37Å; T93-S117 PolarHBondContact OG1-OG 3.25Å; L94-S117 PolarHBondContact N-O 2.96Å; L94-S117 VanDerWaalsContact N-O 3.13Å
118	I	94.4	Very high	92.4	Very high	20 Å²	20	47.5 Å²	47.5	10%	0.103	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.1	174.9	-58.6	-175.7	0	0	0	106.5	L94 L115 A122 F123 L134 L142 L146	L94-I118 HydrophobicContact CB-CG1 4.21Å; L94-I118 HydrophobicContact CB-CG2 4.3Å; L94-I118 HydrophobicContact CD2-CG2 4.28Å; L115-I118 HydrophobicContact CD2-CD1 4.02Å; L115-I118 HydrophobicContact CD2-CG1 4.05Å; I118-A122 HydrophobicContact CG2-CB 3.44Å; I118-A122 VanDerWaalsContact CG2-CB 3.44Å; I118-F123 HydrophobicContact CD1-CZ 4.4Å; I118-F123 HydrophobicContact CG2-CE2 4.48Å; I118-F123 HydrophobicContact CG2-CZ 4.31Å; I118-L134 HydrophobicContact CD1-CD1 3.66Å; I118-L134 HydrophobicContact CD1-CD2 4.39Å; I118-L142 HydrophobicContact CD1-CD1 4.01Å; I118-L142 HydrophobicContact CG1-CD1 4.43Å; I118-L146 HydrophobicContact CB-CD1 4.14Å; I118-L146 HydrophobicContact CG2-CD1 4.07Å; I118-L146 HydrophobicContact CG2-CD2 3.84Å
119	Q	91.9	Very high	92.3	Very high	75 Å²	75	47.5 Å²	47.5	35%	0.35	24%	0.239	S	C	.	.			trans	-68	142.4	-179.6	-70.6	-174.6	-7.7	0	0	111.5	T93 L94 N95 R121 A122 L146	T93-Q119 HydrophobicContact CG2-CG 4.49Å; L94-Q119 PolarHBondContact O-N 3.07Å; N95-Q119 PolarHBondContact OD1-NE2 3.21Å; Q119-R121 PolarHBondContact O-N 3.33Å; Q119-A122 WeakPolarHBondContact O-CB 3.33Å; Q119-A122 PolarHBondContact O-N 3.21Å; Q119-L146 WeakPolarHBondContact O-CD2 3.42Å
120	P	86.4	Confident	92.3	Very high	96 Å²	96	50.4 Å²	50.4	62%	0.623	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-20.9	-171.6	-29.6	35.8	0	0	0	117.1
121	R	87.6	Confident	92.5	Very high	201 Å²	201	54.1 Å²	54.1	76%	0.758	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	16.5	178.2	-65.3	-175.7	177.5	173.7	-1	113.5	A96 Q119 F123 A124	A96-R121 HydrophobicContact CB-CB 4.48Å; Q119-R121 PolarHBondContact O-N 3.33Å; R121-F123 PolarHBondContact O-N 3.2Å; R121-F123 VanDerWaalsContact O-N 3.12Å; R121-A124 HydrophobicContact CB-CB 4.12Å; R121-A124 WeakPolarHBondContact O-CB 3.46Å; R121-A124 PolarHBondContact O-N 2.97Å; R121-A124 VanDerWaalsContact O-N 3.11Å
122	A	92	Very high	92.6	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.008	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.4	-173.3	0	0	0	0	0	114.4	M99 I118 Q119 N126 L146	M99-A122 WeakPolarHBondContact CB-O 3.22Å; M99-A122 WeakPolarHBondContact CG-O 3.44Å; I118-A122 HydrophobicContact CG2-CB 3.44Å; I118-A122 VanDerWaalsContact CG2-CB 3.44Å; Q119-A122 WeakPolarHBondContact O-CB 3.33Å; Q119-A122 PolarHBondContact O-N 3.21Å; A122-N126 PolarHBondContact O-OD1 3.32Å; A122-L146 HydrophobicContact CB-CD2 4.43Å
123	F	93.8	Very high	92.8	Very high	2 Å²	2	50 Å²	50	1%	0.009	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	6	-179.9	-50.4	-46.3	0	0	0	114.1	L94 M99 L108 I118 R121 K125 N126 L129 I132 L146 F147 L150	L94-F123 HydrophobicContact CD2-CE1 3.78Å; L94-F123 HydrophobicContact CD2-CZ 4.04Å; M99-F123 HydrophobicContact CE-CD1 4.06Å; M99-F123 HydrophobicContact CE-CE1 4.11Å; L108-F123 HydrophobicContact CD2-CE1 3.64Å; L108-F123 HydrophobicContact CD2-CZ 4.08Å; I118-F123 HydrophobicContact CD1-CZ 4.4Å; I118-F123 HydrophobicContact CG2-CE2 4.48Å; I118-F123 HydrophobicContact CG2-CZ 4.31Å; R121-F123 PolarHBondContact O-N 3.2Å; R121-F123 VanDerWaalsContact O-N 3.12Å; F123-K125 PolarHBondContact O-N 3.39Å; F123-N126 WeakPolarHBondContact CA-OD1 3.22Å; F123-N126 PolarHBondContact O-N 3Å; F123-L129 HydrophobicContact CB-CD2 4.33Å; F123-L129 HydrophobicContact CD1-CD2 3.71Å; F123-L129 HydrophobicContact CE1-CD2 4.16Å; F123-L129 HydrophobicContact CG-CD2 3.96Å; F123-I132 HydrophobicContact CD2-CD1 4.29Å; F123-I132 HydrophobicContact CE2-CD1 4.08Å; F123-I132 HydrophobicContact CZ-CD1 4.42Å; F123-L146 HydrophobicContact CD2-CB 4.24Å; F123-L146 HydrophobicContact CE2-CB 4.45Å; F123-F147 HydrophobicContact CD2-CD1 4.26Å; F123-F147 HydrophobicContact CD2-CE1 4.04Å; F123-F147 HydrophobicContact CE2-CD1 4.4Å; F123-F147 AromaticContact CE2-CE1 3.72Å; F123-F147 HydrophobicContact CE2-CE1 3.72Å; F123-F147 HydrophobicContact CE2-CZ 4.48Å; F123-L150 HydrophobicContact CB-CD1 3.9Å; F123-L150 HydrophobicContact CD2-CD1 4.32Å; F123-L150 HydrophobicContact CG-CD1 4.35Å
124	A	88.8	Confident	93	Very high	63 Å²	63	49.7 Å²	49.7	52%	0.521	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-11.5	-173.4	0	0	0	0	0	114.5	R121	R121-A124 HydrophobicContact CB-CB 4.12Å; R121-A124 WeakPolarHBondContact O-CB 3.46Å; R121-A124 PolarHBondContact O-N 2.97Å; R121-A124 VanDerWaalsContact O-N 3.11Å
125	K	89.9	Confident	93.3	Very high	113 Å²	113	50.3 Å²	50.3	49%	0.491	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	6.6	176.6	-65.3	-66.5	-169.4	178.3	0	113.1	E100 T103 F123 P127	E100-K125 HydrophobicContact CB-CG 4.44Å; E100-K125 HydrophobicContact CG-CG 4.12Å; E100-K125 WeakPolarHBondContact OE1-CE 3.45Å; T103-K125 WeakPolarHBondContact CA-O 3.21Å; F123-K125 PolarHBondContact O-N 3.39Å; K125-P127 VanDerWaalsContact O-CD 3.24Å; K125-P127 WeakPolarHBondContact O-CD 3.28Å
126	N	92.4	Very high	93.4	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.253	C	S	.	.			trans	-120.2	57.4	-173.5	-44.3	95.2	0	0	0	111.5	M99 Y102 A122 F123 H128 L129 L150	M99-N126 PolarHBondContact O-ND2 3.42Å; Y102-N126 PolarHBondContact O-ND2 3.39Å; A122-N126 PolarHBondContact O-OD1 3.32Å; F123-N126 WeakPolarHBondContact CA-OD1 3.22Å; F123-N126 PolarHBondContact O-N 3Å; N126-H128 PolarHBondContact O-N 3.28Å; N126-L129 HydrophobicContact CB-CB 4.24Å; N126-L129 HydrophobicContact CB-CD2 4.46Å; N126-L129 WeakPolarHBondContact O-CB 3.41Å; N126-L129 PolarHBondContact O-N 3.11Å; N126-L150 WeakPolarHBondContact O-CD2 3.27Å
127	P	91.5	Very high	93.4	Very high	56 Å²	56	45.5 Å²	45.5	36%	0.364	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.2	-171.4	29.9	-38.1	0	0	0	114.3	K125	K125-P127 VanDerWaalsContact O-CD 3.24Å; K125-P127 WeakPolarHBondContact O-CD 3.28Å
128	H	93.5	Very high	93.5	Very high	59 Å²	59	49.6 Å²	49.6	27%	0.273	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-2.2	178	-57.5	-49.2	0	0	0	113.6	L105 Q106 N126 R130	L105-H128 CarbonylContact O-C 3.52Å; L105-H128 VanDerWaalsContact O-C 3.25Å; Q106-H128 WeakPolarHBondContact CA-O 3.3Å; Q106-H128 HydrophobicContact CG-CB 4.22Å; N126-H128 PolarHBondContact O-N 3.28Å; H128-R130 PolarHBondContact O-N 2.95Å
129	L	94.6	Very high	93.5	Very high	1 Å²	1	48.7 Å²	48.7	1%	0.005	23%	0.234	C	C	.	.			trans	-69.9	110.4	-175.9	-170.2	58.1	0	0	0	110.5	L105 L108 F123 N126 I132 L150 L152	L105-L129 HydrophobicContact CD2-CD1 4.07Å; L105-L129 HydrophobicContact CG-CD1 4.1Å; L105-L129 WeakPolarHBondContact O-CA 3.44Å; L105-L129 PolarHBondContact O-N 3.23Å; L105-L129 VanDerWaalsContact O-N 3.1Å; L108-L129 HydrophobicContact CB-CD1 3.96Å; F123-L129 HydrophobicContact CB-CD2 4.33Å; F123-L129 HydrophobicContact CD1-CD2 3.71Å; F123-L129 HydrophobicContact CE1-CD2 4.16Å; F123-L129 HydrophobicContact CG-CD2 3.96Å; N126-L129 HydrophobicContact CB-CB 4.24Å; N126-L129 HydrophobicContact CB-CD2 4.46Å; N126-L129 WeakPolarHBondContact O-CB 3.41Å; N126-L129 PolarHBondContact O-N 3.11Å; L129-I132 HydrophobicContact CD1-CG1 4.2Å; L129-I132 HydrophobicContact CD2-CD1 3.65Å; L129-I132 HydrophobicContact CD2-CG1 3.91Å; L129-I132 HydrophobicContact CG-CD1 3.92Å; L129-I132 HydrophobicContact CG-CG1 3.81Å; L129-L150 HydrophobicContact CB-CD1 4.27Å; L129-L150 HydrophobicContact CB-CD2 4.28Å; L129-L150 HydrophobicContact CD2-CD1 4.26Å; L129-L150 HydrophobicContact CG-CD1 4.48Å; L129-L152 WeakPolarHBondContact O-CD2 3.37Å
130	R	95.7	Very high	93.6	Very high	68 Å²	68	48 Å²	48	26%	0.257	24%	0.236	S	C	.	.			trans	-115.2	-21.3	-175.3	-72.8	178.4	176.5	-168.9	-2.5	114	Q106 H128 R153 E154	Q106-R130 PolarHBondContact O-N 3.32Å; H128-R130 PolarHBondContact O-N 2.95Å; R130-R153 HydrophobicContact CB-CG 4.32Å; R130-R153 PolarHBondContact O-N 2.97Å; R130-E154 PolarHBondContact O-N 3.25Å
131	Y	97.6	Very high	94	Very high	78 Å²	78	46.4 Å²	46.4	31%	0.306	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115.1	-176.7	-60.9	-89	0	0	0	109.5	Q106 K107 L108 R153 E154	Q106-Y131 PolarHBondContact O-N 2.9Å; Q106-Y131 VanDerWaalsContact O-N 3.16Å; K107-Y131 CarbonylContact C-O 3.51Å; K107-Y131 WeakPolarHBondContact CA-O 3.42Å; L108-Y131 PolarHBondContact N-O 3.47Å; Y131-R153 HydrophobicContact CE1-CB 4.02Å; Y131-R153 VanDerWaalsContact OH-CD 3.28Å; Y131-R153 WeakPolarHBondContact OH-CD 3.43Å; Y131-R153 PolarHBondContact OH-NH1 3.31Å; Y131-R153 VanDerWaalsContact OH-NH1 3.12Å; Y131-E154 HydrophobicContact CD1-CB 3.77Å; Y131-E154 HydrophobicContact CE1-CB 4.26Å
132	I	97	Very high	94.3	Very high	4 Å²	4	37.2 Å²	37.2	2%	0.021	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	125.8	179.2	-63.2	179	0	0	0	108.6	L108 F123 L129 L134 F147 L150 L152 E154 L155 Q156	L108-I132 CarbonylContact O-C 3.53Å; L108-I132 WeakPolarHBondContact O-CA 3.36Å; F123-I132 HydrophobicContact CD2-CD1 4.29Å; F123-I132 HydrophobicContact CE2-CD1 4.08Å; F123-I132 HydrophobicContact CZ-CD1 4.42Å; L129-I132 HydrophobicContact CD1-CG1 4.2Å; L129-I132 HydrophobicContact CD2-CD1 3.65Å; L129-I132 HydrophobicContact CD2-CG1 3.91Å; L129-I132 HydrophobicContact CG-CD1 3.92Å; L129-I132 HydrophobicContact CG-CG1 3.81Å; I132-L134 HydrophobicContact CG2-CD1 3.91Å; I132-L134 HydrophobicContact CG2-CD2 4.38Å; I132-L134 HydrophobicContact CG2-CG 3.76Å; I132-F147 HydrophobicContact CD1-CD1 4.05Å; I132-F147 HydrophobicContact CD1-CE1 3.73Å; I132-L150 HydrophobicContact CD1-CD1 4.25Å; I132-L152 HydrophobicContact CD1-CD1 4.4Å; I132-L152 HydrophobicContact CD1-CD2 3.75Å; I132-L152 HydrophobicContact CG1-CD2 3.97Å; I132-E154 PolarHBondContact N-O 2.91Å; I132-L155 HydrophobicContact CB-CD1 3.79Å; I132-L155 HydrophobicContact CG2-CD1 3.65Å; I132-L155 CarbonylContact O-C 3.53Å; I132-L155 WeakPolarHBondContact O-CA 3.41Å; I132-Q156 PolarHBondContact O-N 3.5Å
133	N	97.3	Very high	94.4	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.118	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	114.7	172.7	-176.8	-12.5	0	0	0	110	L108 T109 I110 S135 Q156	L108-N133 PolarHBondContact O-N 2.87Å; T109-N133 CarbonylContact C-O 3.49Å; T109-N133 WeakPolarHBondContact CA-O 3.48Å; T109-N133 HydrophobicContact CG2-CB 4Å; I110-N133 PolarHBondContact N-O 2.94Å; N133-S135 WeakPolarHBondContact OD1-CB 3.34Å; N133-S135 PolarHBondContact OD1-N 3.36Å; N133-S135 PolarHBondContact OD1-OG 3.2Å; N133-Q156 HydrophobicContact CB-CB 4.16Å; N133-Q156 PolarHBondContact ND2-OE1 3.17Å
134	L	96.8	Very high	94.4	Very high	0 Å²	0	40 Å²	40	0%	0	21%	0.207	C	C	.	.			trans	-121	24.1	178.2	-58	171.2	0	0	0	111.1	I110 L115 I118 I132 N137 L139 Q156 L157 N160	I110-L134 HydrophobicContact CB-CD2 4.09Å; I110-L134 HydrophobicContact CD1-CD2 4.37Å; I110-L134 HydrophobicContact CG1-CD2 4.43Å; I110-L134 WeakPolarHBondContact O-CA 3.34Å; L115-L134 HydrophobicContact CD2-CD2 3.98Å; I118-L134 HydrophobicContact CD1-CD1 3.66Å; I118-L134 HydrophobicContact CD1-CD2 4.39Å; I132-L134 HydrophobicContact CG2-CD1 3.91Å; I132-L134 HydrophobicContact CG2-CD2 4.38Å; I132-L134 HydrophobicContact CG2-CG 3.76Å; L134-N137 PolarHBondContact O-ND2 2.86Å; L134-L139 HydrophobicContact CB-CD1 4.11Å; L134-L139 HydrophobicContact CD1-CD1 4.23Å; L134-Q156 PolarHBondContact N-O 3.28Å; L134-L157 HydrophobicContact CB-CD2 4.17Å; L134-L157 HydrophobicContact CD1-CD2 4.31Å; L134-N160 PolarHBondContact O-ND2 3.33Å
135	S	96.4	Very high	94.5	Very high	16 Å²	16	40.2 Å²	40.2	11%	0.112	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	151.5	-175.8	72.1	0	0	0	0	113.1	K111 N112 N133 N137 Q156 E158	K111-S135 WeakPolarHBondContact CA-O 3.43Å; K111-S135 VanDerWaalsContact CB-O 3.28Å; K111-S135 WeakPolarHBondContact CB-O 3.43Å; N112-S135 PolarHBondContact N-O 3.32Å; N133-S135 WeakPolarHBondContact OD1-CB 3.34Å; N133-S135 PolarHBondContact OD1-N 3.36Å; N133-S135 PolarHBondContact OD1-OG 3.2Å; S135-N137 VanDerWaalsContact C-N 3.34Å; S135-N137 PolarHBondContact O-N 3.19Å; S135-N137 PolarHBondContact O-ND2 2.84Å; S135-Q156 PolarHBondContact N-O 3.05Å; S135-E158 CarbonylContact C-O 3.57Å; S135-E158 WeakPolarHBondContact CA-O 3.09Å; S135-E158 VanDerWaalsContact CB-O 3.3Å; S135-E158 WeakPolarHBondContact CB-O 3.49Å
136	S	95.5	Very high	94.7	Very high	21 Å²	21	35.2 Å²	35.2	15%	0.147	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	41.2	175.7	-44.9	0	0	0	0	113.7	N112 S113 E158 Q159	N112-S136 CarbonylContact C-O 3.51Å; N112-S136 WeakPolarHBondContact CA-O 3.45Å; N112-S136 PolarHBondContact N-O 3.23Å; N112-S136 WeakPolarHBondContact OD1-CB 3.34Å; S113-S136 PolarHBondContact N-O 2.87Å; S136-E158 PolarHBondContact N-O 3.29Å; S136-Q159 VanDerWaalsContact OG-CD 3.31Å; S136-Q159 PolarHBondContact OG-OE1 2.99Å
137	N	95.1	Very high	94.7	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.032	18%	0.176	C	C	.	.	S	Bend	trans	-106.5	-156.7	171.7	-74.1	-77.7	0	0	0	111	I110 S113 L115 L134 S135 L139 N160	I110-N137 PolarHBondContact O-ND2 3.32Å; S113-N137 WeakPolarHBondContact CA-OD1 3.38Å; S113-N137 VanDerWaalsContact CB-OD1 3.26Å; S113-N137 WeakPolarHBondContact CB-OD1 3.33Å; S113-N137 PolarHBondContact N-OD1 3.39Å; S113-N137 PolarHBondContact O-OD1 2.97Å; L115-N137 HydrophobicContact CB-CB 4.04Å; L115-N137 WeakPolarHBondContact CB-OD1 3.25Å; L115-N137 PolarHBondContact N-OD1 3.41Å; L134-N137 PolarHBondContact O-ND2 2.86Å; S135-N137 VanDerWaalsContact C-N 3.34Å; S135-N137 PolarHBondContact O-N 3.19Å; S135-N137 PolarHBondContact O-ND2 2.84Å; N137-L139 HydrophobicContact CB-CG 4.48Å; N137-N160 WeakPolarHBondContact CA-OD1 3.42Å; N137-N160 VanDerWaalsContact CB-OD1 3.29Å; N137-N160 WeakPolarHBondContact CB-OD1 3.39Å; N137-N160 PolarHBondContact N-OD1 3.48Å
138	R	94.5	Very high	94.5	Very high	140 Å²	140	37.8 Å²	37.8	53%	0.528	18%	0.183	S	C	.	.			trans	-124.7	30.9	-179.7	-59.3	-173.3	177.8	-160.9	-1.1	111.7	L115 R116 T140	L115-R138 CarbonylContact O-C 3.45Å; L115-R138 VanDerWaalsContact O-CA 3.26Å; L115-R138 WeakPolarHBondContact O-CA 3.36Å; L115-R138 PolarHBondContact O-N 3.1Å; R116-R138 HydrophobicContact CG-CB 3.99Å; R138-T140 PolarHBondContact O-N 2.86Å
139	L	95.4	Very high	94	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.197	C	C	.	.			trans	-68.4	126.6	174.7	-60.8	171.3	0	0	0	108.9	L115 L134 N137 N160 F161 F162	L115-L139 HydrophobicContact CD2-CD2 4.34Å; L115-L139 HydrophobicContact CG-CD2 4.18Å; L115-L139 PolarHBondContact O-N 3.2Å; L134-L139 HydrophobicContact CB-CD1 4.11Å; L134-L139 HydrophobicContact CD1-CD1 4.23Å; N137-L139 HydrophobicContact CB-CG 4.48Å; L139-N160 HydrophobicContact CB-CB 4.3Å; L139-N160 WeakPolarHBondContact CB-OD1 3.48Å; L139-N160 PolarHBondContact N-OD1 3.13Å; L139-F161 CarbonylContact O-C 3.58Å; L139-F161 PolarHBondContact O-N 2.79Å; L139-F162 HydrophobicContact CB-CE1 3.85Å; L139-F162 HydrophobicContact CB-CZ 4.43Å
140	T	94.2	Very high	93.8	Very high	62 Å²	62	40.1 Å²	40.1	38%	0.38	20%	0.201	S	C	.	.	S	Bend	trans	-104.7	-15.8	175.4	56.1	0	0	0	0	112.8	R138 F162 N163	R138-T140 PolarHBondContact O-N 2.86Å; T140-F162 WeakPolarHBondContact O-CA 3.32Å; T140-N163 PolarHBondContact O-N 3.18Å
141	T	94.5	Very high	93.6	Very high	61 Å²	61	41.6 Å²	41.6	37%	0.374	22%	0.221	S	C	.	.			trans	-157.3	165.5	172.5	-174.5	0	0	0	0	109.1	D167	T141-D167 WeakPolarHBondContact OG1-CB 3.4Å
142	L	94.1	Very high	93.4	Very high	8 Å²	8	39 Å²	39	4%	0.042	21%	0.212	C	C	.	.			trans	-160.6	129.9	178.9	-170.7	67.4	0	0	0	108.3	I118 L146 F147 L157 F162 W170 M171	I118-L142 HydrophobicContact CD1-CD1 4.01Å; I118-L142 HydrophobicContact CG1-CD1 4.43Å; L142-L146 HydrophobicContact CD1-CD1 3.39Å; L142-L146 HydrophobicContact CG-CD1 4.03Å; L142-F147 HydrophobicContact CD2-CE2 3.9Å; L142-F147 HydrophobicContact CD2-CZ 3.87Å; L142-F147 HydrophobicContact CG-CE2 4.18Å; L142-F147 HydrophobicContact CG-CZ 4.33Å; L142-L157 HydrophobicContact CD2-CD1 4.31Å; L142-L157 HydrophobicContact CD2-CD2 3.88Å; L142-F162 HydrophobicContact CB-CE1 4.47Å; L142-W170 HydrophobicContact CB-CZ2 4.21Å; L142-W170 HydrophobicContact CD2-CH2 4.33Å; L142-W170 HydrophobicContact CD2-CZ2 4.14Å; L142-W170 HydrophobicContact CG-CZ2 4.19Å; L142-W170 PolarHBondContact O-NE1 3.38Å; L142-M171 HydrophobicContact CB-CE 3.56Å; L142-M171 HydrophobicContact CD2-CE 4.17Å; L142-M171 HydrophobicContact CG-CE 4.44Å
143	S	94	Very high	93.3	Very high	42 Å²	42	42 Å²	42	29%	0.294	22%	0.223	S	C	.	.			trans	-83.3	140.8	178.7	176.2	0	0	0	0	111.7	Q145 L146	S143-Q145 PolarHBondContact O-N 3.02Å; S143-Q145 WeakPolarHBondContact OG-CB 3.15Å; S143-Q145 PolarHBondContact OG-N 3.45Å; S143-Q145 PolarHBondContact OG-OE1 3.15Å; S143-L146 WeakPolarHBondContact O-CB 3.18Å; S143-L146 PolarHBondContact O-N 2.75Å
144	W	93	Very high	93.2	Very high	21 Å²	21	43 Å²	43	8%	0.08	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-63.8	-26.7	172.6	66.7	-95.8	0	0	0	112.8	L146 F147 Q148 W170 E287 N288 M292	W144-L146 PolarHBondContact O-N 3.28Å; W144-L146 VanDerWaalsContact O-N 3.09Å; W144-F147 PolarHBondContact O-N 2.84Å; W144-Q148 HydrophobicContact CE3-CB 4.06Å; W144-Q148 HydrophobicContact CZ3-CB 3.65Å; W144-Q148 PolarHBondContact O-N 2.92Å; W144-W170 HydrophobicContact CB-CB 3.99Å; W144-W170 HydrophobicContact CB-CD2 3.69Å; W144-W170 HydrophobicContact CB-CE3 4.14Å; W144-W170 HydrophobicContact CB-CG 3.63Å; W144-W170 HydrophobicContact CG-CB 4.41Å; W144-W170 HydrophobicContact CG-CG 4.36Å; W144-E287 HydrophobicContact CH2-CB 4.43Å; W144-E287 HydrophobicContact CZ2-CB 4.15Å; W144-N288 PolarHBondContact NE1-O 3.13Å; W144-M292 HydrophobicContact CH2-CB 3.59Å; W144-M292 HydrophobicContact CH2-CE 4.22Å; W144-M292 HydrophobicContact CZ2-CB 4.1Å; W144-M292 HydrophobicContact CZ3-CB 4.19Å
145	Q	91.9	Very high	93.2	Very high	67 Å²	67	43 Å²	43	31%	0.313	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-59.2	-24.7	-179.4	-66.6	169.7	-46.4	0	0	112.8	S143 F147 Q148 E287	S143-Q145 PolarHBondContact O-N 3.02Å; S143-Q145 WeakPolarHBondContact OG-CB 3.15Å; S143-Q145 PolarHBondContact OG-N 3.45Å; S143-Q145 PolarHBondContact OG-OE1 3.15Å; Q145-F147 PolarHBondContact O-N 2.71Å; Q145-Q148 WeakPolarHBondContact O-CG 3.45Å; Q145-Q148 PolarHBondContact O-N 3.31Å; Q145-E287 PolarHBondContact NE2-OE1 3.21Å
146	L	93	Very high	93.2	Very high	7 Å²	7	45.3 Å²	45.3	4%	0.037	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-57.8	-26.5	172	-71	170.1	0	0	0	113	I118 Q119 A122 F123 L142 S143 W144	I118-L146 HydrophobicContact CB-CD1 4.14Å; I118-L146 HydrophobicContact CG2-CD1 4.07Å; I118-L146 HydrophobicContact CG2-CD2 3.84Å; Q119-L146 WeakPolarHBondContact O-CD2 3.42Å; A122-L146 HydrophobicContact CB-CD2 4.43Å; F123-L146 HydrophobicContact CD2-CB 4.24Å; F123-L146 HydrophobicContact CE2-CB 4.45Å; L142-L146 HydrophobicContact CD1-CD1 3.39Å; L142-L146 HydrophobicContact CG-CD1 4.03Å; S143-L146 WeakPolarHBondContact O-CB 3.18Å; S143-L146 PolarHBondContact O-N 2.75Å; W144-L146 PolarHBondContact O-N 3.28Å; W144-L146 VanDerWaalsContact O-N 3.09Å
147	F	93.2	Very high	93.3	Very high	3 Å²	3	44.3 Å²	44.3	1%	0.013	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.4	-5	-171.5	-49.1	-58.8	0	0	0	113.1	F123 I132 L142 W144 Q145 T149 L150 L152 L155 W170 W174	F123-F147 HydrophobicContact CD2-CD1 4.26Å; F123-F147 HydrophobicContact CD2-CE1 4.04Å; F123-F147 HydrophobicContact CE2-CD1 4.4Å; F123-F147 AromaticContact CE2-CE1 3.72Å; F123-F147 HydrophobicContact CE2-CE1 3.72Å; F123-F147 HydrophobicContact CE2-CZ 4.48Å; I132-F147 HydrophobicContact CD1-CD1 4.05Å; I132-F147 HydrophobicContact CD1-CE1 3.73Å; L142-F147 HydrophobicContact CD2-CE2 3.9Å; L142-F147 HydrophobicContact CD2-CZ 3.87Å; L142-F147 HydrophobicContact CG-CE2 4.18Å; L142-F147 HydrophobicContact CG-CZ 4.33Å; W144-F147 PolarHBondContact O-N 2.84Å; Q145-F147 PolarHBondContact O-N 2.71Å; F147-T149 PolarHBondContact O-N 3.38Å; F147-L150 HydrophobicContact CD1-CD1 4.33Å; F147-L150 PolarHBondContact O-N 2.99Å; F147-L152 HydrophobicContact CB-CD1 3.92Å; F147-L152 HydrophobicContact CD1-CD1 3.6Å; F147-L152 HydrophobicContact CE1-CD1 4.3Å; F147-L152 HydrophobicContact CG-CD1 3.84Å; F147-L155 HydrophobicContact CD2-CD2 4.27Å; F147-L155 HydrophobicContact CE1-CD1 4.31Å; F147-L155 HydrophobicContact CE1-CD2 4.48Å; F147-L155 HydrophobicContact CE2-CD2 3.92Å; F147-L155 HydrophobicContact CZ-CD1 4.14Å; F147-L155 HydrophobicContact CZ-CD2 4.02Å; F147-W170 AromaticContact CD2-CH2 3.88Å; F147-W170 HydrophobicContact CD2-CH2 3.88Å; F147-W170 HydrophobicContact CD2-CZ2 4.49Å; F147-W170 HydrophobicContact CD2-CZ3 4.27Å; F147-W170 AromaticContact CE2-CH2 3.56Å; F147-W170 HydrophobicContact CE2-CH2 3.56Å; F147-W170 HydrophobicContact CE2-CZ2 4.05Å; F147-W170 HydrophobicContact CE2-CZ3 4.36Å; F147-W174 HydrophobicContact CB-CH2 3.87Å; F147-W174 HydrophobicContact CD2-CH2 4.44Å; F147-W174 HydrophobicContact CG-CH2 4.47Å
148	Q	86.8	Confident	93.3	Very high	108 Å²	108	47 Å²	47	51%	0.505	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-22	-171.5	78.5	-169.3	24.8	0	0	115.1	W144 Q145	W144-Q148 HydrophobicContact CE3-CB 4.06Å; W144-Q148 HydrophobicContact CZ3-CB 3.65Å; W144-Q148 PolarHBondContact O-N 2.92Å; Q145-Q148 WeakPolarHBondContact O-CG 3.45Å; Q145-Q148 PolarHBondContact O-N 3.31Å
149	T	83.7	Confident	93.2	Very high	93 Å²	93	46.7 Å²	46.7	57%	0.571	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.6	3.7	178.6	48.6	0	0	0	0	113.2	F147	F147-T149 PolarHBondContact O-N 3.38Å
150	L	91.3	Very high	93.2	Very high	16 Å²	16	47.1 Å²	47.1	8%	0.084	25%	0.248	C	C	.	.			trans	-112.9	122.2	-172.5	-57.5	-177.1	0	0	0	111.6	F123 N126 L129 I132 F147 L152	F123-L150 HydrophobicContact CB-CD1 3.9Å; F123-L150 HydrophobicContact CD2-CD1 4.32Å; F123-L150 HydrophobicContact CG-CD1 4.35Å; N126-L150 WeakPolarHBondContact O-CD2 3.27Å; L129-L150 HydrophobicContact CB-CD1 4.27Å; L129-L150 HydrophobicContact CB-CD2 4.28Å; L129-L150 HydrophobicContact CD2-CD1 4.26Å; L129-L150 HydrophobicContact CG-CD1 4.48Å; I132-L150 HydrophobicContact CD1-CD1 4.25Å; F147-L150 HydrophobicContact CD1-CD1 4.33Å; F147-L150 PolarHBondContact O-N 2.99Å; L150-L152 HydrophobicContact CB-CD2 4.22Å; L150-L152 HydrophobicContact CB-CG 3.98Å; L150-L152 HydrophobicContact CD1-CD2 4.25Å; L150-L152 PolarHBondContact O-N 3.18Å
151	S	90.3	Very high	93	Very high	98 Å²	98	49.9 Å²	49.9	69%	0.685	26%	0.256	S	S	*	.			trans	-76.1	68.4	168.9	-45.8	0	0	0	0	111
152	L	93.1	Very high	93.1	Very high	23 Å²	23	47.1 Å²	47.1	12%	0.12	24%	0.238	C	C	.	.			trans	-63.8	137.3	-177.7	-71.4	179.1	0	0	0	112.1	L129 I132 F147 L150 L155 W174 A180	L129-L152 WeakPolarHBondContact O-CD2 3.37Å; I132-L152 HydrophobicContact CD1-CD1 4.4Å; I132-L152 HydrophobicContact CD1-CD2 3.75Å; I132-L152 HydrophobicContact CG1-CD2 3.97Å; F147-L152 HydrophobicContact CB-CD1 3.92Å; F147-L152 HydrophobicContact CD1-CD1 3.6Å; F147-L152 HydrophobicContact CE1-CD1 4.3Å; F147-L152 HydrophobicContact CG-CD1 3.84Å; L150-L152 HydrophobicContact CB-CD2 4.22Å; L150-L152 HydrophobicContact CB-CG 3.98Å; L150-L152 HydrophobicContact CD1-CD2 4.25Å; L150-L152 PolarHBondContact O-N 3.18Å; L152-L155 HydrophobicContact CD1-CB 4.4Å; L152-L155 HydrophobicContact CD1-CD2 4.35Å; L152-W174 HydrophobicContact CD1-CZ3 4.45Å; L152-A180 HydrophobicContact CB-CB 4.11Å
153	R	94.5	Very high	93.1	Very high	68 Å²	68	50.9 Å²	50.9	26%	0.257	26%	0.258	S	S	.	.	S	Bend	trans	-103.2	-26.1	174	-68.1	178.2	160.3	-149.3	-15.7	112.8	R130 Y131 S775 E778	R130-R153 HydrophobicContact CB-CG 4.32Å; R130-R153 PolarHBondContact O-N 2.97Å; Y131-R153 HydrophobicContact CE1-CB 4.02Å; Y131-R153 VanDerWaalsContact OH-CD 3.28Å; Y131-R153 WeakPolarHBondContact OH-CD 3.43Å; Y131-R153 PolarHBondContact OH-NH1 3.31Å; Y131-R153 VanDerWaalsContact OH-NH1 3.12Å; R153-S775 PolarHBondContact NH2-OG 3.36Å; R153-S775 VanDerWaalsContact NH2-OG 3.15Å; R153-E778 IonicContact CZ-OE1 3.43Å; R153-E778 IonicContact CZ-OE2 2.74Å; R153-E778 IonicContact NH1-OE1 3.87Å; R153-E778 PolarHBondContact NH1-OE1 3.09Å; R153-E778 IonicContact NH1-OE2 3.17Å; R153-E778 IonicContact NH2-OE1 3.98Å; R153-E778 PolarHBondContact NH2-OE1 3.32Å; R153-E778 IonicContact NH2-OE2 2.71Å; R153-E778 PolarHBondContact NH2-OE2 3.23Å
154	E	96.3	Very high	93.1	Very high	43 Å²	43	50.2 Å²	50.2	20%	0.201	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	126.5	179.1	-159.6	167.4	130.4	0	0	111.2	R130 Y131 I132 Q156 A180 K181	R130-E154 PolarHBondContact O-N 3.25Å; Y131-E154 HydrophobicContact CD1-CB 3.77Å; Y131-E154 HydrophobicContact CE1-CB 4.26Å; I132-E154 PolarHBondContact N-O 2.91Å; E154-Q156 HydrophobicContact CG-CG 4.31Å; E154-Q156 PolarHBondContact OE1-NE2 3.11Å; E154-A180 WeakPolarHBondContact CA-O 3.43Å; E154-K181 HydrophobicContact CG-CB 4.49Å; E154-K181 HydrophobicContact CG-CD 4.1Å; E154-K181 WeakPolarHBondContact OE2-CE 3.35Å; E154-K181 IonicContact OE2-NZ 3.65Å; E154-K181 PolarHBondContact OE2-NZ 3.29Å
155	L	96.8	Very high	93.1	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	102.6	175.2	176.9	57.7	0	0	0	109.7	I132 F147 L152 L157 W170 W174 A180 L182 Q185	I132-L155 HydrophobicContact CB-CD1 3.79Å; I132-L155 HydrophobicContact CG2-CD1 3.65Å; I132-L155 CarbonylContact O-C 3.53Å; I132-L155 WeakPolarHBondContact O-CA 3.41Å; F147-L155 HydrophobicContact CD2-CD2 4.27Å; F147-L155 HydrophobicContact CE1-CD1 4.31Å; F147-L155 HydrophobicContact CE1-CD2 4.48Å; F147-L155 HydrophobicContact CE2-CD2 3.92Å; F147-L155 HydrophobicContact CZ-CD1 4.14Å; F147-L155 HydrophobicContact CZ-CD2 4.02Å; L152-L155 HydrophobicContact CD1-CB 4.4Å; L152-L155 HydrophobicContact CD1-CD2 4.35Å; L155-L157 HydrophobicContact CD1-CD2 4.03Å; L155-L157 HydrophobicContact CD1-CG 4.3Å; L155-L157 HydrophobicContact CD2-CD1 4.18Å; L155-L157 HydrophobicContact CG-CD1 4.21Å; L155-L157 HydrophobicContact CG-CD2 4.28Å; L155-L157 HydrophobicContact CG-CG 4.01Å; L155-W170 HydrophobicContact CD2-CH2 4.05Å; L155-W170 HydrophobicContact CD2-CZ3 4.24Å; L155-W174 HydrophobicContact CD2-CZ3 4.22Å; L155-A180 HydrophobicContact CB-CB 3.91Å; L155-A180 PolarHBondContact N-O 3.4Å; L155-L182 WeakPolarHBondContact O-CD2 3.49Å; L155-Q185 PolarHBondContact O-NE2 2.76Å
156	Q	97	Very high	93.2	Very high	64 Å²	64	48.1 Å²	48.1	30%	0.299	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	119.8	179.3	-60.8	-170.2	0.6	0	0	111.6	I132 N133 L134 S135 E154	I132-Q156 PolarHBondContact O-N 3.5Å; N133-Q156 HydrophobicContact CB-CB 4.16Å; N133-Q156 PolarHBondContact ND2-OE1 3.17Å; L134-Q156 PolarHBondContact N-O 3.28Å; S135-Q156 PolarHBondContact N-O 3.05Å; E154-Q156 HydrophobicContact CG-CG 4.31Å; E154-Q156 PolarHBondContact OE1-NE2 3.11Å
157	L	96.4	Very high	93.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.266	C	S	.	.			trans	-125.2	-0.7	-176.6	-63.1	179.1	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 4.31Å; L142-L157 HydrophobicContact CD2-CD1 4.31Å; L142-L157 HydrophobicContact CD2-CD2 3.88Å; L155-L157 HydrophobicContact CD1-CD2 4.03Å; L155-L157 HydrophobicContact CD1-CG 4.3Å; L155-L157 HydrophobicContact CD2-CD1 4.18Å; L155-L157 HydrophobicContact CG-CD1 4.21Å; L155-L157 HydrophobicContact CG-CD2 4.28Å; L155-L157 HydrophobicContact CG-CG 4.01Å; L157-N160 PolarHBondContact O-N 3Å; L157-N160 PolarHBondContact O-ND2 3.31Å; L157-F162 HydrophobicContact CB-CE2 4.17Å; L157-F162 HydrophobicContact CB-CZ 4.2Å; L157-F162 HydrophobicContact CD1-CZ 4.35Å; L157-F162 HydrophobicContact CD2-CZ 4.48Å; L157-W170 HydrophobicContact CD1-CH2 4.45Å; L157-M171 HydrophobicContact CD1-CE 4.12Å; L157-M171 HydrophobicContact CD1-CG 4.45Å; L157-M171 HydrophobicContact CD1-SD 4.02Å; L157-L182 HydrophobicContact CD1-CD2 4.08Å; L157-L182 HydrophobicContact CG-CD2 4.43Å; L157-L187 HydrophobicContact CB-CD2 3.98Å
158	E	94.4	Very high	93.3	Very high	64 Å²	64	51.1 Å²	51.1	30%	0.299	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51	150.6	-178.3	-65.9	-164.9	132.9	0	0	113.7	S135 S136 N160 Q185 N186 L187	S135-E158 CarbonylContact C-O 3.57Å; S135-E158 WeakPolarHBondContact CA-O 3.09Å; S135-E158 VanDerWaalsContact CB-O 3.3Å; S135-E158 WeakPolarHBondContact CB-O 3.49Å; S136-E158 PolarHBondContact N-O 3.29Å; E158-N160 PolarHBondContact O-N 3.15Å; E158-Q185 HydrophobicContact CG-CB 3.72Å; E158-Q185 HydrophobicContact CG-CG 3.83Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.32Å; E158-N186 PolarHBondContact OE1-N 3.31Å; E158-L187 HydrophobicContact CG-CD2 4.32Å
159	Q	93.7	Very high	93.7	Very high	133 Å²	133	48.2 Å²	48.2	62%	0.621	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	21.3	179.3	-50.1	177.5	18	0	0	115.3	S136	S136-Q159 VanDerWaalsContact OG-CD 3.31Å; S136-Q159 PolarHBondContact OG-OE1 2.99Å
160	N	94.5	Very high	94.2	Very high	8 Å²	8	44 Å²	44	4%	0.043	22%	0.223	C	C	.	.			trans	-91.2	150.8	158.5	-72.6	-81.3	0	0	0	110.3	L134 N137 L139 L157 E158 F162	L134-N160 PolarHBondContact O-ND2 3.33Å; N137-N160 WeakPolarHBondContact CA-OD1 3.42Å; N137-N160 VanDerWaalsContact CB-OD1 3.29Å; N137-N160 WeakPolarHBondContact CB-OD1 3.39Å; N137-N160 PolarHBondContact N-OD1 3.48Å; L139-N160 HydrophobicContact CB-CB 4.3Å; L139-N160 WeakPolarHBondContact CB-OD1 3.48Å; L139-N160 PolarHBondContact N-OD1 3.13Å; L157-N160 PolarHBondContact O-N 3Å; L157-N160 PolarHBondContact O-ND2 3.31Å; E158-N160 PolarHBondContact O-N 3.15Å; N160-F162 HydrophobicContact CB-CD2 4.12Å; N160-F162 HydrophobicContact CB-CE1 4.16Å; N160-F162 HydrophobicContact CB-CE2 3.57Å; N160-F162 HydrophobicContact CB-CZ 3.6Å
161	F	91.1	Very high	94.4	Very high	121 Å²	121	43.2 Å²	43.2	53%	0.531	22%	0.219	S	C	.	.			trans	-104.8	71.3	-176.9	-63.6	-67.5	0	0	0	110.1	L139 I190	L139-F161 CarbonylContact O-C 3.58Å; L139-F161 PolarHBondContact O-N 2.79Å; F161-I190 HydrophobicContact CB-CD1 3.88Å; F161-I190 HydrophobicContact CD1-CD1 3.83Å; F161-I190 HydrophobicContact CG-CD1 4.2Å
162	F	95.4	Very high	94.5	Very high	3 Å²	3	38.8 Å²	38.8	1%	0.013	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	142.2	-179.6	-60.6	-69.7	0	0	0	111.8	L139 T140 L142 L157 N160 I168 M171 C189 I190	L139-F162 HydrophobicContact CB-CE1 3.85Å; L139-F162 HydrophobicContact CB-CZ 4.43Å; T140-F162 WeakPolarHBondContact O-CA 3.32Å; L142-F162 HydrophobicContact CB-CE1 4.47Å; L157-F162 HydrophobicContact CB-CE2 4.17Å; L157-F162 HydrophobicContact CB-CZ 4.2Å; L157-F162 HydrophobicContact CD1-CZ 4.35Å; L157-F162 HydrophobicContact CD2-CZ 4.48Å; N160-F162 HydrophobicContact CB-CD2 4.12Å; N160-F162 HydrophobicContact CB-CE1 4.16Å; N160-F162 HydrophobicContact CB-CE2 3.57Å; N160-F162 HydrophobicContact CB-CZ 3.6Å; F162-I168 HydrophobicContact CB-CD1 3.89Å; F162-I168 HydrophobicContact CB-CG2 4.35Å; F162-I168 HydrophobicContact CD1-CG2 4.31Å; F162-M171 HydrophobicContact CD1-CE 4.09Å; F162-M171 HydrophobicContact CD2-SD 4.33Å; F162-M171 HydrophobicContact CE1-CE 3.69Å; F162-M171 HydrophobicContact CE1-SD 4.37Å; F162-M171 HydrophobicContact CE2-CE 4.44Å; F162-M171 HydrophobicContact CE2-SD 4.14Å; F162-M171 HydrophobicContact CZ-CE 3.89Å; F162-M171 HydrophobicContact CZ-SD 4.17Å; F162-C189 CarbonylContact O-C 3.44Å; F162-C189 WeakPolarHBondContact O-CA 3.23Å; F162-I190 PolarHBondContact O-N 2.83Å
163	N	94.7	Very high	94.6	Very high	86 Å²	86	39 Å²	39	46%	0.46	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.3	172.8	-67.5	-19.3	0	0	0	109.2	T140 S165 I168	T140-N163 PolarHBondContact O-N 3.18Å; N163-S165 WeakPolarHBondContact O-CB 3.33Å; N163-S165 PolarHBondContact O-N 3.12Å; N163-S165 PolarHBondContact O-OG 3.09Å; N163-I168 VanDerWaalsContact O-CD1 3.25Å; N163-I168 WeakPolarHBondContact O-CD1 3.48Å
164	C	94.3	Very high	94.5	Very high	28 Å²	28	38.5 Å²	38.5	19%	0.189	19%	0.187	C	C	.	.	S	Bend	trans	-62.2	103	173.4	-59.1	0	0	0	0	109	C189 I190 N191 M202	C164-C189 VanDerWaalsContact CA-SG 3.53Å; C164-C189 HydrophobicContact CB-CB 3.91Å; C164-C189 WeakPolarHBondContact CB-SG 3.43Å; C164-C189 WeakPolarHBondContact SG-CB 3.05Å; C164-C189 CovalentContact SG-SG 2.04Å; C164-C189 PolarHBondContact SG-SG 3.43Å; C164-I190 PolarHBondContact N-O 2.89Å; C164-I190 PolarHBondContact SG-N 2.9Å; C164-N191 WeakPolarHBondContact CB-OD1 3.36Å; C164-N191 PolarHBondContact SG-OD1 3.4Å; C164-M202 HydrophobicContact CB-SD 4.36Å
165	S	93.5	Very high	94.4	Very high	26 Å²	26	37.6 Å²	37.6	18%	0.182	18%	0.183	C	C	.	.	S	Bend	trans	-156.5	161.5	-167.6	55.2	0	0	0	0	110.1	N163 D167 I168 I204	N163-S165 WeakPolarHBondContact O-CB 3.33Å; N163-S165 PolarHBondContact O-N 3.12Å; N163-S165 PolarHBondContact O-OG 3.09Å; S165-D167 PolarHBondContact O-N 2.96Å; S165-I168 VanDerWaalsContact O-CG1 3.26Å; S165-I168 WeakPolarHBondContact O-CG1 3.45Å; S165-I168 PolarHBondContact O-N 3.2Å; S165-I204 VanDerWaalsContact CA-CD1 3.47Å; S165-I204 VanDerWaalsContact O-CD1 3.32Å; S165-I204 WeakPolarHBondContact O-CD1 3.04Å
166	C	94.2	Very high	94.2	Very high	19 Å²	19	43 Å²	43	13%	0.128	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-67	-27.8	-177.7	-166.8	0	0	0	0	112.4	I168 R169 C207 V289 V290	C166-I168 PolarHBondContact O-N 2.92Å; C166-R169 WeakPolarHBondContact O-CB 3.46Å; C166-R169 PolarHBondContact O-N 3.38Å; C166-C207 WeakPolarHBondContact CA-SG 3.4Å; C166-C207 HydrophobicContact CB-CB 3.94Å; C166-C207 WeakPolarHBondContact CB-SG 3.47Å; C166-C207 VanDerWaalsContact SG-CA 3.51Å; C166-C207 WeakPolarHBondContact SG-CB 3.08Å; C166-C207 CovalentContact SG-SG 2.04Å; C166-C207 PolarHBondContact SG-SG 2.8Å; C166-V289 HydrophobicContact CB-CG2 4.07Å; C166-V290 WeakPolarHBondContact SG-CG2 3.39Å
167	D	92.8	Very high	94	Very high	73 Å²	73	45.7 Å²	45.7	39%	0.39	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-60.8	-16.1	178.7	-47.8	-90.9	0	0	0	114.6	T141 S165 W170	T141-D167 WeakPolarHBondContact OG1-CB 3.4Å; S165-D167 PolarHBondContact O-N 2.96Å; D167-W170 PolarHBondContact O-NE1 2.79Å; D167-W170 VanDerWaalsContact O-NE1 3.1Å
168	I	94.3	Very high	93.8	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-110.7	5.3	175.9	65.2	163.7	0	0	0	113.5	F162 N163 S165 C166 W170 M171 C189 L199 M202	F162-I168 HydrophobicContact CB-CD1 3.89Å; F162-I168 HydrophobicContact CB-CG2 4.35Å; F162-I168 HydrophobicContact CD1-CG2 4.31Å; N163-I168 VanDerWaalsContact O-CD1 3.25Å; N163-I168 WeakPolarHBondContact O-CD1 3.48Å; S165-I168 VanDerWaalsContact O-CG1 3.26Å; S165-I168 WeakPolarHBondContact O-CG1 3.45Å; S165-I168 PolarHBondContact O-N 3.2Å; C166-I168 PolarHBondContact O-N 2.92Å; I168-W170 PolarHBondContact O-N 3.16Å; I168-M171 HydrophobicContact CB-CE 4.32Å; I168-M171 HydrophobicContact CB-CG 4.48Å; I168-M171 HydrophobicContact CB-SD 4.03Å; I168-M171 HydrophobicContact CG2-CE 3.9Å; I168-M171 HydrophobicContact CG2-SD 4.17Å; I168-M171 WeakPolarHBondContact O-CB 3.35Å; I168-M171 PolarHBondContact O-N 2.91Å; I168-C189 HydrophobicContact CD1-CB 3.66Å; I168-L199 HydrophobicContact CD1-CD1 3.83Å; I168-L199 HydrophobicContact CG1-CD1 4.47Å; I168-M202 HydrophobicContact CD1-SD 3.86Å; I168-M202 HydrophobicContact CG1-CE 4.05Å; I168-M202 HydrophobicContact CG1-SD 3.89Å
169	R	94.7	Very high	93.7	Very high	47 Å²	47	48.7 Å²	48.7	18%	0.177	24%	0.242	C	C	.	.	H	α-helix	trans	-60.7	-34.3	179.1	-177.6	68.2	165.4	125.9	15.3	112.2	C166 M171 Q172 L173 M202 C207 V290	C166-R169 WeakPolarHBondContact O-CB 3.46Å; C166-R169 PolarHBondContact O-N 3.38Å; R169-M171 VanDerWaalsContact C-N 3.25Å; R169-M171 PolarHBondContact O-N 3.15Å; R169-Q172 WeakPolarHBondContact O-CB 3.46Å; R169-Q172 PolarHBondContact O-N 2.85Å; R169-Q172 VanDerWaalsContact O-N 3.08Å; R169-L173 WeakPolarHBondContact O-CG 3.25Å; R169-L173 PolarHBondContact O-N 3.07Å; R169-M202 HydrophobicContact CB-CE 4.24Å; R169-C207 VanDerWaalsContact CB-SG 3.5Å; R169-C207 PolarHBondContact NE-O 2.88Å; R169-V290 HydrophobicContact CB-CG1 3.98Å; R169-V290 HydrophobicContact CB-CG2 4.17Å; R169-V290 HydrophobicContact CG-CB 4.49Å; R169-V290 HydrophobicContact CG-CG1 3.54Å; R169-V290 HydrophobicContact CG-CG2 4.22Å
170	W	94.4	Very high	93.7	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.011	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-36.2	173.5	71	-95.8	0	0	0	112.7	L142 W144 F147 L155 L157 D167 I168 Q172 L173 W174 V290	L142-W170 HydrophobicContact CB-CZ2 4.21Å; L142-W170 HydrophobicContact CD2-CH2 4.33Å; L142-W170 HydrophobicContact CD2-CZ2 4.14Å; L142-W170 HydrophobicContact CG-CZ2 4.19Å; L142-W170 PolarHBondContact O-NE1 3.38Å; W144-W170 HydrophobicContact CB-CB 3.99Å; W144-W170 HydrophobicContact CB-CD2 3.69Å; W144-W170 HydrophobicContact CB-CE3 4.14Å; W144-W170 HydrophobicContact CB-CG 3.63Å; W144-W170 HydrophobicContact CG-CB 4.41Å; W144-W170 HydrophobicContact CG-CG 4.36Å; F147-W170 AromaticContact CD2-CH2 3.88Å; F147-W170 HydrophobicContact CD2-CH2 3.88Å; F147-W170 HydrophobicContact CD2-CZ2 4.49Å; F147-W170 HydrophobicContact CD2-CZ3 4.27Å; F147-W170 AromaticContact CE2-CH2 3.56Å; F147-W170 HydrophobicContact CE2-CH2 3.56Å; F147-W170 HydrophobicContact CE2-CZ2 4.05Å; F147-W170 HydrophobicContact CE2-CZ3 4.36Å; L155-W170 HydrophobicContact CD2-CH2 4.05Å; L155-W170 HydrophobicContact CD2-CZ3 4.24Å; L157-W170 HydrophobicContact CD1-CH2 4.45Å; D167-W170 PolarHBondContact O-NE1 2.79Å; D167-W170 VanDerWaalsContact O-NE1 3.1Å; I168-W170 PolarHBondContact O-N 3.16Å; W170-Q172 VanDerWaalsContact C-N 3.3Å; W170-Q172 PolarHBondContact O-N 3.11Å; W170-L173 PolarHBondContact O-N 3.15Å; W170-W174 AromaticContact CE3-CD2 3.86Å; W170-W174 HydrophobicContact CE3-CD2 3.86Å; W170-W174 HydrophobicContact CE3-CE3 4.01Å; W170-W174 HydrophobicContact CE3-CG 4.24Å; W170-W174 HydrophobicContact CE3-CZ3 4.42Å; W170-W174 AromaticContact CZ3-CD2 3.99Å; W170-W174 HydrophobicContact CZ3-CD2 3.99Å; W170-W174 AromaticContact CZ3-CE3 3.62Å; W170-W174 HydrophobicContact CZ3-CE3 3.62Å; W170-W174 HydrophobicContact CZ3-CH2 4.39Å; W170-W174 AromaticContact CZ3-CZ3 3.84Å; W170-W174 HydrophobicContact CZ3-CZ3 3.84Å; W170-W174 WeakPolarHBondContact O-CB 3.46Å; W170-W174 PolarHBondContact O-N 2.74Å; W170-V290 VanDerWaalsContact CB-O 3.29Å; W170-V290 WeakPolarHBondContact CB-O 3.49Å
171	M	95.2	Very high	93.6	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-66.1	-36.2	177.4	-59.7	179.8	-173.1	0	0	111.3	L142 L157 F162 I168 R169 Q175 L199	L142-M171 HydrophobicContact CB-CE 3.56Å; L142-M171 HydrophobicContact CD2-CE 4.17Å; L142-M171 HydrophobicContact CG-CE 4.44Å; L157-M171 HydrophobicContact CD1-CE 4.12Å; L157-M171 HydrophobicContact CD1-CG 4.45Å; L157-M171 HydrophobicContact CD1-SD 4.02Å; F162-M171 HydrophobicContact CD1-CE 4.09Å; F162-M171 HydrophobicContact CD2-SD 4.33Å; F162-M171 HydrophobicContact CE1-CE 3.69Å; F162-M171 HydrophobicContact CE1-SD 4.37Å; F162-M171 HydrophobicContact CE2-CE 4.44Å; F162-M171 HydrophobicContact CE2-SD 4.14Å; F162-M171 HydrophobicContact CZ-CE 3.89Å; F162-M171 HydrophobicContact CZ-SD 4.17Å; I168-M171 HydrophobicContact CB-CE 4.32Å; I168-M171 HydrophobicContact CB-CG 4.48Å; I168-M171 HydrophobicContact CB-SD 4.03Å; I168-M171 HydrophobicContact CG2-CE 3.9Å; I168-M171 HydrophobicContact CG2-SD 4.17Å; I168-M171 WeakPolarHBondContact O-CB 3.35Å; I168-M171 PolarHBondContact O-N 2.91Å; R169-M171 VanDerWaalsContact C-N 3.25Å; R169-M171 PolarHBondContact O-N 3.15Å; M171-Q175 VanDerWaalsContact O-CB 3.23Å; M171-Q175 WeakPolarHBondContact O-CB 3.31Å; M171-Q175 PolarHBondContact O-N 3.03Å; M171-L199 HydrophobicContact CB-CD2 3.72Å
172	Q	94.3	Very high	93.7	Very high	6 Å²	6	41.3 Å²	41.3	3%	0.028	21%	0.209	C	C	.	.	H	α-helix	trans	-68	-44.8	175.7	-173.1	-176	4.5	0	0	110.5	R169 W170 Q175 E176 L199 M202	R169-Q172 WeakPolarHBondContact O-CB 3.46Å; R169-Q172 PolarHBondContact O-N 2.85Å; R169-Q172 VanDerWaalsContact O-N 3.08Å; W170-Q172 VanDerWaalsContact C-N 3.3Å; W170-Q172 PolarHBondContact O-N 3.11Å; Q172-Q175 WeakPolarHBondContact O-CB 3.49Å; Q172-Q175 PolarHBondContact O-N 3.42Å; Q172-E176 WeakPolarHBondContact CG-OE1 3.49Å; Q172-E176 PolarHBondContact NE2-OE1 2.86Å; Q172-E176 WeakPolarHBondContact O-CG 3.32Å; Q172-E176 PolarHBondContact O-N 3.24Å; Q172-L199 HydrophobicContact CB-CD1 4.44Å; Q172-L199 HydrophobicContact CB-CD2 4.48Å; Q172-L199 HydrophobicContact CB-CG 4.09Å; Q172-M202 PolarHBondContact NE2-O 3.43Å; Q172-M202 PolarHBondContact OE1-O 3.26Å
173	L	93.4	Very high	93.6	Very high	26 Å²	26	45.9 Å²	45.9	14%	0.136	23%	0.234	C	C	.	.	H	α-helix	trans	-61.3	-46	176.1	-65.4	173.2	0	0	0	111.5	R169 W170 Q175 E176 Q177 L209 V290	R169-L173 WeakPolarHBondContact O-CG 3.25Å; R169-L173 PolarHBondContact O-N 3.07Å; W170-L173 PolarHBondContact O-N 3.15Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; L173-Q175 PolarHBondContact O-N 2.64Å; L173-E176 PolarHBondContact O-N 3.43Å; L173-E176 VanDerWaalsContact O-N 3.16Å; L173-Q177 WeakPolarHBondContact O-CB 3.46Å; L173-Q177 VanDerWaalsContact O-CG 3.26Å; L173-Q177 WeakPolarHBondContact O-CG 3.47Å; L173-Q177 PolarHBondContact O-N 2.91Å; L173-Q177 PolarHBondContact O-OE1 2.8Å; L173-L209 HydrophobicContact CD1-CD1 4.03Å; L173-L209 HydrophobicContact CD1-CD2 4.09Å; L173-L209 HydrophobicContact CD1-CG 3.86Å; L173-V290 HydrophobicContact CD1-CG1 3.59Å
174	W	94.2	Very high	93.6	Very high	59 Å²	59	45.8 Å²	45.8	22%	0.223	24%	0.24	C	C	.	.	H	α-helix	trans	-64	-35.7	174.8	-76.6	18	0	0	0	112.3	F147 L152 L155 W170 G178 E179 L182	F147-W174 HydrophobicContact CB-CH2 3.87Å; F147-W174 HydrophobicContact CD2-CH2 4.44Å; F147-W174 HydrophobicContact CG-CH2 4.47Å; L152-W174 HydrophobicContact CD1-CZ3 4.45Å; L155-W174 HydrophobicContact CD2-CZ3 4.22Å; W170-W174 AromaticContact CE3-CD2 3.86Å; W170-W174 HydrophobicContact CE3-CD2 3.86Å; W170-W174 HydrophobicContact CE3-CE3 4.01Å; W170-W174 HydrophobicContact CE3-CG 4.24Å; W170-W174 HydrophobicContact CE3-CZ3 4.42Å; W170-W174 AromaticContact CZ3-CD2 3.99Å; W170-W174 HydrophobicContact CZ3-CD2 3.99Å; W170-W174 AromaticContact CZ3-CE3 3.62Å; W170-W174 HydrophobicContact CZ3-CE3 3.62Å; W170-W174 HydrophobicContact CZ3-CH2 4.39Å; W170-W174 AromaticContact CZ3-CZ3 3.84Å; W170-W174 HydrophobicContact CZ3-CZ3 3.84Å; W170-W174 WeakPolarHBondContact O-CB 3.46Å; W170-W174 PolarHBondContact O-N 2.74Å; W174-G178 CarbonylContact O-C 3.52Å; W174-G178 PolarHBondContact O-N 3.22Å; W174-E179 HydrophobicContact CB-CB 3.8Å; W174-E179 HydrophobicContact CD2-CB 3.99Å; W174-E179 HydrophobicContact CE3-CB 4.31Å; W174-E179 HydrophobicContact CG-CB 3.76Å; W174-E179 HydrophobicContact CG-CG 4.32Å; W174-E179 PolarHBondContact O-N 3.18Å; W174-L182 HydrophobicContact CB-CD1 3.58Å; W174-L182 HydrophobicContact CD2-CD1 4.33Å; W174-L182 HydrophobicContact CE3-CD1 3.68Å; W174-L182 HydrophobicContact CG-CD1 4.36Å
175	Q	93.6	Very high	93.5	Very high	24 Å²	24	45.1 Å²	45.1	11%	0.112	23%	0.234	C	C	.	.	H	α-helix	trans	-65.6	-36.3	173.1	-174.5	174	53.9	0	0	112.3	M171 Q172 L173 L182 N183 Q185	M171-Q175 VanDerWaalsContact O-CB 3.23Å; M171-Q175 WeakPolarHBondContact O-CB 3.31Å; M171-Q175 PolarHBondContact O-N 3.03Å; Q172-Q175 WeakPolarHBondContact O-CB 3.49Å; Q172-Q175 PolarHBondContact O-N 3.42Å; L173-Q175 VanDerWaalsContact C-N 3.32Å; L173-Q175 PolarHBondContact O-N 2.64Å; Q175-L182 HydrophobicContact CB-CB 4.29Å; Q175-L182 PolarHBondContact NE2-O 3.2Å; Q175-N183 WeakPolarHBondContact O-CB 3.49Å; Q175-Q185 PolarHBondContact NE2-O 2.97Å
176	E	92.7	Very high	93.5	Very high	113 Å²	113	49.1 Å²	49.1	53%	0.528	25%	0.253	S	S	.	.	H	α-helix	trans	-74.1	-38	176.1	-72.4	168.6	-166.6	0	0	112.3	Q172 L173	Q172-E176 WeakPolarHBondContact CG-OE1 3.49Å; Q172-E176 PolarHBondContact NE2-OE1 2.86Å; Q172-E176 WeakPolarHBondContact O-CG 3.32Å; Q172-E176 PolarHBondContact O-N 3.24Å; L173-E176 PolarHBondContact O-N 3.43Å; L173-E176 VanDerWaalsContact O-N 3.16Å
177	Q	92.1	Very high	93.5	Very high	121 Å²	121	48.5 Å²	48.5	57%	0.565	25%	0.249	S	C	*	.	H	α-helix	trans	-77.5	-24.2	178.5	-70.4	165	-24	0	0	113.4	L173 E179	L173-Q177 WeakPolarHBondContact O-CB 3.46Å; L173-Q177 VanDerWaalsContact O-CG 3.26Å; L173-Q177 WeakPolarHBondContact O-CG 3.47Å; L173-Q177 PolarHBondContact O-N 2.91Å; L173-Q177 PolarHBondContact O-OE1 2.8Å; Q177-E179 HydrophobicContact CB-CG 4.06Å
178	G	91.6	Very high	93.5	Very high	28 Å²	28	49.4 Å²	49.4	29%	0.289	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.1	8.1	-175.4	0	0	0	0	0	114.7	W174	W174-G178 CarbonylContact O-C 3.52Å; W174-G178 PolarHBondContact O-N 3.22Å
179	E	92.6	Very high	93.6	Very high	99 Å²	99	49.4 Å²	49.4	46%	0.463	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-61.7	140	-177.6	-71.2	-58.7	156.9	0	0	112.8	W174 Q177 K181 L182	W174-E179 HydrophobicContact CB-CB 3.8Å; W174-E179 HydrophobicContact CD2-CB 3.99Å; W174-E179 HydrophobicContact CE3-CB 4.31Å; W174-E179 HydrophobicContact CG-CB 3.76Å; W174-E179 HydrophobicContact CG-CG 4.32Å; W174-E179 PolarHBondContact O-N 3.18Å; Q177-E179 HydrophobicContact CB-CG 4.06Å; E179-K181 PolarHBondContact O-N 3.01Å; E179-L182 PolarHBondContact O-N 2.81Å
180	A	93.7	Very high	93.6	Very high	8 Å²	8	49.4 Å²	49.4	7%	0.066	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	44.2	29.5	-179.5	0	0	0	0	0	115.4	L152 E154 L155 L182	L152-A180 HydrophobicContact CB-CB 4.11Å; E154-A180 WeakPolarHBondContact CA-O 3.43Å; L155-A180 HydrophobicContact CB-CB 3.91Å; L155-A180 PolarHBondContact N-O 3.4Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.08Å
181	K	93.4	Very high	93.5	Very high	98 Å²	98	52 Å²	52	43%	0.426	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	56.8	30.8	-174.6	-50.3	-177.4	-167.3	167.6	0	115.2	E154 E179 N183 S184 Q185	E154-K181 HydrophobicContact CG-CB 4.49Å; E154-K181 HydrophobicContact CG-CD 4.1Å; E154-K181 WeakPolarHBondContact OE2-CE 3.35Å; E154-K181 IonicContact OE2-NZ 3.65Å; E154-K181 PolarHBondContact OE2-NZ 3.29Å; E179-K181 PolarHBondContact O-N 3.01Å; K181-N183 PolarHBondContact O-N 3.45Å; K181-S184 PolarHBondContact O-N 3.28Å; K181-S184 PolarHBondContact O-OG 2.78Å; K181-Q185 PolarHBondContact O-NE2 3.43Å
182	L	93.5	Very high	93.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-68.3	-26.5	173.7	-74.7	159.4	0	0	0	112.3	L155 L157 W174 Q175 E179 A180 S184 Q185 L187	L155-L182 WeakPolarHBondContact O-CD2 3.49Å; L157-L182 HydrophobicContact CD1-CD2 4.08Å; L157-L182 HydrophobicContact CG-CD2 4.43Å; W174-L182 HydrophobicContact CB-CD1 3.58Å; W174-L182 HydrophobicContact CD2-CD1 4.33Å; W174-L182 HydrophobicContact CE3-CD1 3.68Å; W174-L182 HydrophobicContact CG-CD1 4.36Å; Q175-L182 HydrophobicContact CB-CB 4.29Å; Q175-L182 PolarHBondContact NE2-O 3.2Å; E179-L182 PolarHBondContact O-N 2.81Å; A180-L182 VanDerWaalsContact C-N 3.3Å; A180-L182 PolarHBondContact O-N 3.08Å; L182-S184 PolarHBondContact O-N 3.44Å; L182-Q185 PolarHBondContact O-N 3.28Å; L182-L187 HydrophobicContact CD2-CD1 3.78Å
183	N	92.9	Very high	92.9	Very high	100 Å²	100	63.5 Å²	63.5	54%	0.535	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-60.2	-21.7	172.4	66.6	-14.1	0	0	0	114.6	Q175 K181 Q185	Q175-N183 WeakPolarHBondContact O-CB 3.49Å; K181-N183 PolarHBondContact O-N 3.45Å; N183-Q185 VanDerWaalsContact C-N 3.35Å
184	S	93.4	Very high	92.6	Very high	84 Å²	84	64.9 Å²	64.9	59%	0.587	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-88.9	2.7	178.1	72.1	0	0	0	0	114.2	K181 L182	K181-S184 PolarHBondContact O-N 3.28Å; K181-S184 PolarHBondContact O-OG 2.78Å; L182-S184 PolarHBondContact O-N 3.44Å
185	Q	94	Very high	92.5	Very high	13 Å²	13	64.3 Å²	64.3	6%	0.061	37%	0.369	C	S	.	.	S	Bend	trans	-114.5	144.4	-172.5	-69.8	172.1	68.3	0	0	112.6	L155 E158 Q175 K181 L182 N183 L187	L155-Q185 PolarHBondContact O-NE2 2.76Å; E158-Q185 HydrophobicContact CG-CB 3.72Å; E158-Q185 HydrophobicContact CG-CG 3.83Å; E158-Q185 WeakPolarHBondContact OE1-CA 3.32Å; Q175-Q185 PolarHBondContact NE2-O 2.97Å; K181-Q185 PolarHBondContact O-NE2 3.43Å; L182-Q185 PolarHBondContact O-N 3.28Å; N183-Q185 VanDerWaalsContact C-N 3.35Å; Q185-L187 HydrophobicContact CB-CD2 4.18Å; Q185-L187 HydrophobicContact CB-CG 4.13Å; Q185-L187 PolarHBondContact O-N 3.05Å
186	N	92.2	Very high	92.4	Very high	110 Å²	110	68.6 Å²	68.6	59%	0.588	39%	0.388	S	S	*	.			trans	-89.9	79.8	175.3	-65.4	-79	0	0	0	110.1	E158 Y188	E158-N186 PolarHBondContact OE1-N 3.31Å; N186-Y188 HydrophobicContact CB-CE2 3.99Å; N186-Y188 VanDerWaalsContact O-CD2 3.22Å; N186-Y188 WeakPolarHBondContact O-CD2 3.33Å; N186-Y188 VanDerWaalsContact O-CE2 3.24Å; N186-Y188 WeakPolarHBondContact O-CE2 3.41Å
187	L	94.4	Very high	92.4	Very high	7 Å²	7	65.4 Å²	65.4	4%	0.037	38%	0.375	C	S	.	.			trans	-84	143.7	177	-57.3	-178.2	0	0	0	111.9	L157 E158 L182 Q185 L199	L157-L187 HydrophobicContact CB-CD2 3.98Å; E158-L187 HydrophobicContact CG-CD2 4.32Å; L182-L187 HydrophobicContact CD2-CD1 3.78Å; Q185-L187 HydrophobicContact CB-CD2 4.18Å; Q185-L187 HydrophobicContact CB-CG 4.13Å; Q185-L187 PolarHBondContact O-N 3.05Å; L187-L199 HydrophobicContact CB-CB 3.9Å; L187-L199 HydrophobicContact CB-CD2 3.84Å; L187-L199 HydrophobicContact CD1-CD2 3.86Å; L187-L199 PolarHBondContact O-N 3.15Å
188	Y	94.1	Very high	92.5	Very high	91 Å²	91	61.1 Å²	61.1	36%	0.357	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	153.3	179.1	-59.6	-96.5	0	0	0	110.1	N186 Q196 L197 P198	N186-Y188 HydrophobicContact CB-CE2 3.99Å; N186-Y188 VanDerWaalsContact O-CD2 3.22Å; N186-Y188 WeakPolarHBondContact O-CD2 3.33Å; N186-Y188 VanDerWaalsContact O-CE2 3.24Å; N186-Y188 WeakPolarHBondContact O-CE2 3.41Å; Y188-Q196 HydrophobicContact CD1-CG 3.83Å; Y188-Q196 VanDerWaalsContact CD1-NE2 3.27Å; Y188-Q196 HydrophobicContact CG-CG 4.01Å; Y188-L197 CarbonylContact C-O 3.6Å; Y188-L197 VanDerWaalsContact CA-O 3.23Å; Y188-L197 WeakPolarHBondContact CA-O 3.08Å; Y188-L197 WeakPolarHBondContact CB-O 3.46Å; Y188-P198 HydrophobicContact CD1-CB 4.28Å; Y188-P198 HydrophobicContact CD1-CG 4.18Å; Y188-P198 HydrophobicContact CE1-CB 4.31Å; Y188-P198 HydrophobicContact CE1-CG 4Å
189	C	95.3	Very high	92.6	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	159.2	165.9	72	0	0	0	0	110.6	F162 C164 I168 Q196 L197	F162-C189 CarbonylContact O-C 3.44Å; F162-C189 WeakPolarHBondContact O-CA 3.23Å; C164-C189 VanDerWaalsContact CA-SG 3.53Å; C164-C189 HydrophobicContact CB-CB 3.91Å; C164-C189 WeakPolarHBondContact CB-SG 3.43Å; C164-C189 WeakPolarHBondContact SG-CB 3.05Å; C164-C189 CovalentContact SG-SG 2.04Å; C164-C189 PolarHBondContact SG-SG 3.43Å; I168-C189 HydrophobicContact CD1-CB 3.66Å; C189-Q196 WeakPolarHBondContact O-CA 3.39Å; C189-L197 PolarHBondContact N-O 3.16Å; C189-L197 PolarHBondContact O-N 3.15Å
190	I	94.4	Very high	92.5	Very high	48 Å²	48	60.7 Å²	60.7	25%	0.246	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.5	176.9	-55.6	-175.9	0	0	0	108.8	F161 F162 C164 S195	F161-I190 HydrophobicContact CB-CD1 3.88Å; F161-I190 HydrophobicContact CD1-CD1 3.83Å; F161-I190 HydrophobicContact CG-CD1 4.2Å; F162-I190 PolarHBondContact O-N 2.83Å; C164-I190 PolarHBondContact N-O 2.89Å; C164-I190 PolarHBondContact SG-N 2.9Å; I190-S195 WeakPolarHBondContact CA-O 3.24Å
191	N	91.9	Very high	92.4	Very high	57 Å²	57	68.1 Å²	68.1	31%	0.305	37%	0.373	S	S	.	.			trans	-75.4	165.3	173.3	-72.6	-47.2	0	0	0	111.4	C164 D193 G194 S195	C164-N191 WeakPolarHBondContact CB-OD1 3.36Å; C164-N191 PolarHBondContact SG-OD1 3.4Å; N191-D193 WeakPolarHBondContact CB-OD1 3.2Å; N191-D193 PolarHBondContact O-N 3.21Å; N191-G194 PolarHBondContact O-N 3.33Å; N191-S195 WeakPolarHBondContact CB-OG 3.3Å; N191-S195 PolarHBondContact N-O 3.23Å; N191-S195 PolarHBondContact ND2-OG 3.45Å
192	A	87.7	Confident	92.3	Very high	122 Å²	122	63.8 Å²	63.8	100%	1.008	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.4	178.2	0	0	0	0	0	114.6	G194	A192-G194 VanDerWaalsContact C-N 3.34Å
193	D	89.5	Confident	92.2	Very high	126 Å²	126	71 Å²	71	67%	0.674	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-0.5	174.1	69	-9.5	0	0	0	113.8	N191 S195	N191-D193 WeakPolarHBondContact CB-OD1 3.2Å; N191-D193 PolarHBondContact O-N 3.21Å; D193-S195 VanDerWaalsContact C-N 3.33Å; D193-S195 VanDerWaalsContact OD1-CB 3.23Å; D193-S195 WeakPolarHBondContact OD1-CB 3.23Å; D193-S195 PolarHBondContact OD1-N 3.33Å; D193-S195 PolarHBondContact OD1-OG 3.08Å; D193-S195 PolarHBondContact OD2-OG 3.46Å
194	G	88.2	Confident	92	Very high	55 Å²	55	68.4 Å²	68.4	57%	0.567	38%	0.378	S	S	*	.	S	Bend	trans	82.7	1.3	-175.7	0	0	0	0	0	114.7	N191 A192	N191-G194 PolarHBondContact O-N 3.33Å; A192-G194 VanDerWaalsContact C-N 3.34Å
195	S	91	Very high	91.8	Very high	47 Å²	47	69 Å²	69	33%	0.329	38%	0.383	S	S	.	.			trans	-71.5	134.1	175.6	66.3	0	0	0	0	111.3	I190 N191 D193	I190-S195 WeakPolarHBondContact CA-O 3.24Å; N191-S195 WeakPolarHBondContact CB-OG 3.3Å; N191-S195 PolarHBondContact N-O 3.23Å; N191-S195 PolarHBondContact ND2-OG 3.45Å; D193-S195 VanDerWaalsContact C-N 3.33Å; D193-S195 VanDerWaalsContact OD1-CB 3.23Å; D193-S195 WeakPolarHBondContact OD1-CB 3.23Å; D193-S195 PolarHBondContact OD1-N 3.33Å; D193-S195 PolarHBondContact OD1-OG 3.08Å; D193-S195 PolarHBondContact OD2-OG 3.46Å
196	Q	92.1	Very high	91.5	Very high	113 Å²	113	75.2 Å²	75.2	53%	0.528	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.1	177.9	-175.8	177.9	-25	0	0	110.2	Y188 C189	Y188-Q196 HydrophobicContact CD1-CG 3.83Å; Y188-Q196 VanDerWaalsContact CD1-NE2 3.27Å; Y188-Q196 HydrophobicContact CG-CG 4.01Å; C189-Q196 WeakPolarHBondContact O-CA 3.39Å
197	L	92.8	Very high	91.5	Very high	46 Å²	46	70 Å²	70	24%	0.241	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	134	-177.9	-173	70	0	0	0	109.8	Y188 C189 L199 R201	Y188-L197 CarbonylContact C-O 3.6Å; Y188-L197 VanDerWaalsContact CA-O 3.23Å; Y188-L197 WeakPolarHBondContact CA-O 3.08Å; Y188-L197 WeakPolarHBondContact CB-O 3.46Å; C189-L197 PolarHBondContact N-O 3.16Å; C189-L197 PolarHBondContact O-N 3.15Å; L197-L199 PolarHBondContact O-N 2.85Å; L197-R201 HydrophobicContact CD1-CB 3.96Å; L197-R201 HydrophobicContact CD2-CB 4.49Å; L197-R201 HydrophobicContact CG-CB 4.13Å
198	P	93.6	Very high	91.3	Very high	32 Å²	32	73.7 Å²	73.7	21%	0.208	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	135.8	169.7	-20.5	32.2	0	0	0	110.6	Y188 F200 R201	Y188-P198 HydrophobicContact CD1-CB 4.28Å; Y188-P198 HydrophobicContact CD1-CG 4.18Å; Y188-P198 HydrophobicContact CE1-CB 4.31Å; Y188-P198 HydrophobicContact CE1-CG 4Å; P198-F200 VanDerWaalsContact C-N 3.32Å; P198-F200 HydrophobicContact CB-CD1 3.73Å; P198-F200 HydrophobicContact CB-CE1 3.38Å; P198-F200 HydrophobicContact CB-CZ 4.1Å; P198-F200 HydrophobicContact CG-CE1 4.27Å; P198-F200 PolarHBondContact O-N 2.96Å; P198-R201 WeakPolarHBondContact O-CB 3.42Å; P198-R201 PolarHBondContact O-N 2.04Å
199	L	93.1	Very high	91.2	Very high	2 Å²	2	73 Å²	73	1%	0.01	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	-58.2	-40.3	-169.2	-176.5	65.2	0	0	0	113.1	I168 M171 Q172 L187 L197 R201 M202	I168-L199 HydrophobicContact CD1-CD1 3.83Å; I168-L199 HydrophobicContact CG1-CD1 4.47Å; M171-L199 HydrophobicContact CB-CD2 3.72Å; Q172-L199 HydrophobicContact CB-CD1 4.44Å; Q172-L199 HydrophobicContact CB-CD2 4.48Å; Q172-L199 HydrophobicContact CB-CG 4.09Å; L187-L199 HydrophobicContact CB-CB 3.9Å; L187-L199 HydrophobicContact CB-CD2 3.84Å; L187-L199 HydrophobicContact CD1-CD2 3.86Å; L187-L199 PolarHBondContact O-N 3.15Å; L197-L199 PolarHBondContact O-N 2.85Å; L199-R201 PolarHBondContact O-N 2.84Å; L199-M202 HydrophobicContact CD1-CE 4.26Å; L199-M202 HydrophobicContact CD1-SD 4.16Å; L199-M202 WeakPolarHBondContact O-CB 3.03Å; L199-M202 PolarHBondContact O-N 2.98Å
200	F	90.9	Very high	91.1	Very high	116 Å²	116	73.2 Å²	73.2	51%	0.509	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-61.3	-11.3	175.2	74.9	-92.2	0	0	0	115.1	P198	P198-F200 VanDerWaalsContact C-N 3.32Å; P198-F200 HydrophobicContact CB-CD1 3.73Å; P198-F200 HydrophobicContact CB-CE1 3.38Å; P198-F200 HydrophobicContact CB-CZ 4.1Å; P198-F200 HydrophobicContact CG-CE1 4.27Å; P198-F200 PolarHBondContact O-N 2.96Å
201	R	92.2	Very high	91	Very high	163 Å²	163	77.4 Å²	77.4	62%	0.615	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-101	-1.3	173.5	-62.1	-169.6	175.4	-172.2	-2.9	113.2	L197 P198 L199 N203	L197-R201 HydrophobicContact CD1-CB 3.96Å; L197-R201 HydrophobicContact CD2-CB 4.49Å; L197-R201 HydrophobicContact CG-CB 4.13Å; P198-R201 WeakPolarHBondContact O-CB 3.42Å; P198-R201 PolarHBondContact O-N 2.04Å; L199-R201 PolarHBondContact O-N 2.84Å; R201-N203 PolarHBondContact O-N 3.28Å
202	M	91.9	Very high	91.1	Very high	7 Å²	7	76.6 Å²	76.6	3%	0.034	42%	0.421	C	S	.	.			trans	-62.4	129	176.1	-171.1	177.9	74	0	0	109.2	C164 I168 R169 Q172 L199 I204	C164-M202 HydrophobicContact CB-SD 4.36Å; I168-M202 HydrophobicContact CD1-SD 3.86Å; I168-M202 HydrophobicContact CG1-CE 4.05Å; I168-M202 HydrophobicContact CG1-SD 3.89Å; R169-M202 HydrophobicContact CB-CE 4.24Å; Q172-M202 PolarHBondContact NE2-O 3.43Å; Q172-M202 PolarHBondContact OE1-O 3.26Å; L199-M202 HydrophobicContact CD1-CE 4.26Å; L199-M202 HydrophobicContact CD1-SD 4.16Å; L199-M202 WeakPolarHBondContact O-CB 3.03Å; L199-M202 PolarHBondContact O-N 2.98Å; M202-I204 HydrophobicContact CE-CD1 4.04Å; M202-I204 HydrophobicContact CG-CD1 3.89Å; M202-I204 HydrophobicContact CG-CG1 3.95Å; M202-I204 HydrophobicContact SD-CD1 3.64Å; M202-I204 HydrophobicContact SD-CG1 4.36Å
203	N	91.1	Very high	91.3	Very high	151 Å²	151	73.5 Å²	73.5	81%	0.807	39%	0.392	S	S	*	.			trans	-135.3	109.7	177	-177.3	3.3	0	0	0	107.7	R201	R201-N203 PolarHBondContact O-N 3.28Å
204	I	89.5	Confident	91.4	Very high	46 Å²	46	69.3 Å²	69.3	24%	0.236	37%	0.371	C	S	.	.			trans	-122.3	116.8	-178.5	-62.1	177.4	0	0	0	106.1	S165 M202 C207	S165-I204 VanDerWaalsContact CA-CD1 3.47Å; S165-I204 VanDerWaalsContact O-CD1 3.32Å; S165-I204 WeakPolarHBondContact O-CD1 3.04Å; M202-I204 HydrophobicContact CE-CD1 4.04Å; M202-I204 HydrophobicContact CG-CD1 3.89Å; M202-I204 HydrophobicContact CG-CG1 3.95Å; M202-I204 HydrophobicContact SD-CD1 3.64Å; M202-I204 HydrophobicContact SD-CG1 4.36Å; I204-C207 HydrophobicContact CB-CB 3.99Å; I204-C207 HydrophobicContact CG2-CB 3.74Å; I204-C207 WeakPolarHBondContact O-CB 3.49Å
205	S	89.1	Confident	91.6	Very high	98 Å²	98	69.7 Å²	69.7	69%	0.685	37%	0.365	S	S	*	.	S	Bend	trans	-61.7	143.7	173.9	55.2	0	0	0	0	110.6
206	Q	87.4	Confident	91.6	Very high	143 Å²	143	71 Å²	71	67%	0.668	37%	0.366	S	S	*	.	S	Bend	trans	62.5	47.6	177.2	-57.9	176.7	23.5	0	0	112	S236	Q206-S236 CarbonylContact C-O 3.53Å; Q206-S236 VanDerWaalsContact C-O 3.26Å; Q206-S236 WeakPolarHBondContact CB-OG 3.2Å; Q206-S236 CarbonylContact O-C 3.59Å; Q206-S236 VanDerWaalsContact O-O 3.1Å
207	C	91.5	Very high	91.4	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.372	C	S	.	.			trans	-146.7	71.8	-175.8	-173	0	0	0	0	111	C166 R169 I204 S236	C166-C207 WeakPolarHBondContact CA-SG 3.4Å; C166-C207 HydrophobicContact CB-CB 3.94Å; C166-C207 WeakPolarHBondContact CB-SG 3.47Å; C166-C207 VanDerWaalsContact SG-CA 3.51Å; C166-C207 WeakPolarHBondContact SG-CB 3.08Å; C166-C207 CovalentContact SG-SG 2.04Å; C166-C207 PolarHBondContact SG-SG 2.8Å; R169-C207 VanDerWaalsContact CB-SG 3.5Å; R169-C207 PolarHBondContact NE-O 2.88Å; I204-C207 HydrophobicContact CB-CB 3.99Å; I204-C207 HydrophobicContact CG2-CB 3.74Å; I204-C207 WeakPolarHBondContact O-CB 3.49Å; C207-S236 CarbonylContact C-O 3.55Å; C207-S236 VanDerWaalsContact CA-O 3.28Å; C207-S236 WeakPolarHBondContact CA-O 3.43Å; C207-S236 PolarHBondContact N-O 3.4Å
208	D	90.4	Very high	91.3	Very high	85 Å²	85	73.8 Å²	73.8	46%	0.455	39%	0.388	S	S	.	.			trans	-126.5	158.9	-169.8	-58.4	-68.5	0	0	0	110.5	S236 N288	D208-S236 PolarHBondContact N-O 2.96Å; D208-N288 PolarHBondContact O-ND2 3.28Å
209	L	91.9	Very high	91.2	Very high	76 Å²	76	72.8 Å²	72.8	40%	0.398	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-62.7	151.7	173.5	-75.9	169.8	0	0	0	110.6	L173 V290	L173-L209 HydrophobicContact CD1-CD1 4.03Å; L173-L209 HydrophobicContact CD1-CD2 4.09Å; L173-L209 HydrophobicContact CD1-CG 3.86Å; L209-V290 HydrophobicContact CD2-CB 4.42Å; L209-V290 HydrophobicContact CD2-CG1 3.95Å; L209-V290 HydrophobicContact CG-CG1 4.12Å
210	P	93.3	Very high	91.3	Very high	4 Å²	4	76.4 Å²	76.4	3%	0.026	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-69.8	134.3	178.3	28.2	-32	0	0	0	111.3	P239 A286 S293	P210-P239 HydrophobicContact CB-CB 3.77Å; P210-P239 HydrophobicContact CB-CG 3.93Å; P210-A286 HydrophobicContact CB-CB 4.06Å; P210-A286 HydrophobicContact CG-CB 4.48Å; P210-A286 WeakPolarHBondContact CG-O 3.36Å; P210-S293 VanDerWaalsContact O-CB 3.23Å; P210-S293 WeakPolarHBondContact O-CB 3.43Å; P210-S293 PolarHBondContact O-OG 3.09Å
211	E	92.7	Very high	91.4	Very high	137 Å²	137	71.4 Å²	71.4	64%	0.64	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	136.7	167.9	-67.1	-178.4	158	0	0	108.9	G233 S234	E211-G233 CarbonylContact O-C 3.6Å; E211-G233 WeakPolarHBondContact O-CA 3.32Å; E211-S234 PolarHBondContact N-O 3.4Å; E211-S234 PolarHBondContact O-N 2.8Å
212	I	92.4	Very high	91.5	Very high	40 Å²	40	70.6 Å²	70.6	21%	0.205	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	138.5	-176.3	-173.9	166.3	0	0	0	110.4	C284 A286 N294 A295	I212-C284 HydrophobicContact CD1-CB 4.02Å; I212-C284 WeakPolarHBondContact CD1-O 3.26Å; I212-A286 HydrophobicContact CB-CB 4.2Å; I212-A286 HydrophobicContact CD1-CB 3.98Å; I212-A286 HydrophobicContact CG1-CB 4.32Å; I212-N294 WeakPolarHBondContact CG2-O 3.47Å; I212-A295 HydrophobicContact CD1-CB 3.85Å; I212-A295 HydrophobicContact CG1-CB 3.86Å; I212-A295 HydrophobicContact CG2-CB 4.11Å
213	S	92.5	Very high	91.6	Very high	57 Å²	57	73 Å²	73	40%	0.399	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	139.8	176.3	59.4	0	0	0	0	111.3	C231 N232	S213-C231 CarbonylContact O-C 3.54Å; S213-C231 WeakPolarHBondContact O-CA 3.16Å; S213-N232 PolarHBondContact N-O 2.86Å; S213-N232 PolarHBondContact O-N 3.44Å; S213-N232 PolarHBondContact OG-O 2.96Å
214	V	92.8	Very high	91.7	Very high	38 Å²	38	67.5 Å²	67.5	23%	0.23	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	145.1	-178.9	-73.8	0	0	0	0	110.2	H216 T230 C231 W243 C284 A295 V297	V214-H216 VanDerWaalsContact CG2-O 3.29Å; V214-H216 WeakPolarHBondContact CG2-O 3.47Å; V214-H216 PolarHBondContact O-N 2.7Å; V214-T230 CarbonylContact C-O 3.59Å; V214-T230 WeakPolarHBondContact CA-O 3.25Å; V214-C231 HydrophobicContact CG1-CB 4.17Å; V214-W243 HydrophobicContact CG1-CH2 3.8Å; V214-W243 HydrophobicContact CG1-CZ2 4.38Å; V214-C284 HydrophobicContact CG1-CB 4.25Å; V214-A295 HydrophobicContact CG1-CB 3.77Å; V214-A295 HydrophobicContact CG2-CB 4.21Å; V214-V297 HydrophobicContact CB-CG2 3.95Å; V214-V297 HydrophobicContact CG1-CG2 4.15Å; V214-V297 HydrophobicContact CG2-CG2 3.82Å
215	S	91.6	Very high	91.8	Very high	62 Å²	62	69.3 Å²	69.3	43%	0.434	38%	0.38	S	S	.	.	S	Bend	trans	-71.1	-15.5	-175.8	62.7	0	0	0	0	114.4	T230	S215-T230 PolarHBondContact N-O 3.27Å; S215-T230 PolarHBondContact OG-N 2.99Å
216	H	90.4	Very high	92	Very high	75 Å²	75	69.6 Å²	69.6	35%	0.347	37%	0.373	S	S	.	.			trans	-139.3	147.9	177.4	-59.9	78.9	0	0	0	109.7	V214 I229 V297	V214-H216 VanDerWaalsContact CG2-O 3.29Å; V214-H216 WeakPolarHBondContact CG2-O 3.47Å; V214-H216 PolarHBondContact O-N 2.7Å; H216-I229 HydrophobicContact CB-CD1 3.96Å; H216-V297 HydrophobicContact CB-CG1 4.15Å; H216-V297 WeakPolarHBondContact O-CG1 3.2Å; H216-V297 WeakPolarHBondContact O-CG2 3.5Å
217	V	88.1	Confident	92.2	Very high	111 Å²	111	63.4 Å²	63.4	67%	0.673	35%	0.346	S	S	*	.	S	Bend	trans	-93.9	-38.5	166.8	180	0	0	0	0	110.5	V297 A298	V217-V297 WeakPolarHBondContact O-CA 3.09Å; V217-V297 WeakPolarHBondContact O-CG1 3.4Å; V217-A298 PolarHBondContact O-N 3.43Å
218	N	90.2	Very high	92.2	Very high	106 Å²	106	67 Å²	67	57%	0.567	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	132.8	170.4	-59.7	-26.6	0	0	0	107.9	A298	N218-A298 CarbonylContact C-O 3.6Å; N218-A298 WeakPolarHBondContact CA-O 3.08Å
219	L	92.9	Very high	92.3	Very high	12 Å²	12	62.9 Å²	62.9	6%	0.063	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	119.9	176.5	178.8	59.8	0	0	0	108.7	V221 A227 I229 L270 L282 V297 A298 L299 T300	L219-V221 HydrophobicContact CD1-CG2 4.25Å; L219-V221 HydrophobicContact CD2-CG2 4.38Å; L219-V221 HydrophobicContact CG-CG2 3.88Å; L219-A227 HydrophobicContact CD1-CB 4.31Å; L219-A227 HydrophobicContact CD2-CB 4.08Å; L219-I229 HydrophobicContact CD2-CB 4.38Å; L219-L270 HydrophobicContact CD2-CD1 4.02Å; L219-L282 HydrophobicContact CD2-CD1 4.39Å; L219-V297 HydrophobicContact CB-CG1 4.22Å; L219-A298 PolarHBondContact N-O 3.29Å; L219-L299 HydrophobicContact CB-CD1 4.34Å; L219-L299 HydrophobicContact CD2-CD1 4.1Å; L219-L299 HydrophobicContact CG-CD1 4.08Å; L219-L299 WeakPolarHBondContact O-CA 3.47Å; L219-T300 PolarHBondContact O-N 3.5Å
220	T	94.2	Very high	92.3	Very high	78 Å²	78	60.8 Å²	60.8	48%	0.479	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	123.8	179.8	-52.7	0	0	0	0	110.5	T300 Y302	T220-T300 WeakPolarHBondContact CA-O 3.36Å; T220-T300 HydrophobicContact CG2-CG2 4.4Å; T220-Y302 HydrophobicContact CG2-CD2 3.59Å; T220-Y302 HydrophobicContact CG2-CE2 3.37Å
221	V	94.3	Very high	92.3	Very high	11 Å²	11	60.6 Å²	60.6	7%	0.067	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	158.3	-172.7	-164.3	0	0	0	0	108.7	L219 D225 A227 V273 L299 T300 V301 Y302	L219-V221 HydrophobicContact CD1-CG2 4.25Å; L219-V221 HydrophobicContact CD2-CG2 4.38Å; L219-V221 HydrophobicContact CG-CG2 3.88Å; V221-D225 HydrophobicContact CG1-CB 3.78Å; V221-A227 HydrophobicContact CG1-CB 4.19Å; V221-A227 HydrophobicContact CG2-CB 3.62Å; V221-V273 HydrophobicContact CB-CG1 4.43Å; V221-V273 HydrophobicContact CG1-CB 4.1Å; V221-V273 HydrophobicContact CG1-CG1 4.41Å; V221-V273 HydrophobicContact CG1-CG2 4.01Å; V221-L299 HydrophobicContact CG2-CD1 3.85Å; V221-T300 PolarHBondContact N-O 2.99Å; V221-V301 CarbonylContact O-C 3.57Å; V221-V301 WeakPolarHBondContact O-CA 3.49Å; V221-Y302 PolarHBondContact O-N 3Å
222	R	94.4	Very high	92.3	Very high	146 Å²	146	56.6 Å²	56.6	55%	0.551	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.2	151.8	168	-59.8	176.6	172.5	-171.5	-2.9	109.9	G224 D225 Y302	R222-G224 PolarHBondContact O-N 2.79Å; R222-D225 WeakPolarHBondContact CB-OD2 3.49Å; R222-D225 WeakPolarHBondContact O-CB 3.49Å; R222-D225 PolarHBondContact O-N 3.29Å; R222-Y302 CarbonylContact C-O 3.54Å; R222-Y302 VanDerWaalsContact CA-O 3.29Å; R222-Y302 WeakPolarHBondContact CA-O 3.27Å
223	E	93.5	Very high	92.3	Very high	57 Å²	57	54.7 Å²	54.7	27%	0.266	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	128.9	173.7	178	178.2	-127.5	0	0	110.7	V273 S275 V301 Y302 Y303 R306	E223-V273 CarbonylContact C-O 3.55Å; E223-V273 VanDerWaalsContact CA-O 3.29Å; E223-V273 WeakPolarHBondContact CA-O 3.45Å; E223-S275 WeakPolarHBondContact OE1-CB 3.39Å; E223-S275 PolarHBondContact OE1-N 3.35Å; E223-S275 PolarHBondContact OE1-OG 2.8Å; E223-V301 HydrophobicContact CB-CG1 4.19Å; E223-Y302 PolarHBondContact N-O 2.88Å; E223-Y303 WeakPolarHBondContact OE2-CB 3.31Å; E223-R306 IonicContact OE1-CZ 2.69Å; E223-R306 IonicContact OE1-NH1 3.7Å; E223-R306 IonicContact OE1-NH2 2.94Å; E223-R306 PolarHBondContact OE1-NH2 3.4Å; E223-R306 IonicContact OE2-CZ 3.3Å; E223-R306 IonicContact OE2-NH2 2.71Å; E223-R306 PolarHBondContact OE2-NH2 3.24Å
224	G	91.9	Very high	92.2	Very high	36 Å²	36	53.4 Å²	53.4	37%	0.371	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.1	-15	-174.8	0	0	0	0	0	115.6	R222 V273	R222-G224 PolarHBondContact O-N 2.79Å; G224-V273 PolarHBondContact N-O 3.39Å
225	D	93.4	Very high	91.9	Very high	84 Å²	84	52.5 Å²	52.5	45%	0.449	30%	0.298	S	S	.	.			trans	-75.8	161.6	174	-75.3	-20.6	0	0	0	111.2	V221 R222 V273	V221-D225 HydrophobicContact CG1-CB 3.78Å; R222-D225 WeakPolarHBondContact CB-OD2 3.49Å; R222-D225 WeakPolarHBondContact O-CB 3.49Å; R222-D225 PolarHBondContact O-N 3.29Å; D225-V273 WeakPolarHBondContact O-CB 3.35Å; D225-V273 WeakPolarHBondContact O-CG2 3.44Å; D225-V273 PolarHBondContact O-N 2.76Å
226	N	93.1	Very high	91.8	Very high	104 Å²	104	51 Å²	51	56%	0.556	29%	0.288	S	S	*	.			trans	-102.9	148.1	171	-61.9	-15.1	0	0	0	109.9	L270 V271 N272	N226-L270 CarbonylContact C-O 3.55Å; N226-L270 VanDerWaalsContact CA-O 3.26Å; N226-L270 WeakPolarHBondContact CA-O 3.42Å; N226-L270 WeakPolarHBondContact CB-O 3.1Å; N226-V271 WeakPolarHBondContact OD1-CA 3.2Å; N226-N272 PolarHBondContact OD1-N 3.18Å
227	A	91.5	Very high	91.8	Very high	12 Å²	12	49.8 Å²	49.8	10%	0.099	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	151.2	175.8	0	0	0	0	0	111.4	L219 V221 T269 L270	L219-A227 HydrophobicContact CD1-CB 4.31Å; L219-A227 HydrophobicContact CD2-CB 4.08Å; V221-A227 HydrophobicContact CG1-CB 4.19Å; V221-A227 HydrophobicContact CG2-CB 3.62Å; A227-T269 CarbonylContact O-C 3.46Å; A227-T269 WeakPolarHBondContact O-CA 3.41Å; A227-L270 HydrophobicContact CB-CB 4.47Å; A227-L270 HydrophobicContact CB-CD1 4.48Å; A227-L270 PolarHBondContact N-O 3.24Å; A227-L270 PolarHBondContact O-N 3.31Å
228	V	91.9	Very high	91.9	Very high	75 Å²	75	48.4 Å²	48.4	46%	0.455	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	129.1	175.3	-177.1	0	0	0	0	108.8	N267 L268 T269	V228-N267 HydrophobicContact CG1-CB 4.2Å; V228-L268 WeakPolarHBondContact CA-O 3.48Å; V228-T269 HydrophobicContact CG2-CG2 3.97Å
229	I	92.1	Very high	92	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	145.9	171.7	-168.3	163.4	0	0	0	110.4	H216 L219 W243 N267 L268 L282 V297	H216-I229 HydrophobicContact CB-CD1 3.96Å; L219-I229 HydrophobicContact CD2-CB 4.38Å; I229-W243 HydrophobicContact CB-CZ2 4.36Å; I229-W243 HydrophobicContact CD1-CH2 3.81Å; I229-W243 HydrophobicContact CD1-CZ2 4.39Å; I229-W243 HydrophobicContact CG1-CH2 3.87Å; I229-W243 HydrophobicContact CG1-CZ2 3.95Å; I229-W243 HydrophobicContact CG2-CH2 3.92Å; I229-W243 HydrophobicContact CG2-CZ2 3.7Å; I229-N267 CarbonylContact O-C 3.58Å; I229-N267 VanDerWaalsContact O-CA 3.3Å; I229-N267 WeakPolarHBondContact O-CA 3.5Å; I229-L268 HydrophobicContact CG2-CB 3.81Å; I229-L268 HydrophobicContact CG2-CD2 4.16Å; I229-L268 HydrophobicContact CG2-CG 4.31Å; I229-L268 PolarHBondContact N-O 2.78Å; I229-L268 PolarHBondContact O-N 2.78Å; I229-L282 HydrophobicContact CG2-CD1 4.42Å; I229-V297 HydrophobicContact CD1-CB 3.87Å; I229-V297 HydrophobicContact CD1-CG1 3.55Å; I229-V297 HydrophobicContact CD1-CG2 3.68Å
230	T	92.4	Very high	91.9	Very high	32 Å²	32	47.8 Å²	47.8	20%	0.196	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.2	-176.5	-57	0	0	0	0	108.5	V214 S215 N232 N267	V214-T230 CarbonylContact C-O 3.59Å; V214-T230 WeakPolarHBondContact CA-O 3.25Å; S215-T230 PolarHBondContact N-O 3.27Å; S215-T230 PolarHBondContact OG-N 2.99Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.47Å; T230-N267 WeakPolarHBondContact CB-OD1 3.05Å; T230-N267 VanDerWaalsContact CG2-OD1 3.25Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.4Å; T230-N267 PolarHBondContact OG1-OD1 3.24Å
231	C	92.7	Very high	91.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	133.9	166.5	-179.8	0	0	0	0	109	S213 V214 V241 W243 A265 I266 C284	S213-C231 CarbonylContact O-C 3.54Å; S213-C231 WeakPolarHBondContact O-CA 3.16Å; V214-C231 HydrophobicContact CG1-CB 4.17Å; C231-V241 HydrophobicContact CB-CG1 4.33Å; C231-W243 HydrophobicContact CB-CH2 4.26Å; C231-W243 HydrophobicContact CB-CZ2 3.48Å; C231-W243 VanDerWaalsContact CB-CZ2 3.48Å; C231-A265 CarbonylContact O-C 3.59Å; C231-A265 VanDerWaalsContact O-CA 3.29Å; C231-A265 WeakPolarHBondContact O-CA 3.3Å; C231-I266 HydrophobicContact CB-CG2 4.26Å; C231-I266 PolarHBondContact N-O 3.26Å; C231-I266 PolarHBondContact O-N 3.19Å; C231-C284 HydrophobicContact CB-CB 3.61Å; C231-C284 WeakPolarHBondContact CB-SG 3.38Å; C231-C284 WeakPolarHBondContact SG-CB 3.27Å; C231-C284 CovalentContact SG-SG 2.02Å; C231-C284 PolarHBondContact SG-SG 3.06Å
232	N	92.2	Very high	91.6	Very high	53 Å²	53	47 Å²	47	28%	0.283	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	117.9	176.2	-57.2	-40	0	0	0	108.4	S213 T230 V263 A265	S213-N232 PolarHBondContact N-O 2.86Å; S213-N232 PolarHBondContact O-N 3.44Å; S213-N232 PolarHBondContact OG-O 2.96Å; T230-N232 WeakPolarHBondContact CG2-OD1 3.47Å; N232-V263 HydrophobicContact CB-CG1 3.89Å; N232-A265 WeakPolarHBondContact OD1-CB 3.36Å
233	G	92.3	Very high	91.4	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	125.3	166.1	0	0	0	0	0	110.6	E211 V263 H264	E211-G233 CarbonylContact O-C 3.6Å; E211-G233 WeakPolarHBondContact O-CA 3.32Å; G233-V263 CarbonylContact O-C 3.41Å; G233-V263 WeakPolarHBondContact O-CA 3.47Å; G233-H264 PolarHBondContact N-O 3.22Å; G233-H264 PolarHBondContact O-N 3.35Å
234	S	90.8	Very high	91.1	Very high	30 Å²	30	41 Å²	41	21%	0.21	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	156.1	169.5	39.2	0	0	0	0	110.5	E211 N262	E211-S234 PolarHBondContact N-O 3.4Å; E211-S234 PolarHBondContact O-N 2.8Å; S234-N262 WeakPolarHBondContact CA-O 3.38Å
235	G	86.3	Confident	90.7	Very high	18 Å²	18	40.7 Å²	40.7	19%	0.186	23%	0.234	C	C	.	.			trans	162.7	176	176	0	0	0	0	0	112.7	P237	G235-P237 CarbonylContact C-O 3.57Å; G235-P237 CarbonylContact O-C 3.59Å
236	S	88.4	Confident	90.1	Very high	32 Å²	32	42.4 Å²	42.4	22%	0.224	25%	0.248	C	C	.	.	S	Bend	trans	-138.4	113.8	170.8	-134.2	0	0	0	0	109.2	Q206 C207 D208	Q206-S236 CarbonylContact C-O 3.53Å; Q206-S236 VanDerWaalsContact C-O 3.26Å; Q206-S236 WeakPolarHBondContact CB-OG 3.2Å; Q206-S236 CarbonylContact O-C 3.59Å; Q206-S236 VanDerWaalsContact O-O 3.1Å; C207-S236 CarbonylContact C-O 3.55Å; C207-S236 VanDerWaalsContact CA-O 3.28Å; C207-S236 WeakPolarHBondContact CA-O 3.43Å; C207-S236 PolarHBondContact N-O 3.4Å; D208-S236 PolarHBondContact N-O 2.96Å
237	P	91.6	Very high	89.5	Confident	48 Å²	48	40 Å²	40	31%	0.312	25%	0.248	S	C	.	.	S	Bend	cis	-60.6	155	-2.4	-25.3	37.8	0	0	0	114.2	G235 N288 V289	G235-P237 CarbonylContact C-O 3.57Å; G235-P237 CarbonylContact O-C 3.59Å; P237-N288 PolarHBondContact O-ND2 2.71Å; P237-V289 HydrophobicContact CG-CG2 3.91Å
238	L	90	Very high	89.2	Confident	83 Å²	83	40.3 Å²	40.3	44%	0.435	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-55.2	124.4	176.6	177.9	73.9	0	0	0	109.6	L258 H264	L238-L258 HydrophobicContact CD2-CD2 4.38Å; L238-H264 HydrophobicContact CD1-CB 4.42Å
239	P	92	Very high	88.7	Confident	2 Å²	2	42.5 Å²	42.5	1%	0.013	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-75.5	151.3	179.1	27.3	-32.7	0	0	0	113.6	P210 V241 H264 A286 E287 N288	P210-P239 HydrophobicContact CB-CB 3.77Å; P210-P239 HydrophobicContact CB-CG 3.93Å; P239-V241 HydrophobicContact CB-CG2 4.4Å; P239-V241 HydrophobicContact CG-CG2 4.3Å; P239-H264 WeakPolarHBondContact O-CB 3.26Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.38Å; P239-E287 CarbonylContact C-O 3.6Å; P239-E287 WeakPolarHBondContact CA-O 2.93Å; P239-E287 VanDerWaalsContact CB-O 3.32Å; P239-E287 WeakPolarHBondContact CB-O 3.29Å; P239-N288 HydrophobicContact CB-CB 4.39Å
240	D	90.2	Very high	88	Confident	102 Å²	102	42.6 Å²	42.6	55%	0.545	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	145.4	157.2	-160.6	12	0	0	0	109.4	H264 A286 E287	D240-H264 IonicContact OD1-CE1 2.7Å; D240-H264 PolarHBondContact OD1-CE1 3.37Å; D240-H264 VanDerWaalsContact OD1-CE1 3.23Å; D240-H264 IonicContact OD1-ND1 2.7Å; D240-H264 PolarHBondContact OD1-ND1 3.11Å; D240-A286 CarbonylContact O-C 3.58Å; D240-A286 VanDerWaalsContact O-CA 3.28Å; D240-A286 WeakPolarHBondContact O-CA 3.4Å; D240-E287 HydrophobicContact CB-CG 4.36Å; D240-E287 PolarHBondContact N-O 3.03Å; D240-E287 PolarHBondContact O-N 2.71Å
241	V	91.3	Very high	87	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	124.3	-167.6	-177.6	0	0	0	0	109.9	C231 P239 H264 I266 I285 A286	C231-V241 HydrophobicContact CB-CG1 4.33Å; P239-V241 HydrophobicContact CB-CG2 4.4Å; P239-V241 HydrophobicContact CG-CG2 4.3Å; V241-H264 HydrophobicContact CB-CB 4.33Å; V241-H264 HydrophobicContact CG2-CB 3.8Å; V241-H264 PolarHBondContact N-ND1 2.79Å; V241-I266 HydrophobicContact CG1-CG2 3.85Å; V241-I266 WeakPolarHBondContact O-CD1 3.42Å; V241-I285 WeakPolarHBondContact CA-O 3.33Å; V241-A286 HydrophobicContact CG2-CB 4.03Å
242	D	90.7	Very high	86.3	Confident	71 Å²	71	48.7 Å²	48.7	38%	0.38	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	165.1	-179.9	-159.8	13.1	0	0	0	112.6	H254 C284 I285	D242-H254 IonicContact OD1-CE1 3.78Å; D242-H254 PolarHBondContact OD1-CE1 3.43Å; D242-H254 VanDerWaalsContact OD1-CE1 3.23Å; D242-H254 IonicContact OD1-ND1 2.94Å; D242-H254 PolarHBondContact OD1-ND1 3.02Å; D242-C284 WeakPolarHBondContact O-CA 3.43Å; D242-C284 PolarHBondContact O-SG 3.07Å; D242-I285 PolarHBondContact N-O 2.66Å; D242-I285 VanDerWaalsContact N-O 3.09Å; D242-I285 WeakPolarHBondContact O-CG1 3.28Å; D242-I285 PolarHBondContact O-N 3.18Å
243	W	90.2	Very high	85.2	Confident	6 Å²	6	49.8 Å²	49.8	2%	0.023	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.7	175.7	-69.9	92.5	0	0	0	111.9	V214 I229 C231 V245 I266 L268 L282 C284 V297	V214-W243 HydrophobicContact CG1-CH2 3.8Å; V214-W243 HydrophobicContact CG1-CZ2 4.38Å; I229-W243 HydrophobicContact CB-CZ2 4.36Å; I229-W243 HydrophobicContact CD1-CH2 3.81Å; I229-W243 HydrophobicContact CD1-CZ2 4.39Å; I229-W243 HydrophobicContact CG1-CH2 3.87Å; I229-W243 HydrophobicContact CG1-CZ2 3.95Å; I229-W243 HydrophobicContact CG2-CH2 3.92Å; I229-W243 HydrophobicContact CG2-CZ2 3.7Å; C231-W243 HydrophobicContact CB-CH2 4.26Å; C231-W243 HydrophobicContact CB-CZ2 3.48Å; C231-W243 VanDerWaalsContact CB-CZ2 3.48Å; W243-V245 HydrophobicContact CB-CG1 3.95Å; W243-V245 PolarHBondContact O-N 3.5Å; W243-I266 PolarHBondContact NE1-O 2.97Å; W243-L268 HydrophobicContact CB-CD2 4.16Å; W243-L268 HydrophobicContact CD2-CB 4.15Å; W243-L268 HydrophobicContact CD2-CD2 3.98Å; W243-L268 HydrophobicContact CE3-CD2 4.26Å; W243-L268 HydrophobicContact CG-CB 3.92Å; W243-L268 HydrophobicContact CG-CD2 3.96Å; W243-L268 HydrophobicContact CG-CG 4.44Å; W243-L282 HydrophobicContact CE3-CB 4.07Å; W243-L282 HydrophobicContact CZ3-CB 3.81Å; W243-C284 HydrophobicContact CD2-CB 3.91Å; W243-C284 HydrophobicContact CE3-CB 3.74Å; W243-C284 HydrophobicContact CH2-CB 4.04Å; W243-C284 HydrophobicContact CZ2-CB 4.21Å; W243-C284 HydrophobicContact CZ3-CB 3.79Å; W243-V297 HydrophobicContact CH2-CG2 4.16Å; W243-V297 HydrophobicContact CZ3-CG2 4.32Å
244	I	87.7	Confident	84.5	Confident	72 Å²	72	53.1 Å²	53.1	37%	0.369	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	99.7	168.5	-55.8	177.7	0	0	0	108	T283 I285	I244-T283 HydrophobicContact CD1-CG2 4.34Å; I244-T283 PolarHBondContact N-O 2.98Å; I244-I285 HydrophobicContact CD1-CG2 3.75Å; I244-I285 HydrophobicContact CG1-CD1 4.45Å; I244-I285 HydrophobicContact CG1-CG2 4.26Å
245	V	84	Confident	83.6	Confident	29 Å²	29	56.9 Å²	56.9	18%	0.176	32%	0.322	C	S	.	.			trans	-108.1	14.2	-180	-62.5	0	0	0	0	113.4	W243 G247 L248 L268	W243-V245 HydrophobicContact CB-CG1 3.95Å; W243-V245 PolarHBondContact O-N 3.5Å; V245-G247 PolarHBondContact O-N 2.93Å; V245-G247 VanDerWaalsContact O-N 3.15Å; V245-L248 HydrophobicContact CB-CB 4.46Å; V245-L248 HydrophobicContact CB-CD2 4.25Å; V245-L248 HydrophobicContact CG1-CD2 4.33Å; V245-L248 VanDerWaalsContact O-CB 3.32Å; V245-L248 WeakPolarHBondContact O-CB 3.35Å; V245-L248 PolarHBondContact O-N 3.44Å; V245-L268 HydrophobicContact CG1-CD1 3.84Å; V245-L268 HydrophobicContact CG1-CD2 3.78Å; V245-L268 HydrophobicContact CG1-CG 4.49Å
246	T	81.5	Confident	82.9	Confident	119 Å²	119	59.8 Å²	59.8	73%	0.73	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	113.7	-179.6	49.9	0	0	0	0	111.4
247	G	79	Confident	81.8	Confident	54 Å²	54	61 Å²	61	56%	0.557	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	103.9	-8.7	180	0	0	0	0	0	114.9	V245 Q249	V245-G247 PolarHBondContact O-N 2.93Å; V245-G247 VanDerWaalsContact O-N 3.15Å; G247-Q249 PolarHBondContact O-NE2 3.47Å
248	L	85.6	Confident	80.4	Confident	18 Å²	18	63.6 Å²	63.6	9%	0.094	35%	0.351	C	S	.	.			trans	-70	128.2	173.4	-173.1	77.7	0	0	0	110.1	V245 N252 L270 D277 F280 L282 L299	V245-L248 HydrophobicContact CB-CB 4.46Å; V245-L248 HydrophobicContact CB-CD2 4.25Å; V245-L248 HydrophobicContact CG1-CD2 4.33Å; V245-L248 VanDerWaalsContact O-CB 3.32Å; V245-L248 WeakPolarHBondContact O-CB 3.35Å; V245-L248 PolarHBondContact O-N 3.44Å; L248-N252 HydrophobicContact CD2-CB 4.29Å; L248-L270 HydrophobicContact CD2-CD2 3.64Å; L248-D277 HydrophobicContact CD1-CB 4.14Å; L248-D277 VanDerWaalsContact CD1-OD1 3.3Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.44Å; L248-F280 HydrophobicContact CB-CE1 4.3Å; L248-F280 HydrophobicContact CB-CE2 4.23Å; L248-F280 HydrophobicContact CB-CZ 4.02Å; L248-F280 HydrophobicContact CD1-CB 4.47Å; L248-F280 HydrophobicContact CD1-CD1 3.9Å; L248-F280 HydrophobicContact CD1-CD2 4.34Å; L248-F280 HydrophobicContact CD1-CE1 4.23Å; L248-F280 HydrophobicContact CD1-CG 3.97Å; L248-L282 HydrophobicContact CD1-CD2 4.16Å; L248-L282 HydrophobicContact CD2-CD2 4.36Å; L248-L299 HydrophobicContact CD1-CD2 4.42Å
249	Q	81.6	Confident	79	Confident	121 Å²	121	64.6 Å²	64.6	57%	0.565	36%	0.357	S	S	*	.			trans	-85.2	-31.4	-179.7	-58.4	-56.8	-38.9	0	0	112.3	G247 I251 E276 D277	G247-Q249 PolarHBondContact O-NE2 3.47Å; Q249-I251 PolarHBondContact O-N 2.79Å; Q249-E276 HydrophobicContact CG-CB 4.3Å; Q249-D277 PolarHBondContact N-OD1 3.03Å
250	S	77.7	Confident	77.2	Confident	2 Å²	2	76.8 Å²	76.8	1%	0.014	40%	0.403	C	S	.	.	S	Bend	trans	-56.1	134.6	174.4	-73.2	0	0	0	0	112.5	N252 V273 T274 D277	S250-N252 PolarHBondContact O-N 3.25Å; S250-N252 PolarHBondContact O-ND2 2.99Å; S250-N252 VanDerWaalsContact O-ND2 3.1Å; S250-V273 WeakPolarHBondContact OG-CA 3.48Å; S250-T274 PolarHBondContact OG-N 2.88Å; S250-D277 WeakPolarHBondContact CB-OD2 3.31Å; S250-D277 PolarHBondContact N-OD1 3.24Å; S250-D277 PolarHBondContact N-OD2 2.56Å; S250-D277 PolarHBondContact OG-OD2 3.41Å
251	I	71.9	Confident	76	Confident	113 Å²	113	76.5 Å²	76.5	58%	0.579	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.9	131.5	169.4	-63.6	172.1	0	0	0	107.7	Q249 V271	Q249-I251 PolarHBondContact O-N 2.79Å; I251-V271 HydrophobicContact CB-CB 4.19Å; I251-V271 HydrophobicContact CG2-CB 4.29Å; I251-V271 PolarHBondContact O-N 3.41Å
252	N	76.6	Confident	75.2	Confident	48 Å²	48	81.8 Å²	81.8	26%	0.257	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.7	-178.2	59.5	79.9	0	0	0	112.9	L248 S250 L268 T269	L248-N252 HydrophobicContact CD2-CB 4.29Å; S250-N252 PolarHBondContact O-N 3.25Å; S250-N252 PolarHBondContact O-ND2 2.99Å; S250-N252 VanDerWaalsContact O-ND2 3.1Å; N252-L268 HydrophobicContact CB-CD1 3.79Å; N252-T269 WeakPolarHBondContact CA-O 3.44Å
253	T	70.3	Confident	74.8	Confident	75 Å²	75	80.2 Å²	80.2	46%	0.46	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	134.6	173.2	59.7	0	0	0	0	110.8	T269	T253-T269 PolarHBondContact N-O 2.89Å; T253-T269 VanDerWaalsContact N-O 3.07Å; T253-T269 PolarHBondContact O-N 3.08Å
254	H	76.7	Confident	74.6	Confident	71 Å²	71	80.6 Å²	80.6	33%	0.329	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.2	176.9	-64.1	-136.3	0	0	0	108.3	D242 I266 N267	D242-H254 IonicContact OD1-CE1 3.78Å; D242-H254 PolarHBondContact OD1-CE1 3.43Å; D242-H254 VanDerWaalsContact OD1-CE1 3.23Å; D242-H254 IonicContact OD1-ND1 2.94Å; D242-H254 PolarHBondContact OD1-ND1 3.02Å; H254-I266 HydrophobicContact CB-CD1 4.15Å; H254-I266 HydrophobicContact CB-CG1 4.45Å; H254-N267 CarbonylContact C-O 3.51Å; H254-N267 WeakPolarHBondContact CA-O 3.44Å
255	Q	71.5	Confident	74.7	Confident	108 Å²	108	77.4 Å²	77.4	51%	0.505	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	105.4	174.5	-177	-177.9	-2.2	0	0	110.1	N267	Q255-N267 HydrophobicContact CB-CB 4.32Å; Q255-N267 PolarHBondContact N-O 3.47Å; Q255-N267 PolarHBondContact O-N 3.41Å
256	T	73	Confident	75	Confident	80 Å²	80	76.3 Å²	76.3	49%	0.491	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	122.4	174.3	53.9	0	0	0	0	110.9	I266	T256-I266 HydrophobicContact CG2-CD1 3.67Å; T256-I266 HydrophobicContact CG2-CG1 3.88Å
257	N	64.6	Low	75.4	Confident	56 Å²	56	72 Å²	72	30%	0.299	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	92	171.6	-68	-46.3	0	0	0	109	N259 A265 N267	N257-N259 PolarHBondContact O-N 3.31Å; N257-N259 VanDerWaalsContact O-N 3.09Å; N257-A265 HydrophobicContact CB-CB 4.44Å; N257-A265 PolarHBondContact N-O 3.17Å; N257-A265 PolarHBondContact O-N 3.08Å; N257-N267 PolarHBondContact ND2-ND2 3.44Å
258	L	63.2	Low	76	Confident	104 Å²	104	69.5 Å²	69.5	55%	0.545	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	89.2	172.6	-80.1	140.8	0	0	0	110.2	L238	L238-L258 HydrophobicContact CD2-CD2 4.38Å
259	N	59.3	Low	76.3	Confident	104 Å²	104	70 Å²	70	56%	0.556	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	143.5	167.6	-75.4	-22.6	0	0	0	109.7	N257 T261	N257-N259 PolarHBondContact O-N 3.31Å; N257-N259 VanDerWaalsContact O-N 3.09Å; N259-T261 PolarHBondContact O-N 3.06Å
260	W	55.5	Low	76.7	Confident	258 Å²	258	64.2 Å²	64.2	98%	0.977	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	26.6	-174.6	-69.1	23.4	0	0	0	114.1
261	T	65.1	Low	77.3	Confident	95 Å²	95	66.1 Å²	66.1	58%	0.583	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	46.5	-164.3	57.8	0	0	0	0	112.2	N259 V263	N259-T261 PolarHBondContact O-N 3.06Å; T261-V263 WeakPolarHBondContact O-CG2 3.08Å; T261-V263 PolarHBondContact O-N 3.11Å
262	N	73.5	Confident	78.2	Confident	114 Å²	114	65.4 Å²	65.4	61%	0.61	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	29	178.1	-64.6	-8.4	0	0	0	115.2	S234	S234-N262 WeakPolarHBondContact CA-O 3.38Å
263	V	82.8	Confident	79	Confident	38 Å²	38	63.1 Å²	63.1	23%	0.23	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	121.2	-178.2	171.8	0	0	0	0	108	N232 G233 T261	N232-V263 HydrophobicContact CB-CG1 3.89Å; G233-V263 CarbonylContact O-C 3.41Å; G233-V263 WeakPolarHBondContact O-CA 3.47Å; T261-V263 WeakPolarHBondContact O-CG2 3.08Å; T261-V263 PolarHBondContact O-N 3.11Å
264	H	86	Confident	80	Confident	13 Å²	13	61.1 Å²	61.1	6%	0.06	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	114.7	166.1	-173.6	-169.5	0	0	0	107.6	G233 L238 P239 D240 V241	G233-H264 PolarHBondContact N-O 3.22Å; G233-H264 PolarHBondContact O-N 3.35Å; L238-H264 HydrophobicContact CD1-CB 4.42Å; P239-H264 WeakPolarHBondContact O-CB 3.26Å; D240-H264 IonicContact OD1-CE1 2.7Å; D240-H264 PolarHBondContact OD1-CE1 3.37Å; D240-H264 VanDerWaalsContact OD1-CE1 3.23Å; D240-H264 IonicContact OD1-ND1 2.7Å; D240-H264 PolarHBondContact OD1-ND1 3.11Å; V241-H264 HydrophobicContact CB-CB 4.33Å; V241-H264 HydrophobicContact CG2-CB 3.8Å; V241-H264 PolarHBondContact N-ND1 2.79Å
265	A	88.5	Confident	80.7	Confident	6 Å²	6	58.5 Å²	58.5	5%	0.05	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133	177.7	0	0	0	0	0	110.1	C231 N232 N257	C231-A265 CarbonylContact O-C 3.59Å; C231-A265 VanDerWaalsContact O-CA 3.29Å; C231-A265 WeakPolarHBondContact O-CA 3.3Å; N232-A265 WeakPolarHBondContact OD1-CB 3.36Å; N257-A265 HydrophobicContact CB-CB 4.44Å; N257-A265 PolarHBondContact N-O 3.17Å; N257-A265 PolarHBondContact O-N 3.08Å
266	I	90.3	Very high	81.6	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.1	174.2	-155.9	171.3	0	0	0	110.5	C231 V241 W243 H254 T256	C231-I266 HydrophobicContact CB-CG2 4.26Å; C231-I266 PolarHBondContact N-O 3.26Å; C231-I266 PolarHBondContact O-N 3.19Å; V241-I266 HydrophobicContact CG1-CG2 3.85Å; V241-I266 WeakPolarHBondContact O-CD1 3.42Å; W243-I266 PolarHBondContact NE1-O 2.97Å; H254-I266 HydrophobicContact CB-CD1 4.15Å; H254-I266 HydrophobicContact CB-CG1 4.45Å; T256-I266 HydrophobicContact CG2-CD1 3.67Å; T256-I266 HydrophobicContact CG2-CG1 3.88Å
267	N	90.5	Very high	82.5	Confident	29 Å²	29	55.3 Å²	55.3	16%	0.155	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	124.4	175.5	-70.5	-11	0	0	0	109.3	V228 I229 T230 H254 Q255 N257	V228-N267 HydrophobicContact CG1-CB 4.2Å; I229-N267 CarbonylContact O-C 3.58Å; I229-N267 VanDerWaalsContact O-CA 3.3Å; I229-N267 WeakPolarHBondContact O-CA 3.5Å; T230-N267 WeakPolarHBondContact CB-OD1 3.05Å; T230-N267 VanDerWaalsContact CG2-OD1 3.25Å; T230-N267 WeakPolarHBondContact CG2-OD1 3.4Å; T230-N267 PolarHBondContact OG1-OD1 3.24Å; H254-N267 CarbonylContact C-O 3.51Å; H254-N267 WeakPolarHBondContact CA-O 3.44Å; Q255-N267 HydrophobicContact CB-CB 4.32Å; Q255-N267 PolarHBondContact N-O 3.47Å; Q255-N267 PolarHBondContact O-N 3.41Å; N257-N267 PolarHBondContact ND2-ND2 3.44Å
268	L	91.1	Very high	83.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.7	165.9	176.4	67.1	0	0	0	108.3	V228 I229 W243 V245 N252 L270 L282	V228-L268 WeakPolarHBondContact CA-O 3.48Å; I229-L268 HydrophobicContact CG2-CB 3.81Å; I229-L268 HydrophobicContact CG2-CD2 4.16Å; I229-L268 HydrophobicContact CG2-CG 4.31Å; I229-L268 PolarHBondContact N-O 2.78Å; I229-L268 PolarHBondContact O-N 2.78Å; W243-L268 HydrophobicContact CB-CD2 4.16Å; W243-L268 HydrophobicContact CD2-CB 4.15Å; W243-L268 HydrophobicContact CD2-CD2 3.98Å; W243-L268 HydrophobicContact CE3-CD2 4.26Å; W243-L268 HydrophobicContact CG-CB 3.92Å; W243-L268 HydrophobicContact CG-CD2 3.96Å; W243-L268 HydrophobicContact CG-CG 4.44Å; V245-L268 HydrophobicContact CG1-CD1 3.84Å; V245-L268 HydrophobicContact CG1-CD2 3.78Å; V245-L268 HydrophobicContact CG1-CG 4.49Å; N252-L268 HydrophobicContact CB-CD1 3.79Å; L268-L270 HydrophobicContact CD2-CD2 4.15Å; L268-L270 HydrophobicContact CG-CD2 4.19Å; L268-L282 HydrophobicContact CD2-CD1 4.44Å; L268-L282 HydrophobicContact CD2-CD2 3.99Å
269	T	91.6	Very high	85	Confident	28 Å²	28	50.2 Å²	50.2	17%	0.172	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.5	171.7	-54.9	0	0	0	0	108.8	A227 V228 N252 T253 V271	A227-T269 CarbonylContact O-C 3.46Å; A227-T269 WeakPolarHBondContact O-CA 3.41Å; V228-T269 HydrophobicContact CG2-CG2 3.97Å; N252-T269 WeakPolarHBondContact CA-O 3.44Å; T253-T269 PolarHBondContact N-O 2.89Å; T253-T269 VanDerWaalsContact N-O 3.07Å; T253-T269 PolarHBondContact O-N 3.08Å; T269-V271 HydrophobicContact CG2-CG2 3.88Å
270	L	91.7	Very high	86.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.7	168	-52.4	178.2	0	0	0	108.7	L219 N226 A227 L248 L268 V273 L282 L299	L219-L270 HydrophobicContact CD2-CD1 4.02Å; N226-L270 CarbonylContact C-O 3.55Å; N226-L270 VanDerWaalsContact CA-O 3.26Å; N226-L270 WeakPolarHBondContact CA-O 3.42Å; N226-L270 WeakPolarHBondContact CB-O 3.1Å; A227-L270 HydrophobicContact CB-CB 4.47Å; A227-L270 HydrophobicContact CB-CD1 4.48Å; A227-L270 PolarHBondContact N-O 3.24Å; A227-L270 PolarHBondContact O-N 3.31Å; L248-L270 HydrophobicContact CD2-CD2 3.64Å; L268-L270 HydrophobicContact CD2-CD2 4.15Å; L268-L270 HydrophobicContact CG-CD2 4.19Å; L270-V273 HydrophobicContact CB-CG2 3.64Å; L270-V273 HydrophobicContact CD1-CG2 4.3Å; L270-L282 HydrophobicContact CD1-CD1 4.2Å; L270-L299 HydrophobicContact CD1-CD1 4.09Å; L270-L299 HydrophobicContact CD1-CD2 3.97Å
271	V	90.2	Very high	88.3	Confident	43 Å²	43	38.8 Å²	38.8	26%	0.261	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	128.8	-176	-178.2	0	0	0	0	110	N226 I251 T269	N226-V271 WeakPolarHBondContact OD1-CA 3.2Å; I251-V271 HydrophobicContact CB-CB 4.19Å; I251-V271 HydrophobicContact CG2-CB 4.29Å; I251-V271 PolarHBondContact O-N 3.41Å; T269-V271 HydrophobicContact CG2-CG2 3.88Å
272	N	90	Very high	89.5	Confident	97 Å²	97	34.2 Å²	34.2	52%	0.519	20%	0.195	S	C	.	.	S	Bend	trans	53.5	61.3	-178.8	-174.9	66.7	0	0	0	111.5	N226 T274	N226-N272 PolarHBondContact OD1-N 3.18Å; N272-T274 PolarHBondContact O-N 3.35Å
273	V	92.6	Very high	90.5	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	17%	0.174	C	C	.	.			trans	-59.6	130.7	-169.9	173.9	0	0	0	0	111.6	V221 E223 G224 D225 S250 L270 V301	V221-V273 HydrophobicContact CB-CG1 4.43Å; V221-V273 HydrophobicContact CG1-CB 4.1Å; V221-V273 HydrophobicContact CG1-CG1 4.41Å; V221-V273 HydrophobicContact CG1-CG2 4.01Å; E223-V273 CarbonylContact C-O 3.55Å; E223-V273 VanDerWaalsContact CA-O 3.29Å; E223-V273 WeakPolarHBondContact CA-O 3.45Å; G224-V273 PolarHBondContact N-O 3.39Å; D225-V273 WeakPolarHBondContact O-CB 3.35Å; D225-V273 WeakPolarHBondContact O-CG2 3.44Å; D225-V273 PolarHBondContact O-N 2.76Å; S250-V273 WeakPolarHBondContact OG-CA 3.48Å; L270-V273 HydrophobicContact CB-CG2 3.64Å; L270-V273 HydrophobicContact CD1-CG2 4.3Å; V273-V301 HydrophobicContact CG1-CB 4.32Å; V273-V301 HydrophobicContact CG1-CG1 3.87Å; V273-V301 HydrophobicContact CG1-CG2 3.46Å; V273-V301 VanDerWaalsContact CG1-CG2 3.46Å
274	T	92.6	Very high	91	Very high	33 Å²	33	28.3 Å²	28.3	20%	0.202	16%	0.163	C	C	.	.			trans	-93.4	154.7	-175.6	82.6	0	0	0	0	111.8	S250 N272 E276 D277 V301	S250-T274 PolarHBondContact OG-N 2.88Å; N272-T274 PolarHBondContact O-N 3.35Å; T274-E276 PolarHBondContact O-N 3.39Å; T274-E276 PolarHBondContact OG1-N 2.91Å; T274-D277 WeakPolarHBondContact CB-OD2 3.5Å; T274-D277 PolarHBondContact N-OD2 3.21Å; T274-D277 PolarHBondContact O-N 2.03Å; T274-D277 PolarHBondContact OG1-N 2.88Å; T274-D277 PolarHBondContact OG1-OD2 3.36Å; T274-V301 WeakPolarHBondContact O-CG1 3.41Å
275	S	91.6	Very high	91.3	Very high	16 Å²	16	29.3 Å²	29.3	11%	0.112	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-64.9	-17.3	170.2	40	0	0	0	0	113.7	E223 D277 N278 Y303	E223-S275 WeakPolarHBondContact OE1-CB 3.39Å; E223-S275 PolarHBondContact OE1-N 3.35Å; E223-S275 PolarHBondContact OE1-OG 2.8Å; S275-D277 VanDerWaalsContact C-N 3.32Å; S275-N278 WeakPolarHBondContact O-CB 3.43Å; S275-N278 PolarHBondContact O-N 3.38Å; S275-Y303 VanDerWaalsContact CB-CD1 3.43Å
276	E	90.2	Very high	91.5	Very high	120 Å²	120	29 Å²	29	56%	0.561	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-75.3	-21.5	176.9	-57.4	-178.1	175.2	0	0	112.4	Q249 T274 N278 I484	Q249-E276 HydrophobicContact CG-CB 4.3Å; T274-E276 PolarHBondContact O-N 3.39Å; T274-E276 PolarHBondContact OG1-N 2.91Å; E276-N278 VanDerWaalsContact C-N 3.27Å; E276-N278 PolarHBondContact O-N 3.01Å; E276-I484 VanDerWaalsContact O-CD1 3.28Å; E276-I484 WeakPolarHBondContact O-CD1 3.45Å
277	D	91.3	Very high	91.7	Very high	1 Å²	1	31 Å²	31	1%	0.005	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-83.8	3	175.9	-57.2	-67.8	0	0	0	113.2	L248 Q249 S250 T274 S275 G279 F280 L299 V301	L248-D277 HydrophobicContact CD1-CB 4.14Å; L248-D277 VanDerWaalsContact CD1-OD1 3.3Å; L248-D277 WeakPolarHBondContact CD1-OD1 3.44Å; Q249-D277 PolarHBondContact N-OD1 3.03Å; S250-D277 WeakPolarHBondContact CB-OD2 3.31Å; S250-D277 PolarHBondContact N-OD1 3.24Å; S250-D277 PolarHBondContact N-OD2 2.56Å; S250-D277 PolarHBondContact OG-OD2 3.41Å; T274-D277 WeakPolarHBondContact CB-OD2 3.5Å; T274-D277 PolarHBondContact N-OD2 3.21Å; T274-D277 PolarHBondContact O-N 2.03Å; T274-D277 PolarHBondContact OG1-N 2.88Å; T274-D277 PolarHBondContact OG1-OD2 3.36Å; S275-D277 VanDerWaalsContact C-N 3.32Å; D277-G279 PolarHBondContact O-N 3.19Å; D277-F280 VanDerWaalsContact O-CB 3.26Å; D277-F280 WeakPolarHBondContact O-CB 3.41Å; D277-F280 PolarHBondContact O-N 2.81Å; D277-L299 HydrophobicContact CB-CD2 3.9Å; D277-V301 HydrophobicContact CB-CG2 4.46Å
278	N	91	Very high	91.8	Very high	16 Å²	16	30.3 Å²	30.3	9%	0.086	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	130.5	175.8	-171.1	46.8	0	0	0	110.9	S275 E276 F280 T300 V301 N328 E357 H483	S275-N278 WeakPolarHBondContact O-CB 3.43Å; S275-N278 PolarHBondContact O-N 3.38Å; E276-N278 VanDerWaalsContact C-N 3.27Å; E276-N278 PolarHBondContact O-N 3.01Å; N278-F280 VanDerWaalsContact C-N 3.28Å; N278-T300 WeakPolarHBondContact OD1-CA 3.39Å; N278-V301 HydrophobicContact CB-CB 4.06Å; N278-V301 HydrophobicContact CB-CG2 4.36Å; N278-V301 PolarHBondContact OD1-N 2.97Å; N278-N328 PolarHBondContact ND2-ND2 3.49Å; N278-N328 PolarHBondContact OD1-ND2 2.86Å; N278-E357 PolarHBondContact ND2-OE2 3.37Å; N278-H483 PolarHBondContact O-CE1 2.74Å; N278-H483 PolarHBondContact O-ND1 3.03Å
279	G	89.5	Confident	91.9	Very high	36 Å²	36	33 Å²	33	37%	0.371	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	-0.9	-175.6	0	0	0	0	0	114.4	D277 T281 L299	D277-G279 PolarHBondContact O-N 3.19Å; G279-T281 PolarHBondContact O-N 2.8Å; G279-L299 WeakPolarHBondContact CA-O 3.41Å; G279-L299 PolarHBondContact N-O 3Å
280	F	91.1	Very high	92	Very high	46 Å²	46	31.8 Å²	31.8	20%	0.202	18%	0.18	C	C	.	.			trans	-65.2	134.9	176.9	-162.2	-82.9	0	0	0	111.1	L248 D277 N278 L282 L299	L248-F280 HydrophobicContact CB-CE1 4.3Å; L248-F280 HydrophobicContact CB-CE2 4.23Å; L248-F280 HydrophobicContact CB-CZ 4.02Å; L248-F280 HydrophobicContact CD1-CB 4.47Å; L248-F280 HydrophobicContact CD1-CD1 3.9Å; L248-F280 HydrophobicContact CD1-CD2 4.34Å; L248-F280 HydrophobicContact CD1-CE1 4.23Å; L248-F280 HydrophobicContact CD1-CG 3.97Å; D277-F280 VanDerWaalsContact O-CB 3.26Å; D277-F280 WeakPolarHBondContact O-CB 3.41Å; D277-F280 PolarHBondContact O-N 2.81Å; N278-F280 VanDerWaalsContact C-N 3.28Å; F280-L282 HydrophobicContact CD1-CD2 3.82Å; F280-L282 HydrophobicContact CD1-CG 4.31Å; F280-L282 HydrophobicContact CE1-CD2 4.04Å; F280-L299 HydrophobicContact CB-CB 4.5Å; F280-L299 VanDerWaalsContact O-CB 3.3Å; F280-L299 WeakPolarHBondContact O-CB 3.45Å; F280-L299 PolarHBondContact O-N 3.4Å
281	T	92.2	Very high	92	Very high	76 Å²	76	32.1 Å²	32.1	47%	0.466	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	108.5	175.2	-62.4	0	0	0	0	109.4	G279 T283	G279-T281 PolarHBondContact O-N 2.8Å; T281-T283 PolarHBondContact O-N 3.36Å
282	L	91.7	Very high	92.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.5	175.1	-60.4	169.4	0	0	0	108.7	L219 I229 W243 L248 L268 L270 F280 S296 V297	L219-L282 HydrophobicContact CD2-CD1 4.39Å; I229-L282 HydrophobicContact CG2-CD1 4.42Å; W243-L282 HydrophobicContact CE3-CB 4.07Å; W243-L282 HydrophobicContact CZ3-CB 3.81Å; L248-L282 HydrophobicContact CD1-CD2 4.16Å; L248-L282 HydrophobicContact CD2-CD2 4.36Å; L268-L282 HydrophobicContact CD2-CD1 4.44Å; L268-L282 HydrophobicContact CD2-CD2 3.99Å; L270-L282 HydrophobicContact CD1-CD1 4.2Å; F280-L282 HydrophobicContact CD1-CD2 3.82Å; F280-L282 HydrophobicContact CD1-CG 4.31Å; F280-L282 HydrophobicContact CE1-CD2 4.04Å; L282-S296 CarbonylContact O-C 3.54Å; L282-S296 WeakPolarHBondContact O-CA 3.34Å; L282-V297 HydrophobicContact CB-CB 4.38Å; L282-V297 PolarHBondContact N-O 2.99Å; L282-V297 PolarHBondContact O-N 3.16Å
283	T	93	Very high	92.2	Very high	28 Å²	28	30.3 Å²	30.3	17%	0.172	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.8	179.6	-57.4	0	0	0	0	110.2	I244 T281 N294 A295 S296	I244-T283 HydrophobicContact CD1-CG2 4.34Å; I244-T283 PolarHBondContact N-O 2.98Å; T281-T283 PolarHBondContact O-N 3.36Å; T283-N294 HydrophobicContact CG2-CB 4.15Å; T283-A295 WeakPolarHBondContact CA-O 3.39Å; T283-S296 PolarHBondContact OG1-OG 3.47Å
284	C	93.3	Very high	92.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	143.4	164.8	-176.9	0	0	0	0	110.1	I212 V214 C231 D242 W243 N294 A295	I212-C284 HydrophobicContact CD1-CB 4.02Å; I212-C284 WeakPolarHBondContact CD1-O 3.26Å; V214-C284 HydrophobicContact CG1-CB 4.25Å; C231-C284 HydrophobicContact CB-CB 3.61Å; C231-C284 WeakPolarHBondContact CB-SG 3.38Å; C231-C284 WeakPolarHBondContact SG-CB 3.27Å; C231-C284 CovalentContact SG-SG 2.02Å; C231-C284 PolarHBondContact SG-SG 3.06Å; D242-C284 WeakPolarHBondContact O-CA 3.43Å; D242-C284 PolarHBondContact O-SG 3.07Å; W243-C284 HydrophobicContact CD2-CB 3.91Å; W243-C284 HydrophobicContact CE3-CB 3.74Å; W243-C284 HydrophobicContact CH2-CB 4.04Å; W243-C284 HydrophobicContact CZ2-CB 4.21Å; W243-C284 HydrophobicContact CZ3-CB 3.79Å; C284-N294 CarbonylContact O-C 3.55Å; C284-N294 VanDerWaalsContact O-CA 3.23Å; C284-N294 WeakPolarHBondContact O-CA 3.49Å; C284-N294 WeakPolarHBondContact O-CB 3.4Å; C284-A295 PolarHBondContact N-O 3.25Å; C284-A295 PolarHBondContact O-N 2.81Å
285	I	93.1	Very high	92.3	Very high	34 Å²	34	34.6 Å²	34.6	17%	0.174	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	144.9	170.9	54.3	171.4	0	0	0	110.1	V241 D242 I244 M292 N294	V241-I285 WeakPolarHBondContact CA-O 3.33Å; D242-I285 PolarHBondContact N-O 2.66Å; D242-I285 VanDerWaalsContact N-O 3.09Å; D242-I285 WeakPolarHBondContact O-CG1 3.28Å; D242-I285 PolarHBondContact O-N 3.18Å; I244-I285 HydrophobicContact CD1-CG2 3.75Å; I244-I285 HydrophobicContact CG1-CD1 4.45Å; I244-I285 HydrophobicContact CG1-CG2 4.26Å; I285-M292 HydrophobicContact CB-CE 4.18Å; I285-M292 HydrophobicContact CB-SD 4.25Å; I285-M292 HydrophobicContact CD1-CE 3.87Å; I285-M292 HydrophobicContact CG2-CE 4.37Å; I285-M292 HydrophobicContact CG2-SD 3.97Å; I285-N294 HydrophobicContact CG2-CB 4.16Å
286	A	93.4	Very high	92.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.6	168.5	0	0	0	0	0	108.1	P210 I212 P239 D240 V241 M292 S293	P210-A286 HydrophobicContact CB-CB 4.06Å; P210-A286 HydrophobicContact CG-CB 4.48Å; P210-A286 WeakPolarHBondContact CG-O 3.36Å; I212-A286 HydrophobicContact CB-CB 4.2Å; I212-A286 HydrophobicContact CD1-CB 3.98Å; I212-A286 HydrophobicContact CG1-CB 4.32Å; P239-A286 HydrophobicContact CB-CB 4.14Å; P239-A286 HydrophobicContact CG-CB 4.38Å; D240-A286 CarbonylContact O-C 3.58Å; D240-A286 VanDerWaalsContact O-CA 3.28Å; D240-A286 WeakPolarHBondContact O-CA 3.4Å; V241-A286 HydrophobicContact CG2-CB 4.03Å; A286-M292 WeakPolarHBondContact O-CA 3.31Å; A286-S293 PolarHBondContact N-O 2.84Å; A286-S293 PolarHBondContact O-N 2.98Å
287	E	93	Very high	92.5	Very high	48 Å²	48	31.2 Å²	31.2	22%	0.224	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	141.1	-176.7	64.6	165.4	-127	0	0	113.4	W144 Q145 P239 D240 M292	W144-E287 HydrophobicContact CH2-CB 4.43Å; W144-E287 HydrophobicContact CZ2-CB 4.15Å; Q145-E287 PolarHBondContact NE2-OE1 3.21Å; P239-E287 CarbonylContact C-O 3.6Å; P239-E287 WeakPolarHBondContact CA-O 2.93Å; P239-E287 VanDerWaalsContact CB-O 3.32Å; P239-E287 WeakPolarHBondContact CB-O 3.29Å; D240-E287 HydrophobicContact CB-CG 4.36Å; D240-E287 PolarHBondContact N-O 3.03Å; D240-E287 PolarHBondContact O-N 2.71Å; E287-M292 HydrophobicContact CB-CB 4.17Å; E287-M292 HydrophobicContact CB-CE 4.01Å; E287-M292 HydrophobicContact CB-CG 4.42Å; E287-M292 HydrophobicContact CG-CE 4.46Å; E287-M292 WeakPolarHBondContact OE2-CE 3.43Å
288	N	93	Very high	92.6	Very high	14 Å²	14	33 Å²	33	8%	0.075	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	-175.6	170.2	74.9	9.6	0	0	0	110.5	W144 D208 P237 P239 V290 G291	W144-N288 PolarHBondContact NE1-O 3.13Å; D208-N288 PolarHBondContact O-ND2 3.28Å; P237-N288 PolarHBondContact O-ND2 2.71Å; P239-N288 HydrophobicContact CB-CB 4.39Å; N288-V290 PolarHBondContact O-N 3.47Å; N288-V290 VanDerWaalsContact O-N 3.09Å; N288-V290 WeakPolarHBondContact OD1-CA 3.43Å; N288-V290 VanDerWaalsContact OD1-CB 3.26Å; N288-V290 WeakPolarHBondContact OD1-CB 3.46Å; N288-V290 PolarHBondContact OD1-N 3.06Å; N288-G291 PolarHBondContact N-O 3.31Å; N288-G291 PolarHBondContact O-N 2.88Å; N288-G291 PolarHBondContact OD1-N 3.04Å
289	V	92.8	Very high	92.7	Very high	55 Å²	55	32.3 Å²	32.3	33%	0.333	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.9	-178.7	-55	0	0	0	0	114.4	C166 P237	C166-V289 HydrophobicContact CB-CG2 4.07Å; P237-V289 HydrophobicContact CG-CG2 3.91Å
290	V	93.8	Very high	93	Very high	3 Å²	3	32.6 Å²	32.6	2%	0.018	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-31.2	-179.9	-172.9	0	0	0	0	111.9	C166 R169 W170 L173 L209 N288	C166-V290 WeakPolarHBondContact SG-CG2 3.39Å; R169-V290 HydrophobicContact CB-CG1 3.98Å; R169-V290 HydrophobicContact CB-CG2 4.17Å; R169-V290 HydrophobicContact CG-CB 4.49Å; R169-V290 HydrophobicContact CG-CG1 3.54Å; R169-V290 HydrophobicContact CG-CG2 4.22Å; W170-V290 VanDerWaalsContact CB-O 3.29Å; W170-V290 WeakPolarHBondContact CB-O 3.49Å; L173-V290 HydrophobicContact CD1-CG1 3.59Å; L209-V290 HydrophobicContact CD2-CB 4.42Å; L209-V290 HydrophobicContact CD2-CG1 3.95Å; L209-V290 HydrophobicContact CG-CG1 4.12Å; N288-V290 PolarHBondContact O-N 3.47Å; N288-V290 VanDerWaalsContact O-N 3.09Å; N288-V290 WeakPolarHBondContact OD1-CA 3.43Å; N288-V290 VanDerWaalsContact OD1-CB 3.26Å; N288-V290 WeakPolarHBondContact OD1-CB 3.46Å; N288-V290 PolarHBondContact OD1-N 3.06Å
291	G	92.5	Very high	93.2	Very high	8 Å²	8	30.4 Å²	30.4	8%	0.082	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	166	-165	179.3	0	0	0	0	0	113.1	N288	N288-G291 PolarHBondContact N-O 3.31Å; N288-G291 PolarHBondContact O-N 2.88Å; N288-G291 PolarHBondContact OD1-N 3.04Å
292	M	92.8	Very high	93.3	Very high	70 Å²	70	31 Å²	31	35%	0.345	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	143.4	177.2	172.1	-176.4	-78.4	0	0	110.2	W144 I285 A286 E287	W144-M292 HydrophobicContact CH2-CB 3.59Å; W144-M292 HydrophobicContact CH2-CE 4.22Å; W144-M292 HydrophobicContact CZ2-CB 4.1Å; W144-M292 HydrophobicContact CZ3-CB 4.19Å; I285-M292 HydrophobicContact CB-CE 4.18Å; I285-M292 HydrophobicContact CB-SD 4.25Å; I285-M292 HydrophobicContact CD1-CE 3.87Å; I285-M292 HydrophobicContact CG2-CE 4.37Å; I285-M292 HydrophobicContact CG2-SD 3.97Å; A286-M292 WeakPolarHBondContact O-CA 3.31Å; E287-M292 HydrophobicContact CB-CB 4.17Å; E287-M292 HydrophobicContact CB-CE 4.01Å; E287-M292 HydrophobicContact CB-CG 4.42Å; E287-M292 HydrophobicContact CG-CE 4.46Å; E287-M292 WeakPolarHBondContact OE2-CE 3.43Å
293	S	92	Very high	93.6	Very high	32 Å²	32	31.4 Å²	31.4	22%	0.224	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.1	168	-62.4	0	0	0	0	109.1	P210 A286	P210-S293 VanDerWaalsContact O-CB 3.23Å; P210-S293 WeakPolarHBondContact O-CB 3.43Å; P210-S293 PolarHBondContact O-OG 3.09Å; A286-S293 PolarHBondContact N-O 2.84Å; A286-S293 PolarHBondContact O-N 2.98Å
294	N	93.6	Very high	93.7	Very high	106 Å²	106	32.3 Å²	32.3	57%	0.567	19%	0.187	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-130.3	161.1	178.5	63.6	20.1	0	0	0	111.8	I212 T283 C284 I285	I212-N294 WeakPolarHBondContact CG2-O 3.47Å; T283-N294 HydrophobicContact CG2-CB 4.15Å; C284-N294 CarbonylContact O-C 3.55Å; C284-N294 VanDerWaalsContact O-CA 3.23Å; C284-N294 WeakPolarHBondContact O-CA 3.49Å; C284-N294 WeakPolarHBondContact O-CB 3.4Å; I285-N294 HydrophobicContact CG2-CB 4.16Å
295	A	93	Very high	93.9	Very high	17 Å²	17	32.7 Å²	32.7	14%	0.14	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	131.6	175.7	0	0	0	0	0	109.6	I212 V214 T283 C284	I212-A295 HydrophobicContact CD1-CB 3.85Å; I212-A295 HydrophobicContact CG1-CB 3.86Å; I212-A295 HydrophobicContact CG2-CB 4.11Å; V214-A295 HydrophobicContact CG1-CB 3.77Å; V214-A295 HydrophobicContact CG2-CB 4.21Å; T283-A295 WeakPolarHBondContact CA-O 3.39Å; C284-A295 PolarHBondContact N-O 3.25Å; C284-A295 PolarHBondContact O-N 2.81Å
296	S	93.4	Very high	94	Very high	65 Å²	65	36.6 Å²	36.6	46%	0.455	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.8	-172.6	-64.6	0	0	0	0	112	L282 T283	L282-S296 CarbonylContact O-C 3.54Å; L282-S296 WeakPolarHBondContact O-CA 3.34Å; T283-S296 PolarHBondContact OG1-OG 3.47Å
297	V	93	Very high	94	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	124.3	-178.2	-172	0	0	0	0	110	V214 H216 V217 L219 I229 W243 L282	V214-V297 HydrophobicContact CB-CG2 3.95Å; V214-V297 HydrophobicContact CG1-CG2 4.15Å; V214-V297 HydrophobicContact CG2-CG2 3.82Å; H216-V297 HydrophobicContact CB-CG1 4.15Å; H216-V297 WeakPolarHBondContact O-CG1 3.2Å; H216-V297 WeakPolarHBondContact O-CG2 3.5Å; V217-V297 WeakPolarHBondContact O-CA 3.09Å; V217-V297 WeakPolarHBondContact O-CG1 3.4Å; L219-V297 HydrophobicContact CB-CG1 4.22Å; I229-V297 HydrophobicContact CD1-CB 3.87Å; I229-V297 HydrophobicContact CD1-CG1 3.55Å; I229-V297 HydrophobicContact CD1-CG2 3.68Å; W243-V297 HydrophobicContact CH2-CG2 4.16Å; W243-V297 HydrophobicContact CZ3-CG2 4.32Å; L282-V297 HydrophobicContact CB-CB 4.38Å; L282-V297 PolarHBondContact N-O 2.99Å; L282-V297 PolarHBondContact O-N 3.16Å
298	A	93.5	Very high	94.1	Very high	39 Å²	39	39.7 Å²	39.7	32%	0.322	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	123.9	178.3	0	0	0	0	0	111	V217 N218 L219	V217-A298 PolarHBondContact O-N 3.43Å; N218-A298 CarbonylContact C-O 3.6Å; N218-A298 WeakPolarHBondContact CA-O 3.08Å; L219-A298 PolarHBondContact N-O 3.29Å
299	L	93.8	Very high	94.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	123.2	174	-179.2	59.5	0	0	0	110.7	L219 V221 L248 L270 D277 G279 F280 V301	L219-L299 HydrophobicContact CB-CD1 4.34Å; L219-L299 HydrophobicContact CD2-CD1 4.1Å; L219-L299 HydrophobicContact CG-CD1 4.08Å; L219-L299 WeakPolarHBondContact O-CA 3.47Å; V221-L299 HydrophobicContact CG2-CD1 3.85Å; L248-L299 HydrophobicContact CD1-CD2 4.42Å; L270-L299 HydrophobicContact CD1-CD1 4.09Å; L270-L299 HydrophobicContact CD1-CD2 3.97Å; D277-L299 HydrophobicContact CB-CD2 3.9Å; G279-L299 WeakPolarHBondContact CA-O 3.41Å; G279-L299 PolarHBondContact N-O 3Å; F280-L299 HydrophobicContact CB-CB 4.5Å; F280-L299 VanDerWaalsContact O-CB 3.3Å; F280-L299 WeakPolarHBondContact O-CB 3.45Å; F280-L299 PolarHBondContact O-N 3.4Å; L299-V301 HydrophobicContact CD1-CG2 4.38Å; L299-V301 HydrophobicContact CD2-CG2 4.33Å; L299-V301 HydrophobicContact CG-CG2 4.02Å
300	T	94.4	Very high	94.2	Very high	43 Å²	43	38.2 Å²	38.2	26%	0.264	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	118.6	173.3	-53.4	0	0	0	0	109.4	L219 T220 V221 N278 Y302	L219-T300 PolarHBondContact O-N 3.5Å; T220-T300 WeakPolarHBondContact CA-O 3.36Å; T220-T300 HydrophobicContact CG2-CG2 4.4Å; V221-T300 PolarHBondContact N-O 2.99Å; N278-T300 WeakPolarHBondContact OD1-CA 3.39Å; T300-Y302 HydrophobicContact CG2-CE1 4.36Å
301	V	95.2	Very high	94.1	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.2	178.9	-170	0	0	0	0	110.4	V221 E223 V273 T274 D277 N278 L299 Y303 N328	V221-V301 CarbonylContact O-C 3.57Å; V221-V301 WeakPolarHBondContact O-CA 3.49Å; E223-V301 HydrophobicContact CB-CG1 4.19Å; V273-V301 HydrophobicContact CG1-CB 4.32Å; V273-V301 HydrophobicContact CG1-CG1 3.87Å; V273-V301 HydrophobicContact CG1-CG2 3.46Å; V273-V301 VanDerWaalsContact CG1-CG2 3.46Å; T274-V301 WeakPolarHBondContact O-CG1 3.41Å; D277-V301 HydrophobicContact CB-CG2 4.46Å; N278-V301 HydrophobicContact CB-CB 4.06Å; N278-V301 HydrophobicContact CB-CG2 4.36Å; N278-V301 PolarHBondContact OD1-N 2.97Å; L299-V301 HydrophobicContact CD1-CG2 4.38Å; L299-V301 HydrophobicContact CD2-CG2 4.33Å; L299-V301 HydrophobicContact CG-CG2 4.02Å; V301-Y303 WeakPolarHBondContact O-CD1 3.46Å; V301-N328 PolarHBondContact O-ND2 2.97Å
302	Y	96.1	Very high	93.9	Very high	89 Å²	89	48.3 Å²	48.3	35%	0.349	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.6	177.5	-78.5	-38.9	0	0	0	111.8	T220 V221 R222 E223 T300 N328 P329	T220-Y302 HydrophobicContact CG2-CD2 3.59Å; T220-Y302 HydrophobicContact CG2-CE2 3.37Å; V221-Y302 PolarHBondContact O-N 3Å; R222-Y302 CarbonylContact C-O 3.54Å; R222-Y302 VanDerWaalsContact CA-O 3.29Å; R222-Y302 WeakPolarHBondContact CA-O 3.27Å; E223-Y302 PolarHBondContact N-O 2.88Å; T300-Y302 HydrophobicContact CG2-CE1 4.36Å; Y302-N328 CarbonylContact C-O 3.53Å; Y302-N328 VanDerWaalsContact CA-O 3.26Å; Y302-N328 WeakPolarHBondContact CA-O 3.47Å; Y302-N328 HydrophobicContact CD1-CB 4.32Å; Y302-N328 WeakPolarHBondContact CD1-O 3.42Å; Y302-N328 WeakPolarHBondContact CD1-OD1 3.25Å; Y302-N328 WeakPolarHBondContact CE1-OD1 3.21Å; Y302-P329 HydrophobicContact CD1-CG 3.99Å; Y302-P329 HydrophobicContact CE1-CG 3.83Å
303	Y	96.2	Very high	93.7	Very high	7 Å²	7	46 Å²	46	3%	0.027	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.3	-173.7	59	-89.8	0	0	0	113.3	E223 S275 V301 R326 G327 N328 E357 N382	E223-Y303 WeakPolarHBondContact OE2-CB 3.31Å; S275-Y303 VanDerWaalsContact CB-CD1 3.43Å; V301-Y303 WeakPolarHBondContact O-CD1 3.46Å; Y303-R326 HydrophobicContact CE2-CB 4.31Å; Y303-G327 VanDerWaalsContact CE2-CA 3.45Å; Y303-N328 HydrophobicContact CD1-CB 3.82Å; Y303-N328 HydrophobicContact CE1-CB 3.51Å; Y303-N328 PolarHBondContact N-O 2.74Å; Y303-N328 PolarHBondContact O-N 3.42Å; Y303-E357 WeakPolarHBondContact CE1-OE2 3.4Å; Y303-E357 WeakPolarHBondContact OH-CB 3.47Å; Y303-E357 WeakPolarHBondContact OH-CG 3.46Å; Y303-E357 PolarHBondContact OH-OE2 3.35Å; Y303-N382 PolarHBondContact O-ND2 2.91Å
304	P	96.3	Very high	93.3	Very high	48 Å²	48	49.2 Å²	49.2	31%	0.312	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	161.4	178.9	30.1	-36.8	0	0	0	112.3	L384	P304-L384 HydrophobicContact CB-CB 4.24Å
305	P	96.4	Very high	92.7	Very high	7 Å²	7	49.9 Å²	49.9	5%	0.045	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	149.3	-176.5	-14.8	31.7	0	0	0	111.2	V325 R326 P331 A380 N382 A387	P305-V325 HydrophobicContact CB-CG1 4.49Å; P305-R326 CarbonylContact C-O 3.54Å; P305-R326 VanDerWaalsContact CA-O 3.23Å; P305-R326 WeakPolarHBondContact CA-O 3.35Å; P305-P331 HydrophobicContact CB-CB 3.94Å; P305-P331 HydrophobicContact CB-CG 4.33Å; P305-P331 HydrophobicContact CG-CB 3.9Å; P305-A380 HydrophobicContact CB-CB 3.86Å; P305-N382 WeakPolarHBondContact CD-OD1 3.21Å; P305-N382 HydrophobicContact CG-CB 3.95Å; P305-A387 HydrophobicContact CB-CB 4.45Å; P305-A387 VanDerWaalsContact O-CB 3.23Å; P305-A387 WeakPolarHBondContact O-CB 3.33Å
306	R	95.5	Very high	91.4	Very high	117 Å²	117	52.8 Å²	52.8	44%	0.442	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	129.5	173	-60.4	-178.8	-174.6	169.6	3	108.7	E223 V325 R326	E223-R306 IonicContact OE1-CZ 2.69Å; E223-R306 IonicContact OE1-NH1 3.7Å; E223-R306 IonicContact OE1-NH2 2.94Å; E223-R306 PolarHBondContact OE1-NH2 3.4Å; E223-R306 IonicContact OE2-CZ 3.3Å; E223-R306 IonicContact OE2-NH2 2.71Å; E223-R306 PolarHBondContact OE2-NH2 3.24Å; R306-V325 CarbonylContact O-C 3.6Å; R306-V325 WeakPolarHBondContact O-CA 3.44Å; R306-R326 PolarHBondContact N-O 3.38Å; R306-R326 PolarHBondContact O-N 2.79Å
307	V	94.7	Very high	90.3	Very high	27 Å²	27	55.8 Å²	55.8	16%	0.164	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	120.5	168.4	-170.4	0	0	0	0	106.8	S309 L310 V325 L378 A387 Q389	V307-S309 WeakPolarHBondContact CG1-O 3.14Å; V307-L310 HydrophobicContact CG1-CB 4.28Å; V307-V325 HydrophobicContact CG1-CG2 4.43Å; V307-V325 HydrophobicContact CG2-CG2 4.3Å; V307-L378 HydrophobicContact CG1-CD2 4.28Å; V307-A387 HydrophobicContact CG2-CB 4.29Å; V307-Q389 HydrophobicContact CB-CB 4.15Å; V307-Q389 HydrophobicContact CG1-CB 4.07Å; V307-Q389 HydrophobicContact CG2-CB 4.18Å
308	V	93.4	Very high	89.9	Confident	86 Å²	86	58.1 Å²	58.1	52%	0.521	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-41.3	-178.1	178.7	0	0	0	0	110.2	V324 R326	V308-V324 HydrophobicContact CB-CB 4.22Å; V308-V324 HydrophobicContact CB-CG1 4.07Å; V308-V324 HydrophobicContact CG2-CG1 4.48Å; V308-V324 PolarHBondContact N-O 3.14Å; V308-R326 HydrophobicContact CG2-CB 4.29Å; V308-R326 HydrophobicContact CG2-CG 3.84Å
309	S	93.4	Very high	89.6	Confident	25 Å²	25	57.8 Å²	57.8	18%	0.175	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.3	171.8	65.3	0	0	0	0	111.3	V307 F323 V324	V307-S309 WeakPolarHBondContact CG1-O 3.14Å; S309-F323 WeakPolarHBondContact O-CA 2.96Å; S309-V324 PolarHBondContact N-O 3.03Å; S309-V324 PolarHBondContact O-N 2.9Å; S309-V324 WeakPolarHBondContact OG-CB 3.37Å; S309-V324 WeakPolarHBondContact OG-CG2 3.17Å; S309-V324 PolarHBondContact OG-N 3.17Å; S309-V324 VanDerWaalsContact OG-N 3.17Å
310	L	94.5	Very high	89.5	Confident	12 Å²	12	57.9 Å²	57.9	6%	0.063	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	110.5	167.6	179.6	66.7	0	0	0	106.4	V307 I321 E322 F323 W335 L378 Q389 I391	V307-L310 HydrophobicContact CG1-CB 4.28Å; L310-I321 HydrophobicContact CD1-CG2 3.67Å; L310-E322 CarbonylContact C-O 3.54Å; L310-E322 WeakPolarHBondContact CA-O 3.45Å; L310-F323 HydrophobicContact CD1-CB 4.02Å; L310-W335 HydrophobicContact CD1-CH2 3.53Å; L310-W335 HydrophobicContact CD1-CZ3 3.99Å; L310-L378 HydrophobicContact CD1-CB 4.38Å; L310-Q389 HydrophobicContact CB-CG 4.22Å; L310-Q389 HydrophobicContact CD2-CB 3.87Å; L310-Q389 HydrophobicContact CD2-CG 3.89Å; L310-Q389 VanDerWaalsContact CD2-O 3.32Å; L310-Q389 WeakPolarHBondContact CD2-O 3.41Å; L310-I391 HydrophobicContact CD1-CG2 4.24Å; L310-I391 HydrophobicContact CD2-CB 3.96Å; L310-I391 HydrophobicContact CD2-CG2 3.88Å; L310-I391 HydrophobicContact CG-CB 4.07Å; L310-I391 HydrophobicContact CG-CG2 3.83Å; L310-I391 WeakPolarHBondContact O-CD1 3.49Å
311	E	91.7	Very high	89.5	Confident	85 Å²	85	55.9 Å²	55.9	40%	0.397	27%	0.274	S	S	.	.			trans	-108.3	158.5	-167.1	-58.2	-169	176.9	0	0	113.2	I321 E322	E311-I321 WeakPolarHBondContact O-CG2 3.45Å; E311-E322 HydrophobicContact CB-CB 4.32Å; E311-E322 PolarHBondContact N-O 3.16Å
312	E	89.5	Confident	89.4	Confident	138 Å²	138	58 Å²	58	65%	0.645	28%	0.283	S	S	*	.			trans	-66.3	156.1	178.8	-68	-167.6	168.9	0	0	111	E314 I391	E312-E314 PolarHBondContact O-N 3.22Å; E312-I391 HydrophobicContact CG-CD1 3.86Å; E312-I391 HydrophobicContact CG-CG1 4.06Å
313	P	88.1	Confident	89.3	Confident	23 Å²	23	53.7 Å²	53.7	15%	0.149	27%	0.267	C	S	.	.			trans	-66.6	107.8	-173.4	-8.7	19	0	0	0	113	H319 C320 I321 G393 F395	P313-H319 HydrophobicContact CB-CB 4.44Å; P313-C320 CarbonylContact C-O 3.37Å; P313-C320 WeakPolarHBondContact CA-O 3.18Å; P313-I321 HydrophobicContact CB-CG1 3.86Å; P313-I321 HydrophobicContact CG-CD1 4.05Å; P313-I321 HydrophobicContact CG-CG1 3.71Å; P313-G393 VanDerWaalsContact CG-CA 3.44Å; P313-F395 HydrophobicContact CB-CD1 4.12Å; P313-F395 HydrophobicContact CB-CE1 3.48Å; P313-F395 VanDerWaalsContact CB-CE1 3.48Å; P313-F395 HydrophobicContact CB-CZ 4.08Å; P313-F395 HydrophobicContact CG-CD1 4.47Å; P313-F395 HydrophobicContact CG-CE1 3.84Å; P313-F395 HydrophobicContact CG-CZ 3.98Å
314	E	82.7	Confident	89.2	Confident	98 Å²	98	54.4 Å²	54.4	46%	0.458	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129.6	174.1	-69.6	-157.4	139	0	0	111.5	E312 R316 H319 C320	E312-E314 PolarHBondContact O-N 3.22Å; E314-R316 HydrophobicContact CB-CG 4.22Å; E314-R316 PolarHBondContact O-N 3.41Å; E314-R316 IonicContact OE2-CZ 3.67Å; E314-R316 IonicContact OE2-NE 3.23Å; E314-R316 PolarHBondContact OE2-NE 3.03Å; E314-R316 IonicContact OE2-NH2 3.98Å; E314-R316 PolarHBondContact OE2-NH2 3.2Å; E314-H319 CarbonylContact O-C 3.57Å; E314-H319 VanDerWaalsContact O-CA 3.31Å; E314-H319 WeakPolarHBondContact O-CA 3.32Å; E314-C320 PolarHBondContact N-O 2.72Å; E314-C320 PolarHBondContact O-N 2.65Å
315	L	81.1	Confident	89.1	Confident	120 Å²	120	52.1 Å²	52.1	63%	0.628	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	112.4	167.8	177.4	59.9	0	0	0	110.1
316	R	66.6	Low	89	Confident	78 Å²	78	56.1 Å²	56.1	29%	0.294	27%	0.271	S	S	.	.	S	Bend	trans	-119.1	-48.7	179.4	-69.2	167	169.6	-164.9	6.9	112	E314 E318 E322 L579	E314-R316 HydrophobicContact CB-CG 4.22Å; E314-R316 PolarHBondContact O-N 3.41Å; E314-R316 IonicContact OE2-CZ 3.67Å; E314-R316 IonicContact OE2-NE 3.23Å; E314-R316 PolarHBondContact OE2-NE 3.03Å; E314-R316 IonicContact OE2-NH2 3.98Å; E314-R316 PolarHBondContact OE2-NH2 3.2Å; R316-E318 PolarHBondContact N-O 3.35Å; R316-E322 IonicContact CZ-OE2 2.78Å; R316-E322 IonicContact NH1-OE2 3.75Å; R316-E322 PolarHBondContact NH1-OE2 3.39Å; R316-E322 IonicContact NH2-OE2 3.78Å; R316-E322 PolarHBondContact NH2-OE2 3.02Å; R316-L579 HydrophobicContact CB-CD1 3.82Å; R316-L579 HydrophobicContact CB-CD2 4.37Å; R316-L579 HydrophobicContact CG-CD1 4.18Å; R316-L579 HydrophobicContact CG-CD2 3.85Å
317	L	70.9	Confident	89	Confident	128 Å²	128	50.5 Å²	50.5	67%	0.67	25%	0.25	S	C	*	.	S	Bend	trans	-144.2	-55.6	172.2	-93.9	156.9	0	0	0	107.2
318	E	83.2	Confident	89	Confident	49 Å²	49	50.2 Å²	50.2	23%	0.229	25%	0.247	C	C	.	.	S	Bend	trans	-100.9	174.2	153	-66.2	-178.7	150.9	0	0	108.1	R316 H349 L364 F365 N366	R316-E318 PolarHBondContact N-O 3.35Å; E318-H349 IonicContact OE2-CE1 3.23Å; E318-H349 PolarHBondContact OE2-CE1 3.25Å; E318-L364 HydrophobicContact CB-CD2 4.46Å; E318-F365 WeakPolarHBondContact CB-O 3.49Å; E318-N366 HydrophobicContact CG-CB 4.41Å; E318-N366 WeakPolarHBondContact OE1-CB 3.17Å; E318-N366 PolarHBondContact OE1-ND2 3.28Å
319	H	87.5	Confident	89.1	Confident	32 Å²	32	47.9 Å²	47.9	15%	0.148	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	133.9	168.1	-60.8	71.9	0	0	0	108.4	P313 E314 L364 F365 P368 F395	P313-H319 HydrophobicContact CB-CB 4.44Å; E314-H319 CarbonylContact O-C 3.57Å; E314-H319 VanDerWaalsContact O-CA 3.31Å; E314-H319 WeakPolarHBondContact O-CA 3.32Å; H319-L364 CarbonylContact O-C 3.6Å; H319-L364 WeakPolarHBondContact O-CA 3.07Å; H319-F365 HydrophobicContact CB-CB 4.24Å; H319-F365 PolarHBondContact N-O 3.05Å; H319-F365 VanDerWaalsContact N-O 3.09Å; H319-F365 PolarHBondContact O-N 3.2Å; H319-P368 HydrophobicContact CB-CG 4.38Å; H319-P368 WeakPolarHBondContact ND1-CD 3.42Å; H319-P368 WeakPolarHBondContact ND1-CG 3.28Å; H319-F395 HydrophobicContact CB-CD1 3.96Å; H319-F395 HydrophobicContact CB-CE1 3.75Å; H319-F395 AromaticContact CD2-CD1 3.78Å; H319-F395 AromaticContact CG-CD1 3.83Å
320	C	91.8	Very high	89	Confident	4 Å²	4	49.2 Å²	49.2	3%	0.027	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.3	177.7	162.5	0	0	0	0	109.7	P313 E314 E322 C362 L364	P313-C320 CarbonylContact C-O 3.37Å; P313-C320 WeakPolarHBondContact CA-O 3.18Å; E314-C320 PolarHBondContact N-O 2.72Å; E314-C320 PolarHBondContact O-N 2.65Å; C320-E322 PolarHBondContact SG-N 3.11Å; C320-C362 HydrophobicContact CB-CB 3.81Å; C320-C362 WeakPolarHBondContact CB-SG 3.4Å; C320-C362 WeakPolarHBondContact SG-CB 3.33Å; C320-C362 CovalentContact SG-SG 2.03Å; C320-C362 PolarHBondContact SG-SG 3.41Å; C320-L364 HydrophobicContact CB-CD2 3.99Å
321	I	94.3	Very high	88.9	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	103.1	157.1	-66.7	176.9	0	0	0	105.9	L310 E311 P313 W335 C362 L363 F365 Y376 I391	L310-I321 HydrophobicContact CD1-CG2 3.67Å; E311-I321 WeakPolarHBondContact O-CG2 3.45Å; P313-I321 HydrophobicContact CB-CG1 3.86Å; P313-I321 HydrophobicContact CG-CD1 4.05Å; P313-I321 HydrophobicContact CG-CG1 3.71Å; I321-W335 HydrophobicContact CG2-CH2 3.72Å; I321-W335 HydrophobicContact CG2-CZ3 4.13Å; I321-C362 WeakPolarHBondContact O-CA 3.34Å; I321-L363 HydrophobicContact CB-CB 4.28Å; I321-L363 HydrophobicContact CD1-CD2 4.47Å; I321-L363 PolarHBondContact N-O 2.84Å; I321-L363 PolarHBondContact O-N 3.1Å; I321-F365 HydrophobicContact CB-CE2 4.46Å; I321-F365 HydrophobicContact CD1-CE2 3.67Å; I321-F365 HydrophobicContact CD1-CZ 3.9Å; I321-F365 HydrophobicContact CG1-CE2 3.85Å; I321-Y376 HydrophobicContact CD1-CD1 4.46Å; I321-Y376 HydrophobicContact CD1-CD2 3.67Å; I321-Y376 HydrophobicContact CD1-CE2 4.33Å; I321-Y376 HydrophobicContact CD1-CG 3.75Å; I321-I391 HydrophobicContact CD1-CG2 4.42Å; I321-I391 HydrophobicContact CG2-CG2 3.92Å
322	E	92.7	Very high	89	Confident	44 Å²	44	48.3 Å²	48.3	21%	0.206	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	143.1	-177	-170.7	161.8	176.4	0	0	110.7	L310 E311 R316 C320 G361	L310-E322 CarbonylContact C-O 3.54Å; L310-E322 WeakPolarHBondContact CA-O 3.45Å; E311-E322 HydrophobicContact CB-CB 4.32Å; E311-E322 PolarHBondContact N-O 3.16Å; R316-E322 IonicContact CZ-OE2 2.78Å; R316-E322 IonicContact NH1-OE2 3.75Å; R316-E322 PolarHBondContact NH1-OE2 3.39Å; R316-E322 IonicContact NH2-OE2 3.78Å; R316-E322 PolarHBondContact NH2-OE2 3.02Å; C320-E322 PolarHBondContact SG-N 3.11Å; E322-G361 WeakPolarHBondContact CA-O 3.29Å
323	F	94.8	Very high	89.2	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	147.4	179.5	68.5	-91.6	0	0	0	113	S309 L310 V325 L333 W335 V350 Y352 E360 G361 L378	S309-F323 WeakPolarHBondContact O-CA 2.96Å; L310-F323 HydrophobicContact CD1-CB 4.02Å; F323-V325 HydrophobicContact CD2-CG2 4.23Å; F323-L333 HydrophobicContact CD2-CD1 4.37Å; F323-L333 HydrophobicContact CE2-CD1 3.41Å; F323-L333 VanDerWaalsContact CE2-CD1 3.41Å; F323-L333 HydrophobicContact CZ-CD1 3.93Å; F323-W335 HydrophobicContact CD1-CH2 4.23Å; F323-W335 AromaticContact CD1-CZ2 3.52Å; F323-W335 HydrophobicContact CD1-CZ2 3.52Å; F323-W335 AromaticContact CE1-CZ2 3.75Å; F323-W335 HydrophobicContact CE1-CZ2 3.75Å; F323-W335 HydrophobicContact CG-CZ2 4.17Å; F323-V350 HydrophobicContact CE1-CG1 3.98Å; F323-V350 HydrophobicContact CZ-CG1 3.98Å; F323-Y352 HydrophobicContact CZ-CD1 4.46Å; F323-Y352 HydrophobicContact CZ-CG 4.13Å; F323-E360 WeakPolarHBondContact O-CA 3.5Å; F323-G361 WeakPolarHBondContact CD1-O 3.32Å; F323-G361 VanDerWaalsContact CE1-C 3.45Å; F323-G361 PolarHBondContact N-O 3.02Å; F323-G361 PolarHBondContact O-N 3.44Å; F323-L378 HydrophobicContact CB-CD2 3.67Å; F323-L378 HydrophobicContact CD2-CD2 3.73Å; F323-L378 HydrophobicContact CG-CD2 3.76Å
324	V	94.3	Very high	89.5	Confident	21 Å²	21	46.9 Å²	46.9	13%	0.127	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.6	169.4	179.9	0	0	0	0	108.9	V308 S309 I358 E360	V308-V324 HydrophobicContact CB-CB 4.22Å; V308-V324 HydrophobicContact CB-CG1 4.07Å; V308-V324 HydrophobicContact CG2-CG1 4.48Å; V308-V324 PolarHBondContact N-O 3.14Å; S309-V324 PolarHBondContact N-O 3.03Å; S309-V324 PolarHBondContact O-N 2.9Å; S309-V324 WeakPolarHBondContact OG-CB 3.37Å; S309-V324 WeakPolarHBondContact OG-CG2 3.17Å; S309-V324 PolarHBondContact OG-N 3.17Å; S309-V324 VanDerWaalsContact OG-N 3.17Å; V324-I358 HydrophobicContact CG1-CG2 3.96Å; V324-E360 HydrophobicContact CG2-CB 4.23Å; V324-E360 HydrophobicContact CG2-CG 3.93Å
325	V	94.7	Very high	90.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	136.2	176.7	-179.8	0	0	0	0	109	P305 R306 V307 F323 P331 L333 I358 S359 L378 A380	P305-V325 HydrophobicContact CB-CG1 4.49Å; R306-V325 CarbonylContact O-C 3.6Å; R306-V325 WeakPolarHBondContact O-CA 3.44Å; V307-V325 HydrophobicContact CG1-CG2 4.43Å; V307-V325 HydrophobicContact CG2-CG2 4.3Å; F323-V325 HydrophobicContact CD2-CG2 4.23Å; V325-P331 HydrophobicContact CG1-CG 3.67Å; V325-L333 HydrophobicContact CB-CD2 4.31Å; V325-L333 HydrophobicContact CG1-CD2 4.21Å; V325-L333 HydrophobicContact CG2-CD2 4.05Å; V325-I358 CarbonylContact O-C 3.35Å; V325-I358 WeakPolarHBondContact O-CA 3.45Å; V325-S359 PolarHBondContact N-O 2.96Å; V325-S359 PolarHBondContact O-N 2.86Å; V325-L378 HydrophobicContact CG2-CD2 3.7Å; V325-A380 HydrophobicContact CG1-CB 3.49Å; V325-A380 VanDerWaalsContact CG1-CB 3.49Å; V325-A380 HydrophobicContact CG2-CB 4.29Å
326	R	94.4	Very high	90.9	Very high	91 Å²	91	39.3 Å²	39.3	34%	0.343	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	148.7	168.9	-67.9	-172.8	179	173.4	1.4	111.1	Y303 P305 R306 V308 E357 I358	Y303-R326 HydrophobicContact CE2-CB 4.31Å; P305-R326 CarbonylContact C-O 3.54Å; P305-R326 VanDerWaalsContact CA-O 3.23Å; P305-R326 WeakPolarHBondContact CA-O 3.35Å; R306-R326 PolarHBondContact N-O 3.38Å; R306-R326 PolarHBondContact O-N 2.79Å; V308-R326 HydrophobicContact CG2-CB 4.29Å; V308-R326 HydrophobicContact CG2-CG 3.84Å; R326-E357 CarbonylContact C-O 3.55Å; R326-E357 VanDerWaalsContact CA-O 3.31Å; R326-E357 WeakPolarHBondContact CA-O 3.4Å; R326-I358 HydrophobicContact CG-CG1 4.18Å; R326-I358 HydrophobicContact CG-CG2 4.5Å
327	G	94.5	Very high	92.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.6	137.6	173.2	0	0	0	0	0	112.5	Y303 P329 P330 E357	Y303-G327 VanDerWaalsContact CE2-CA 3.45Å; G327-P329 CarbonylContact C-O 3.54Å; G327-P329 CarbonylContact O-C 3.55Å; G327-P330 WeakPolarHBondContact O-CA 3.48Å; G327-E357 PolarHBondContact N-O 3.1Å; G327-E357 WeakPolarHBondContact O-CA 3.5Å
328	N	95.4	Very high	93.3	Very high	20 Å²	20	35.6 Å²	35.6	11%	0.107	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	115	175.8	-170.5	13.2	0	0	0	110.3	N278 V301 Y302 Y303 E357 L384	N278-N328 PolarHBondContact ND2-ND2 3.49Å; N278-N328 PolarHBondContact OD1-ND2 2.86Å; V301-N328 PolarHBondContact O-ND2 2.97Å; Y302-N328 CarbonylContact C-O 3.53Å; Y302-N328 VanDerWaalsContact CA-O 3.26Å; Y302-N328 WeakPolarHBondContact CA-O 3.47Å; Y302-N328 HydrophobicContact CD1-CB 4.32Å; Y302-N328 WeakPolarHBondContact CD1-O 3.42Å; Y302-N328 WeakPolarHBondContact CD1-OD1 3.25Å; Y302-N328 WeakPolarHBondContact CE1-OD1 3.21Å; Y303-N328 HydrophobicContact CD1-CB 3.82Å; Y303-N328 HydrophobicContact CE1-CB 3.51Å; Y303-N328 PolarHBondContact N-O 2.74Å; Y303-N328 PolarHBondContact O-N 3.42Å; N328-E357 HydrophobicContact CB-CB 4.19Å; N328-L384 WeakPolarHBondContact O-CD1 3.13Å
329	P	94.2	Very high	93.7	Very high	38 Å²	38	35.6 Å²	35.6	25%	0.247	20%	0.195	C	C	.	.	S	Bend	cis	-63.6	158.9	3.2	-22.5	34.4	0	0	0	113.7	Y302 G327 N382	Y302-P329 HydrophobicContact CD1-CG 3.99Å; Y302-P329 HydrophobicContact CE1-CG 3.83Å; G327-P329 CarbonylContact C-O 3.54Å; G327-P329 CarbonylContact O-C 3.55Å; P329-N382 VanDerWaalsContact O-CB 3.31Å; P329-N382 WeakPolarHBondContact O-CB 3.28Å; P329-N382 PolarHBondContact O-ND2 2.9Å
330	P	91.6	Very high	94	Very high	53 Å²	53	40.7 Å²	40.7	34%	0.344	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-58.9	135.6	-174.4	-25.1	36.1	0	0	0	112.5	G327 Q354 G356	G327-P330 WeakPolarHBondContact O-CA 3.48Å; P330-Q354 HydrophobicContact CB-CG 4.26Å; P330-G356 WeakPolarHBondContact CG-O 3.41Å
331	P	92.7	Very high	94.1	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.006	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-83.1	141.4	-173.3	30.6	-33	0	0	0	113.6	P305 V325 L333 A380 K381 N382	P305-P331 HydrophobicContact CB-CB 3.94Å; P305-P331 HydrophobicContact CB-CG 4.33Å; P305-P331 HydrophobicContact CG-CB 3.9Å; V325-P331 HydrophobicContact CG1-CG 3.67Å; P331-L333 HydrophobicContact CB-CD2 4.49Å; P331-L333 HydrophobicContact CG-CD2 4.35Å; P331-A380 HydrophobicContact CB-CB 4.15Å; P331-A380 HydrophobicContact CG-CB 4.49Å; P331-K381 CarbonylContact C-O 3.51Å; P331-K381 VanDerWaalsContact CA-O 3.26Å; P331-K381 WeakPolarHBondContact CA-O 3.5Å; P331-N382 HydrophobicContact CB-CB 4.4Å
332	T	93.9	Very high	94	Very high	76 Å²	76	46.2 Å²	46.2	47%	0.466	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	134.3	163.7	56.6	0	0	0	0	110.1	K381	T332-K381 PolarHBondContact N-O 3.2Å; T332-K381 PolarHBondContact O-N 3.2Å; T332-K381 PolarHBondContact OG1-O 2.85Å; T332-K381 VanDerWaalsContact OG1-O 3.1Å
333	L	94.7	Very high	93.8	Very high	20 Å²	20	54.7 Å²	54.7	11%	0.105	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.8	-176.4	-55.1	-175.9	0	0	0	112	F323 V325 P331 Y352 L378 I379 A380	F323-L333 HydrophobicContact CD2-CD1 4.37Å; F323-L333 HydrophobicContact CE2-CD1 3.41Å; F323-L333 VanDerWaalsContact CE2-CD1 3.41Å; F323-L333 HydrophobicContact CZ-CD1 3.93Å; V325-L333 HydrophobicContact CB-CD2 4.31Å; V325-L333 HydrophobicContact CG1-CD2 4.21Å; V325-L333 HydrophobicContact CG2-CD2 4.05Å; P331-L333 HydrophobicContact CB-CD2 4.49Å; P331-L333 HydrophobicContact CG-CD2 4.35Å; L333-Y352 HydrophobicContact CD1-CD1 4.5Å; L333-Y352 HydrophobicContact CD1-CD2 3.98Å; L333-Y352 HydrophobicContact CD1-CE1 4.45Å; L333-Y352 HydrophobicContact CD1-CE2 3.94Å; L333-Y352 HydrophobicContact CD1-CG 4.27Å; L333-Y352 HydrophobicContact CG-CE2 4.5Å; L333-L378 HydrophobicContact CB-CD1 4.29Å; L333-L378 HydrophobicContact CD2-CD1 4.44Å; L333-I379 CarbonylContact C-O 3.58Å; L333-I379 WeakPolarHBondContact CA-O 3.33Å; L333-A380 HydrophobicContact CD2-CB 3.6Å
334	H	94.3	Very high	93.5	Very high	112 Å²	112	60.7 Å²	60.7	52%	0.519	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	151.1	175.8	-58.9	-43.3	0	0	0	110.7	I379	H334-I379 PolarHBondContact N-O 2.03Å; H334-I379 PolarHBondContact O-N 2.72Å
335	W	96	Very high	93.2	Very high	17 Å²	17	62.3 Å²	62.3	6%	0.064	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	143.2	179.2	-72.7	88.9	0	0	0	112.6	L310 I321 F323 L342 V350 L363 T377 L378	L310-W335 HydrophobicContact CD1-CH2 3.53Å; L310-W335 HydrophobicContact CD1-CZ3 3.99Å; I321-W335 HydrophobicContact CG2-CH2 3.72Å; I321-W335 HydrophobicContact CG2-CZ3 4.13Å; F323-W335 HydrophobicContact CD1-CH2 4.23Å; F323-W335 AromaticContact CD1-CZ2 3.52Å; F323-W335 HydrophobicContact CD1-CZ2 3.52Å; F323-W335 AromaticContact CE1-CZ2 3.75Å; F323-W335 HydrophobicContact CE1-CZ2 3.75Å; F323-W335 HydrophobicContact CG-CZ2 4.17Å; W335-L342 HydrophobicContact CB-CB 3.86Å; W335-L342 HydrophobicContact CB-CD2 3.77Å; W335-L342 HydrophobicContact CB-CG 4.45Å; W335-L342 HydrophobicContact CG-CD2 4.37Å; W335-L342 WeakPolarHBondContact O-CB 3.29Å; W335-L342 PolarHBondContact O-N 2.99Å; W335-V350 VanDerWaalsContact CD1-CG2 3.46Å; W335-V350 HydrophobicContact CG-CG2 4.45Å; W335-L363 HydrophobicContact CD2-CB 4.37Å; W335-L363 HydrophobicContact CD2-CD2 3.82Å; W335-L363 HydrophobicContact CE3-CD2 3.7Å; W335-L363 HydrophobicContact CG-CD2 4.36Å; W335-L363 HydrophobicContact CH2-CB 3.94Å; W335-L363 HydrophobicContact CH2-CD2 4.27Å; W335-L363 HydrophobicContact CZ2-CB 3.63Å; W335-L363 HydrophobicContact CZ2-CD2 4.4Å; W335-L363 HydrophobicContact CZ3-CB 4.46Å; W335-L363 HydrophobicContact CZ3-CD2 3.93Å; W335-T377 CarbonylContact C-O 3.11Å; W335-T377 WeakPolarHBondContact CA-O 3.37Å; W335-L378 HydrophobicContact CD2-CB 4.34Å; W335-L378 HydrophobicContact CD2-CD1 4.21Å; W335-L378 HydrophobicContact CE3-CB 4.11Å; W335-L378 HydrophobicContact CH2-CB 3.98Å; W335-L378 HydrophobicContact CZ2-CB 4.16Å; W335-L378 HydrophobicContact CZ2-CD1 3.95Å; W335-L378 HydrophobicContact CZ2-CD2 4.36Å; W335-L378 HydrophobicContact CZ2-CG 4.39Å; W335-L378 HydrophobicContact CZ3-CB 3.93Å
336	L	96.2	Very high	92.6	Very high	41 Å²	41	71.9 Å²	71.9	22%	0.215	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	147.8	164.2	-48	-179.4	0	0	0	110.1	Q340 P341 Y376 T377 I379	L336-Q340 CarbonylContact C-O 3.57Å; L336-Q340 WeakPolarHBondContact CA-O 3.14Å; L336-Q340 WeakPolarHBondContact CB-O 3.34Å; L336-P341 HydrophobicContact CD2-CB 4.45Å; L336-P341 HydrophobicContact CD2-CG 4.29Å; L336-Y376 CarbonylContact O-C 3.5Å; L336-Y376 WeakPolarHBondContact O-CA 3.26Å; L336-T377 PolarHBondContact N-O 3.02Å; L336-T377 PolarHBondContact O-N 2.91Å; L336-I379 HydrophobicContact CD1-CD1 3.84Å; L336-I379 HydrophobicContact CD2-CD1 4.33Å; L336-I379 HydrophobicContact CG-CD1 3.87Å
337	H	94.3	Very high	92.1	Very high	37 Å²	37	71.8 Å²	71.8	17%	0.171	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.1	165.8	177.1	-135.8	0	0	0	108.6	G339 Q340 L342 N372 N373 N375 Y376	H337-G339 PolarHBondContact O-N 3.24Å; H337-G339 VanDerWaalsContact O-N 3.13Å; H337-Q340 PolarHBondContact N-O 2.96Å; H337-Q340 PolarHBondContact O-N 3.28Å; H337-L342 HydrophobicContact CB-CD1 3.96Å; H337-N372 PolarHBondContact NE2-O 3.49Å; H337-N373 PolarHBondContact NE2-O 2.92Å; H337-N375 CarbonylContact C-O 2.98Å; H337-N375 WeakPolarHBondContact CA-O 3.45Å; H337-Y376 HydrophobicContact CB-CD1 4.14Å; H337-Y376 HydrophobicContact CB-CE1 3.8Å; H337-Y376 AromaticContact CD2-CE1 3.47Å; H337-Y376 VanDerWaalsContact CD2-CE1 3.47Å; H337-Y376 WeakPolarHBondContact CD2-CE1 3.32Å; H337-Y376 AromaticContact CD2-CE2 3.58Å; H337-Y376 AromaticContact CD2-CZ 3.22Å; H337-Y376 PolarHBondContact CD2-OH 3.34Å; H337-Y376 AromaticContact CG-CE1 3.71Å; H337-Y376 AromaticContact CG-CZ 3.82Å; H337-Y376 AromaticContact NE2-CE2 3.8Å; H337-Y376 AromaticContact NE2-CZ 3.49Å; H337-Y376 PolarHBondContact NE2-OH 3.13Å
338	N	93.1	Very high	92	Very high	92 Å²	92	72.6 Å²	72.6	49%	0.492	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.9	-175	-63.7	-36.7	0	0	0	113.3	Q340 G374 N375	N338-Q340 VanDerWaalsContact C-N 3.31Å; N338-Q340 PolarHBondContact O-N 3.23Å; N338-G374 WeakPolarHBondContact OD1-CA 3.31Å; N338-N375 PolarHBondContact N-O 3.25Å; N338-N375 PolarHBondContact OD1-N 2.71Å
339	G	92.6	Very high	91.8	Very high	49 Å²	49	73.7 Å²	73.7	51%	0.505	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	-1.9	179.4	0	0	0	0	0	115.9	H337	H337-G339 PolarHBondContact O-N 3.24Å; H337-G339 VanDerWaalsContact O-N 3.13Å
340	Q	94	Very high	91.7	Very high	138 Å²	138	73.2 Å²	73.2	65%	0.645	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	148.1	175.8	-63.4	-58.8	-41.4	0	0	111.2	L336 H337 N338 L342	L336-Q340 CarbonylContact C-O 3.57Å; L336-Q340 WeakPolarHBondContact CA-O 3.14Å; L336-Q340 WeakPolarHBondContact CB-O 3.34Å; H337-Q340 PolarHBondContact N-O 2.96Å; H337-Q340 PolarHBondContact O-N 3.28Å; N338-Q340 VanDerWaalsContact C-N 3.31Å; N338-Q340 PolarHBondContact O-N 3.23Å; Q340-L342 PolarHBondContact O-N 3.33Å
341	P	94.2	Very high	91.5	Very high	92 Å²	92	75 Å²	75	60%	0.597	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	123.1	176.3	-26.4	35.4	0	0	0	112.1	L336 R343	L336-P341 HydrophobicContact CD2-CB 4.45Å; L336-P341 HydrophobicContact CD2-CG 4.29Å; P341-R343 PolarHBondContact O-N 3.35Å
342	L	92.4	Very high	91.3	Very high	29 Å²	29	79.8 Å²	79.8	15%	0.152	40%	0.397	C	S	.	.			trans	-66.9	125.9	179.9	179.1	60.6	0	0	0	109.4	W335 H337 Q340 I348 L363 Y376	W335-L342 HydrophobicContact CB-CB 3.86Å; W335-L342 HydrophobicContact CB-CD2 3.77Å; W335-L342 HydrophobicContact CB-CG 4.45Å; W335-L342 HydrophobicContact CG-CD2 4.37Å; W335-L342 WeakPolarHBondContact O-CB 3.29Å; W335-L342 PolarHBondContact O-N 2.99Å; H337-L342 HydrophobicContact CB-CD1 3.96Å; Q340-L342 PolarHBondContact O-N 3.33Å; L342-I348 HydrophobicContact CD1-CD1 4.47Å; L342-I348 HydrophobicContact CD1-CG2 4.13Å; L342-I348 HydrophobicContact CD2-CG2 4Å; L342-I348 HydrophobicContact CG-CG2 4.42Å; L342-L363 HydrophobicContact CD2-CD1 3.58Å; L342-L363 HydrophobicContact CD2-CD2 3.58Å; L342-L363 HydrophobicContact CD2-CG 4.23Å; L342-Y376 HydrophobicContact CD1-CE1 4.29Å; L342-Y376 HydrophobicContact CD2-CD1 4.37Å; L342-Y376 HydrophobicContact CD2-CE1 4.25Å
343	R	88.5	Confident	90.8	Very high	222 Å²	222	83.2 Å²	83.2	84%	0.838	40%	0.403	S	S	*	.			trans	-90.7	109.6	176.2	-67.8	-174.7	-179.7	-175	0.8	109.8	P341	P341-R343 PolarHBondContact O-N 3.35Å
344	E	87.5	Confident	90.1	Very high	125 Å²	125	86.4 Å²	86.4	58%	0.584	42%	0.417	S	S	*	.			trans	-63.6	144.3	173.6	-64.8	-172.6	-109.5	0	0	111.8	I348 V350	E344-I348 CarbonylContact C-O 3.52Å; E344-I348 VanDerWaalsContact CA-O 3.25Å; E344-I348 WeakPolarHBondContact CA-O 3.4Å; E344-V350 HydrophobicContact CG-CG2 4.47Å; E344-V350 PolarHBondContact OE2-N 2.95Å
345	S	87.1	Confident	89.2	Confident	56 Å²	56	84.5 Å²	84.5	39%	0.392	41%	0.409	S	S	.	.			trans	-157.7	175.5	-173.3	68.3	0	0	0	0	109.7	I347 I348	S345-I347 PolarHBondContact O-N 2.85Å; S345-I347 PolarHBondContact OG-N 2.97Å; S345-I348 PolarHBondContact N-O 3.5Å; S345-I348 CarbonylContact O-C 3.46Å; S345-I348 PolarHBondContact O-N 2.75Å; S345-I348 PolarHBondContact OG-N 2.74Å; S345-I348 VanDerWaalsContact OG-N 3.16Å
346	K	83.4	Confident	88.5	Confident	200 Å²	200	86.5 Å²	86.5	87%	0.87	43%	0.434	S	S	*	.	S	Bend	trans	-65.1	-7	172.9	-61	-173.1	179.6	-177.7	0	114.5
347	I	83.8	Confident	88	Confident	90 Å²	90	86 Å²	86	46%	0.462	43%	0.431	S	S	.	.	S	Bend	trans	-103.9	-34.1	179.7	-60.8	175	0	0	0	110.5	S345 F365 N366	S345-I347 PolarHBondContact O-N 2.85Å; S345-I347 PolarHBondContact OG-N 2.97Å; I347-F365 CarbonylContact O-C 3.56Å; I347-F365 WeakPolarHBondContact O-CA 3.4Å; I347-N366 PolarHBondContact O-N 3.25Å
348	I	91.8	Very high	87.7	Confident	16 Å²	16	86.4 Å²	86.4	8%	0.082	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	114.9	-176.2	-47.8	178.8	0	0	0	108.2	L342 E344 S345 L363 L364 F365	L342-I348 HydrophobicContact CD1-CD1 4.47Å; L342-I348 HydrophobicContact CD1-CG2 4.13Å; L342-I348 HydrophobicContact CD2-CG2 4Å; L342-I348 HydrophobicContact CG-CG2 4.42Å; E344-I348 CarbonylContact C-O 3.52Å; E344-I348 VanDerWaalsContact CA-O 3.25Å; E344-I348 WeakPolarHBondContact CA-O 3.4Å; S345-I348 PolarHBondContact N-O 3.5Å; S345-I348 CarbonylContact O-C 3.46Å; S345-I348 PolarHBondContact O-N 2.75Å; S345-I348 PolarHBondContact OG-N 2.74Å; S345-I348 VanDerWaalsContact OG-N 3.16Å; I348-L363 HydrophobicContact CG2-CD1 3.92Å; I348-L364 VanDerWaalsContact CA-O 3.3Å; I348-L364 WeakPolarHBondContact CA-O 3.43Å; I348-F365 HydrophobicContact CB-CD1 4.35Å; I348-F365 HydrophobicContact CB-CE1 4.47Å; I348-F365 HydrophobicContact CD1-CD1 4.13Å; I348-F365 HydrophobicContact CD1-CE1 4.11Å; I348-F365 HydrophobicContact CG1-CD1 3.84Å; I348-F365 HydrophobicContact CG1-CE1 4.17Å; I348-F365 HydrophobicContact CG2-CD1 3.85Å; I348-F365 HydrophobicContact CG2-CE1 3.57Å; I348-F365 HydrophobicContact CG2-CZ 4.19Å
349	H	91	Very high	87.5	Confident	44 Å²	44	82 Å²	82	20%	0.204	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	155.5	-176.3	61.8	-59.2	0	0	0	111.1	E318 E351 L364	E318-H349 IonicContact OE2-CE1 3.23Å; E318-H349 PolarHBondContact OE2-CE1 3.25Å; H349-E351 IonicContact CD2-OE1 3.56Å; H349-E351 IonicContact NE2-OE1 3.45Å; H349-L364 PolarHBondContact N-O 3.44Å; H349-L364 VanDerWaalsContact N-O 3.11Å; H349-L364 PolarHBondContact O-N 3.24Å
350	V	91.8	Very high	87.5	Confident	28 Å²	28	84.3 Å²	84.3	17%	0.17	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.2	177.3	-164.1	0	0	0	0	109.5	F323 W335 E344 Y352 L363	F323-V350 HydrophobicContact CE1-CG1 3.98Å; F323-V350 HydrophobicContact CZ-CG1 3.98Å; W335-V350 VanDerWaalsContact CD1-CG2 3.46Å; W335-V350 HydrophobicContact CG-CG2 4.45Å; E344-V350 HydrophobicContact CG-CG2 4.47Å; E344-V350 PolarHBondContact OE2-N 2.95Å; V350-Y352 HydrophobicContact CG1-CD1 3.85Å; V350-L363 HydrophobicContact CG2-CD1 3.76Å
351	E	88	Confident	87.3	Confident	89 Å²	89	78.4 Å²	78.4	42%	0.416	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120	167.6	-69.5	-167.2	156.2	0	0	108.8	H349 G361 C362 L364	H349-E351 IonicContact CD2-OE1 3.56Å; H349-E351 IonicContact NE2-OE1 3.45Å; E351-G361 CarbonylContact O-C 3.6Å; E351-G361 VanDerWaalsContact O-CA 3.3Å; E351-G361 WeakPolarHBondContact O-CA 3.31Å; E351-C362 PolarHBondContact N-O 3.35Å; E351-C362 PolarHBondContact O-N 3.48Å; E351-L364 HydrophobicContact CB-CD1 3.96Å; E351-L364 HydrophobicContact CG-CD1 3.8Å; E351-L364 WeakPolarHBondContact OE2-CD1 3.38Å
352	Y	89.1	Confident	87.2	Confident	102 Å²	102	75.2 Å²	75.2	40%	0.4	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	151.1	179.8	74.9	-85.5	0	0	0	112	F323 L333 V350 Q354 E360	F323-Y352 HydrophobicContact CZ-CD1 4.46Å; F323-Y352 HydrophobicContact CZ-CG 4.13Å; L333-Y352 HydrophobicContact CD1-CD1 4.5Å; L333-Y352 HydrophobicContact CD1-CD2 3.98Å; L333-Y352 HydrophobicContact CD1-CE1 4.45Å; L333-Y352 HydrophobicContact CD1-CE2 3.94Å; L333-Y352 HydrophobicContact CD1-CG 4.27Å; L333-Y352 HydrophobicContact CG-CE2 4.5Å; V350-Y352 HydrophobicContact CG1-CD1 3.85Å; Y352-Q354 HydrophobicContact CE2-CB 4.41Å; Y352-E360 CarbonylContact C-O 3.25Å; Y352-E360 VanDerWaalsContact CA-O 3.29Å; Y352-E360 WeakPolarHBondContact CA-O 3.42Å; Y352-E360 WeakPolarHBondContact CB-O 3.39Å
353	Y	82.1	Confident	87.3	Confident	149 Å²	149	73.9 Å²	73.9	58%	0.584	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.1	146.8	171.9	-171.3	-118.7	0	0	0	109.3	E355 S359 E360	Y353-E355 HydrophobicContact CD1-CB 4.03Å; Y353-E355 HydrophobicContact CE1-CB 3.58Å; Y353-E355 HydrophobicContact CE1-CG 3.77Å; Y353-S359 CarbonylContact O-C 3.48Å; Y353-S359 WeakPolarHBondContact O-CA 3.34Å; Y353-E360 PolarHBondContact N-O 2.79Å; Y353-E360 PolarHBondContact O-N 2.89Å
354	Q	81.5	Confident	87.5	Confident	87 Å²	87	64.2 Å²	64.2	41%	0.407	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	107.4	178	-174.1	-174.4	-66.5	0	0	108.5	P330 Y352 I358	P330-Q354 HydrophobicContact CB-CG 4.26Å; Y352-Q354 HydrophobicContact CE2-CB 4.41Å; Q354-I358 CarbonylContact C-O 3.59Å; Q354-I358 WeakPolarHBondContact CA-O 3.12Å
355	E	75.5	Confident	87.7	Confident	71 Å²	71	58.3 Å²	58.3	33%	0.332	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	106.9	-179.3	-150.7	175.1	-175.7	0	0	109.8	Y353 E357 I358 H482	Y353-E355 HydrophobicContact CD1-CB 4.03Å; Y353-E355 HydrophobicContact CE1-CB 3.58Å; Y353-E355 HydrophobicContact CE1-CG 3.77Å; E355-E357 PolarHBondContact O-N 3.33Å; E355-I358 PolarHBondContact N-O 2.99Å; E355-I358 PolarHBondContact O-N 2.82Å; E355-H482 IonicContact OE1-CD2 3.51Å; E355-H482 IonicContact OE1-CE1 2.76Å; E355-H482 IonicContact OE1-NE2 2.66Å; E355-H482 PolarHBondContact OE1-NE2 2.9Å; E355-H482 IonicContact OE2-CE1 3.48Å; E355-H482 PolarHBondContact OE2-CE1 2.95Å; E355-H482 IonicContact OE2-NE2 3.74Å; E355-H482 PolarHBondContact OE2-NE2 3.36Å
356	G	80.4	Confident	87.8	Confident	59 Å²	59	58.6 Å²	58.6	61%	0.608	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	-116	-172.3	0	0	0	0	0	111.2	P330	P330-G356 WeakPolarHBondContact CG-O 3.41Å
357	E	86.1	Confident	87.8	Confident	31 Å²	31	57.5 Å²	57.5	15%	0.145	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-5.8	-178.6	66.5	-165.3	165.2	0	0	115	N278 Y303 R326 G327 N328 E355	N278-E357 PolarHBondContact ND2-OE2 3.37Å; Y303-E357 WeakPolarHBondContact CE1-OE2 3.4Å; Y303-E357 WeakPolarHBondContact OH-CB 3.47Å; Y303-E357 WeakPolarHBondContact OH-CG 3.46Å; Y303-E357 PolarHBondContact OH-OE2 3.35Å; R326-E357 CarbonylContact C-O 3.55Å; R326-E357 VanDerWaalsContact CA-O 3.31Å; R326-E357 WeakPolarHBondContact CA-O 3.4Å; G327-E357 PolarHBondContact N-O 3.1Å; G327-E357 WeakPolarHBondContact O-CA 3.5Å; N328-E357 HydrophobicContact CB-CB 4.19Å; E355-E357 PolarHBondContact O-N 3.33Å
358	I	87.8	Confident	88.1	Confident	46 Å²	46	53.5 Å²	53.5	24%	0.236	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.1	-176.4	-46.2	-169.7	0	0	0	109.9	V324 V325 R326 Q354 E355	V324-I358 HydrophobicContact CG1-CG2 3.96Å; V325-I358 CarbonylContact O-C 3.35Å; V325-I358 WeakPolarHBondContact O-CA 3.45Å; R326-I358 HydrophobicContact CG-CG1 4.18Å; R326-I358 HydrophobicContact CG-CG2 4.5Å; Q354-I358 CarbonylContact C-O 3.59Å; Q354-I358 WeakPolarHBondContact CA-O 3.12Å; E355-I358 PolarHBondContact N-O 2.99Å; E355-I358 PolarHBondContact O-N 2.82Å
359	S	89.8	Confident	87.9	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	114.5	169.6	-54.6	0	0	0	0	109.4	V325 Y353	V325-S359 PolarHBondContact N-O 2.96Å; V325-S359 PolarHBondContact O-N 2.86Å; Y353-S359 CarbonylContact O-C 3.48Å; Y353-S359 WeakPolarHBondContact O-CA 3.34Å
360	E	91.2	Very high	87.7	Confident	97 Å²	97	55.2 Å²	55.2	45%	0.453	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	137.5	-176.1	173.1	173.4	-127	0	0	110.2	F323 V324 Y352 Y353	F323-E360 WeakPolarHBondContact O-CA 3.5Å; V324-E360 HydrophobicContact CG2-CB 4.23Å; V324-E360 HydrophobicContact CG2-CG 3.93Å; Y352-E360 CarbonylContact C-O 3.25Å; Y352-E360 VanDerWaalsContact CA-O 3.29Å; Y352-E360 WeakPolarHBondContact CA-O 3.42Å; Y352-E360 WeakPolarHBondContact CB-O 3.39Å; Y353-E360 PolarHBondContact N-O 2.79Å; Y353-E360 PolarHBondContact O-N 2.89Å
361	G	90.9	Very high	87.5	Confident	13 Å²	13	62.5 Å²	62.5	13%	0.134	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.3	-167.1	179.8	0	0	0	0	0	116.2	E322 F323 E351	E322-G361 WeakPolarHBondContact CA-O 3.29Å; F323-G361 WeakPolarHBondContact CD1-O 3.32Å; F323-G361 VanDerWaalsContact CE1-C 3.45Å; F323-G361 PolarHBondContact N-O 3.02Å; F323-G361 PolarHBondContact O-N 3.44Å; E351-G361 CarbonylContact O-C 3.6Å; E351-G361 VanDerWaalsContact O-CA 3.3Å; E351-G361 WeakPolarHBondContact O-CA 3.31Å
362	C	92.4	Very high	87.6	Confident	26 Å²	26	59.6 Å²	59.6	18%	0.176	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	136.4	179.4	-77	0	0	0	0	110.5	C320 I321 E351 L364	C320-C362 HydrophobicContact CB-CB 3.81Å; C320-C362 WeakPolarHBondContact CB-SG 3.4Å; C320-C362 WeakPolarHBondContact SG-CB 3.33Å; C320-C362 CovalentContact SG-SG 2.03Å; C320-C362 PolarHBondContact SG-SG 3.41Å; I321-C362 WeakPolarHBondContact O-CA 3.34Å; E351-C362 PolarHBondContact N-O 3.35Å; E351-C362 PolarHBondContact O-N 3.48Å; C362-L364 HydrophobicContact CB-CD2 3.57Å; C362-L364 HydrophobicContact CB-CG 3.72Å
363	L	94.7	Very high	87.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	111.5	149.6	174.8	68.4	0	0	0	107.6	I321 W335 L342 I348 V350 F365 Y376	I321-L363 HydrophobicContact CB-CB 4.28Å; I321-L363 HydrophobicContact CD1-CD2 4.47Å; I321-L363 PolarHBondContact N-O 2.84Å; I321-L363 PolarHBondContact O-N 3.1Å; W335-L363 HydrophobicContact CD2-CB 4.37Å; W335-L363 HydrophobicContact CD2-CD2 3.82Å; W335-L363 HydrophobicContact CE3-CD2 3.7Å; W335-L363 HydrophobicContact CG-CD2 4.36Å; W335-L363 HydrophobicContact CH2-CB 3.94Å; W335-L363 HydrophobicContact CH2-CD2 4.27Å; W335-L363 HydrophobicContact CZ2-CB 3.63Å; W335-L363 HydrophobicContact CZ2-CD2 4.4Å; W335-L363 HydrophobicContact CZ3-CB 4.46Å; W335-L363 HydrophobicContact CZ3-CD2 3.93Å; L342-L363 HydrophobicContact CD2-CD1 3.58Å; L342-L363 HydrophobicContact CD2-CD2 3.58Å; L342-L363 HydrophobicContact CD2-CG 4.23Å; I348-L363 HydrophobicContact CG2-CD1 3.92Å; V350-L363 HydrophobicContact CG2-CD1 3.76Å; L363-F365 HydrophobicContact CB-CE2 4.35Å; L363-F365 HydrophobicContact CD2-CE1 4.5Å; L363-F365 HydrophobicContact CD2-CE2 3.89Å; L363-F365 HydrophobicContact CD2-CZ 3.49Å; L363-F365 VanDerWaalsContact CD2-CZ 3.49Å; L363-F365 HydrophobicContact CG-CE2 3.67Å; L363-F365 HydrophobicContact CG-CZ 3.69Å; L363-F365 WeakPolarHBondContact O-CD2 3.43Å; L363-F365 VanDerWaalsContact O-CE2 3.3Å; L363-F365 WeakPolarHBondContact O-CE2 3.44Å; L363-Y376 HydrophobicContact CD2-CD1 3.61Å; L363-Y376 HydrophobicContact CD2-CE1 4.05Å; L363-Y376 HydrophobicContact CD2-CG 4.35Å
364	L	91.8	Very high	88.3	Confident	20 Å²	20	50 Å²	50	11%	0.105	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	139.6	-170.3	-69	173.2	0	0	0	112.4	E318 H319 C320 I348 H349 E351 C362	E318-L364 HydrophobicContact CB-CD2 4.46Å; H319-L364 CarbonylContact O-C 3.6Å; H319-L364 WeakPolarHBondContact O-CA 3.07Å; C320-L364 HydrophobicContact CB-CD2 3.99Å; I348-L364 VanDerWaalsContact CA-O 3.3Å; I348-L364 WeakPolarHBondContact CA-O 3.43Å; H349-L364 PolarHBondContact N-O 3.44Å; H349-L364 VanDerWaalsContact N-O 3.11Å; H349-L364 PolarHBondContact O-N 3.24Å; E351-L364 HydrophobicContact CB-CD1 3.96Å; E351-L364 HydrophobicContact CG-CD1 3.8Å; E351-L364 WeakPolarHBondContact OE2-CD1 3.38Å; C362-L364 HydrophobicContact CB-CD2 3.57Å; C362-L364 HydrophobicContact CB-CG 3.72Å
365	F	92.3	Very high	89	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	111.3	179.2	-55.4	-100.2	0	0	0	111.8	E318 H319 I321 I347 I348 L363 K367 P368 Y376 F395	E318-F365 WeakPolarHBondContact CB-O 3.49Å; H319-F365 HydrophobicContact CB-CB 4.24Å; H319-F365 PolarHBondContact N-O 3.05Å; H319-F365 VanDerWaalsContact N-O 3.09Å; H319-F365 PolarHBondContact O-N 3.2Å; I321-F365 HydrophobicContact CB-CE2 4.46Å; I321-F365 HydrophobicContact CD1-CE2 3.67Å; I321-F365 HydrophobicContact CD1-CZ 3.9Å; I321-F365 HydrophobicContact CG1-CE2 3.85Å; I347-F365 CarbonylContact O-C 3.56Å; I347-F365 WeakPolarHBondContact O-CA 3.4Å; I348-F365 HydrophobicContact CB-CD1 4.35Å; I348-F365 HydrophobicContact CB-CE1 4.47Å; I348-F365 HydrophobicContact CD1-CD1 4.13Å; I348-F365 HydrophobicContact CD1-CE1 4.11Å; I348-F365 HydrophobicContact CG1-CD1 3.84Å; I348-F365 HydrophobicContact CG1-CE1 4.17Å; I348-F365 HydrophobicContact CG2-CD1 3.85Å; I348-F365 HydrophobicContact CG2-CE1 3.57Å; I348-F365 HydrophobicContact CG2-CZ 4.19Å; L363-F365 HydrophobicContact CB-CE2 4.35Å; L363-F365 HydrophobicContact CD2-CE1 4.5Å; L363-F365 HydrophobicContact CD2-CE2 3.89Å; L363-F365 HydrophobicContact CD2-CZ 3.49Å; L363-F365 VanDerWaalsContact CD2-CZ 3.49Å; L363-F365 HydrophobicContact CG-CE2 3.67Å; L363-F365 HydrophobicContact CG-CZ 3.69Å; L363-F365 WeakPolarHBondContact O-CD2 3.43Å; L363-F365 VanDerWaalsContact O-CE2 3.3Å; L363-F365 WeakPolarHBondContact O-CE2 3.44Å; F365-K367 PolarHBondContact O-N 3.46Å; F365-P368 HydrophobicContact CB-CB 4.04Å; F365-P368 HydrophobicContact CB-CG 3.75Å; F365-P368 WeakPolarHBondContact O-CD 3.23Å; F365-Y376 AromaticContact CE1-CE1 3.73Å; F365-Y376 HydrophobicContact CE1-CE1 3.73Å; F365-Y376 HydrophobicContact CE1-CE2 4.29Å; F365-Y376 AromaticContact CE1-CZ 3.5Å; F365-Y376 VanDerWaalsContact CE1-OH 3.29Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.47Å; F365-Y376 HydrophobicContact CZ-CD1 4.07Å; F365-Y376 AromaticContact CZ-CE1 3.56Å; F365-Y376 HydrophobicContact CZ-CE1 3.56Å; F365-Y376 HydrophobicContact CZ-CE2 4.06Å; F365-Y376 AromaticContact CZ-CZ 3.55Å; F365-F395 HydrophobicContact CB-CE1 4.14Å; F365-F395 HydrophobicContact CB-CZ 4.41Å; F365-F395 HydrophobicContact CD1-CE1 4.27Å; F365-F395 HydrophobicContact CD1-CE2 4.18Å; F365-F395 AromaticContact CD1-CZ 3.69Å; F365-F395 HydrophobicContact CD1-CZ 3.69Å; F365-F395 AromaticContact CD2-CE1 3.74Å; F365-F395 HydrophobicContact CD2-CE1 3.74Å; F365-F395 AromaticContact CD2-CZ 3.6Å; F365-F395 HydrophobicContact CD2-CZ 3.6Å; F365-F395 HydrophobicContact CE1-CE2 4.12Å; F365-F395 AromaticContact CE1-CZ 3.73Å; F365-F395 HydrophobicContact CE1-CZ 3.73Å; F365-F395 HydrophobicContact CE2-CE1 4.18Å; F365-F395 AromaticContact CE2-CZ 3.64Å; F365-F395 HydrophobicContact CE2-CZ 3.64Å; F365-F395 AromaticContact CG-CE1 3.8Å; F365-F395 HydrophobicContact CG-CE1 3.8Å; F365-F395 AromaticContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CZ-CE2 4.38Å; F365-F395 AromaticContact CZ-CZ 3.69Å; F365-F395 HydrophobicContact CZ-CZ 3.69Å
366	N	88.6	Confident	90	Very high	63 Å²	63	46.4 Å²	46.4	34%	0.337	25%	0.245	S	C	.	.	S	Bend	trans	-81.2	105.7	175	-165.3	-46.8	0	0	0	110.5	E318 I347	E318-N366 HydrophobicContact CG-CB 4.41Å; E318-N366 WeakPolarHBondContact OE1-CB 3.17Å; E318-N366 PolarHBondContact OE1-ND2 3.28Å; I347-N366 PolarHBondContact O-N 3.25Å
367	K	84.3	Confident	90.7	Very high	177 Å²	177	44.4 Å²	44.4	77%	0.77	22%	0.221	S	C	*	.	S	Bend	trans	49	56.3	178.9	-60.9	174.1	-176.6	177	0	113.8	F365	F365-K367 PolarHBondContact O-N 3.46Å
368	P	89.1	Confident	91.3	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.032	21%	0.214	C	C	.	.			trans	-59.9	158.3	175.9	26	-34.5	0	0	0	112.3	H319 F365 N372 F395 L396	H319-P368 HydrophobicContact CB-CG 4.38Å; H319-P368 WeakPolarHBondContact ND1-CD 3.42Å; H319-P368 WeakPolarHBondContact ND1-CG 3.28Å; F365-P368 HydrophobicContact CB-CB 4.04Å; F365-P368 HydrophobicContact CB-CG 3.75Å; F365-P368 WeakPolarHBondContact O-CD 3.23Å; P368-N372 WeakPolarHBondContact CA-OD1 3.34Å; P368-N372 HydrophobicContact CB-CB 3.84Å; P368-F395 HydrophobicContact CB-CB 3.78Å; P368-F395 HydrophobicContact CB-CD1 3.78Å; P368-F395 HydrophobicContact CB-CD2 3.93Å; P368-F395 HydrophobicContact CB-CE1 4.31Å; P368-F395 HydrophobicContact CB-CE2 4.46Å; P368-F395 HydrophobicContact CB-CG 3.55Å; P368-F395 HydrophobicContact CG-CB 3.72Å; P368-F395 HydrophobicContact CG-CD1 3.26Å; P368-F395 HydrophobicContact CG-CD2 4.34Å; P368-F395 HydrophobicContact CG-CE1 3.89Å; P368-F395 HydrophobicContact CG-CG 3.51Å; P368-L396 WeakPolarHBondContact O-CD1 3.48Å
369	T	87.7	Confident	91.7	Very high	58 Å²	58	42.5 Å²	42.5	36%	0.356	21%	0.212	S	C	.	.			trans	-120.6	178.4	178.5	64.9	0	0	0	0	110.2	Y371 N372	T369-Y371 PolarHBondContact O-N 2.9Å; T369-Y371 VanDerWaalsContact O-N 3.16Å; T369-Y371 PolarHBondContact OG1-N 2.87Å; T369-N372 PolarHBondContact N-OD1 2.95Å; T369-N372 WeakPolarHBondContact O-CB 3.09Å; T369-N372 PolarHBondContact O-N 2.8Å; T369-N372 PolarHBondContact O-OD1 2.91Å; T369-N372 PolarHBondContact OG1-OD1 3.04Å
370	H	87.7	Confident	92	Very high	39 Å²	39	42.5 Å²	42.5	18%	0.181	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-58	-26.9	175.1	60.5	-87.4	0	0	0	113.2	N372 N373 L396 E398	H370-N372 PolarHBondContact O-N 3.44Å; H370-N373 VanDerWaalsContact O-CB 3.31Å; H370-N373 WeakPolarHBondContact O-CB 3.23Å; H370-N373 PolarHBondContact O-N 3.25Å; H370-L396 HydrophobicContact CB-CB 4.47Å; H370-L396 WeakPolarHBondContact CB-O 3.19Å; H370-E398 HydrophobicContact CB-CB 4.5Å
371	Y	87.3	Confident	92.3	Very high	181 Å²	181	43.4 Å²	43.4	71%	0.71	21%	0.214	S	C	*	.	G	3₁₀ helix	trans	-64.7	-17.8	172.3	-64.5	-66.8	0	0	0	114.3	T369	T369-Y371 PolarHBondContact O-N 2.9Å; T369-Y371 VanDerWaalsContact O-N 3.16Å; T369-Y371 PolarHBondContact OG1-N 2.87Å
372	N	90.5	Very high	92.5	Very high	27 Å²	27	43.2 Å²	43.2	14%	0.144	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-88.1	-7.3	175.1	-58	106.4	0	0	0	112.1	H337 P368 T369 H370 Y376 F395	H337-N372 PolarHBondContact NE2-O 3.49Å; P368-N372 WeakPolarHBondContact CA-OD1 3.34Å; P368-N372 HydrophobicContact CB-CB 3.84Å; T369-N372 PolarHBondContact N-OD1 2.95Å; T369-N372 WeakPolarHBondContact O-CB 3.09Å; T369-N372 PolarHBondContact O-N 2.8Å; T369-N372 PolarHBondContact O-OD1 2.91Å; T369-N372 PolarHBondContact OG1-OD1 3.04Å; H370-N372 PolarHBondContact O-N 3.44Å; N372-Y376 PolarHBondContact O-OH 3.45Å; N372-F395 HydrophobicContact CB-CD2 3.72Å; N372-F395 HydrophobicContact CB-CE2 3.95Å; N372-F395 WeakPolarHBondContact O-CE2 3.43Å
373	N	91.8	Very high	92.6	Very high	40 Å²	40	47.5 Å²	47.5	21%	0.214	24%	0.238	C	C	.	.			trans	-63.8	150	178.4	-64.2	-7.8	0	0	0	111.4	H337 H370 G393 F395 L396	H337-N373 PolarHBondContact NE2-O 2.92Å; H370-N373 VanDerWaalsContact O-CB 3.31Å; H370-N373 WeakPolarHBondContact O-CB 3.23Å; H370-N373 PolarHBondContact O-N 3.25Å; N373-G393 CarbonylContact C-O 3.59Å; N373-G393 WeakPolarHBondContact CA-O 3.41Å; N373-F395 PolarHBondContact OD1-N 2.77Å; N373-L396 PolarHBondContact ND2-O 2.9Å; N373-L396 PolarHBondContact OD1-N 2.78Å
374	G	93	Very high	92.6	Very high	11 Å²	11	50.4 Å²	50.4	11%	0.113	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	140	-171.1	170.9	0	0	0	0	0	114.1	N338 Y376 N392 G393	N338-G374 WeakPolarHBondContact OD1-CA 3.31Å; G374-Y376 VanDerWaalsContact O-CD2 3.3Å; G374-Y376 WeakPolarHBondContact O-CD2 3.27Å; G374-Y376 PolarHBondContact O-N 3.45Å; G374-N392 PolarHBondContact O-OD1 3.2Å; G374-G393 PolarHBondContact N-O 3.36Å; G374-G393 PolarHBondContact O-N 3.36Å
375	N	96	Very high	92.8	Very high	82 Å²	82	50.6 Å²	50.6	44%	0.439	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	119.3	-173.9	-70	-26	0	0	0	111	H337 N338 T390 I391	H337-N375 CarbonylContact C-O 2.98Å; H337-N375 WeakPolarHBondContact CA-O 3.45Å; N338-N375 PolarHBondContact N-O 3.25Å; N338-N375 PolarHBondContact OD1-N 2.71Å; N375-T390 HydrophobicContact CB-CG2 3.82Å; N375-I391 CarbonylContact C-O 3.57Å; N375-I391 WeakPolarHBondContact CA-O 3.42Å
376	Y	96	Very high	93	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.2	173.5	-72.8	-83.9	0	0	0	109.8	I321 L336 H337 L342 L363 F365 N372 G374 T390 I391 F395	I321-Y376 HydrophobicContact CD1-CD1 4.46Å; I321-Y376 HydrophobicContact CD1-CD2 3.67Å; I321-Y376 HydrophobicContact CD1-CE2 4.33Å; I321-Y376 HydrophobicContact CD1-CG 3.75Å; L336-Y376 CarbonylContact O-C 3.5Å; L336-Y376 WeakPolarHBondContact O-CA 3.26Å; H337-Y376 HydrophobicContact CB-CD1 4.14Å; H337-Y376 HydrophobicContact CB-CE1 3.8Å; H337-Y376 AromaticContact CD2-CE1 3.47Å; H337-Y376 VanDerWaalsContact CD2-CE1 3.47Å; H337-Y376 WeakPolarHBondContact CD2-CE1 3.32Å; H337-Y376 AromaticContact CD2-CE2 3.58Å; H337-Y376 AromaticContact CD2-CZ 3.22Å; H337-Y376 PolarHBondContact CD2-OH 3.34Å; H337-Y376 AromaticContact CG-CE1 3.71Å; H337-Y376 AromaticContact CG-CZ 3.82Å; H337-Y376 AromaticContact NE2-CE2 3.8Å; H337-Y376 AromaticContact NE2-CZ 3.49Å; H337-Y376 PolarHBondContact NE2-OH 3.13Å; L342-Y376 HydrophobicContact CD1-CE1 4.29Å; L342-Y376 HydrophobicContact CD2-CD1 4.37Å; L342-Y376 HydrophobicContact CD2-CE1 4.25Å; L363-Y376 HydrophobicContact CD2-CD1 3.61Å; L363-Y376 HydrophobicContact CD2-CE1 4.05Å; L363-Y376 HydrophobicContact CD2-CG 4.35Å; F365-Y376 AromaticContact CE1-CE1 3.73Å; F365-Y376 HydrophobicContact CE1-CE1 3.73Å; F365-Y376 HydrophobicContact CE1-CE2 4.29Å; F365-Y376 AromaticContact CE1-CZ 3.5Å; F365-Y376 VanDerWaalsContact CE1-OH 3.29Å; F365-Y376 WeakPolarHBondContact CE1-OH 3.47Å; F365-Y376 HydrophobicContact CZ-CD1 4.07Å; F365-Y376 AromaticContact CZ-CE1 3.56Å; F365-Y376 HydrophobicContact CZ-CE1 3.56Å; F365-Y376 HydrophobicContact CZ-CE2 4.06Å; F365-Y376 AromaticContact CZ-CZ 3.55Å; N372-Y376 PolarHBondContact O-OH 3.45Å; G374-Y376 VanDerWaalsContact O-CD2 3.3Å; G374-Y376 WeakPolarHBondContact O-CD2 3.27Å; G374-Y376 PolarHBondContact O-N 3.45Å; Y376-T390 CarbonylContact O-C 3.35Å; Y376-T390 VanDerWaalsContact O-CA 3.3Å; Y376-T390 WeakPolarHBondContact O-CA 3.19Å; Y376-I391 PolarHBondContact N-O 2.94Å; Y376-I391 PolarHBondContact O-N 2.87Å; Y376-F395 AromaticContact CE2-CE2 3.96Å; Y376-F395 HydrophobicContact CE2-CE2 3.96Å; Y376-F395 HydrophobicContact CE2-CZ 4.36Å
377	T	96.8	Very high	93.4	Very high	16 Å²	16	52.3 Å²	52.3	10%	0.098	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	116.9	179.1	-52.9	0	0	0	0	110	W335 L336 I379 N388 Q389 T390	W335-T377 CarbonylContact C-O 3.11Å; W335-T377 WeakPolarHBondContact CA-O 3.37Å; L336-T377 PolarHBondContact N-O 3.02Å; L336-T377 PolarHBondContact O-N 2.91Å; T377-I379 HydrophobicContact CG2-CG1 4.13Å; T377-N388 HydrophobicContact CG2-CB 4.16Å; T377-Q389 CarbonylContact C-O 3.52Å; T377-Q389 VanDerWaalsContact CA-O 3.3Å; T377-Q389 WeakPolarHBondContact CA-O 3.3Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.28Å; T377-T390 PolarHBondContact OG1-OG1 3.2Å
378	L	97	Very high	93.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	135.5	167	176.1	59.5	0	0	0	109.2	V307 L310 F323 V325 L333 W335 N388 Q389	V307-L378 HydrophobicContact CG1-CD2 4.28Å; L310-L378 HydrophobicContact CD1-CB 4.38Å; F323-L378 HydrophobicContact CB-CD2 3.67Å; F323-L378 HydrophobicContact CD2-CD2 3.73Å; F323-L378 HydrophobicContact CG-CD2 3.76Å; V325-L378 HydrophobicContact CG2-CD2 3.7Å; L333-L378 HydrophobicContact CB-CD1 4.29Å; L333-L378 HydrophobicContact CD2-CD1 4.44Å; W335-L378 HydrophobicContact CD2-CB 4.34Å; W335-L378 HydrophobicContact CD2-CD1 4.21Å; W335-L378 HydrophobicContact CE3-CB 4.11Å; W335-L378 HydrophobicContact CH2-CB 3.98Å; W335-L378 HydrophobicContact CZ2-CB 4.16Å; W335-L378 HydrophobicContact CZ2-CD1 3.95Å; W335-L378 HydrophobicContact CZ2-CD2 4.36Å; W335-L378 HydrophobicContact CZ2-CG 4.39Å; W335-L378 HydrophobicContact CZ3-CB 3.93Å; L378-N388 WeakPolarHBondContact O-CA 3.41Å; L378-N388 VanDerWaalsContact O-CB 3.3Å; L378-N388 WeakPolarHBondContact O-CB 3.39Å; L378-Q389 PolarHBondContact N-O 2.8Å; L378-Q389 PolarHBondContact O-N 3.42Å
379	I	97	Very high	94.3	Very high	37 Å²	37	52.6 Å²	52.6	19%	0.19	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	118.7	175.7	-55.4	-179.6	0	0	0	108.4	L333 H334 L336 T377 T386 A387 N388	L333-I379 CarbonylContact C-O 3.58Å; L333-I379 WeakPolarHBondContact CA-O 3.33Å; H334-I379 PolarHBondContact N-O 2.03Å; H334-I379 PolarHBondContact O-N 2.72Å; L336-I379 HydrophobicContact CD1-CD1 3.84Å; L336-I379 HydrophobicContact CD2-CD1 4.33Å; L336-I379 HydrophobicContact CG-CD1 3.87Å; T377-I379 HydrophobicContact CG2-CG1 4.13Å; I379-T386 HydrophobicContact CG2-CG2 3.68Å; I379-A387 WeakPolarHBondContact CA-O 3.47Å; I379-N388 HydrophobicContact CG1-CB 4Å
380	A	96.6	Very high	94.7	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.8	177.1	0	0	0	0	0	110.5	P305 V325 P331 L333 T386 A387	P305-A380 HydrophobicContact CB-CB 3.86Å; V325-A380 HydrophobicContact CG1-CB 3.49Å; V325-A380 VanDerWaalsContact CG1-CB 3.49Å; V325-A380 HydrophobicContact CG2-CB 4.29Å; P331-A380 HydrophobicContact CB-CB 4.15Å; P331-A380 HydrophobicContact CG-CB 4.49Å; L333-A380 HydrophobicContact CD2-CB 3.6Å; A380-T386 CarbonylContact O-C 3.57Å; A380-T386 VanDerWaalsContact O-CA 3.24Å; A380-T386 WeakPolarHBondContact O-CA 3.42Å; A380-T386 WeakPolarHBondContact O-CG2 3.37Å; A380-A387 PolarHBondContact N-O 2.8Å; A380-A387 PolarHBondContact O-N 2.83Å
381	K	96.4	Very high	95.1	Very high	116 Å²	116	52.8 Å²	52.8	50%	0.504	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	132.6	-175.1	178.9	170.2	-177.9	180	0	112.4	P331 T332 T386	P331-K381 CarbonylContact C-O 3.51Å; P331-K381 VanDerWaalsContact CA-O 3.26Å; P331-K381 WeakPolarHBondContact CA-O 3.5Å; T332-K381 PolarHBondContact N-O 3.2Å; T332-K381 PolarHBondContact O-N 3.2Å; T332-K381 PolarHBondContact OG1-O 2.85Å; T332-K381 VanDerWaalsContact OG1-O 3.1Å; K381-T386 HydrophobicContact CB-CG2 4.29Å; K381-T386 WeakPolarHBondContact CG-OG1 3.42Å
382	N	94.9	Very high	95.4	Very high	10 Å²	10	48.1 Å²	48.1	5%	0.053	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	-179.7	166.9	81.1	4.7	0	0	0	109.5	Y303 P305 P329 P331 L384 G385	Y303-N382 PolarHBondContact O-ND2 2.91Å; P305-N382 WeakPolarHBondContact CD-OD1 3.21Å; P305-N382 HydrophobicContact CG-CB 3.95Å; P329-N382 VanDerWaalsContact O-CB 3.31Å; P329-N382 WeakPolarHBondContact O-CB 3.28Å; P329-N382 PolarHBondContact O-ND2 2.9Å; P331-N382 HydrophobicContact CB-CB 4.4Å; N382-L384 PolarHBondContact O-N 2.87Å; N382-L384 VanDerWaalsContact O-N 3.09Å; N382-L384 WeakPolarHBondContact OD1-CA 3.38Å; N382-L384 WeakPolarHBondContact OD1-CB 3.2Å; N382-L384 PolarHBondContact OD1-N 2.56Å; N382-G385 PolarHBondContact N-O 2.74Å; N382-G385 VanDerWaalsContact N-O 3.12Å; N382-G385 PolarHBondContact O-N 2.64Å; N382-G385 VanDerWaalsContact O-O 3.05Å; N382-G385 PolarHBondContact OD1-N 3.3Å
383	P	95.8	Very high	95.4	Very high	116 Å²	116	46.9 Å²	46.9	75%	0.753	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-11.9	-179.5	-25.7	36.3	0	0	0	116.1
384	L	94.5	Very high	95.3	Very high	61 Å²	61	49.6 Å²	49.6	32%	0.319	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-19.5	-174.6	-57.3	165.2	0	0	0	112.7	P304 N328 N382	P304-L384 HydrophobicContact CB-CB 4.24Å; N328-L384 WeakPolarHBondContact O-CD1 3.13Å; N382-L384 PolarHBondContact O-N 2.87Å; N382-L384 VanDerWaalsContact O-N 3.09Å; N382-L384 WeakPolarHBondContact OD1-CA 3.38Å; N382-L384 WeakPolarHBondContact OD1-CB 3.2Å; N382-L384 PolarHBondContact OD1-N 2.56Å
385	G	94.7	Very high	95.1	Very high	23 Å²	23	49.8 Å²	49.8	24%	0.237	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179	-170.9	-179.3	0	0	0	0	0	114.8	N382	N382-G385 PolarHBondContact N-O 2.74Å; N382-G385 VanDerWaalsContact N-O 3.12Å; N382-G385 PolarHBondContact O-N 2.64Å; N382-G385 VanDerWaalsContact O-O 3.05Å; N382-G385 PolarHBondContact OD1-N 3.3Å
386	T	96.6	Very high	94.6	Very high	81 Å²	81	50.2 Å²	50.2	50%	0.497	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	132.5	175.9	-59.2	0	0	0	0	108.6	I379 A380 K381	I379-T386 HydrophobicContact CG2-CG2 3.68Å; A380-T386 CarbonylContact O-C 3.57Å; A380-T386 VanDerWaalsContact O-CA 3.24Å; A380-T386 WeakPolarHBondContact O-CA 3.42Å; A380-T386 WeakPolarHBondContact O-CG2 3.37Å; K381-T386 HydrophobicContact CB-CG2 4.29Å; K381-T386 WeakPolarHBondContact CG-OG1 3.42Å
387	A	96.8	Very high	93.9	Very high	19 Å²	19	58.2 Å²	58.2	16%	0.157	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	150	170.6	0	0	0	0	0	109.7	P305 V307 I379 A380	P305-A387 HydrophobicContact CB-CB 4.45Å; P305-A387 VanDerWaalsContact O-CB 3.23Å; P305-A387 WeakPolarHBondContact O-CB 3.33Å; V307-A387 HydrophobicContact CG2-CB 4.29Å; I379-A387 WeakPolarHBondContact CA-O 3.47Å; A380-A387 PolarHBondContact N-O 2.8Å; A380-A387 PolarHBondContact O-N 2.83Å
388	N	96.3	Very high	93.1	Very high	111 Å²	111	63.5 Å²	63.5	59%	0.594	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.2	172.2	59	6.4	0	0	0	111.3	T377 L378 I379	T377-N388 HydrophobicContact CG2-CB 4.16Å; L378-N388 WeakPolarHBondContact O-CA 3.41Å; L378-N388 VanDerWaalsContact O-CB 3.3Å; L378-N388 WeakPolarHBondContact O-CB 3.39Å; I379-N388 HydrophobicContact CG1-CB 4Å
389	Q	96.6	Very high	91.5	Very high	77 Å²	77	67.4 Å²	67.4	36%	0.36	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	144.4	175.9	-167.9	171.3	-13.7	0	0	108.5	V307 L310 T377 L378	V307-Q389 HydrophobicContact CB-CB 4.15Å; V307-Q389 HydrophobicContact CG1-CB 4.07Å; V307-Q389 HydrophobicContact CG2-CB 4.18Å; L310-Q389 HydrophobicContact CB-CG 4.22Å; L310-Q389 HydrophobicContact CD2-CB 3.87Å; L310-Q389 HydrophobicContact CD2-CG 3.89Å; L310-Q389 VanDerWaalsContact CD2-O 3.32Å; L310-Q389 WeakPolarHBondContact CD2-O 3.41Å; T377-Q389 CarbonylContact C-O 3.52Å; T377-Q389 VanDerWaalsContact CA-O 3.3Å; T377-Q389 WeakPolarHBondContact CA-O 3.3Å; L378-Q389 PolarHBondContact N-O 2.8Å; L378-Q389 PolarHBondContact O-N 3.42Å
390	T	96.5	Very high	90.2	Very high	74 Å²	74	73.5 Å²	73.5	45%	0.454	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	138.1	-176.2	-57.2	0	0	0	0	110.2	N375 Y376 T377	N375-T390 HydrophobicContact CB-CG2 3.82Å; Y376-T390 CarbonylContact O-C 3.35Å; Y376-T390 VanDerWaalsContact O-CA 3.3Å; Y376-T390 WeakPolarHBondContact O-CA 3.19Å; T377-T390 WeakPolarHBondContact CG2-OG1 3.28Å; T377-T390 PolarHBondContact OG1-OG1 3.2Å
391	I	95.2	Very high	88.3	Confident	26 Å²	26	78.8 Å²	78.8	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	151.1	174.1	-164	138.7	0	0	0	110.8	L310 E312 I321 N375 Y376	L310-I391 HydrophobicContact CD1-CG2 4.24Å; L310-I391 HydrophobicContact CD2-CB 3.96Å; L310-I391 HydrophobicContact CD2-CG2 3.88Å; L310-I391 HydrophobicContact CG-CB 4.07Å; L310-I391 HydrophobicContact CG-CG2 3.83Å; L310-I391 WeakPolarHBondContact O-CD1 3.49Å; E312-I391 HydrophobicContact CG-CD1 3.86Å; E312-I391 HydrophobicContact CG-CG1 4.06Å; I321-I391 HydrophobicContact CD1-CG2 4.42Å; I321-I391 HydrophobicContact CG2-CG2 3.92Å; N375-I391 CarbonylContact C-O 3.57Å; N375-I391 WeakPolarHBondContact CA-O 3.42Å; Y376-I391 PolarHBondContact N-O 2.94Å; Y376-I391 PolarHBondContact O-N 2.87Å
392	N	94.3	Very high	86	Confident	84 Å²	84	82.6 Å²	82.6	45%	0.449	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	107.8	176.5	179.9	35.2	0	0	0	109.6	G374 H394	G374-N392 PolarHBondContact O-OD1 3.2Å; N392-H394 PolarHBondContact O-N 2.64Å
393	G	90.7	Very high	83.6	Confident	0 Å²	0	87.5 Å²	87.5	0%	0	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	115.4	173.4	0	0	0	0	0	110.6	P313 N373 G374	P313-G393 VanDerWaalsContact CG-CA 3.44Å; N373-G393 CarbonylContact C-O 3.59Å; N373-G393 WeakPolarHBondContact CA-O 3.41Å; G374-G393 PolarHBondContact N-O 3.36Å; G374-G393 PolarHBondContact O-N 3.36Å
394	H	90.5	Very high	80.7	Confident	97 Å²	97	88.4 Å²	88.4	45%	0.449	48%	0.478	S	S	.	.			trans	-120.2	119.9	174.1	171.7	-74.5	0	0	0	110.6	N392	N392-H394 PolarHBondContact O-N 2.64Å
395	F	88.1	Confident	78.1	Confident	16 Å²	16	92.2 Å²	92.2	7%	0.07	50%	0.499	C	S	.	.			trans	-112	-44.6	-173.8	-56.7	-76.8	0	0	0	113.3	P313 H319 F365 P368 N372 N373 Y376	P313-F395 HydrophobicContact CB-CD1 4.12Å; P313-F395 HydrophobicContact CB-CE1 3.48Å; P313-F395 VanDerWaalsContact CB-CE1 3.48Å; P313-F395 HydrophobicContact CB-CZ 4.08Å; P313-F395 HydrophobicContact CG-CD1 4.47Å; P313-F395 HydrophobicContact CG-CE1 3.84Å; P313-F395 HydrophobicContact CG-CZ 3.98Å; H319-F395 HydrophobicContact CB-CD1 3.96Å; H319-F395 HydrophobicContact CB-CE1 3.75Å; H319-F395 AromaticContact CD2-CD1 3.78Å; H319-F395 AromaticContact CG-CD1 3.83Å; F365-F395 HydrophobicContact CB-CE1 4.14Å; F365-F395 HydrophobicContact CB-CZ 4.41Å; F365-F395 HydrophobicContact CD1-CE1 4.27Å; F365-F395 HydrophobicContact CD1-CE2 4.18Å; F365-F395 AromaticContact CD1-CZ 3.69Å; F365-F395 HydrophobicContact CD1-CZ 3.69Å; F365-F395 AromaticContact CD2-CE1 3.74Å; F365-F395 HydrophobicContact CD2-CE1 3.74Å; F365-F395 AromaticContact CD2-CZ 3.6Å; F365-F395 HydrophobicContact CD2-CZ 3.6Å; F365-F395 HydrophobicContact CE1-CE2 4.12Å; F365-F395 AromaticContact CE1-CZ 3.73Å; F365-F395 HydrophobicContact CE1-CZ 3.73Å; F365-F395 HydrophobicContact CE2-CE1 4.18Å; F365-F395 AromaticContact CE2-CZ 3.64Å; F365-F395 HydrophobicContact CE2-CZ 3.64Å; F365-F395 AromaticContact CG-CE1 3.8Å; F365-F395 HydrophobicContact CG-CE1 3.8Å; F365-F395 AromaticContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CG-CZ 3.64Å; F365-F395 HydrophobicContact CZ-CE2 4.38Å; F365-F395 AromaticContact CZ-CZ 3.69Å; F365-F395 HydrophobicContact CZ-CZ 3.69Å; P368-F395 HydrophobicContact CB-CB 3.78Å; P368-F395 HydrophobicContact CB-CD1 3.78Å; P368-F395 HydrophobicContact CB-CD2 3.93Å; P368-F395 HydrophobicContact CB-CE1 4.31Å; P368-F395 HydrophobicContact CB-CE2 4.46Å; P368-F395 HydrophobicContact CB-CG 3.55Å; P368-F395 HydrophobicContact CG-CB 3.72Å; P368-F395 HydrophobicContact CG-CD1 3.26Å; P368-F395 HydrophobicContact CG-CD2 4.34Å; P368-F395 HydrophobicContact CG-CE1 3.89Å; P368-F395 HydrophobicContact CG-CG 3.51Å; N372-F395 HydrophobicContact CB-CD2 3.72Å; N372-F395 HydrophobicContact CB-CE2 3.95Å; N372-F395 WeakPolarHBondContact O-CE2 3.43Å; N373-F395 PolarHBondContact OD1-N 2.77Å; Y376-F395 AromaticContact CE2-CE2 3.96Å; Y376-F395 HydrophobicContact CE2-CE2 3.96Å; Y376-F395 HydrophobicContact CE2-CZ 4.36Å
396	L	84.6	Confident	75.3	Confident	90 Å²	90	98.1 Å²	98.1	47%	0.471	53%	0.525	S	S	.	.			trans	-147	150.9	179.6	-102.7	110.3	0	0	0	111.5	P368 H370 N373	P368-L396 WeakPolarHBondContact O-CD1 3.48Å; H370-L396 HydrophobicContact CB-CB 4.47Å; H370-L396 WeakPolarHBondContact CB-O 3.19Å; N373-L396 PolarHBondContact ND2-O 2.9Å; N373-L396 PolarHBondContact OD1-N 2.78Å
397	K	82.4	Confident	72.4	Confident	169 Å²	169	103.6 Å²	103.6	74%	0.735	54%	0.542	S	S	*	.			trans	-77.3	150.4	167.7	-66.9	-176.2	178.1	-178.9	0	110.6
398	E	79.4	Confident	69.6	Low	126 Å²	126	109.2 Å²	109.2	59%	0.589	57%	0.568	S	S	*	*			trans	-68.3	130.9	175	-172.6	165	-148.1	0	0	110.5	H370 F400	H370-E398 HydrophobicContact CB-CB 4.5Å; E398-F400 PolarHBondContact O-N 2.83Å
399	P	62.9	Low	66.7	Low	83 Å²	83	110.9 Å²	110.9	54%	0.539	58%	0.576	S	S	.	*	S	Bend	trans	-76.8	-17.4	-168.3	27.4	-34.1	0	0	0	114.9
400	F	70.3	Confident	63.9	Low	164 Å²	164	116.8 Å²	116.8	72%	0.719	60%	0.601	S	S	*	*			trans	-142.4	107.4	178	-54.1	-76.6	0	0	0	109.9	E398 E402	E398-F400 PolarHBondContact O-N 2.83Å; F400-E402 PolarHBondContact O-N 2.82Å
401	P	56.8	Low	61.1	Low	112 Å²	112	119.8 Å²	119.8	73%	0.727	61%	0.614	S	S	*	*			trans	-66.3	129.6	167.2	28.1	-32.1	0	0	0	108.7	S403	P401-S403 PolarHBondContact O-N 2.59Å
402	E	48.9	Very low	58.4	Low	195 Å²	195	126.5 Å²	126.5	91%	0.911	65%	0.645	S	S	*	*			trans	-58.8	103	-177.8	-68.5	-169.9	147.2	0	0	111.3	F400 T404	F400-E402 PolarHBondContact O-N 2.82Å; E402-T404 PolarHBondContact O-N 3.02Å
403	S	43	Very low	55.7	Low	114 Å²	114	129.4 Å²	129.4	80%	0.797	67%	0.665	S	S	*	*			trans	-78.8	107.7	172.3	58.4	0	0	0	0	109.5	P401 D405	P401-S403 PolarHBondContact O-N 2.59Å; S403-D405 PolarHBondContact O-N 2.87Å; S403-D405 VanDerWaalsContact O-N 3.12Å
404	T	36.6	Very low	53.1	Low	135 Å²	135	134.5 Å²	134.5	83%	0.828	70%	0.701	S	S	*	*			trans	-56.3	109.3	165.5	46.9	0	0	0	0	110.7	E402	E402-T404 PolarHBondContact O-N 3.02Å
405	D	39.2	Very low	50.8	Low	141 Å²	141	134.9 Å²	134.9	75%	0.754	71%	0.712	S	S	*	*			trans	-162.8	126.1	136.5	-115.8	-35.7	0	0	0	114.5	S403	S403-D405 PolarHBondContact O-N 2.87Å; S403-D405 VanDerWaalsContact O-N 3.12Å
406	N	35.2	Very low	48.3	Very low	147 Å²	147	141 Å²	141	79%	0.786	75%	0.751	S	S	*	*			trans	-0.8	112.1	155.7	-60	-72.8	0	0	0	119
407	F	36.4	Very low	46.1	Very low	195 Å²	195	142.1 Å²	142.1	86%	0.855	76%	0.764	S	S	*	*			trans	-131.6	139.1	145.9	-160.9	-99.3	0	0	0	111
408	I	38.7	Very low	44.1	Very low	138 Å²	138	139.6 Å²	139.6	71%	0.708	77%	0.765	S	S	*	*			trans	-94.3	149.3	-162.3	-64	172.6	0	0	0	111.1
409	L	34.3	Very low	42.3	Very low	146 Å²	146	141.5 Å²	141.5	76%	0.764	78%	0.777	S	S	*	*			trans	-50.3	140.8	173	-100.4	71.9	0	0	0	112.9
410	F	38.8	Very low	40.9	Very low	201 Å²	201	144 Å²	144	88%	0.882	79%	0.791	S	S	*	*			trans	-120.9	157.2	143.2	-84.2	-80.9	0	0	0	109.2
411	D	37.7	Very low	39.4	Very low	136 Å²	136	142.8 Å²	142.8	73%	0.727	80%	0.797	S	S	*	*			trans	-111.3	173.4	-141.2	-148.1	-16.2	0	0	0	113.9
412	E	37	Very low	38.5	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	80%	0.801	S	S	*	*			trans	80.3	145	152.9	-68.3	-169.5	147.2	0	0	123.4
413	V	38.1	Very low	37.8	Very low	145 Å²	145	143.6 Å²	143.6	88%	0.879	80%	0.8	S	S	*	*			trans	89.4	103.3	162.7	-157.2	0	0	0	0	119
414	S	36.4	Very low	37.5	Very low	107 Å²	107	147.7 Å²	147.7	75%	0.748	80%	0.803	S	S	*	*			trans	-149.8	175.8	167.2	-165.6	0	0	0	0	105.9
415	P	42.2	Very low	37.6	Very low	105 Å²	105	146.7 Å²	146.7	68%	0.682	80%	0.799	S	S	*	*				-128	166.5	-50	32.4	-17.3	0	0	0	113
416	T	35.5	Very low	38	Very low	144 Å²	144	149 Å²	149	88%	0.883	81%	0.805	S	S	*	*			trans	-167.5	143.6	138.5	2.3	0	0	0	0	114.1
417	P	38.8	Very low	38.4	Very low	114 Å²	114	150.4 Å²	150.4	74%	0.74	81%	0.807	S	S	*	*			trans	-115.1	-161.3	176	40.9	-28.1	0	0	0	112.1
418	P	40.4	Very low	39	Very low	117 Å²	117	148.3 Å²	148.3	76%	0.76	81%	0.805	S	S	*	*				-121	166.9	-56.5	34.3	-19.4	0	0	0	112.3
419	I	40.4	Very low	39.5	Very low	166 Å²	166	148 Å²	148	85%	0.851	81%	0.809	S	S	*	*			trans	-131.3	135.1	166.2	-64.5	-177.3	0	0	0	111.8
420	T	34.1	Very low	40.3	Very low	134 Å²	134	148.6 Å²	148.6	82%	0.822	81%	0.806	S	S	*	*			trans	-76.2	139.9	-179.4	24.1	0	0	0	0	113.9
421	V	38.1	Very low	41.1	Very low	140 Å²	140	141.4 Å²	141.4	85%	0.848	79%	0.789	S	S	*	*			trans	-131	126.2	154.8	-178.2	0	0	0	0	110.1
422	T	37.6	Very low	42.1	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	78%	0.784	S	S	*	*			trans	-43.2	145.6	-173.7	43.9	0	0	0	0	119.5
423	H	35.5	Very low	43.3	Very low	191 Å²	191	136.2 Å²	136.2	88%	0.884	78%	0.777	S	S	*	*			trans	-60	154.9	173.3	-72.4	-107.4	0	0	0	115.6
424	K	37	Very low	44.9	Very low	200 Å²	200	133.5 Å²	133.5	87%	0.87	76%	0.757	S	S	*	*			trans	-131.8	128.3	147.2	-154.2	178.3	-173.9	-174	0	107.4
425	P	39.1	Very low	46.4	Very low	114 Å²	114	131.2 Å²	131.2	74%	0.74	74%	0.744	S	S	*	*			trans	-87	142.3	-171.5	33.2	-33.8	0	0	0	112.3
426	E	46	Very low	48	Very low	191 Å²	191	130.8 Å²	130.8	89%	0.893	74%	0.739	S	S	*	*			trans	-113.2	145.5	165.7	-73.1	-173.6	147.7	0	0	110.3	D428	E426-D428 PolarHBondContact O-N 2.89Å
427	E	44.9	Very low	50.1	Low	176 Å²	176	125.9 Å²	125.9	82%	0.822	72%	0.717	S	S	*	*			trans	-102.6	65.2	-151.8	-60.7	176.1	118.4	0	0	114.4	T429	E427-T429 PolarHBondContact O-N 2.64Å
428	D	47.4	Very low	52.1	Low	150 Å²	150	125.9 Å²	125.9	80%	0.802	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	10.9	-177.1	-86.1	-28.3	0	0	0	116.1	E426	E426-D428 PolarHBondContact O-N 2.89Å
429	T	51.2	Low	53.9	Low	131 Å²	131	123 Å²	123	80%	0.804	70%	0.696	S	S	*	*	H	α-helix	trans	-82.5	-8.2	176.4	27.3	0	0	0	0	114.9	E427	E427-T429 PolarHBondContact O-N 2.64Å
430	F	50.9	Low	56.1	Low	160 Å²	160	117.6 Å²	117.6	70%	0.702	68%	0.677	S	S	*	*	H	α-helix	trans	-86.6	-34	-178.3	-139.6	-101.7	0	0	0	113.6	I434	F430-I434 HydrophobicContact CD1-CD1 3.65Å; F430-I434 HydrophobicContact CD1-CG1 4.43Å; F430-I434 HydrophobicContact CE1-CD1 3.92Å; F430-I434 WeakPolarHBondContact O-CG1 3.45Å; F430-I434 PolarHBondContact O-N 2.82Å
431	G	54.1	Low	58.6	Low	50 Å²	50	117.6 Å²	117.6	52%	0.515	67%	0.666	S	S	.	*	H	α-helix	trans	-68.4	-40.7	-175	0	0	0	0	0	114.5	I434 A435	G431-I434 PolarHBondContact O-N 2.92Å; G431-A435 PolarHBondContact O-N 3.23Å
432	V	58.7	Low	60.8	Low	104 Å²	104	113.2 Å²	113.2	63%	0.63	64%	0.644	S	S	*	*	H	α-helix	trans	-68.6	-37.7	-176.8	-175.3	0	0	0	0	111.7	A435 V436	V432-A435 PolarHBondContact O-N 3.37Å; V432-V436 WeakPolarHBondContact O-CG2 3.42Å; V432-V436 PolarHBondContact O-N 2.88Å
433	S	63.6	Low	63	Low	90 Å²	90	110.9 Å²	110.9	63%	0.629	63%	0.632	S	S	*	*	H	α-helix	trans	-67.7	-37.9	177.9	-162	0	0	0	0	112	G437	S433-G437 PolarHBondContact O-N 2.91Å
434	I	70.5	Confident	65.5	Low	88 Å²	88	106 Å²	106	45%	0.451	62%	0.616	S	S	.	*	H	α-helix	trans	-65.1	-43.1	173.2	-67	171.3	0	0	0	111	F430 G431 G437 L438	F430-I434 HydrophobicContact CD1-CD1 3.65Å; F430-I434 HydrophobicContact CD1-CG1 4.43Å; F430-I434 HydrophobicContact CE1-CD1 3.92Å; F430-I434 WeakPolarHBondContact O-CG1 3.45Å; F430-I434 PolarHBondContact O-N 2.82Å; G431-I434 PolarHBondContact O-N 2.92Å; I434-G437 PolarHBondContact O-N 3.3Å; I434-L438 HydrophobicContact CG2-CD1 3.83Å; I434-L438 HydrophobicContact CG2-CG 4.26Å; I434-L438 WeakPolarHBondContact O-CB 3.34Å; I434-L438 WeakPolarHBondContact O-CG 3.42Å; I434-L438 PolarHBondContact O-N 2.79Å
435	A	67.7	Low	67.9	Low	59 Å²	59	101 Å²	101	49%	0.488	60%	0.598	S	S	.	*	H	α-helix	trans	-62.1	-44.4	178.7	0	0	0	0	0	112.4	G431 V432 L438 A439	G431-A435 PolarHBondContact O-N 3.23Å; V432-A435 PolarHBondContact O-N 3.37Å; A435-L438 PolarHBondContact O-N 2.91Å; A435-A439 WeakPolarHBondContact O-CB 2.9Å; A435-A439 PolarHBondContact O-N 3.32Å
436	V	76.3	Confident	70.1	Confident	96 Å²	96	101.1 Å²	101.1	58%	0.582	59%	0.592	S	S	*	*	H	α-helix	trans	-66.8	-40.2	175.6	175.9	0	0	0	0	111.3	V432 A439 A440	V432-V436 WeakPolarHBondContact O-CG2 3.42Å; V432-V436 PolarHBondContact O-N 2.88Å; V436-A439 PolarHBondContact O-N 3.01Å; V436-A440 WeakPolarHBondContact O-CB 3.28Å; V436-A440 PolarHBondContact O-N 3.13Å
437	G	79.7	Confident	72	Confident	41 Å²	41	96.4 Å²	96.4	42%	0.423	58%	0.576	S	S	.	*	H	α-helix	trans	-61.6	-43.3	175.3	0	0	0	0	0	113.2	S433 I434 F441	S433-G437 PolarHBondContact O-N 2.91Å; I434-G437 PolarHBondContact O-N 3.3Å; G437-F441 WeakPolarHBondContact O-CB 3.26Å; G437-F441 PolarHBondContact O-N 2.99Å
438	L	81.7	Confident	74	Confident	113 Å²	113	91.7 Å²	91.7	59%	0.592	56%	0.559	S	S	*	*	H	α-helix	trans	-67.2	-40.6	176.3	-73.8	172.7	0	0	0	112.2	I434 A435 F441 A442	I434-L438 HydrophobicContact CG2-CD1 3.83Å; I434-L438 HydrophobicContact CG2-CG 4.26Å; I434-L438 WeakPolarHBondContact O-CB 3.34Å; I434-L438 WeakPolarHBondContact O-CG 3.42Å; I434-L438 PolarHBondContact O-N 2.79Å; A435-L438 PolarHBondContact O-N 2.91Å; L438-F441 PolarHBondContact O-N 3.05Å; L438-A442 WeakPolarHBondContact O-CB 3.45Å; L438-A442 PolarHBondContact O-N 2.77Å
439	A	78.3	Confident	75.6	Confident	56 Å²	56	89.5 Å²	89.5	46%	0.463	55%	0.547	S	S	.	.	H	α-helix	trans	-63.7	-45.1	175.5	0	0	0	0	0	111.8	A435 V436 F441 A442 C443	A435-A439 WeakPolarHBondContact O-CB 2.9Å; A435-A439 PolarHBondContact O-N 3.32Å; V436-A439 PolarHBondContact O-N 3.01Å; A439-F441 PolarHBondContact O-N 2.74Å; A439-A442 PolarHBondContact O-N 2.76Å; A439-C443 PolarHBondContact O-N 3.32Å
440	A	85	Confident	77	Confident	54 Å²	54	90 Å²	90	45%	0.446	54%	0.538	S	S	.	.	H	α-helix	trans	-61.4	-43.1	174.8	0	0	0	0	0	111.9	V436 C443 V444	V436-A440 WeakPolarHBondContact O-CB 3.28Å; V436-A440 PolarHBondContact O-N 3.13Å; A440-C443 PolarHBondContact O-N 3.07Å; A440-V444 WeakPolarHBondContact O-CG2 3.44Å; A440-V444 PolarHBondContact O-N 2.72Å
441	F	88	Confident	78.5	Confident	134 Å²	134	86 Å²	86	59%	0.588	53%	0.526	S	S	*	.	H	α-helix	trans	-64.9	-39.4	177.3	-169	-104.6	0	0	0	112.4	G437 L438 A439 V444 L445	G437-F441 WeakPolarHBondContact O-CB 3.26Å; G437-F441 PolarHBondContact O-N 2.99Å; L438-F441 PolarHBondContact O-N 3.05Å; A439-F441 PolarHBondContact O-N 2.74Å; F441-V444 PolarHBondContact O-N 3.24Å; F441-L445 HydrophobicContact CD1-CD1 3.78Å; F441-L445 HydrophobicContact CD1-CG 4.49Å; F441-L445 HydrophobicContact CE1-CD1 3.41Å; F441-L445 VanDerWaalsContact CE1-CD1 3.41Å; F441-L445 HydrophobicContact CE1-CG 4.17Å; F441-L445 HydrophobicContact CZ-CD1 4.12Å; F441-L445 HydrophobicContact CZ-CG 4.48Å; F441-L445 WeakPolarHBondContact O-CB 3.29Å; F441-L445 PolarHBondContact O-N 2.74Å
442	A	84.3	Confident	79.6	Confident	48 Å²	48	87.9 Å²	87.9	40%	0.397	52%	0.523	S	S	.	.	H	α-helix	trans	-64.2	-43.6	174.3	0	0	0	0	0	112.1	L438 A439 L445 L446	L438-A442 WeakPolarHBondContact O-CB 3.45Å; L438-A442 PolarHBondContact O-N 2.77Å; A439-A442 PolarHBondContact O-N 2.76Å; A442-L445 PolarHBondContact O-N 3.07Å; A442-L446 WeakPolarHBondContact O-CG 3.35Å; A442-L446 PolarHBondContact O-N 2.83Å
443	C	83.9	Confident	80.3	Confident	82 Å²	82	87.9 Å²	87.9	55%	0.554	52%	0.518	S	S	*	.	H	α-helix	trans	-61.2	-44.9	173.7	-75.7	0	0	0	0	112	A439 A440 L446 V447	A439-C443 PolarHBondContact O-N 3.32Å; A440-C443 PolarHBondContact O-N 3.07Å; C443-L446 PolarHBondContact O-N 3.06Å; C443-V447 WeakPolarHBondContact O-CG2 3.23Å; C443-V447 PolarHBondContact O-N 3.38Å
444	V	87.6	Confident	80.7	Confident	89 Å²	89	87.7 Å²	87.7	54%	0.539	51%	0.51	S	S	.	.	H	α-helix	trans	-63.5	-42.3	176.5	172	0	0	0	0	111.1	A440 F441 V447 V448	A440-V444 WeakPolarHBondContact O-CG2 3.44Å; A440-V444 PolarHBondContact O-N 2.72Å; F441-V444 PolarHBondContact O-N 3.24Å; V444-V447 PolarHBondContact O-N 2.91Å; V444-V448 HydrophobicContact CG1-CG2 4.35Å; V444-V448 WeakPolarHBondContact O-CB 3.5Å; V444-V448 VanDerWaalsContact O-CG2 3.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.41Å; V444-V448 PolarHBondContact O-N 3.32Å
445	L	87	Confident	80.7	Confident	94 Å²	94	91 Å²	91	49%	0.492	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-43.3	174.9	-93.9	171.2	0	0	0	112.4	F441 A442 V448 L449	F441-L445 HydrophobicContact CD1-CD1 3.78Å; F441-L445 HydrophobicContact CD1-CG 4.49Å; F441-L445 HydrophobicContact CE1-CD1 3.41Å; F441-L445 VanDerWaalsContact CE1-CD1 3.41Å; F441-L445 HydrophobicContact CE1-CG 4.17Å; F441-L445 HydrophobicContact CZ-CD1 4.12Å; F441-L445 HydrophobicContact CZ-CG 4.48Å; F441-L445 WeakPolarHBondContact O-CB 3.29Å; F441-L445 PolarHBondContact O-N 2.74Å; A442-L445 PolarHBondContact O-N 3.07Å; L445-V448 PolarHBondContact O-N 3.1Å; L445-L449 VanDerWaalsContact O-CB 3.31Å; L445-L449 WeakPolarHBondContact O-CB 3.49Å; L445-L449 PolarHBondContact O-N 3.42Å
446	L	85.1	Confident	80.3	Confident	118 Å²	118	96.1 Å²	96.1	62%	0.618	53%	0.529	S	S	*	.	H	α-helix	trans	-65.8	-40.9	177.6	-74.2	171.7	0	0	0	112	A442 C443 L449 F450	A442-L446 WeakPolarHBondContact O-CG 3.35Å; A442-L446 PolarHBondContact O-N 2.83Å; C443-L446 PolarHBondContact O-N 3.06Å; L446-L449 PolarHBondContact O-N 2.98Å; L446-F450 VanDerWaalsContact O-CB 3.3Å; L446-F450 WeakPolarHBondContact O-CB 3.21Å; L446-F450 PolarHBondContact O-N 3.27Å
447	V	87	Confident	78.9	Confident	92 Å²	92	94.6 Å²	94.6	56%	0.558	53%	0.532	S	S	*	.	H	α-helix	trans	-65.1	-43.4	174.6	172.6	0	0	0	0	111	C443 V444 F450 V451	C443-V447 WeakPolarHBondContact O-CG2 3.23Å; C443-V447 PolarHBondContact O-N 3.38Å; V444-V447 PolarHBondContact O-N 2.91Å; V447-F450 PolarHBondContact O-N 2.9Å; V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 WeakPolarHBondContact O-CB 3.38Å; V447-V451 VanDerWaalsContact O-CG2 3.29Å; V447-V451 WeakPolarHBondContact O-CG2 3.48Å; V447-V451 PolarHBondContact O-N 3.39Å
448	V	86.3	Confident	77.3	Confident	76 Å²	76	103.5 Å²	103.5	46%	0.461	55%	0.553	S	S	.	*	H	α-helix	trans	-63.2	-43	175	170.2	0	0	0	0	110.9	V444 L445 V451 M452	V444-V448 HydrophobicContact CG1-CG2 4.35Å; V444-V448 WeakPolarHBondContact O-CB 3.5Å; V444-V448 VanDerWaalsContact O-CG2 3.3Å; V444-V448 WeakPolarHBondContact O-CG2 3.41Å; V444-V448 PolarHBondContact O-N 3.32Å; L445-V448 PolarHBondContact O-N 3.1Å; V448-V451 PolarHBondContact O-N 2.83Å; V448-M452 HydrophobicContact CG1-CG 4.21Å; V448-M452 WeakPolarHBondContact O-CB 3.43Å; V448-M452 WeakPolarHBondContact O-CG 3.25Å; V448-M452 PolarHBondContact O-N 3.42Å
449	L	80.8	Confident	75.1	Confident	105 Å²	105	109.4 Å²	109.4	55%	0.55	57%	0.568	S	S	.	*	H	α-helix	trans	-63.1	-43.7	177.3	-158.2	87.8	0	0	0	111.2	L445 L446 M452 I453	L445-L449 VanDerWaalsContact O-CB 3.31Å; L445-L449 WeakPolarHBondContact O-CB 3.49Å; L445-L449 PolarHBondContact O-N 3.42Å; L446-L449 PolarHBondContact O-N 2.98Å; L449-M452 PolarHBondContact O-N 2.9Å; L449-I453 HydrophobicContact CD2-CD1 4.11Å; L449-I453 HydrophobicContact CG-CD1 4.1Å; L449-I453 WeakPolarHBondContact O-CB 3.35Å; L449-I453 VanDerWaalsContact O-CG1 3.27Å; L449-I453 WeakPolarHBondContact O-CG1 3.43Å; L449-I453 PolarHBondContact O-N 2.89Å
450	F	81.2	Confident	73.3	Confident	141 Å²	141	112.2 Å²	112.2	62%	0.618	58%	0.584	S	S	*	*	H	α-helix	trans	-63.6	-41.4	176.2	-174.6	-102.8	0	0	0	112.1	L446 V447 N454	L446-F450 VanDerWaalsContact O-CB 3.3Å; L446-F450 WeakPolarHBondContact O-CB 3.21Å; L446-F450 PolarHBondContact O-N 3.27Å; V447-F450 PolarHBondContact O-N 2.9Å; F450-N454 WeakPolarHBondContact CD1-ND2 3.04Å; F450-N454 WeakPolarHBondContact CE1-ND2 3.39Å; F450-N454 WeakPolarHBondContact CE2-ND2 3.46Å; F450-N454 VanDerWaalsContact CZ-ND2 3.26Å; F450-N454 WeakPolarHBondContact CZ-ND2 3.28Å; F450-N454 WeakPolarHBondContact O-CB 3.24Å; F450-N454 PolarHBondContact O-N 2.84Å; F450-N454 PolarHBondContact O-ND2 2.81Å
451	V	82.4	Confident	70.8	Confident	75 Å²	75	119 Å²	119	46%	0.455	60%	0.604	S	S	.	*	H	α-helix	trans	-65.7	-40.7	173.3	170.6	0	0	0	0	111	V447 V448 N454 K455	V447-V451 HydrophobicContact CG1-CG2 4.49Å; V447-V451 WeakPolarHBondContact O-CB 3.38Å; V447-V451 VanDerWaalsContact O-CG2 3.29Å; V447-V451 WeakPolarHBondContact O-CG2 3.48Å; V447-V451 PolarHBondContact O-N 3.39Å; V448-V451 PolarHBondContact O-N 2.83Å; V451-N454 PolarHBondContact O-N 3.07Å; V451-K455 WeakPolarHBondContact O-CB 3.24Å; V451-K455 PolarHBondContact O-N 2.74Å
452	M	77.2	Confident	68.4	Low	90 Å²	90	122.7 Å²	122.7	44%	0.443	62%	0.62	S	S	.	*	H	α-helix	trans	-65	-44.9	176.7	-71.3	-68.5	-76.9	0	0	111.5	V448 L449 N454 K455 Y456	V448-M452 HydrophobicContact CG1-CG 4.21Å; V448-M452 WeakPolarHBondContact O-CB 3.43Å; V448-M452 WeakPolarHBondContact O-CG 3.25Å; V448-M452 PolarHBondContact O-N 3.42Å; L449-M452 PolarHBondContact O-N 2.9Å; M452-N454 PolarHBondContact O-N 3.3Å; M452-K455 PolarHBondContact O-N 3.35Å; M452-Y456 HydrophobicContact CE-CD2 3.92Å; M452-Y456 HydrophobicContact CE-CE2 3.53Å; M452-Y456 WeakPolarHBondContact O-CB 3.26Å; M452-Y456 WeakPolarHBondContact O-CD2 3.46Å; M452-Y456 PolarHBondContact O-N 3.25Å; M452-Y456 HydrophobicContact SD-CD2 3.95Å; M452-Y456 HydrophobicContact SD-CE2 3.55Å; M452-Y456 VanDerWaalsContact SD-CE2 3.55Å
453	I	74	Confident	65.9	Low	104 Å²	104	124 Å²	124	53%	0.533	64%	0.638	S	S	.	*	H	α-helix	trans	-60.8	-45.4	176	-69.6	164.6	0	0	0	110.5	L449 G457	L449-I453 HydrophobicContact CD2-CD1 4.11Å; L449-I453 HydrophobicContact CG-CD1 4.1Å; L449-I453 WeakPolarHBondContact O-CB 3.35Å; L449-I453 VanDerWaalsContact O-CG1 3.27Å; L449-I453 WeakPolarHBondContact O-CG1 3.43Å; L449-I453 PolarHBondContact O-N 2.89Å; I453-G457 VanDerWaalsContact O-CA 3.28Å; I453-G457 WeakPolarHBondContact O-CA 3.08Å; I453-G457 PolarHBondContact O-N 3.13Å
454	N	70.4	Confident	63.7	Low	86 Å²	86	127.2 Å²	127.2	46%	0.46	65%	0.647	S	S	.	*	H	α-helix	trans	-72.6	-28.3	178.9	-75.2	-58.3	0	0	0	114.1	F450 V451 M452	F450-N454 WeakPolarHBondContact CD1-ND2 3.04Å; F450-N454 WeakPolarHBondContact CE1-ND2 3.39Å; F450-N454 WeakPolarHBondContact CE2-ND2 3.46Å; F450-N454 VanDerWaalsContact CZ-ND2 3.26Å; F450-N454 WeakPolarHBondContact CZ-ND2 3.28Å; F450-N454 WeakPolarHBondContact O-CB 3.24Å; F450-N454 PolarHBondContact O-N 2.84Å; F450-N454 PolarHBondContact O-ND2 2.81Å; V451-N454 PolarHBondContact O-N 3.07Å; M452-N454 PolarHBondContact O-N 3.3Å
455	K	70	Confident	61.2	Low	159 Å²	159	132.1 Å²	132.1	69%	0.691	66%	0.661	S	S	*	*	H	α-helix	trans	-88	-27.9	-178.5	-162.9	172.3	-174.8	179.1	0	113.2	V451 M452	V451-K455 WeakPolarHBondContact O-CB 3.24Å; V451-K455 PolarHBondContact O-N 2.74Å; M452-K455 PolarHBondContact O-N 3.35Å
456	Y	59.6	Low	58.6	Low	166 Å²	166	131 Å²	131	65%	0.651	67%	0.672	S	S	*	*	H	α-helix	trans	-102.2	-25	176.9	-72.5	-94.4	0	0	0	113.7	M452 R458 R459	M452-Y456 HydrophobicContact CE-CD2 3.92Å; M452-Y456 HydrophobicContact CE-CE2 3.53Å; M452-Y456 WeakPolarHBondContact O-CB 3.26Å; M452-Y456 WeakPolarHBondContact O-CD2 3.46Å; M452-Y456 PolarHBondContact O-N 3.25Å; M452-Y456 HydrophobicContact SD-CD2 3.95Å; M452-Y456 HydrophobicContact SD-CE2 3.55Å; M452-Y456 VanDerWaalsContact SD-CE2 3.55Å; Y456-R458 PolarHBondContact O-N 2.88Å; Y456-R458 VanDerWaalsContact O-N 3.16Å; Y456-R459 PolarHBondContact O-N 3.33Å
457	G	47.9	Very low	56.4	Low	63 Å²	63	131 Å²	131	65%	0.649	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-13.6	174	0	0	0	0	0	114.6	I453 R459	I453-G457 VanDerWaalsContact O-CA 3.28Å; I453-G457 WeakPolarHBondContact O-CA 3.08Å; I453-G457 PolarHBondContact O-N 3.13Å; G457-R459 PolarHBondContact O-N 3.19Å
458	R	46.1	Very low	53.8	Low	228 Å²	228	133.2 Å²	133.2	86%	0.86	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	11.4	176.8	-98.3	179.5	171.9	174.5	-1.1	115.3	Y456	Y456-R458 PolarHBondContact O-N 2.88Å; Y456-R458 VanDerWaalsContact O-N 3.16Å
459	R	36.2	Very low	51.2	Low	237 Å²	237	133.6 Å²	133.6	89%	0.894	70%	0.703	S	S	*	*			trans	-140	80.1	174.6	-72.6	-171.4	176.2	-176.4	-0.4	113.5	Y456 G457	Y456-R459 PolarHBondContact O-N 3.33Å; G457-R459 PolarHBondContact O-N 3.19Å
460	S	38.6	Very low	48.7	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	71%	0.711	S	S	*	*			trans	-143.1	121.1	150.4	-171.1	0	0	0	0	109.7
461	K	32.9	Very low	46.4	Very low	196 Å²	196	134.6 Å²	134.6	85%	0.852	72%	0.718	S	S	*	*			trans	-134.2	90.1	-169.5	-158.3	-168.6	-168.2	-172.4	0	109.6
462	F	38	Very low	43.7	Very low	212 Å²	212	136.5 Å²	136.5	93%	0.93	74%	0.735	S	S	*	*			trans	-156.1	131.8	165.6	-76.3	-78.2	0	0	0	105
463	G	32.3	Very low	41.4	Very low	76 Å²	76	135.3 Å²	135.3	78%	0.784	75%	0.746	S	S	*	*			cis	127.5	142.9	16.2	0	0	0	0	0	107.6
464	M	37.7	Very low	39.2	Very low	149 Å²	149	139.4 Å²	139.4	73%	0.734	76%	0.763	S	S	*	*			cis	-175.4	120.1	-3.4	168.4	170.7	60.4	0	0	108.8
465	K	34.4	Very low	37.1	Very low	191 Å²	191	144.1 Å²	144.1	83%	0.83	78%	0.782	S	S	*	*			trans	64	132.9	165	-54.6	161.2	-171	172.3	0	115.3
466	G	33.7	Very low	35.1	Very low	70 Å²	70	144.1 Å²	144.1	72%	0.722	79%	0.789	S	S	*	*			cis	98.4	163.7	36.5	0	0	0	0	0	110.3
467	P	37	Very low	33.5	Very low	119 Å²	119	142.1 Å²	142.1	77%	0.773	80%	0.8	S	S	*	*			cis	-146.7	-167.4	0.6	30.9	-4.2	0	0	0	115.8
468	V	32.3	Very low	32.5	Very low	138 Å²	138	143.2 Å²	143.2	84%	0.836	80%	0.803	S	S	*	*			trans	74.7	128.1	160.3	-164.4	0	0	0	0	114.6
469	A	31.8	Very low	31.5	Very low	84 Å²	84	138 Å²	138	69%	0.694	80%	0.801	S	S	*	*			cis	-163.5	174.9	17	0	0	0	0	0	109.4
470	V	30.3	Very low	31	Very low	117 Å²	117	131.9 Å²	131.9	71%	0.709	79%	0.792	S	S	*	*			cis	-170.8	133.9	-15.6	132.8	0	0	0	0	108.8
471	I	31	Very low	30.4	Very low	150 Å²	150	132.3 Å²	132.3	77%	0.769	79%	0.785	S	S	*	*			trans	47	135.8	137.3	-52.9	179.6	0	0	0	119.6
472	S	26.8	Very low	30.1	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	77%	0.767	S	S	*	*			cis	-164	175.8	-6	-111.1	0	0	0	0	110.7
473	G	29.3	Very low	29.6	Very low	65 Å²	65	122.7 Å²	122.7	67%	0.67	75%	0.745	S	S	*	*			trans	97.7	90.2	173	0	0	0	0	0	111.3
474	E	26.7	Very low	29.5	Very low	190 Å²	190	124.6 Å²	124.6	89%	0.888	74%	0.736	S	S	*	*				59.8	126.3	61.9	-74.2	-177.6	153.7	0	0	114.1
475	E	26.5	Very low	29	Very low	185 Å²	185	120.9 Å²	120.9	86%	0.864	72%	0.72	S	S	*	*			trans	67.4	93.4	177	-49.9	-160.6	167.2	0	0	118.3
476	D	28	Very low	28.7	Very low	159 Å²	159	118.6 Å²	118.6	85%	0.85	71%	0.712	S	S	*	*			trans	-178.5	61	137	-103.8	-15.6	0	0	0	112	A478	D476-A478 PolarHBondContact O-N 2.92Å
477	S	26.6	Very low	28.4	Very low	125 Å²	125	118.5 Å²	118.5	87%	0.874	71%	0.71	S	S	*	*			trans	-79.5	69.6	169.2	-73.4	0	0	0	0	110.5	S479	S477-S479 PolarHBondContact O-N 3.16Å
478	A	27.3	Very low	27.9	Very low	86 Å²	86	120.4 Å²	120.4	71%	0.711	71%	0.712	S	S	*	*			trans	-65.5	88.5	-176.6	0	0	0	0	0	112.7	D476	D476-A478 PolarHBondContact O-N 2.92Å
479	S	23.8	Very low	27.6	Very low	117 Å²	117	119.9 Å²	119.9	82%	0.818	71%	0.71	S	S	*	*			trans	-101.2	111	157.3	-61.6	0	0	0	0	108.7	S477	S477-S479 PolarHBondContact O-N 3.16Å
480	P	27.2	Very low	27.3	Very low	109 Å²	109	122.7 Å²	122.7	71%	0.708	72%	0.718	S	S	*	*			trans	-119.1	95.5	170.7	31.3	-14.8	0	0	0	110.7
481	L	25.3	Very low	27.1	Very low	126 Å²	126	122.5 Å²	122.5	66%	0.66	72%	0.719	S	S	*	*			trans	-122.5	133	157	-101.7	169	0	0	0	107.4
482	H	26.1	Very low	27	Very low	102 Å²	102	121 Å²	121	47%	0.472	72%	0.722	S	S	.	*			trans	88.4	147.3	174.6	-66	-68.6	0	0	0	121.3	E355	E355-H482 IonicContact OE1-CD2 3.51Å; E355-H482 IonicContact OE1-CE1 2.76Å; E355-H482 IonicContact OE1-NE2 2.66Å; E355-H482 PolarHBondContact OE1-NE2 2.9Å; E355-H482 IonicContact OE2-CE1 3.48Å; E355-H482 PolarHBondContact OE2-CE1 2.95Å; E355-H482 IonicContact OE2-NE2 3.74Å; E355-H482 PolarHBondContact OE2-NE2 3.36Å
483	H	27.9	Very low	27.1	Very low	103 Å²	103	120.1 Å²	120.1	48%	0.477	72%	0.716	S	S	.	*			trans	73.2	133.3	-177.3	-53.3	-81.8	0	0	0	116.4	N278	N278-H483 PolarHBondContact O-CE1 2.74Å; N278-H483 PolarHBondContact O-ND1 3.03Å
484	I	29	Very low	27.1	Very low	116 Å²	116	124.5 Å²	124.5	60%	0.595	72%	0.723	S	S	*	*			cis	-156.3	158.4	-5.4	-116.3	160.9	0	0	0	110	E276	E276-I484 VanDerWaalsContact O-CD1 3.28Å; E276-I484 WeakPolarHBondContact O-CD1 3.45Å
485	N	27.9	Very low	27.2	Very low	72 Å²	72	122.1 Å²	122.1	39%	0.385	72%	0.717	S	S	.	*			trans	-95.7	132.3	179.2	-153.6	-23	0	0	0	109.2
486	H	28.6	Very low	27.3	Very low	143 Å²	143	118.2 Å²	118.2	66%	0.662	72%	0.716	S	S	*	*				164	155.7	96.9	-81.4	-58.2	0	0	0	109.7
487	G	26.1	Very low	27.5	Very low	67 Å²	67	113.7 Å²	113.7	69%	0.691	71%	0.707	S	S	*	*			trans	166.5	71.3	166.4	0	0	0	0	0	122.5
488	I	26.8	Very low	27.8	Very low	159 Å²	159	112.2 Å²	112.2	82%	0.815	70%	0.695	S	S	*	*			trans	74.8	125.7	138.9	-57.5	169.7	0	0	0	121.2
489	T	25.9	Very low	28	Very low	128 Å²	128	113.6 Å²	113.6	79%	0.785	69%	0.69	S	S	*	*			trans	74.1	103.8	158.9	50	0	0	0	0	123.1
490	T	26.1	Very low	28.3	Very low	143 Å²	143	111.2 Å²	111.2	88%	0.877	67%	0.671	S	S	*	*				-162.1	151.9	109.9	19.8	0	0	0	0	109.7
491	P	26.3	Very low	28.2	Very low	112 Å²	112	111.4 Å²	111.4	73%	0.727	67%	0.67	S	S	*	*			trans	-89.6	141	-168.8	33.3	-34.3	0	0	0	114.8
492	S	27.8	Very low	28.4	Very low	118 Å²	118	107.5 Å²	107.5	83%	0.825	65%	0.651	S	S	*	*			trans	69.2	117.2	163	-45.2	0	0	0	0	116.1
493	S	30.1	Very low	28.5	Very low	98 Å²	98	106.3 Å²	106.3	69%	0.685	65%	0.647	S	S	*	*			cis	177.5	153.9	0.3	45.5	0	0	0	0	106.9
494	L	29.3	Very low	28.6	Very low	156 Å²	156	102.6 Å²	102.6	82%	0.817	64%	0.637	S	S	*	*			cis	-163.7	145.2	0.4	-124.2	161.2	0	0	0	107.6
495	D	28	Very low	28.8	Very low	141 Å²	141	100.7 Å²	100.7	75%	0.754	63%	0.626	S	S	*	*				-126.1	115.2	-70.8	-83.9	-43.2	0	0	0	108
496	A	28.7	Very low	29.2	Very low	103 Å²	103	100.4 Å²	100.4	85%	0.851	63%	0.627	S	S	*	*			trans	-110.5	96.9	-176.9	0	0	0	0	0	110.8
497	G	32.6	Very low	29.5	Very low	64 Å²	64	101.9 Å²	101.9	66%	0.66	63%	0.627	S	S	*	*			trans	-64.8	149.4	-178.2	0	0	0	0	0	113.8
498	P	32.5	Very low	29.7	Very low	94 Å²	94	100.1 Å²	100.1	61%	0.61	60%	0.601	S	S	*	*			trans	-116.2	41.9	-152.2	39.3	-25.2	0	0	0	115.8
499	D	31.5	Very low	29.7	Very low	115 Å²	115	96.4 Å²	96.4	62%	0.615	59%	0.587	S	S	*	*			trans	-124.6	23.5	-174.1	-83.8	-45.6	0	0	0	116.8
500	T	29.9	Very low	29.9	Very low	67 Å²	67	95.6 Å²	95.6	41%	0.411	58%	0.582	S	S	.	*			trans	-87.1	117.9	168.5	10.2	0	0	0	0	111.6	V502	T500-V502 PolarHBondContact O-N 2.98Å
501	V	25.6	Very low	30.2	Very low	113 Å²	113	93.6 Å²	93.6	69%	0.685	57%	0.565	S	S	*	*			trans	-77.2	63.9	175.7	-171.6	0	0	0	0	110.8	I503	V501-I503 PolarHBondContact O-N 3.49Å
502	V	30.4	Very low	30.5	Very low	43 Å²	43	94.2 Å²	94.2	26%	0.261	56%	0.558	S	S	.	*			trans	-87	99.2	167.1	-177.4	0	0	0	0	107.9	T500 G504 A580	T500-V502 PolarHBondContact O-N 2.98Å; V502-G504 PolarHBondContact O-N 2.85Å; V502-A580 HydrophobicContact CG2-CB 4.39Å
503	I	28.2	Very low	30.7	Very low	78 Å²	78	90 Å²	90	40%	0.4	53%	0.527	S	S	.	.			trans	-66.9	116.3	162	-49.8	172.1	0	0	0	105.5	V501 A548 F549	V501-I503 PolarHBondContact O-N 3.49Å; I503-A548 HydrophobicContact CD1-CB 3.6Å; I503-F549 VanDerWaalsContact C-CE1 3.45Å; I503-F549 HydrophobicContact CB-CE1 4.23Å; I503-F549 HydrophobicContact CB-CE2 4.13Å; I503-F549 HydrophobicContact CB-CZ 4.01Å; I503-F549 HydrophobicContact CG2-CD2 4.35Å; I503-F549 HydrophobicContact CG2-CE1 4.02Å; I503-F549 HydrophobicContact CG2-CE2 3.52Å; I503-F549 HydrophobicContact CG2-CZ 3.35Å; I503-F549 WeakPolarHBondContact O-CD1 3.41Å; I503-F549 WeakPolarHBondContact O-CE1 3.22Å
504	G	29.1	Very low	30.9	Very low	25 Å²	25	90.2 Å²	90.2	26%	0.258	53%	0.525	S	S	.	.			trans	-163.5	140.1	-174.6	0	0	0	0	0	108.3	V502 T506	V502-G504 PolarHBondContact O-N 2.85Å; G504-T506 PolarHBondContact O-N 2.71Å
505	M	33.1	Very low	31.1	Very low	76 Å²	76	90 Å²	90	37%	0.374	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	14.8	178.2	-63.9	-162	-173.8	0	0	113.3	R678 D679 D697	M505-R678 PolarHBondContact O-NH1 2.85Å; M505-D679 HydrophobicContact CE-CB 3.93Å; M505-D697 VanDerWaalsContact CE-OD1 3.25Å; M505-D697 WeakPolarHBondContact CE-OD1 3.32Å
506	T	37	Very low	31.6	Very low	65 Å²	65	89 Å²	89	40%	0.399	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.1	-6.5	-154	43.3	0	0	0	0	115	G504 D584	G504-T506 PolarHBondContact O-N 2.71Å; T506-D584 WeakPolarHBondContact CB-OD2 3.22Å; T506-D584 PolarHBondContact OG1-OD2 2.88Å
507	R	34	Very low	31.9	Very low	175 Å²	175	91.2 Å²	91.2	66%	0.66	50%	0.497	S	S	*	.	S	Bend	trans	-95.3	-3.3	170.9	-93.1	-169.9	178.8	176.1	3	115.2
508	I	31	Very low	31.7	Very low	29 Å²	29	98.7 Å²	98.7	15%	0.149	51%	0.505	C	S	.	.	S	Bend	trans	-88.7	125.8	160.1	-56.4	176.3	0	0	0	105.6	V510 F747	I508-V510 PolarHBondContact O-N 2.66Å; I508-F747 HydrophobicContact CD1-CE2 4.23Å
509	P	26.5	Very low	31.6	Very low	82 Å²	82	102.6 Å²	102.6	53%	0.532	52%	0.516	S	S	.	.			trans	-52.1	142.6	176.7	22.1	-32.8	0	0	0	109.4	I511	P509-I511 HydrophobicContact CG-CG1 4.23Å; P509-I511 PolarHBondContact O-N 3.12Å
510	V	29.9	Very low	31.4	Very low	111 Å²	111	100.5 Å²	100.5	67%	0.673	52%	0.521	S	S	*	.			trans	-63.7	96.5	161.3	179.6	0	0	0	0	105	I508 E512	I508-V510 PolarHBondContact O-N 2.66Å; V510-E512 HydrophobicContact CG1-CG 4.1Å; V510-E512 PolarHBondContact O-N 2.74Å
511	I	32.5	Very low	31.5	Very low	100 Å²	100	106 Å²	106	51%	0.513	54%	0.542	S	S	.	.			trans	-70.8	81.7	168.3	-56.5	178.6	0	0	0	104.8	P509 N513	P509-I511 HydrophobicContact CG-CG1 4.23Å; P509-I511 PolarHBondContact O-N 3.12Å; I511-N513 PolarHBondContact O-N 3.08Å
512	E	33.3	Very low	31.5	Very low	125 Å²	125	108.3 Å²	108.3	58%	0.584	55%	0.55	S	S	*	.			trans	-49.2	111.4	160.6	-67.3	-175.3	168.7	0	0	106	V510 P514 F517	V510-E512 HydrophobicContact CG1-CG 4.1Å; V510-E512 PolarHBondContact O-N 2.74Å; E512-P514 WeakPolarHBondContact O-CD 3.47Å; E512-F517 HydrophobicContact CB-CE2 4.19Å; E512-F517 HydrophobicContact CG-CE2 4.43Å; E512-F517 WeakPolarHBondContact OE2-CE2 3.37Å
513	N	31.1	Very low	31.5	Very low	31 Å²	31	111.3 Å²	111.3	17%	0.166	57%	0.572	C	S	.	*			trans	-58.4	114.4	-174.1	175.5	-1.8	0	0	0	107.9	I511 Q515 Y516	I511-N513 PolarHBondContact O-N 3.08Å; N513-Q515 PolarHBondContact O-N 3.37Å; N513-Q515 PolarHBondContact OD1-N 2.67Å; N513-Y516 HydrophobicContact CB-CD2 3.62Å; N513-Y516 HydrophobicContact CB-CE2 3.73Å; N513-Y516 HydrophobicContact CB-CG 4.48Å; N513-Y516 WeakPolarHBondContact ND2-CE2 3.26Å; N513-Y516 PolarHBondContact O-N 2.91Å
514	P	34.7	Very low	31.5	Very low	102 Å²	102	117 Å²	117	66%	0.662	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.4	-12.3	-170.9	-25.6	35.9	0	0	0	113.8	E512	E512-P514 WeakPolarHBondContact O-CD 3.47Å
515	Q	34.3	Very low	32	Very low	150 Å²	150	123.2 Å²	123.2	70%	0.701	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-19.6	174.7	-58.8	-152.3	-4.1	0	0	114.1	N513	N513-Q515 PolarHBondContact O-N 3.37Å; N513-Q515 PolarHBondContact OD1-N 2.67Å
516	Y	37.5	Very low	32.3	Very low	121 Å²	121	124.8 Å²	124.8	48%	0.475	63%	0.632	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.3	-13	-177.3	-60.5	-40	0	0	0	114.7	N513	N513-Y516 HydrophobicContact CB-CD2 3.62Å; N513-Y516 HydrophobicContact CB-CE2 3.73Å; N513-Y516 HydrophobicContact CB-CG 4.48Å; N513-Y516 WeakPolarHBondContact ND2-CE2 3.26Å; N513-Y516 PolarHBondContact O-N 2.91Å
517	F	34.6	Very low	32.7	Very low	149 Å²	149	127.3 Å²	127.3	65%	0.654	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93	14.8	174.7	-79.9	-73.1	0	0	0	114.8	E512 Q519	E512-F517 HydrophobicContact CB-CE2 4.19Å; E512-F517 HydrophobicContact CG-CE2 4.43Å; E512-F517 WeakPolarHBondContact OE2-CE2 3.37Å; F517-Q519 PolarHBondContact O-N 2.9Å
518	R	29.9	Very low	34.1	Very low	221 Å²	221	121.4 Å²	121.4	83%	0.834	63%	0.627	S	S	*	*	S	Bend	trans	-85.2	35.7	170.3	-80.6	-164.9	177	-173.6	1.3	114.4
519	Q	30.2	Very low	36.2	Very low	177 Å²	177	128.9 Å²	128.9	83%	0.827	65%	0.654	S	S	*	*	S	Bend	trans	-167	110.6	159	-104.4	144.3	28.4	0	0	108.5	F517	F517-Q519 PolarHBondContact O-N 2.9Å
520	G	25.7	Very low	39	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	64%	0.636	S	S	*	*			trans	-77	127	-177.3	0	0	0	0	0	112.2
521	H	32.9	Very low	41.9	Very low	184 Å²	184	125.8 Å²	125.8	85%	0.852	63%	0.627	S	S	*	*			trans	-146.3	133.2	155.6	-89.5	-62.7	0	0	0	111.3
522	N	25.8	Very low	44.7	Very low	160 Å²	160	127.7 Å²	127.7	86%	0.856	63%	0.633	S	S	*	*			trans	-47	135.2	179.3	-56.2	-30.1	0	0	0	113.6
523	C	30.2	Very low	47.5	Very low	107 Å²	107	122.4 Å²	122.4	72%	0.723	61%	0.609	S	S	*	*			trans	-151	67.8	156.6	-146.9	0	0	0	0	112.5	K525	C523-K525 PolarHBondContact O-N 2.91Å; C523-K525 VanDerWaalsContact O-N 3.1Å
524	H	28.2	Very low	50.4	Low	197 Å²	197	126.1 Å²	126.1	91%	0.912	62%	0.624	S	S	*	*			trans	-65.2	101.3	151	-77.9	-78.9	0	0	0	107.5
525	K	38.6	Very low	53.1	Low	155 Å²	155	125.4 Å²	125.4	67%	0.674	61%	0.608	S	S	*	*			trans	-84.8	136.2	159.9	-87.2	-175.6	176.1	177	0	108.6	C523	C523-K525 PolarHBondContact O-N 2.91Å; C523-K525 VanDerWaalsContact O-N 3.1Å
526	P	39.4	Very low	55.9	Low	109 Å²	109	127.6 Å²	127.6	71%	0.708	61%	0.61	S	S	*	*			trans	-74.4	143.2	-177.3	31.1	-35.1	0	0	0	111.7	T528	P526-T528 PolarHBondContact O-N 2.55Å
527	D	45.7	Very low	58.5	Low	119 Å²	119	122.9 Å²	122.9	64%	0.636	59%	0.593	S	S	*	*			trans	12.3	94.2	164.8	-55	-13.3	0	0	0	116.5	Y529	D527-Y529 HydrophobicContact CB-CD2 4.35Å; D527-Y529 HydrophobicContact CB-CE2 3.74Å; D527-Y529 VanDerWaalsContact O-CD2 3.3Å; D527-Y529 WeakPolarHBondContact O-CD2 3.24Å; D527-Y529 PolarHBondContact O-N 3.15Å; D527-Y529 VanDerWaalsContact O-N 3.08Å
528	T	63.3	Low	61.3	Low	50 Å²	50	116.7 Å²	116.7	31%	0.307	57%	0.566	S	S	.	*			trans	-73.1	98.3	168.7	-57.3	0	0	0	0	109.5	P526 V530 T593 N594	P526-T528 PolarHBondContact O-N 2.55Å; T528-V530 PolarHBondContact O-N 2.94Å; T528-T593 HydrophobicContact CG2-CG2 3.56Å; T528-N594 WeakPolarHBondContact CG2-ND2 3.37Å; T528-N594 PolarHBondContact OG1-ND2 3.12Å; T528-N594 PolarHBondContact OG1-OD1 2.87Å
529	Y	76.7	Confident	64.3	Low	186 Å²	186	108.9 Å²	108.9	73%	0.729	54%	0.543	S	S	*	.			trans	-74.9	109.4	174.9	-67.3	-79.5	0	0	0	111.8	D527	D527-Y529 HydrophobicContact CB-CD2 4.35Å; D527-Y529 HydrophobicContact CB-CE2 3.74Å; D527-Y529 VanDerWaalsContact O-CD2 3.3Å; D527-Y529 WeakPolarHBondContact O-CD2 3.24Å; D527-Y529 PolarHBondContact O-N 3.15Å; D527-Y529 VanDerWaalsContact O-N 3.08Å
530	V	84.7	Confident	67.3	Low	26 Å²	26	104.6 Å²	104.6	16%	0.158	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-65.3	131.3	167.8	-176.9	0	0	0	0	109.2	T528 H532 A589 E590 F603 V606	T528-V530 PolarHBondContact O-N 2.94Å; V530-H532 PolarHBondContact O-CD2 2.98Å; V530-H532 PolarHBondContact O-N 2.69Å; V530-A589 HydrophobicContact CG1-CB 4.04Å; V530-A589 HydrophobicContact CG2-CB 4.24Å; V530-E590 HydrophobicContact CG2-CB 4.46Å; V530-E590 HydrophobicContact CG2-CG 3.81Å; V530-F603 HydrophobicContact CG1-CE1 4.17Å; V530-F603 HydrophobicContact CG1-CZ 4.42Å; V530-V606 HydrophobicContact CG1-CB 4.44Å; V530-V606 HydrophobicContact CG1-CG1 3.94Å; V530-V606 HydrophobicContact CG1-CG2 3.82Å
531	Q	90.5	Very high	70.3	Confident	102 Å²	102	106.2 Å²	106.2	48%	0.477	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-71.5	122.2	177.5	175.6	169.2	-7.1	0	0	110.7	I533 Y604 G605 V606	Q531-I533 HydrophobicContact CG-CG1 4.41Å; Q531-Y604 WeakPolarHBondContact CB-O 3.03Å; Q531-Y604 PolarHBondContact OE1-O 3.44Å; Q531-G605 CarbonylContact O-C 3.56Å; Q531-G605 WeakPolarHBondContact O-CA 3.23Å; Q531-V606 PolarHBondContact O-N 2.83Å
532	H	91.4	Very high	72.8	Confident	140 Å²	140	104.2 Å²	104.2	65%	0.648	50%	0.497	S	S	*	.	B	Isolated β-bridge	trans	-88.1	124.3	172.8	-75.7	-108.1	0	0	0	111	V530 V606	V530-H532 PolarHBondContact O-CD2 2.98Å; V530-H532 PolarHBondContact O-N 2.69Å; H532-V606 CarbonylContact C-O 3.55Å; H532-V606 WeakPolarHBondContact CA-O 3.47Å
533	I	92.2	Very high	75.7	Confident	14 Å²	14	100.5 Å²	100.5	7%	0.072	48%	0.475	C	S	.	.			trans	-108.2	128.2	177.1	-60	167.9	0	0	0	107.5	Q531 I538 L560 V606 C607 V616	Q531-I533 HydrophobicContact CG-CG1 4.41Å; I533-I538 HydrophobicContact CG2-CD1 3.83Å; I533-I538 HydrophobicContact CG2-CG1 3.78Å; I533-L560 HydrophobicContact CD1-CD1 4.06Å; I533-L560 HydrophobicContact CD1-CD2 4.35Å; I533-L560 HydrophobicContact CG1-CD1 4.44Å; I533-V606 PolarHBondContact N-O 3.19Å; I533-C607 WeakPolarHBondContact O-CA 3.42Å; I533-C607 WeakPolarHBondContact O-CB 3.15Å; I533-V616 HydrophobicContact CD1-CB 3.67Å; I533-V616 HydrophobicContact CD1-CG1 4.02Å; I533-V616 HydrophobicContact CD1-CG2 3.67Å
534	K	91.6	Very high	78.1	Confident	109 Å²	109	97.6 Å²	97.6	47%	0.474	45%	0.452	S	S	.	.			trans	-75.7	140.6	-176.1	-56.4	178.9	177.2	-178.1	0	110.2	R536 D537	K534-R536 HydrophobicContact CB-CG 4.16Å; K534-R536 PolarHBondContact O-N 3.12Å; K534-R536 VanDerWaalsContact O-N 3.09Å; K534-D537 WeakPolarHBondContact CB-OD2 3.4Å; K534-D537 WeakPolarHBondContact O-CB 3.37Å; K534-D537 PolarHBondContact O-N 2.84Å
535	R	92	Very high	80.2	Confident	88 Å²	88	89 Å²	89	33%	0.332	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-53.8	-38.5	-177.5	-158.8	179.4	-163.4	81.7	3.4	113.5	D537 I538 D609 G610 D611 P612	R535-D537 PolarHBondContact O-N 3.27Å; R535-I538 PolarHBondContact O-N 3.39Å; R535-D609 HydrophobicContact CB-CB 4.06Å; R535-D609 WeakPolarHBondContact CD-O 3.44Å; R535-D609 PolarHBondContact N-OD2 2.96Å; R535-D609 PolarHBondContact NH1-O 3.37Å; R535-G610 PolarHBondContact NH1-O 3.31Å; R535-D611 PolarHBondContact NH2-O 3.43Å; R535-P612 PolarHBondContact NH1-O 3.17Å; R535-P612 VanDerWaalsContact NH1-O 3.16Å
536	R	92.2	Very high	81.7	Confident	196 Å²	196	84.1 Å²	84.1	74%	0.74	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-64	-22.8	178.2	73	-172	-173.9	-172.5	7.7	114.8	K534 I538	K534-R536 HydrophobicContact CB-CG 4.16Å; K534-R536 PolarHBondContact O-N 3.12Å; K534-R536 VanDerWaalsContact O-N 3.09Å; R536-I538 VanDerWaalsContact C-N 3.27Å
537	D	93.4	Very high	82.8	Confident	22 Å²	22	79 Å²	79	12%	0.118	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-84.8	-2.9	177.3	-67.5	-55.7	0	0	0	111.3	K534 R535 C557 Y558 N559	K534-D537 WeakPolarHBondContact CB-OD2 3.4Å; K534-D537 WeakPolarHBondContact O-CB 3.37Å; K534-D537 PolarHBondContact O-N 2.84Å; R535-D537 PolarHBondContact O-N 3.27Å; D537-C557 CarbonylContact O-C 3.55Å; D537-C557 VanDerWaalsContact O-CA 3.24Å; D537-C557 WeakPolarHBondContact O-CA 3.03Å; D537-Y558 PolarHBondContact O-N 2.85Å; D537-N559 PolarHBondContact OD1-ND2 2.94Å
538	I	93.3	Very high	83.4	Confident	18 Å²	18	76 Å²	76	9%	0.092	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.6	179.8	-55.1	177.1	0	0	0	110	I533 R535 R536 L540 A555 V571 C607 I614 V616	I533-I538 HydrophobicContact CG2-CD1 3.83Å; I533-I538 HydrophobicContact CG2-CG1 3.78Å; R535-I538 PolarHBondContact O-N 3.39Å; R536-I538 VanDerWaalsContact C-N 3.27Å; I538-L540 HydrophobicContact CG2-CD2 4.05Å; I538-A555 HydrophobicContact CG2-CB 3.98Å; I538-V571 HydrophobicContact CG2-CG2 3.8Å; I538-C607 HydrophobicContact CD1-CB 3.75Å; I538-I614 HydrophobicContact CD1-CG2 3.85Å; I538-V616 HydrophobicContact CD1-CG2 3.79Å
539	V	92.9	Very high	83.2	Confident	57 Å²	57	76.2 Å²	76.2	35%	0.345	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	98.4	177.5	-178.6	0	0	0	0	109.8	A555 E556 Y558	V539-A555 CarbonylContact O-C 3.6Å; V539-A555 VanDerWaalsContact O-CA 3.26Å; V539-A555 WeakPolarHBondContact O-CA 3.49Å; V539-A555 WeakPolarHBondContact O-CB 3.32Å; V539-E556 HydrophobicContact CB-CB 4.43Å; V539-E556 PolarHBondContact N-O 2.89Å; V539-E556 PolarHBondContact O-N 2.8Å; V539-Y558 HydrophobicContact CB-CE2 4.35Å; V539-Y558 HydrophobicContact CG2-CD2 4.27Å; V539-Y558 HydrophobicContact CG2-CE2 3.76Å
540	L	92.7	Very high	83	Confident	87 Å²	87	67.5 Å²	67.5	46%	0.455	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	140.8	176	-52.6	-176.4	0	0	0	110.9	I538 F553 A555 V571	I538-L540 HydrophobicContact CG2-CD2 4.05Å; L540-F553 HydrophobicContact CD1-CD2 4.47Å; L540-F553 HydrophobicContact CD1-CG 4.43Å; L540-F553 HydrophobicContact CD2-CB 4.03Å; L540-F553 HydrophobicContact CD2-CG 4.35Å; L540-A555 HydrophobicContact CD2-CB 3.98Å; L540-V571 HydrophobicContact CD2-CB 4.18Å; L540-V571 HydrophobicContact CD2-CG1 3.86Å; L540-V571 HydrophobicContact CD2-CG2 4.4Å
541	K	88.6	Confident	82.9	Confident	104 Å²	104	69.4 Å²	69.4	45%	0.452	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	-51.9	-177.6	-61.4	-60.5	-174.5	-176.6	0	113.6	L554 E556	K541-L554 WeakPolarHBondContact CA-O 3.49Å; K541-L554 HydrophobicContact CB-CG 4.35Å; K541-L554 WeakPolarHBondContact CB-O 3.34Å; K541-L554 PolarHBondContact N-O 3.24Å; K541-E556 WeakPolarHBondContact CE-OE2 3.24Å; K541-E556 IonicContact NZ-OE1 3.75Å; K541-E556 IonicContact NZ-OE2 2.64Å; K541-E556 PolarHBondContact NZ-OE2 2.92Å
542	R	85.9	Confident	82.7	Confident	143 Å²	143	64.9 Å²	64.9	54%	0.54	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	154.9	178.6	65.5	173.5	-174.8	-173.2	1.3	110.4	F553 L554	R542-F553 CarbonylContact O-C 3.35Å; R542-F553 VanDerWaalsContact O-CA 3.28Å; R542-F553 WeakPolarHBondContact O-CA 3.3Å; R542-L554 HydrophobicContact CG-CB 3.95Å; R542-L554 HydrophobicContact CG-CD2 4.25Å; R542-L554 PolarHBondContact N-O 2.81Å; R542-L554 PolarHBondContact O-N 3.11Å
543	E	86.7	Confident	82.7	Confident	82 Å²	82	60 Å²	60	38%	0.383	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	141.3	167	-151.6	176.4	110.3	0	0	110.4	K551 F553	E543-K551 IonicContact OE1-NZ 3.76Å; E543-K551 PolarHBondContact OE1-NZ 2.83Å; E543-K551 WeakPolarHBondContact OE2-CD 3.44Å; E543-K551 IonicContact OE2-NZ 2.78Å; E543-K551 PolarHBondContact OE2-NZ 3.3Å; E543-F553 HydrophobicContact CB-CD1 4.14Å; E543-F553 HydrophobicContact CB-CE1 4.1Å; E543-F553 HydrophobicContact CG-CD1 4.23Å; E543-F553 HydrophobicContact CG-CE1 4Å
544	L	80.2	Confident	82.6	Confident	45 Å²	45	60.2 Å²	60.2	24%	0.236	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	-12.6	173.6	-67.7	175.7	0	0	0	112	V552 L554 Y619 R702	L544-V552 PolarHBondContact N-O 2.94Å; L544-L554 HydrophobicContact CD1-CB 3.98Å; L544-L554 HydrophobicContact CD2-CB 4.06Å; L544-L554 HydrophobicContact CG-CB 3.97Å; L544-Y619 HydrophobicContact CD1-CD2 4.07Å; L544-Y619 HydrophobicContact CD1-CE2 3.86Å; L544-Y619 HydrophobicContact CD2-CE2 4.18Å; L544-R702 PolarHBondContact O-NE 3.49Å; L544-R702 PolarHBondContact O-NH2 2.95Å
545	G	71.6	Confident	82.7	Confident	16 Å²	16	55 Å²	55	17%	0.165	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	151.5	161.9	174.8	0	0	0	0	0	111.4	V552	G545-V552 PolarHBondContact N-O 3.22Å; G545-V552 PolarHBondContact O-N 3.15Å
546	E	70.1	Confident	82.8	Confident	54 Å²	54	52 Å²	52	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	145	174.3	-172.6	163.4	177.7	0	0	108.4	K551 K575 R702	E546-K551 HydrophobicContact CB-CG 4.2Å; E546-K551 HydrophobicContact CG-CG 3.81Å; E546-K551 WeakPolarHBondContact OE2-CE 3.41Å; E546-K551 IonicContact OE2-NZ 3.19Å; E546-K551 PolarHBondContact OE2-NZ 3.32Å; E546-K575 WeakPolarHBondContact OE1-CE 3.41Å; E546-K575 IonicContact OE1-NZ 3.71Å; E546-K575 PolarHBondContact OE1-NZ 3.38Å; E546-R702 VanDerWaalsContact O-CA 3.24Å; E546-R702 WeakPolarHBondContact O-CA 3.45Å; E546-R702 WeakPolarHBondContact O-CB 3.32Å
547	G	62.3	Low	82.9	Confident	2 Å²	2	42.7 Å²	42.7	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	-177.4	172.2	0	0	0	0	0	110.2	F549 G550 K575 S701	G547-F549 PolarHBondContact O-N 3.3Å; G547-G550 PolarHBondContact N-O 2.83Å; G547-G550 PolarHBondContact O-N 2.78Å; G547-K575 PolarHBondContact O-NZ 2.98Å; G547-S701 WeakPolarHBondContact CA-O 3.19Å
548	A	58.3	Low	82.8	Confident	54 Å²	54	45.5 Å²	45.5	45%	0.446	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.7	-168.1	0	0	0	0	0	115	I503	I503-A548 HydrophobicContact CD1-CB 3.6Å
549	F	60.8	Low	82.5	Confident	56 Å²	56	49 Å²	49	25%	0.246	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	-7.7	-173.4	-49.8	-132.4	0	0	0	112.9	I503 G547 K575 G699	I503-F549 VanDerWaalsContact C-CE1 3.45Å; I503-F549 HydrophobicContact CB-CE1 4.23Å; I503-F549 HydrophobicContact CB-CE2 4.13Å; I503-F549 HydrophobicContact CB-CZ 4.01Å; I503-F549 HydrophobicContact CG2-CD2 4.35Å; I503-F549 HydrophobicContact CG2-CE1 4.02Å; I503-F549 HydrophobicContact CG2-CE2 3.52Å; I503-F549 HydrophobicContact CG2-CZ 3.35Å; I503-F549 WeakPolarHBondContact O-CD1 3.41Å; I503-F549 WeakPolarHBondContact O-CE1 3.22Å; G547-F549 PolarHBondContact O-N 3.3Å; F549-K575 PolarHBondContact O-N 2.96Å; F549-G699 VanDerWaalsContact CB-O 3.23Å; F549-G699 WeakPolarHBondContact CB-O 3.3Å; F549-G699 WeakPolarHBondContact CD2-O 3.33Å; F549-G699 VanDerWaalsContact CG-O 3.26Å; F549-G699 WeakPolarHBondContact CG-O 3.27Å; F549-G699 VanDerWaalsContact CZ-CA 3.43Å
550	G	71.4	Confident	82.3	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.2	164.6	-168	0	0	0	0	0	115.7	G547 A573	G547-G550 PolarHBondContact N-O 2.83Å; G547-G550 PolarHBondContact O-N 2.78Å; G550-A573 CarbonylContact C-O 3.48Å; G550-A573 WeakPolarHBondContact CA-O 3.29Å
551	K	83.2	Confident	81.8	Confident	67 Å²	67	44.1 Å²	44.1	29%	0.291	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	141.2	165.5	-76.7	177.2	172.5	-74.7	0	109.3	E543 E546 F553 A573	E543-K551 IonicContact OE1-NZ 3.76Å; E543-K551 PolarHBondContact OE1-NZ 2.83Å; E543-K551 WeakPolarHBondContact OE2-CD 3.44Å; E543-K551 IonicContact OE2-NZ 2.78Å; E543-K551 PolarHBondContact OE2-NZ 3.3Å; E546-K551 HydrophobicContact CB-CG 4.2Å; E546-K551 HydrophobicContact CG-CG 3.81Å; E546-K551 WeakPolarHBondContact OE2-CE 3.41Å; E546-K551 IonicContact OE2-NZ 3.19Å; E546-K551 PolarHBondContact OE2-NZ 3.32Å; K551-F553 HydrophobicContact CB-CD2 4.44Å; K551-F553 HydrophobicContact CB-CE2 3.53Å; K551-F553 HydrophobicContact CB-CZ 3.69Å; K551-F553 HydrophobicContact CD-CZ 3.97Å; K551-F553 HydrophobicContact CG-CZ 4.47Å; K551-A573 PolarHBondContact N-O 3.26Å; K551-A573 VanDerWaalsContact N-O 3.12Å; K551-A573 PolarHBondContact O-N 3.22Å
552	V	86.9	Confident	81.3	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.042	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	131.4	176.5	179.5	0	0	0	0	111	L544 G545 A570 V571 K572 M700	L544-V552 PolarHBondContact N-O 2.94Å; G545-V552 PolarHBondContact N-O 3.22Å; G545-V552 PolarHBondContact O-N 3.15Å; V552-A570 HydrophobicContact CG1-CB 4.46Å; V552-V571 CarbonylContact C-O 3.39Å; V552-V571 VanDerWaalsContact CA-O 3.25Å; V552-V571 WeakPolarHBondContact CA-O 3.26Å; V552-K572 HydrophobicContact CG2-CB 3.94Å; V552-K572 HydrophobicContact CG2-CG 4.06Å; V552-M700 HydrophobicContact CB-CE 3.84Å; V552-M700 HydrophobicContact CG1-CE 3.84Å; V552-M700 HydrophobicContact CG2-CE 3.35Å; V552-M700 HydrophobicContact CG2-CG 3.91Å; V552-M700 HydrophobicContact CG2-SD 3.48Å; V552-M700 WeakPolarHBondContact CG2-SD 3.44Å
553	F	90.4	Very high	81	Confident	38 Å²	38	43.8 Å²	43.8	17%	0.167	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.3	-174.3	-59.2	-87.6	0	0	0	111.3	L540 R542 E543 K551 A570 V571 A573	L540-F553 HydrophobicContact CD1-CD2 4.47Å; L540-F553 HydrophobicContact CD1-CG 4.43Å; L540-F553 HydrophobicContact CD2-CB 4.03Å; L540-F553 HydrophobicContact CD2-CG 4.35Å; R542-F553 CarbonylContact O-C 3.35Å; R542-F553 VanDerWaalsContact O-CA 3.28Å; R542-F553 WeakPolarHBondContact O-CA 3.3Å; E543-F553 HydrophobicContact CB-CD1 4.14Å; E543-F553 HydrophobicContact CB-CE1 4.1Å; E543-F553 HydrophobicContact CG-CD1 4.23Å; E543-F553 HydrophobicContact CG-CE1 4Å; K551-F553 HydrophobicContact CB-CD2 4.44Å; K551-F553 HydrophobicContact CB-CE2 3.53Å; K551-F553 HydrophobicContact CB-CZ 3.69Å; K551-F553 HydrophobicContact CD-CZ 3.97Å; K551-F553 HydrophobicContact CG-CZ 4.47Å; F553-A570 CarbonylContact O-C 3.55Å; F553-A570 WeakPolarHBondContact O-CA 3.09Å; F553-V571 HydrophobicContact CB-CB 4.45Å; F553-V571 PolarHBondContact N-O 2.77Å; F553-V571 PolarHBondContact O-N 2.71Å; F553-A573 HydrophobicContact CD2-CB 4.43Å; F553-A573 HydrophobicContact CE2-CB 4.09Å
554	L	90.6	Very high	80.5	Confident	17 Å²	17	46.8 Å²	46.8	9%	0.089	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	130.2	155.9	175.7	59.3	0	0	0	107.3	K541 R542 L544 L568 Y619	K541-L554 WeakPolarHBondContact CA-O 3.49Å; K541-L554 HydrophobicContact CB-CG 4.35Å; K541-L554 WeakPolarHBondContact CB-O 3.34Å; K541-L554 PolarHBondContact N-O 3.24Å; R542-L554 HydrophobicContact CG-CB 3.95Å; R542-L554 HydrophobicContact CG-CD2 4.25Å; R542-L554 PolarHBondContact N-O 2.81Å; R542-L554 PolarHBondContact O-N 3.11Å; L544-L554 HydrophobicContact CD1-CB 3.98Å; L544-L554 HydrophobicContact CD2-CB 4.06Å; L544-L554 HydrophobicContact CG-CB 3.97Å; L554-L568 HydrophobicContact CD1-CB 4.16Å; L554-L568 HydrophobicContact CD1-CD2 4.11Å; L554-Y619 HydrophobicContact CD1-CD1 3.85Å; L554-Y619 HydrophobicContact CD1-CD2 3.63Å; L554-Y619 HydrophobicContact CD1-CE1 3.99Å; L554-Y619 HydrophobicContact CD1-CE2 3.78Å; L554-Y619 HydrophobicContact CD1-CG 3.66Å
555	A	94.3	Very high	80.4	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	158.5	174.1	0	0	0	0	0	111.5	I538 V539 L540 L568 V569 V571	I538-A555 HydrophobicContact CG2-CB 3.98Å; V539-A555 CarbonylContact O-C 3.6Å; V539-A555 VanDerWaalsContact O-CA 3.26Å; V539-A555 WeakPolarHBondContact O-CA 3.49Å; V539-A555 WeakPolarHBondContact O-CB 3.32Å; L540-A555 HydrophobicContact CD2-CB 3.98Å; A555-L568 WeakPolarHBondContact O-CA 3.26Å; A555-V569 HydrophobicContact CB-CG2 3.9Å; A555-V569 PolarHBondContact N-O 2.71Å; A555-V569 PolarHBondContact O-N 3.11Å; A555-V571 HydrophobicContact CB-CB 4.47Å; A555-V571 HydrophobicContact CB-CG2 3.77Å
556	E	93.4	Very high	81.1	Confident	25 Å²	25	54.1 Å²	54.1	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.3	158.4	-77.4	173.6	167.6	0	0	108.2	V539 K541 Y558 K566 M567 L568	V539-E556 HydrophobicContact CB-CB 4.43Å; V539-E556 PolarHBondContact N-O 2.89Å; V539-E556 PolarHBondContact O-N 2.8Å; K541-E556 WeakPolarHBondContact CE-OE2 3.24Å; K541-E556 IonicContact NZ-OE1 3.75Å; K541-E556 IonicContact NZ-OE2 2.64Å; K541-E556 PolarHBondContact NZ-OE2 2.92Å; E556-Y558 HydrophobicContact CB-CE2 4.01Å; E556-Y558 PolarHBondContact OE2-OH 2.83Å; E556-Y558 VanDerWaalsContact OE2-OH 3.11Å; E556-K566 HydrophobicContact CG-CD 4.41Å; E556-K566 WeakPolarHBondContact OE1-CE 3.46Å; E556-K566 IonicContact OE1-NZ 3.96Å; E556-K566 PolarHBondContact OE1-NZ 2.92Å; E556-K566 IonicContact OE2-NZ 3.43Å; E556-M567 CarbonylContact C-O 3.59Å; E556-M567 WeakPolarHBondContact CA-O 3.06Å; E556-L568 HydrophobicContact CG-CD2 3.85Å
557	C	93.8	Very high	82.1	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.1	170.2	-166.9	0	0	0	0	110.5	D537 L560 K566 M567 V569	D537-C557 CarbonylContact O-C 3.55Å; D537-C557 VanDerWaalsContact O-CA 3.24Å; D537-C557 WeakPolarHBondContact O-CA 3.03Å; C557-L560 HydrophobicContact CB-CB 4.4Å; C557-L560 HydrophobicContact CB-CD2 4Å; C557-K566 WeakPolarHBondContact O-CA 3.22Å; C557-M567 PolarHBondContact N-O 2.82Å; C557-M567 PolarHBondContact O-N 3.45Å; C557-V569 HydrophobicContact CB-CB 4.43Å; C557-V569 HydrophobicContact CB-CG1 3.77Å; C557-V569 HydrophobicContact CB-CG2 3.73Å
558	Y	91.8	Very high	83.5	Confident	82 Å²	82	57.5 Å²	57.5	32%	0.322	30%	0.301	S	S	.	.	S	Bend	trans	-95.9	158.8	177.8	-66.2	-101.2	0	0	0	109.7	D537 V539 E556 L560 K566	D537-Y558 PolarHBondContact O-N 2.85Å; V539-Y558 HydrophobicContact CB-CE2 4.35Å; V539-Y558 HydrophobicContact CG2-CD2 4.27Å; V539-Y558 HydrophobicContact CG2-CE2 3.76Å; E556-Y558 HydrophobicContact CB-CE2 4.01Å; E556-Y558 PolarHBondContact OE2-OH 2.83Å; E556-Y558 VanDerWaalsContact OE2-OH 3.11Å; Y558-L560 PolarHBondContact O-N 2.75Å; Y558-K566 HydrophobicContact CD1-CB 3.91Å; Y558-K566 HydrophobicContact CE1-CB 3.64Å; Y558-K566 HydrophobicContact CE1-CD 4.15Å; Y558-K566 HydrophobicContact CE1-CG 4.44Å; Y558-K566 HydrophobicContact CE2-CB 4.25Å; Y558-K566 HydrophobicContact CG-CB 4.33Å; Y558-K566 WeakPolarHBondContact OH-CD 3.05Å
559	N	87.6	Confident	85.2	Confident	92 Å²	92	54.9 Å²	54.9	49%	0.492	28%	0.279	S	S	.	.	S	Bend	trans	59.4	4.6	176.5	-61.8	-60.2	0	0	0	116.6	D537	D537-N559 PolarHBondContact OD1-ND2 2.94Å
560	L	87.6	Confident	86.7	Confident	23 Å²	23	53 Å²	53	12%	0.12	27%	0.274	C	S	.	.			trans	-90.6	-30.7	-179.3	-178.5	61.2	0	0	0	113.2	I533 C557 Y558 M567 V569 Y604 V616	I533-L560 HydrophobicContact CD1-CD1 4.06Å; I533-L560 HydrophobicContact CD1-CD2 4.35Å; I533-L560 HydrophobicContact CG1-CD1 4.44Å; C557-L560 HydrophobicContact CB-CB 4.4Å; C557-L560 HydrophobicContact CB-CD2 4Å; Y558-L560 PolarHBondContact O-N 2.75Å; L560-M567 HydrophobicContact CB-CG 4.42Å; L560-M567 HydrophobicContact CB-SD 3.88Å; L560-M567 HydrophobicContact CD2-CE 4.3Å; L560-M567 HydrophobicContact CD2-CG 4.37Å; L560-M567 HydrophobicContact CD2-SD 3.8Å; L560-M567 HydrophobicContact CG-SD 3.71Å; L560-V569 HydrophobicContact CD2-CG1 3.9Å; L560-Y604 HydrophobicContact CD1-CD1 4.34Å; L560-Y604 HydrophobicContact CD1-CG 4.34Å; L560-Y604 HydrophobicContact CD2-CD1 4.24Å; L560-Y604 HydrophobicContact CD2-CD2 3.81Å; L560-Y604 HydrophobicContact CD2-CE2 4.37Å; L560-Y604 HydrophobicContact CD2-CG 3.75Å; L560-Y604 HydrophobicContact CG-CD1 4.44Å; L560-Y604 HydrophobicContact CG-CG 4.39Å; L560-V616 HydrophobicContact CD2-CG1 4.42Å
561	S	81.5	Confident	87.6	Confident	18 Å²	18	52.9 Å²	52.9	13%	0.126	27%	0.273	C	S	.	.	S	Bend	trans	-77.6	151.7	174.8	68	0	0	0	0	111.1	T563 K564 D565	S561-T563 PolarHBondContact O-N 2.84Å; S561-T563 PolarHBondContact OG-OG1 2.83Å; S561-K564 WeakPolarHBondContact O-CA 3.43Å; S561-K564 PolarHBondContact O-N 2.88Å; S561-K564 WeakPolarHBondContact OG-CA 3.19Å; S561-K564 PolarHBondContact OG-N 2.78Å; S561-D565 PolarHBondContact OG-N 3.45Å; S561-D565 PolarHBondContact OG-O 2.79Å
562	P	78.5	Confident	87.9	Confident	139 Å²	139	49.7 Å²	49.7	90%	0.903	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-28.2	175.1	-25.9	35.4	0	0	0	114	K564	P562-K564 VanDerWaalsContact C-N 3.28Å
563	T	80.9	Confident	87.9	Confident	100 Å²	100	49.8 Å²	49.8	61%	0.613	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.3	174.7	59.3	0	0	0	0	113.1	S561 D565	S561-T563 PolarHBondContact O-N 2.84Å; S561-T563 PolarHBondContact OG-OG1 2.83Å; T563-D565 WeakPolarHBondContact CB-OD2 3.49Å; T563-D565 PolarHBondContact O-N 2.82Å; T563-D565 PolarHBondContact OG1-OD2 3.41Å
564	K	75.1	Confident	87.3	Confident	145 Å²	145	48.9 Å²	48.9	63%	0.63	26%	0.257	S	S	*	.			trans	62.5	4.4	-171.1	-56.6	-176.2	179.2	-179.5	0	115.6	S561 P562	S561-K564 WeakPolarHBondContact O-CA 3.43Å; S561-K564 PolarHBondContact O-N 2.88Å; S561-K564 WeakPolarHBondContact OG-CA 3.19Å; S561-K564 PolarHBondContact OG-N 2.78Å; P562-K564 VanDerWaalsContact C-N 3.28Å
565	D	79.1	Confident	86.2	Confident	102 Å²	102	53.4 Å²	53.4	55%	0.545	28%	0.276	S	S	.	.			trans	-59.6	149.8	168.9	-67.1	-58	0	0	0	111.4	S561 T563	S561-D565 PolarHBondContact OG-N 3.45Å; S561-D565 PolarHBondContact OG-O 2.79Å; T563-D565 WeakPolarHBondContact CB-OD2 3.49Å; T563-D565 PolarHBondContact O-N 2.82Å; T563-D565 PolarHBondContact OG1-OD2 3.41Å
566	K	86.5	Confident	85	Confident	113 Å²	113	55.6 Å²	55.6	49%	0.491	29%	0.288	S	S	.	.			trans	-61.9	136.3	171.5	68	-179.4	-170.3	161	0	110.8	E556 C557 Y558	E556-K566 HydrophobicContact CG-CD 4.41Å; E556-K566 WeakPolarHBondContact OE1-CE 3.46Å; E556-K566 IonicContact OE1-NZ 3.96Å; E556-K566 PolarHBondContact OE1-NZ 2.92Å; E556-K566 IonicContact OE2-NZ 3.43Å; C557-K566 WeakPolarHBondContact O-CA 3.22Å; Y558-K566 HydrophobicContact CD1-CB 3.91Å; Y558-K566 HydrophobicContact CE1-CB 3.64Å; Y558-K566 HydrophobicContact CE1-CD 4.15Å; Y558-K566 HydrophobicContact CE1-CG 4.44Å; Y558-K566 HydrophobicContact CE2-CB 4.25Å; Y558-K566 HydrophobicContact CG-CB 4.33Å; Y558-K566 WeakPolarHBondContact OH-CD 3.05Å
567	M	89.6	Confident	83.7	Confident	42 Å²	42	58 Å²	58	21%	0.207	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	150.3	176.6	60	-176.1	-70.6	0	0	111.3	E556 C557 L560 V569 Y604	E556-M567 CarbonylContact C-O 3.59Å; E556-M567 WeakPolarHBondContact CA-O 3.06Å; C557-M567 PolarHBondContact N-O 2.82Å; C557-M567 PolarHBondContact O-N 3.45Å; L560-M567 HydrophobicContact CB-CG 4.42Å; L560-M567 HydrophobicContact CB-SD 3.88Å; L560-M567 HydrophobicContact CD2-CE 4.3Å; L560-M567 HydrophobicContact CD2-CG 4.37Å; L560-M567 HydrophobicContact CD2-SD 3.8Å; L560-M567 HydrophobicContact CG-SD 3.71Å; M567-V569 HydrophobicContact CE-CG1 4.33Å; M567-V569 HydrophobicContact CG-CG1 4.23Å; M567-Y604 HydrophobicContact CE-CE1 4.11Å; M567-Y604 HydrophobicContact CE-CE2 3.61Å; M567-Y604 VanDerWaalsContact CE-CZ 3.42Å; M567-Y604 VanDerWaalsContact CE-OH 3.29Å; M567-Y604 WeakPolarHBondContact CE-OH 3.48Å
568	L	91.8	Very high	82.8	Confident	85 Å²	85	60.1 Å²	60.1	45%	0.445	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	130.2	175.2	-65.8	178.6	0	0	0	110.3	L554 A555 E556 Y619	L554-L568 HydrophobicContact CD1-CB 4.16Å; L554-L568 HydrophobicContact CD1-CD2 4.11Å; A555-L568 WeakPolarHBondContact O-CA 3.26Å; E556-L568 HydrophobicContact CG-CD2 3.85Å; L568-Y619 HydrophobicContact CB-CD1 3.96Å; L568-Y619 HydrophobicContact CB-CG 4.37Å; L568-Y619 HydrophobicContact CD1-CD1 4.19Å; L568-Y619 HydrophobicContact CD1-CE1 4.37Å; L568-Y619 WeakPolarHBondContact O-CB 3.43Å
569	V	94.2	Very high	81.9	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	157.1	-179.9	-62.7	0	0	0	0	110.4	A555 C557 L560 M567 V571 Y604 V616 F617	A555-V569 HydrophobicContact CB-CG2 3.9Å; A555-V569 PolarHBondContact N-O 2.71Å; A555-V569 PolarHBondContact O-N 3.11Å; C557-V569 HydrophobicContact CB-CB 4.43Å; C557-V569 HydrophobicContact CB-CG1 3.77Å; C557-V569 HydrophobicContact CB-CG2 3.73Å; L560-V569 HydrophobicContact CD2-CG1 3.9Å; M567-V569 HydrophobicContact CE-CG1 4.33Å; M567-V569 HydrophobicContact CG-CG1 4.23Å; V569-V571 HydrophobicContact CG2-CG2 4.05Å; V569-Y604 HydrophobicContact CG1-CD2 4.07Å; V569-Y604 HydrophobicContact CG1-CE2 4.09Å; V569-V616 HydrophobicContact CB-CG1 3.71Å; V569-V616 HydrophobicContact CG1-CG1 3.9Å; V569-V616 HydrophobicContact CG2-CG1 3.8Å; V569-F617 CarbonylContact C-O 3.59Å; V569-F617 WeakPolarHBondContact CA-O 3.08Å; V569-F617 VanDerWaalsContact CB-O 3.31Å; V569-F617 WeakPolarHBondContact CB-O 3.37Å
570	A	92.1	Very high	81	Confident	15 Å²	15	56.2 Å²	56.2	12%	0.124	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	131.8	164.1	0	0	0	0	0	108.9	V552 F553 F617	V552-A570 HydrophobicContact CG1-CB 4.46Å; F553-A570 CarbonylContact O-C 3.55Å; F553-A570 WeakPolarHBondContact O-CA 3.09Å; A570-F617 HydrophobicContact CB-CB 4.32Å; A570-F617 PolarHBondContact N-O 3.01Å; A570-F617 PolarHBondContact O-N 2.88Å
571	V	91.7	Very high	80.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	112.5	-178.5	161.6	0	0	0	0	108.5	I538 L540 V552 F553 A555 V569 I614 M615 V616	I538-V571 HydrophobicContact CG2-CG2 3.8Å; L540-V571 HydrophobicContact CD2-CB 4.18Å; L540-V571 HydrophobicContact CD2-CG1 3.86Å; L540-V571 HydrophobicContact CD2-CG2 4.4Å; V552-V571 CarbonylContact C-O 3.39Å; V552-V571 VanDerWaalsContact CA-O 3.25Å; V552-V571 WeakPolarHBondContact CA-O 3.26Å; F553-V571 HydrophobicContact CB-CB 4.45Å; F553-V571 PolarHBondContact N-O 2.77Å; F553-V571 PolarHBondContact O-N 2.71Å; A555-V571 HydrophobicContact CB-CB 4.47Å; A555-V571 HydrophobicContact CB-CG2 3.77Å; V569-V571 HydrophobicContact CG2-CG2 4.05Å; V571-I614 HydrophobicContact CG1-CB 4.36Å; V571-I614 HydrophobicContact CG1-CD1 4.21Å; V571-I614 HydrophobicContact CG1-CG1 3.9Å; V571-I614 HydrophobicContact CG1-CG2 3.66Å; V571-I614 HydrophobicContact CG2-CG2 4.4Å; V571-M615 CarbonylContact C-O 3.53Å; V571-M615 WeakPolarHBondContact CA-O 3.09Å; V571-V616 HydrophobicContact CG2-CG2 4.42Å
572	K	87.8	Confident	79.8	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	110.8	170.3	179.2	-165.6	178.2	-161.8	0	107.4	V552 L574 E588 I614 M615 F617 F698 M700	V552-K572 HydrophobicContact CG2-CB 3.94Å; V552-K572 HydrophobicContact CG2-CG 4.06Å; K572-L574 HydrophobicContact CD-CD1 4.42Å; K572-L574 HydrophobicContact CG-CD1 4.41Å; K572-E588 IonicContact NZ-OE1 3.01Å; K572-E588 PolarHBondContact NZ-OE1 2.98Å; K572-E588 IonicContact NZ-OE2 2.78Å; K572-E588 PolarHBondContact NZ-OE2 2.98Å; K572-I614 WeakPolarHBondContact O-CA 3.31Å; K572-M615 HydrophobicContact CB-CB 4.32Å; K572-M615 HydrophobicContact CD-SD 4.24Å; K572-M615 PolarHBondContact N-O 3.48Å; K572-M615 PolarHBondContact O-N 3.22Å; K572-F617 HydrophobicContact CB-CE2 4.04Å; K572-F617 HydrophobicContact CD-CE2 4.5Å; K572-F698 HydrophobicContact CD-CB 4Å; K572-F698 HydrophobicContact CD-CG 4.37Å; K572-M700 HydrophobicContact CD-CG 4.45Å; K572-M700 HydrophobicContact CD-SD 4.48Å; K572-M700 HydrophobicContact CG-SD 4.47Å
573	A	87.4	Confident	79.5	Confident	9 Å²	9	56.8 Å²	56.8	7%	0.074	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	118.7	172.9	0	0	0	0	0	108.6	G550 K551 F553 P612 L613 I614	G550-A573 CarbonylContact C-O 3.48Å; G550-A573 WeakPolarHBondContact CA-O 3.29Å; K551-A573 PolarHBondContact N-O 3.26Å; K551-A573 VanDerWaalsContact N-O 3.12Å; K551-A573 PolarHBondContact O-N 3.22Å; F553-A573 HydrophobicContact CD2-CB 4.43Å; F553-A573 HydrophobicContact CE2-CB 4.09Å; A573-P612 HydrophobicContact CB-CB 4.16Å; A573-P612 HydrophobicContact CB-CG 3.8Å; A573-L613 WeakPolarHBondContact CA-O 3.44Å; A573-I614 HydrophobicContact CB-CG1 4.26Å
574	L	77.1	Confident	78.9	Confident	19 Å²	19	53.3 Å²	53.3	10%	0.099	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	141.2	178.5	-81.6	70.6	0	0	0	110	K572 F585 P612 L613	K572-L574 HydrophobicContact CD-CD1 4.42Å; K572-L574 HydrophobicContact CG-CD1 4.41Å; L574-F585 HydrophobicContact CD1-CD2 3.58Å; L574-F585 HydrophobicContact CD1-CE2 3.81Å; L574-F585 HydrophobicContact CD2-CB 4.03Å; L574-F585 HydrophobicContact CD2-CD2 3.64Å; L574-F585 HydrophobicContact CD2-CG 4.31Å; L574-F585 HydrophobicContact CG-CD2 4.24Å; L574-P612 WeakPolarHBondContact O-CB 3.24Å; L574-L613 PolarHBondContact N-O 3.21Å
575	K	69	Low	79.1	Confident	111 Å²	111	47 Å²	47	48%	0.483	25%	0.245	S	C	.	.	S	Bend	trans	-77.9	-34.7	176.1	-82	166.6	175.8	179.7	0	112.9	E546 G547 F549 P577	E546-K575 WeakPolarHBondContact OE1-CE 3.41Å; E546-K575 IonicContact OE1-NZ 3.71Å; E546-K575 PolarHBondContact OE1-NZ 3.38Å; G547-K575 PolarHBondContact O-NZ 2.98Å; F549-K575 PolarHBondContact O-N 2.96Å; K575-P577 WeakPolarHBondContact O-CD 3.45Å
576	D	67.9	Low	79	Confident	47 Å²	47	47.5 Å²	47.5	25%	0.251	24%	0.243	S	C	.	.			trans	-93.4	117.8	-168.9	-176.8	-1.6	0	0	0	111.1	T578 A581	D576-T578 WeakPolarHBondContact OD1-CB 3.44Å; D576-T578 WeakPolarHBondContact OD1-CG2 3.35Å; D576-T578 PolarHBondContact OD1-N 3.27Å; D576-T578 PolarHBondContact OD1-OG1 2.79Å; D576-T578 PolarHBondContact OD2-OG1 2.89Å; D576-A581 HydrophobicContact CB-CB 3.86Å; D576-A581 WeakPolarHBondContact OD2-CB 3.49Å
577	P	67.2	Low	78.4	Confident	75 Å²	75	48.7 Å²	48.7	49%	0.487	25%	0.245	S	C	.	.			trans	-85.5	-5.9	176.1	35.8	-35.2	0	0	0	113.9	K575 R582	K575-P577 WeakPolarHBondContact O-CD 3.45Å; P577-R582 PolarHBondContact O-NE 3.39Å
578	T	73.9	Confident	77.7	Confident	44 Å²	44	49.3 Å²	49.3	27%	0.27	25%	0.247	S	C	.	.	S	Bend	trans	-56.4	150.8	-173.8	62.2	0	0	0	0	112.7	D576 A580 A581 R582	D576-T578 WeakPolarHBondContact OD1-CB 3.44Å; D576-T578 WeakPolarHBondContact OD1-CG2 3.35Å; D576-T578 PolarHBondContact OD1-N 3.27Å; D576-T578 PolarHBondContact OD1-OG1 2.79Å; D576-T578 PolarHBondContact OD2-OG1 2.89Å; T578-A580 PolarHBondContact O-N 3.26Å; T578-A581 CarbonylContact O-C 3.26Å; T578-A581 WeakPolarHBondContact O-CA 3.35Å; T578-A581 WeakPolarHBondContact O-CB 3.43Å; T578-A581 PolarHBondContact O-N 3.44Å; T578-A581 WeakPolarHBondContact OG1-CB 3.21Å; T578-A581 PolarHBondContact OG1-N 2.84Å; T578-R582 WeakPolarHBondContact O-CG 3.23Å; T578-R582 PolarHBondContact O-N 3.47Å
579	L	72.5	Confident	77.3	Confident	46 Å²	46	45.3 Å²	45.3	24%	0.241	23%	0.227	C	C	.	.	H	α-helix	trans	-62.8	-29.5	-179.5	-158.3	80.8	0	0	0	113.1	R316 R582 K583	R316-L579 HydrophobicContact CB-CD1 3.82Å; R316-L579 HydrophobicContact CB-CD2 4.37Å; R316-L579 HydrophobicContact CG-CD1 4.18Å; R316-L579 HydrophobicContact CG-CD2 3.85Å; L579-R582 PolarHBondContact O-N 2.97Å; L579-K583 WeakPolarHBondContact O-CG 3.49Å; L579-K583 PolarHBondContact O-N 2.9Å
580	A	69.8	Low	76.7	Confident	46 Å²	46	49 Å²	49	38%	0.38	24%	0.244	S	C	.	.	H	α-helix	trans	-60.8	-50.2	171.3	0	0	0	0	0	110.8	V502 T578 R582 K583 D584	V502-A580 HydrophobicContact CG2-CB 4.39Å; T578-A580 PolarHBondContact O-N 3.26Å; A580-R582 VanDerWaalsContact C-N 3.33Å; A580-R582 PolarHBondContact O-N 2.98Å; A580-K583 PolarHBondContact O-N 3.02Å; A580-D584 PolarHBondContact O-N 3.05Å
581	A	69	Low	75.9	Confident	6 Å²	6	51.8 Å²	51.8	5%	0.05	26%	0.256	C	S	.	.	H	α-helix	trans	-62	-36.5	174.3	0	0	0	0	0	112.9	D576 T578 D584 F585	D576-A581 HydrophobicContact CB-CB 3.86Å; D576-A581 WeakPolarHBondContact OD2-CB 3.49Å; T578-A581 CarbonylContact O-C 3.26Å; T578-A581 WeakPolarHBondContact O-CA 3.35Å; T578-A581 WeakPolarHBondContact O-CB 3.43Å; T578-A581 PolarHBondContact O-N 3.44Å; T578-A581 WeakPolarHBondContact OG1-CB 3.21Å; T578-A581 PolarHBondContact OG1-N 2.84Å; A581-D584 PolarHBondContact O-N 3.38Å; A581-F585 WeakPolarHBondContact O-CB 3.21Å; A581-F585 PolarHBondContact O-N 3.46Å
582	R	75.8	Confident	75.5	Confident	55 Å²	55	52.7 Å²	52.7	21%	0.208	26%	0.261	C	S	.	.	H	α-helix	trans	-65.4	-41.1	174.6	-59.7	-159.6	171.2	177.4	-6.5	112.6	P577 T578 L579 A580 Q586 D611 L613	P577-R582 PolarHBondContact O-NE 3.39Å; T578-R582 WeakPolarHBondContact O-CG 3.23Å; T578-R582 PolarHBondContact O-N 3.47Å; L579-R582 PolarHBondContact O-N 2.97Å; A580-R582 VanDerWaalsContact C-N 3.33Å; A580-R582 PolarHBondContact O-N 2.98Å; R582-Q586 PolarHBondContact O-N 3.46Å; R582-Q586 VanDerWaalsContact O-N 3.12Å; R582-D611 IonicContact CZ-OD1 3.86Å; R582-D611 IonicContact CZ-OD2 2.77Å; R582-D611 IonicContact NH2-OD1 3.37Å; R582-D611 PolarHBondContact NH2-OD1 2.89Å; R582-D611 IonicContact NH2-OD2 2.64Å; R582-D611 PolarHBondContact NH2-OD2 2.84Å; R582-L613 HydrophobicContact CB-CD1 4.23Å; R582-L613 HydrophobicContact CG-CD1 3.77Å
583	K	71.9	Confident	75.4	Confident	131 Å²	131	53.9 Å²	53.9	57%	0.57	27%	0.268	S	S	*	.	H	α-helix	trans	-66	-41.7	174.1	-75.4	176.4	179.6	174.1	0	111.6	L579 A580 Q586 R587	L579-K583 WeakPolarHBondContact O-CG 3.49Å; L579-K583 PolarHBondContact O-N 2.9Å; A580-K583 PolarHBondContact O-N 3.02Å; K583-Q586 PolarHBondContact O-N 3.17Å; K583-R587 WeakPolarHBondContact O-CG 3.47Å; K583-R587 PolarHBondContact O-N 3.07Å; K583-R587 VanDerWaalsContact O-N 3.08Å
584	D	68.5	Low	75.2	Confident	27 Å²	27	57.2 Å²	57.2	14%	0.144	29%	0.285	C	S	.	.	H	α-helix	trans	-67.2	-41.6	177.5	-82.7	15.6	0	0	0	111.9	T506 A580 A581 Q586 R587 E588	T506-D584 WeakPolarHBondContact CB-OD2 3.22Å; T506-D584 PolarHBondContact OG1-OD2 2.88Å; A580-D584 PolarHBondContact O-N 3.05Å; A581-D584 PolarHBondContact O-N 3.38Å; D584-Q586 VanDerWaalsContact C-N 3.32Å; D584-Q586 PolarHBondContact O-N 3.18Å; D584-R587 PolarHBondContact O-N 3.36Å; D584-R587 IonicContact OD1-CZ 2.74Å; D584-R587 IonicContact OD1-NE 3.95Å; D584-R587 IonicContact OD1-NH2 3.74Å; D584-R587 PolarHBondContact OD1-NH2 3.09Å; D584-E588 VanDerWaalsContact O-CB 3.26Å; D584-E588 WeakPolarHBondContact O-CB 3.47Å; D584-E588 PolarHBondContact O-N 2.76Å
585	F	78.4	Confident	75.5	Confident	14 Å²	14	57.1 Å²	57.1	6%	0.061	29%	0.285	C	S	.	.	H	α-helix	trans	-55.6	-43.8	171.9	174.6	-86.2	0	0	0	112.4	L574 A581 A589 V606 L613 M615	L574-F585 HydrophobicContact CD1-CD2 3.58Å; L574-F585 HydrophobicContact CD1-CE2 3.81Å; L574-F585 HydrophobicContact CD2-CB 4.03Å; L574-F585 HydrophobicContact CD2-CD2 3.64Å; L574-F585 HydrophobicContact CD2-CG 4.31Å; L574-F585 HydrophobicContact CG-CD2 4.24Å; A581-F585 WeakPolarHBondContact O-CB 3.21Å; A581-F585 PolarHBondContact O-N 3.46Å; F585-A589 VanDerWaalsContact O-CB 3.28Å; F585-A589 WeakPolarHBondContact O-CB 2.92Å; F585-A589 PolarHBondContact O-N 2.83Å; F585-V606 HydrophobicContact CE1-CB 3.81Å; F585-V606 HydrophobicContact CE1-CG1 3.57Å; F585-V606 HydrophobicContact CE1-CG2 4.43Å; F585-V606 HydrophobicContact CZ-CB 3.72Å; F585-V606 HydrophobicContact CZ-CG1 3.55Å; F585-L613 HydrophobicContact CB-CD1 4.24Å; F585-L613 HydrophobicContact CD1-CD1 3.96Å; F585-L613 HydrophobicContact CD2-CB 4.01Å; F585-L613 HydrophobicContact CD2-CD1 4.19Å; F585-L613 HydrophobicContact CE1-CB 4.47Å; F585-L613 HydrophobicContact CE1-CD1 4.31Å; F585-L613 HydrophobicContact CE2-CB 3.7Å; F585-L613 HydrophobicContact CG-CD1 3.89Å; F585-L613 HydrophobicContact CZ-CB 3.95Å; F585-M615 HydrophobicContact CD2-CE 3.59Å; F585-M615 HydrophobicContact CD2-CG 4.06Å; F585-M615 HydrophobicContact CE2-CE 3.95Å; F585-M615 HydrophobicContact CE2-CG 3.49Å; F585-M615 VanDerWaalsContact CE2-CG 3.49Å; F585-M615 HydrophobicContact CE2-SD 4.49Å; F585-M615 HydrophobicContact CG-CE 4.02Å; F585-M615 HydrophobicContact CZ-CG 4.08Å; F585-M615 WeakPolarHBondContact O-CE 3.44Å
586	Q	78.1	Confident	76.5	Confident	112 Å²	112	58.1 Å²	58.1	52%	0.523	29%	0.291	S	S	.	.	H	α-helix	trans	-66	-47.3	177.4	-178	176.9	-16.9	0	0	111.5	R582 K583 D584 E588 A589 E590	R582-Q586 PolarHBondContact O-N 3.46Å; R582-Q586 VanDerWaalsContact O-N 3.12Å; K583-Q586 PolarHBondContact O-N 3.17Å; D584-Q586 VanDerWaalsContact C-N 3.32Å; D584-Q586 PolarHBondContact O-N 3.18Å; Q586-E588 VanDerWaalsContact C-N 3.34Å; Q586-E588 PolarHBondContact O-N 3.03Å; Q586-A589 PolarHBondContact O-N 3.2Å; Q586-E590 HydrophobicContact CG-CG 4.48Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.17Å; Q586-E590 PolarHBondContact NE2-OE1 3.48Å; Q586-E590 WeakPolarHBondContact O-CG 3.5Å; Q586-E590 PolarHBondContact O-N 2.86Å
587	R	73.3	Confident	77.8	Confident	138 Å²	138	58.8 Å²	58.8	52%	0.521	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-42.1	177.6	-68.4	-168.1	-66.9	176.1	0.3	112.3	K583 D584 L591	K583-R587 WeakPolarHBondContact O-CG 3.47Å; K583-R587 PolarHBondContact O-N 3.07Å; K583-R587 VanDerWaalsContact O-N 3.08Å; D584-R587 PolarHBondContact O-N 3.36Å; D584-R587 IonicContact OD1-CZ 2.74Å; D584-R587 IonicContact OD1-NE 3.95Å; D584-R587 IonicContact OD1-NH2 3.74Å; D584-R587 PolarHBondContact OD1-NH2 3.09Å; R587-L591 WeakPolarHBondContact O-CB 3.48Å; R587-L591 PolarHBondContact O-N 3.11Å; R587-L591 VanDerWaalsContact O-N 3.13Å
588	E	75.3	Confident	79.1	Confident	54 Å²	54	61.4 Å²	61.4	25%	0.252	30%	0.298	S	S	.	.	H	α-helix	trans	-61.1	-48.9	174.2	-172.9	-179.1	-169.6	0	0	109.5	K572 D584 Q586 E590 L591 L592 M615 F698	K572-E588 IonicContact NZ-OE1 3.01Å; K572-E588 PolarHBondContact NZ-OE1 2.98Å; K572-E588 IonicContact NZ-OE2 2.78Å; K572-E588 PolarHBondContact NZ-OE2 2.98Å; D584-E588 VanDerWaalsContact O-CB 3.26Å; D584-E588 WeakPolarHBondContact O-CB 3.47Å; D584-E588 PolarHBondContact O-N 2.76Å; Q586-E588 VanDerWaalsContact C-N 3.34Å; Q586-E588 PolarHBondContact O-N 3.03Å; E588-E590 PolarHBondContact O-N 3.35Å; E588-L591 PolarHBondContact O-N 2.86Å; E588-L592 HydrophobicContact CG-CD1 4.03Å; E588-L592 WeakPolarHBondContact O-CB 3.23Å; E588-L592 WeakPolarHBondContact O-CD1 3.47Å; E588-L592 WeakPolarHBondContact O-CG 3.4Å; E588-L592 PolarHBondContact O-N 2.84Å; E588-M615 HydrophobicContact CB-CE 3.83Å; E588-M615 HydrophobicContact CG-CE 3.74Å; E588-M615 HydrophobicContact CG-SD 4.41Å; E588-M615 WeakPolarHBondContact OE2-CE 3.14Å; E588-F698 WeakPolarHBondContact OE1-CD1 3.45Å
589	A	82.7	Confident	80.1	Confident	2 Å²	2	60.1 Å²	60.1	2%	0.017	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-41.3	178.5	0	0	0	0	0	114.4	V530 F585 Q586 T593 F603 V606 M615	V530-A589 HydrophobicContact CG1-CB 4.04Å; V530-A589 HydrophobicContact CG2-CB 4.24Å; F585-A589 VanDerWaalsContact O-CB 3.28Å; F585-A589 WeakPolarHBondContact O-CB 2.92Å; F585-A589 PolarHBondContact O-N 2.83Å; Q586-A589 PolarHBondContact O-N 3.2Å; A589-T593 WeakPolarHBondContact O-CB 3.38Å; A589-T593 PolarHBondContact O-N 3.44Å; A589-T593 PolarHBondContact O-OG1 3.18Å; A589-F603 HydrophobicContact CB-CE1 4.06Å; A589-F603 HydrophobicContact CB-CZ 3.82Å; A589-F603 WeakPolarHBondContact O-CE1 3.19Å; A589-V606 HydrophobicContact CB-CG1 3.61Å; A589-M615 HydrophobicContact CB-CE 4.39Å
590	E	80.5	Confident	81.1	Confident	76 Å²	76	58.6 Å²	58.6	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-63.8	-43.6	176.7	-74.5	171.3	-167.7	0	0	111.6	V530 Q586 E588 T593 N594	V530-E590 HydrophobicContact CG2-CB 4.46Å; V530-E590 HydrophobicContact CG2-CG 3.81Å; Q586-E590 HydrophobicContact CG-CG 4.48Å; Q586-E590 WeakPolarHBondContact CG-OE1 3.17Å; Q586-E590 PolarHBondContact NE2-OE1 3.48Å; Q586-E590 WeakPolarHBondContact O-CG 3.5Å; Q586-E590 PolarHBondContact O-N 2.86Å; E588-E590 PolarHBondContact O-N 3.35Å; E590-T593 PolarHBondContact O-N 3.22Å; E590-N594 PolarHBondContact O-ND2 3.02Å; E590-N594 VanDerWaalsContact O-ND2 3.11Å
591	L	76.7	Confident	82.2	Confident	75 Å²	75	56.8 Å²	56.8	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-45.9	177.2	-178.5	140.5	0	0	0	111.6	R587 E588 T593 N594 L595 F675	R587-L591 WeakPolarHBondContact O-CB 3.48Å; R587-L591 PolarHBondContact O-N 3.11Å; R587-L591 VanDerWaalsContact O-N 3.13Å; E588-L591 PolarHBondContact O-N 2.86Å; L591-T593 VanDerWaalsContact C-N 3.32Å; L591-T593 PolarHBondContact O-N 2.87Å; L591-N594 WeakPolarHBondContact O-CB 3.4Å; L591-N594 PolarHBondContact O-N 2.92Å; L591-L595 HydrophobicContact CD2-CD1 3.67Å; L591-L595 HydrophobicContact CD2-CG 4.36Å; L591-L595 PolarHBondContact O-N 3.27Å; L591-F675 HydrophobicContact CD1-CD2 4.08Å; L591-F675 HydrophobicContact CD1-CE2 3.79Å; L591-F675 HydrophobicContact CD2-CD2 4.1Å; L591-F675 HydrophobicContact CD2-CE2 3.51Å; L591-F675 HydrophobicContact CD2-CZ 4.17Å; L591-F675 HydrophobicContact CG-CD2 4.49Å; L591-F675 HydrophobicContact CG-CE2 4.2Å
592	L	83	Confident	83.3	Confident	19 Å²	19	61.2 Å²	61.2	10%	0.099	28%	0.283	C	S	.	.	H	α-helix	trans	-65.7	-32.6	178.9	-66.8	167.7	0	0	0	113.9	E588 N594 L595 F603 M615 F617 F698	E588-L592 HydrophobicContact CG-CD1 4.03Å; E588-L592 WeakPolarHBondContact O-CB 3.23Å; E588-L592 WeakPolarHBondContact O-CD1 3.47Å; E588-L592 WeakPolarHBondContact O-CG 3.4Å; E588-L592 PolarHBondContact O-N 2.84Å; L592-N594 PolarHBondContact O-N 3.25Å; L592-L595 PolarHBondContact O-N 2.83Å; L592-L595 VanDerWaalsContact O-N 3.17Å; L592-F603 HydrophobicContact CB-CB 4.01Å; L592-F603 HydrophobicContact CB-CD1 3.57Å; L592-F603 HydrophobicContact CB-CE1 4.09Å; L592-F603 HydrophobicContact CB-CG 3.85Å; L592-F603 HydrophobicContact CD1-CD1 4.48Å; L592-F603 HydrophobicContact CD1-CD2 4.3Å; L592-F603 HydrophobicContact CD1-CE2 4.41Å; L592-F603 HydrophobicContact CD1-CG 4.3Å; L592-M615 HydrophobicContact CD1-SD 4.36Å; L592-F617 HydrophobicContact CD1-CE1 4.12Å; L592-F617 HydrophobicContact CD1-CZ 4.2Å; L592-F698 HydrophobicContact CD1-CD1 4.19Å; L592-F698 HydrophobicContact CD1-CE1 3.27Å; L592-F698 HydrophobicContact CD1-CZ 3.92Å; L592-F698 HydrophobicContact CD2-CE1 3.44Å; L592-F698 VanDerWaalsContact CD2-CE1 3.44Å; L592-F698 HydrophobicContact CD2-CZ 3.6Å; L592-F698 HydrophobicContact CG-CE1 3.9Å; L592-F698 HydrophobicContact CG-CZ 4.34Å
593	T	85.7	Confident	84	Confident	26 Å²	26	59.5 Å²	59.5	16%	0.16	28%	0.277	C	S	.	.	H	α-helix	trans	-60.4	-31.6	176.5	-58.8	0	0	0	0	111.3	T528 A589 E590 L591 Q596	T528-T593 HydrophobicContact CG2-CG2 3.56Å; A589-T593 WeakPolarHBondContact O-CB 3.38Å; A589-T593 PolarHBondContact O-N 3.44Å; A589-T593 PolarHBondContact O-OG1 3.18Å; E590-T593 PolarHBondContact O-N 3.22Å; L591-T593 VanDerWaalsContact C-N 3.32Å; L591-T593 PolarHBondContact O-N 2.87Å; T593-Q596 PolarHBondContact O-NE2 2.8Å
594	N	82.4	Confident	85	Confident	79 Å²	79	55.3 Å²	55.3	42%	0.422	26%	0.258	S	S	.	.	H	α-helix	trans	-82.6	-24	177.5	-73.4	-57.4	0	0	0	114.1	T528 E590 L591 L592 Q596 Y669	T528-N594 WeakPolarHBondContact CG2-ND2 3.37Å; T528-N594 PolarHBondContact OG1-ND2 3.12Å; T528-N594 PolarHBondContact OG1-OD1 2.87Å; E590-N594 PolarHBondContact O-ND2 3.02Å; E590-N594 VanDerWaalsContact O-ND2 3.11Å; L591-N594 WeakPolarHBondContact O-CB 3.4Å; L591-N594 PolarHBondContact O-N 2.92Å; L592-N594 PolarHBondContact O-N 3.25Å; N594-Q596 PolarHBondContact O-N 3.46Å; N594-Y669 PolarHBondContact O-OH 2.71Å; N594-Y669 VanDerWaalsContact O-OH 3.09Å
595	L	85.2	Confident	86.1	Confident	17 Å²	17	54 Å²	54	9%	0.089	25%	0.252	C	S	.	.			trans	-86.1	85.4	-178.8	-66.7	-176.7	0	0	0	112	L591 L592 I600 Y669 L670 Q673 F675	L591-L595 HydrophobicContact CD2-CD1 3.67Å; L591-L595 HydrophobicContact CD2-CG 4.36Å; L591-L595 PolarHBondContact O-N 3.27Å; L592-L595 PolarHBondContact O-N 2.83Å; L592-L595 VanDerWaalsContact O-N 3.17Å; L595-I600 HydrophobicContact CB-CG2 4.5Å; L595-Y669 HydrophobicContact CB-CE1 4.47Å; L595-Y669 HydrophobicContact CD2-CE1 4.04Å; L595-L670 HydrophobicContact CD1-CD2 4.12Å; L595-L670 HydrophobicContact CD2-CD2 4.09Å; L595-Q673 HydrophobicContact CD2-CB 4.15Å; L595-Q673 HydrophobicContact CD2-CG 4.14Å; L595-F675 HydrophobicContact CD1-CD1 4.32Å; L595-F675 HydrophobicContact CD1-CD2 4.18Å; L595-F675 HydrophobicContact CD1-CE1 4.4Å; L595-F675 HydrophobicContact CD1-CE2 4.3Å; L595-F675 HydrophobicContact CD1-CG 4.2Å; L595-F675 HydrophobicContact CD1-CZ 4.39Å
596	Q	89.4	Confident	86.8	Confident	131 Å²	131	53.7 Å²	53.7	61%	0.612	25%	0.251	S	S	*	.			trans	-120.7	112.1	-179.7	-59.6	-171	29.6	0	0	112	T593 N594 Y669	T593-Q596 PolarHBondContact O-NE2 2.8Å; N594-Q596 PolarHBondContact O-N 3.46Å; Q596-Y669 PolarHBondContact N-OH 2.78Å; Q596-Y669 PolarHBondContact O-OH 2.64Å
597	H	93.6	Very high	87.4	Confident	62 Å²	62	48.4 Å²	48.4	29%	0.287	23%	0.226	S	C	.	.			trans	-156.9	157.6	178.3	-178.8	-110.4	0	0	0	110.9	H599 I600 S665 Y669	H597-H599 PolarHBondContact ND1-N 2.99Å; H597-H599 PolarHBondContact O-N 2.92Å; H597-I600 HydrophobicContact CB-CB 4.28Å; H597-I600 HydrophobicContact CB-CG1 3.86Å; H597-I600 PolarHBondContact O-N 2.92Å; H597-I600 VanDerWaalsContact O-N 3.15Å; H597-S665 PolarHBondContact CE1-O 3.22Å; H597-Y669 HydrophobicContact CB-CD1 3.47Å; H597-Y669 VanDerWaalsContact CB-CD1 3.47Å; H597-Y669 HydrophobicContact CB-CD2 3.9Å; H597-Y669 HydrophobicContact CB-CE1 3.78Å; H597-Y669 HydrophobicContact CB-CE2 4.19Å; H597-Y669 HydrophobicContact CB-CG 3.52Å; H597-Y669 AromaticContact CD2-CD2 3.95Å; H597-Y669 AromaticContact CD2-CG 3.89Å; H597-Y669 AromaticContact CG-CD1 4Å; H597-Y669 AromaticContact CG-CG 3.6Å
598	E	94.6	Very high	87.8	Confident	130 Å²	130	43.6 Å²	43.6	61%	0.607	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-37	-176.1	-175	172.1	177.3	0	0	112.9	K694	E598-K694 WeakPolarHBondContact O-CD 3.48Å; E598-K694 WeakPolarHBondContact O-CE 3.25Å
599	H	96.3	Very high	88	Confident	17 Å²	17	45.1 Å²	45.1	8%	0.079	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	21.2	-178.8	-58.7	-59.3	0	0	0	114.4	H597 Q662 S665 V693 K694 I695	H597-H599 PolarHBondContact ND1-N 2.99Å; H597-H599 PolarHBondContact O-N 2.92Å; H599-Q662 VanDerWaalsContact CB-O 3.25Å; H599-Q662 WeakPolarHBondContact CB-O 3.32Å; H599-Q662 VanDerWaalsContact CE1-CG 3.41Å; H599-Q662 WeakPolarHBondContact CE1-CG 3.18Å; H599-Q662 PolarHBondContact CE1-OE1 3.27Å; H599-Q662 VanDerWaalsContact CG-O 3.29Å; H599-S665 PolarHBondContact CD2-OG 2.78Å; H599-V693 PolarHBondContact ND1-O 3.42Å; H599-K694 CarbonylContact O-C 3.56Å; H599-K694 VanDerWaalsContact O-CA 3.32Å; H599-K694 WeakPolarHBondContact O-CA 3.4Å; H599-I695 PolarHBondContact O-N 2.88Å
600	I	93.4	Very high	87.7	Confident	14 Å²	14	47 Å²	47	7%	0.072	25%	0.249	C	C	.	.	B	Isolated β-bridge	trans	-116.6	136.6	169.2	-58.6	-59.2	0	0	0	108.3	L595 H597 K602 Y669 L670 I695	L595-I600 HydrophobicContact CB-CG2 4.5Å; H597-I600 HydrophobicContact CB-CB 4.28Å; H597-I600 HydrophobicContact CB-CG1 3.86Å; H597-I600 PolarHBondContact O-N 2.92Å; H597-I600 VanDerWaalsContact O-N 3.15Å; I600-K602 PolarHBondContact O-N 3.42Å; I600-Y669 HydrophobicContact CG1-CD1 3.88Å; I600-Y669 HydrophobicContact CG1-CE1 4.31Å; I600-L670 HydrophobicContact CD1-CD1 3.97Å; I600-L670 HydrophobicContact CD1-CD2 3.77Å; I600-L670 HydrophobicContact CD1-CG 3.78Å; I600-L670 HydrophobicContact CG1-CD2 4.3Å; I600-I695 WeakPolarHBondContact CA-O 3.29Å; I600-I695 HydrophobicContact CD1-CB 3.98Å; I600-I695 HydrophobicContact CD1-CD1 4.2Å
601	V	92.6	Very high	87.7	Confident	7 Å²	7	46.4 Å²	46.4	4%	0.042	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.4	118.5	-179.2	173.1	0	0	0	0	109.5	F603 F617 E618 L686 K694 I695	V601-F603 PolarHBondContact O-N 3.03Å; V601-F617 HydrophobicContact CG1-CB 4.39Å; V601-F617 HydrophobicContact CG1-CD1 4.45Å; V601-E618 WeakPolarHBondContact CA-OE1 3.26Å; V601-E618 HydrophobicContact CG1-CG 4.21Å; V601-L686 HydrophobicContact CG1-CD1 4.29Å; V601-L686 HydrophobicContact CG2-CB 4.22Å; V601-L686 HydrophobicContact CG2-CD1 3.81Å; V601-L686 HydrophobicContact CG2-CG 4.14Å; V601-K694 HydrophobicContact CG2-CB 3.8Å; V601-I695 WeakPolarHBondContact CG2-O 3.35Å; V601-I695 PolarHBondContact N-O 2.98Å
602	K	91.8	Very high	88.1	Confident	99 Å²	99	45.4 Å²	45.4	43%	0.43	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-67.9	116.2	-175.6	-176	170.5	-176.8	174.5	0	110.8	I600 Y604 F617 E618	I600-K602 PolarHBondContact O-N 3.42Å; K602-Y604 HydrophobicContact CD-CD1 4.29Å; K602-Y604 HydrophobicContact CD-CE1 3.64Å; K602-Y604 HydrophobicContact CG-CD1 4.33Å; K602-Y604 HydrophobicContact CG-CE1 4.04Å; K602-F617 WeakPolarHBondContact O-CA 3.26Å; K602-E618 HydrophobicContact CB-CB 4.31Å; K602-E618 HydrophobicContact CB-CG 4.17Å; K602-E618 WeakPolarHBondContact CB-OE1 3.33Å; K602-E618 PolarHBondContact N-OE1 2.98Å; K602-E618 PolarHBondContact O-N 3.32Å
603	F	91.7	Very high	88.3	Confident	20 Å²	20	45.2 Å²	45.2	9%	0.088	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	137.5	163	-177.3	-129.6	0	0	0	110.4	V530 A589 L592 V601 G605 V606 M615 V616 F617	V530-F603 HydrophobicContact CG1-CE1 4.17Å; V530-F603 HydrophobicContact CG1-CZ 4.42Å; A589-F603 HydrophobicContact CB-CE1 4.06Å; A589-F603 HydrophobicContact CB-CZ 3.82Å; A589-F603 WeakPolarHBondContact O-CE1 3.19Å; L592-F603 HydrophobicContact CB-CB 4.01Å; L592-F603 HydrophobicContact CB-CD1 3.57Å; L592-F603 HydrophobicContact CB-CE1 4.09Å; L592-F603 HydrophobicContact CB-CG 3.85Å; L592-F603 HydrophobicContact CD1-CD1 4.48Å; L592-F603 HydrophobicContact CD1-CD2 4.3Å; L592-F603 HydrophobicContact CD1-CE2 4.41Å; L592-F603 HydrophobicContact CD1-CG 4.3Å; V601-F603 PolarHBondContact O-N 3.03Å; F603-G605 WeakPolarHBondContact CE2-O 3.1Å; F603-V606 HydrophobicContact CE2-CG1 4.43Å; F603-V606 HydrophobicContact CZ-CG1 3.73Å; F603-M615 HydrophobicContact CE2-CB 4Å; F603-M615 HydrophobicContact CE2-CG 4.19Å; F603-V616 WeakPolarHBondContact CD2-O 3.45Å; F603-F617 HydrophobicContact CB-CD1 4.09Å; F603-F617 HydrophobicContact CB-CE1 3.96Å; F603-F617 AromaticContact CD2-CD1 3.79Å; F603-F617 HydrophobicContact CD2-CD1 3.79Å; F603-F617 AromaticContact CD2-CE1 3.3Å; F603-F617 HydrophobicContact CD2-CE1 3.3Å; F603-F617 AromaticContact CD2-CZ 3.83Å; F603-F617 HydrophobicContact CD2-CZ 3.83Å; F603-F617 HydrophobicContact CE2-CE1 4.09Å; F603-F617 HydrophobicContact CE2-CZ 4.17Å; F603-F617 HydrophobicContact CG-CD1 4.43Å; F603-F617 HydrophobicContact CG-CE1 4Å
604	Y	92.3	Very high	88.6	Confident	42 Å²	42	44.3 Å²	44.3	17%	0.165	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-17.1	177.3	-72.3	-55	0	0	0	113.5	Q531 L560 M567 V569 K602 V616 E618	Q531-Y604 WeakPolarHBondContact CB-O 3.03Å; Q531-Y604 PolarHBondContact OE1-O 3.44Å; L560-Y604 HydrophobicContact CD1-CD1 4.34Å; L560-Y604 HydrophobicContact CD1-CG 4.34Å; L560-Y604 HydrophobicContact CD2-CD1 4.24Å; L560-Y604 HydrophobicContact CD2-CD2 3.81Å; L560-Y604 HydrophobicContact CD2-CE2 4.37Å; L560-Y604 HydrophobicContact CD2-CG 3.75Å; L560-Y604 HydrophobicContact CG-CD1 4.44Å; L560-Y604 HydrophobicContact CG-CG 4.39Å; M567-Y604 HydrophobicContact CE-CE1 4.11Å; M567-Y604 HydrophobicContact CE-CE2 3.61Å; M567-Y604 VanDerWaalsContact CE-CZ 3.42Å; M567-Y604 VanDerWaalsContact CE-OH 3.29Å; M567-Y604 WeakPolarHBondContact CE-OH 3.48Å; V569-Y604 HydrophobicContact CG1-CD2 4.07Å; V569-Y604 HydrophobicContact CG1-CE2 4.09Å; K602-Y604 HydrophobicContact CD-CD1 4.29Å; K602-Y604 HydrophobicContact CD-CE1 3.64Å; K602-Y604 HydrophobicContact CG-CD1 4.33Å; K602-Y604 HydrophobicContact CG-CE1 4.04Å; Y604-V616 WeakPolarHBondContact CB-O 3Å; Y604-V616 HydrophobicContact CD2-CG1 4.35Å; Y604-V616 PolarHBondContact N-O 3.01Å; Y604-E618 HydrophobicContact CE2-CB 3.87Å
605	G	91.8	Very high	88.9	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.01	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.5	-169.5	-178.6	0	0	0	0	0	114.4	Q531 F603 V616	Q531-G605 CarbonylContact O-C 3.56Å; Q531-G605 WeakPolarHBondContact O-CA 3.23Å; F603-G605 WeakPolarHBondContact CE2-O 3.1Å; G605-V616 PolarHBondContact O-N 3.2Å
606	V	92.2	Very high	89.3	Confident	7 Å²	7	39.7 Å²	39.7	4%	0.042	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	149.1	-173.2	-60.6	0	0	0	0	112.4	V530 Q531 H532 I533 F585 A589 F603 I614	V530-V606 HydrophobicContact CG1-CB 4.44Å; V530-V606 HydrophobicContact CG1-CG1 3.94Å; V530-V606 HydrophobicContact CG1-CG2 3.82Å; Q531-V606 PolarHBondContact O-N 2.83Å; H532-V606 CarbonylContact C-O 3.55Å; H532-V606 WeakPolarHBondContact CA-O 3.47Å; I533-V606 PolarHBondContact N-O 3.19Å; F585-V606 HydrophobicContact CE1-CB 3.81Å; F585-V606 HydrophobicContact CE1-CG1 3.57Å; F585-V606 HydrophobicContact CE1-CG2 4.43Å; F585-V606 HydrophobicContact CZ-CB 3.72Å; F585-V606 HydrophobicContact CZ-CG1 3.55Å; A589-V606 HydrophobicContact CB-CG1 3.61Å; F603-V606 HydrophobicContact CE2-CG1 4.43Å; F603-V606 HydrophobicContact CZ-CG1 3.73Å; V606-I614 CarbonylContact C-O 3.58Å; V606-I614 VanDerWaalsContact CA-O 3.29Å; V606-I614 WeakPolarHBondContact CA-O 3.35Å
607	C	91.3	Very high	89.4	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.007	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	100.1	158.9	165.9	0	0	0	0	107.7	I533 I538 D609 I614	I533-C607 WeakPolarHBondContact O-CA 3.42Å; I533-C607 WeakPolarHBondContact O-CB 3.15Å; I538-C607 HydrophobicContact CD1-CB 3.75Å; C607-D609 VanDerWaalsContact C-N 3.33Å; C607-I614 HydrophobicContact CB-CB 3.91Å; C607-I614 HydrophobicContact CB-CG2 3.92Å; C607-I614 PolarHBondContact N-O 3.36Å; C607-I614 PolarHBondContact O-N 3.09Å; C607-I614 VanDerWaalsContact O-N 3.11Å
608	G	82	Confident	89.3	Confident	36 Å²	36	32.2 Å²	32.2	37%	0.371	18%	0.18	S	C	.	.			trans	-88.5	2	170	0	0	0	0	0	113.8	G610	G608-G610 PolarHBondContact O-N 3.28Å
609	D	78.6	Confident	89.2	Confident	86 Å²	86	28.6 Å²	28.6	46%	0.46	16%	0.161	S	C	.	.	S	Bend	trans	-72.1	91.8	175.7	-68.2	-16.3	0	0	0	109.7	R535 C607	R535-D609 HydrophobicContact CB-CB 4.06Å; R535-D609 WeakPolarHBondContact CD-O 3.44Å; R535-D609 PolarHBondContact N-OD2 2.96Å; R535-D609 PolarHBondContact NH1-O 3.37Å; C607-D609 VanDerWaalsContact C-N 3.33Å
610	G	76.4	Confident	88.8	Confident	43 Å²	43	28.3 Å²	28.3	44%	0.443	16%	0.16	S	C	.	.	S	Bend	trans	68.1	170.6	176	0	0	0	0	0	115.1	R535 G608 P612	R535-G610 PolarHBondContact NH1-O 3.31Å; G608-G610 PolarHBondContact O-N 3.28Å; G610-P612 CarbonylContact O-C 3.56Å
611	D	80.6	Confident	88.3	Confident	63 Å²	63	32.5 Å²	32.5	34%	0.337	18%	0.177	S	C	.	.	S	Bend	trans	-86.8	153.2	-175.3	-67.7	-70.8	0	0	0	114.4	R535 R582	R535-D611 PolarHBondContact NH2-O 3.43Å; R582-D611 IonicContact CZ-OD1 3.86Å; R582-D611 IonicContact CZ-OD2 2.77Å; R582-D611 IonicContact NH2-OD1 3.37Å; R582-D611 PolarHBondContact NH2-OD1 2.89Å; R582-D611 IonicContact NH2-OD2 2.64Å; R582-D611 PolarHBondContact NH2-OD2 2.84Å
612	P	86.3	Confident	87.9	Confident	53 Å²	53	36.6 Å²	36.6	34%	0.344	20%	0.196	S	C	.	.	S	Bend	cis	-66	152.8	-14	27.6	-37.2	0	0	0	112.3	R535 A573 L574 G610	R535-P612 PolarHBondContact NH1-O 3.17Å; R535-P612 VanDerWaalsContact NH1-O 3.16Å; A573-P612 HydrophobicContact CB-CB 4.16Å; A573-P612 HydrophobicContact CB-CG 3.8Å; L574-P612 WeakPolarHBondContact O-CB 3.24Å; G610-P612 CarbonylContact O-C 3.56Å
613	L	87.3	Confident	87.7	Confident	16 Å²	16	33 Å²	33	8%	0.084	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-59.8	136.9	166.2	-68.9	-175.6	0	0	0	110.5	A573 L574 R582 F585	A573-L613 WeakPolarHBondContact CA-O 3.44Å; L574-L613 PolarHBondContact N-O 3.21Å; R582-L613 HydrophobicContact CB-CD1 4.23Å; R582-L613 HydrophobicContact CG-CD1 3.77Å; F585-L613 HydrophobicContact CB-CD1 4.24Å; F585-L613 HydrophobicContact CD1-CD1 3.96Å; F585-L613 HydrophobicContact CD2-CB 4.01Å; F585-L613 HydrophobicContact CD2-CD1 4.19Å; F585-L613 HydrophobicContact CE1-CB 4.47Å; F585-L613 HydrophobicContact CE1-CD1 4.31Å; F585-L613 HydrophobicContact CE2-CB 3.7Å; F585-L613 HydrophobicContact CG-CD1 3.89Å; F585-L613 HydrophobicContact CZ-CB 3.95Å
614	I	90.4	Very high	87.7	Confident	6 Å²	6	32.3 Å²	32.3	3%	0.031	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	127.2	-171.2	-80.5	163.1	0	0	0	111.1	I538 V571 K572 A573 V606 C607 V616	I538-I614 HydrophobicContact CD1-CG2 3.85Å; V571-I614 HydrophobicContact CG1-CB 4.36Å; V571-I614 HydrophobicContact CG1-CD1 4.21Å; V571-I614 HydrophobicContact CG1-CG1 3.9Å; V571-I614 HydrophobicContact CG1-CG2 3.66Å; V571-I614 HydrophobicContact CG2-CG2 4.4Å; K572-I614 WeakPolarHBondContact O-CA 3.31Å; A573-I614 HydrophobicContact CB-CG1 4.26Å; V606-I614 CarbonylContact C-O 3.58Å; V606-I614 VanDerWaalsContact CA-O 3.29Å; V606-I614 WeakPolarHBondContact CA-O 3.35Å; C607-I614 HydrophobicContact CB-CB 3.91Å; C607-I614 HydrophobicContact CB-CG2 3.92Å; C607-I614 PolarHBondContact N-O 3.36Å; C607-I614 PolarHBondContact O-N 3.09Å; C607-I614 VanDerWaalsContact O-N 3.11Å; I614-V616 HydrophobicContact CG2-CG2 3.77Å
615	M	89.7	Confident	87.7	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	138.8	162.1	-67.7	-179.3	171.2	0	0	110.3	V571 K572 F585 E588 A589 L592 F603 F617	V571-M615 CarbonylContact C-O 3.53Å; V571-M615 WeakPolarHBondContact CA-O 3.09Å; K572-M615 HydrophobicContact CB-CB 4.32Å; K572-M615 HydrophobicContact CD-SD 4.24Å; K572-M615 PolarHBondContact N-O 3.48Å; K572-M615 PolarHBondContact O-N 3.22Å; F585-M615 HydrophobicContact CD2-CE 3.59Å; F585-M615 HydrophobicContact CD2-CG 4.06Å; F585-M615 HydrophobicContact CE2-CE 3.95Å; F585-M615 HydrophobicContact CE2-CG 3.49Å; F585-M615 VanDerWaalsContact CE2-CG 3.49Å; F585-M615 HydrophobicContact CE2-SD 4.49Å; F585-M615 HydrophobicContact CG-CE 4.02Å; F585-M615 HydrophobicContact CZ-CG 4.08Å; F585-M615 WeakPolarHBondContact O-CE 3.44Å; E588-M615 HydrophobicContact CB-CE 3.83Å; E588-M615 HydrophobicContact CG-CE 3.74Å; E588-M615 HydrophobicContact CG-SD 4.41Å; E588-M615 WeakPolarHBondContact OE2-CE 3.14Å; A589-M615 HydrophobicContact CB-CE 4.39Å; L592-M615 HydrophobicContact CD1-SD 4.36Å; F603-M615 HydrophobicContact CE2-CB 4Å; F603-M615 HydrophobicContact CE2-CG 4.19Å; M615-F617 HydrophobicContact CB-CD2 4.33Å; M615-F617 HydrophobicContact CB-CE2 3.41Å; M615-F617 VanDerWaalsContact CB-CE2 3.41Å; M615-F617 HydrophobicContact CB-CZ 3.69Å; M615-F617 HydrophobicContact CG-CE2 4.47Å; M615-F617 HydrophobicContact CG-CZ 4.39Å; M615-F617 HydrophobicContact SD-CE2 4.36Å; M615-F617 HydrophobicContact SD-CZ 3.94Å
616	V	92.6	Very high	87.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.9	-177.4	-169.1	0	0	0	0	110.6	I533 I538 L560 V569 V571 F603 Y604 G605 I614	I533-V616 HydrophobicContact CD1-CB 3.67Å; I533-V616 HydrophobicContact CD1-CG1 4.02Å; I533-V616 HydrophobicContact CD1-CG2 3.67Å; I538-V616 HydrophobicContact CD1-CG2 3.79Å; L560-V616 HydrophobicContact CD2-CG1 4.42Å; V569-V616 HydrophobicContact CB-CG1 3.71Å; V569-V616 HydrophobicContact CG1-CG1 3.9Å; V569-V616 HydrophobicContact CG2-CG1 3.8Å; V571-V616 HydrophobicContact CG2-CG2 4.42Å; F603-V616 WeakPolarHBondContact CD2-O 3.45Å; Y604-V616 WeakPolarHBondContact CB-O 3Å; Y604-V616 HydrophobicContact CD2-CG1 4.35Å; Y604-V616 PolarHBondContact N-O 3.01Å; G605-V616 PolarHBondContact O-N 3.2Å; I614-V616 HydrophobicContact CG2-CG2 3.77Å
617	F	92.5	Very high	87.6	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.026	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	164.3	-175.2	-60.1	-77.4	0	0	0	112	V569 A570 K572 L592 V601 K602 F603 M615 F698	V569-F617 CarbonylContact C-O 3.59Å; V569-F617 WeakPolarHBondContact CA-O 3.08Å; V569-F617 VanDerWaalsContact CB-O 3.31Å; V569-F617 WeakPolarHBondContact CB-O 3.37Å; A570-F617 HydrophobicContact CB-CB 4.32Å; A570-F617 PolarHBondContact N-O 3.01Å; A570-F617 PolarHBondContact O-N 2.88Å; K572-F617 HydrophobicContact CB-CE2 4.04Å; K572-F617 HydrophobicContact CD-CE2 4.5Å; L592-F617 HydrophobicContact CD1-CE1 4.12Å; L592-F617 HydrophobicContact CD1-CZ 4.2Å; V601-F617 HydrophobicContact CG1-CB 4.39Å; V601-F617 HydrophobicContact CG1-CD1 4.45Å; K602-F617 WeakPolarHBondContact O-CA 3.26Å; F603-F617 HydrophobicContact CB-CD1 4.09Å; F603-F617 HydrophobicContact CB-CE1 3.96Å; F603-F617 AromaticContact CD2-CD1 3.79Å; F603-F617 HydrophobicContact CD2-CD1 3.79Å; F603-F617 AromaticContact CD2-CE1 3.3Å; F603-F617 HydrophobicContact CD2-CE1 3.3Å; F603-F617 AromaticContact CD2-CZ 3.83Å; F603-F617 HydrophobicContact CD2-CZ 3.83Å; F603-F617 HydrophobicContact CE2-CE1 4.09Å; F603-F617 HydrophobicContact CE2-CZ 4.17Å; F603-F617 HydrophobicContact CG-CD1 4.43Å; F603-F617 HydrophobicContact CG-CE1 4Å; M615-F617 HydrophobicContact CB-CD2 4.33Å; M615-F617 HydrophobicContact CB-CE2 3.41Å; M615-F617 VanDerWaalsContact CB-CE2 3.41Å; M615-F617 HydrophobicContact CB-CZ 3.69Å; M615-F617 HydrophobicContact CG-CE2 4.47Å; M615-F617 HydrophobicContact CG-CZ 4.39Å; M615-F617 HydrophobicContact SD-CE2 4.36Å; M615-F617 HydrophobicContact SD-CZ 3.94Å; F617-F698 HydrophobicContact CD1-CD2 4.39Å; F617-F698 AromaticContact CD1-CE2 3.61Å; F617-F698 HydrophobicContact CD1-CE2 3.61Å; F617-F698 AromaticContact CD1-CZ 3.83Å; F617-F698 HydrophobicContact CD1-CZ 3.83Å; F617-F698 HydrophobicContact CD2-CD2 4.45Å; F617-F698 HydrophobicContact CD2-CE2 4.44Å; F617-F698 HydrophobicContact CE1-CD1 4.17Å; F617-F698 AromaticContact CE1-CD2 3.95Å; F617-F698 HydrophobicContact CE1-CD2 3.95Å; F617-F698 AromaticContact CE1-CE1 3.55Å; F617-F698 HydrophobicContact CE1-CE1 3.55Å; F617-F698 AromaticContact CE1-CE2 3.21Å; F617-F698 HydrophobicContact CE1-CE2 3.21Å; F617-F698 HydrophobicContact CE1-CG 4.41Å; F617-F698 AromaticContact CE1-CZ 3.03Å; F617-F698 HydrophobicContact CE1-CZ 3.03Å; F617-F698 HydrophobicContact CE2-CD1 4.33Å; F617-F698 AromaticContact CE2-CD2 3.97Å; F617-F698 HydrophobicContact CE2-CD2 3.97Å; F617-F698 HydrophobicContact CE2-CE1 4.5Å; F617-F698 HydrophobicContact CE2-CE2 4.07Å; F617-F698 HydrophobicContact CE2-CG 4.16Å; F617-F698 HydrophobicContact CE2-CZ 4.39Å; F617-F698 HydrophobicContact CG-CE2 4.23Å; F617-F698 AromaticContact CZ-CD1 3.61Å; F617-F698 HydrophobicContact CZ-CD1 3.61Å; F617-F698 AromaticContact CZ-CD2 3.71Å; F617-F698 HydrophobicContact CZ-CD2 3.71Å; F617-F698 AromaticContact CZ-CE1 3.43Å; F617-F698 HydrophobicContact CZ-CE1 3.43Å; F617-F698 VanDerWaalsContact CZ-CE1 3.43Å; F617-F698 AromaticContact CZ-CE2 3.47Å; F617-F698 HydrophobicContact CZ-CE2 3.47Å; F617-F698 VanDerWaalsContact CZ-CE2 3.47Å; F617-F698 AromaticContact CZ-CG 3.82Å; F617-F698 HydrophobicContact CZ-CG 3.82Å; F617-F698 AromaticContact CZ-CZ 3.38Å; F617-F698 HydrophobicContact CZ-CZ 3.38Å
618	E	91.8	Very high	87.6	Confident	29 Å²	29	34.8 Å²	34.8	14%	0.136	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	138.2	168.3	75	-173.9	140.8	0	0	112.7	V601 K602 Y604 M620 K694	V601-E618 WeakPolarHBondContact CA-OE1 3.26Å; V601-E618 HydrophobicContact CG1-CG 4.21Å; K602-E618 HydrophobicContact CB-CB 4.31Å; K602-E618 HydrophobicContact CB-CG 4.17Å; K602-E618 WeakPolarHBondContact CB-OE1 3.33Å; K602-E618 PolarHBondContact N-OE1 2.98Å; K602-E618 PolarHBondContact O-N 3.32Å; Y604-E618 HydrophobicContact CE2-CB 3.87Å; E618-M620 HydrophobicContact CG-CG 4.22Å; E618-M620 HydrophobicContact CG-SD 4.13Å; E618-M620 PolarHBondContact O-N 3.25Å; E618-K694 WeakPolarHBondContact OE1-CD 3.42Å; E618-K694 VanDerWaalsContact OE1-CE 3.31Å; E618-K694 WeakPolarHBondContact OE1-CE 3.37Å; E618-K694 IonicContact OE1-NZ 2.64Å; E618-K694 PolarHBondContact OE1-NZ 3.17Å; E618-K694 IonicContact OE2-NZ 2.8Å; E618-K694 PolarHBondContact OE2-NZ 3.22Å
619	Y	91.1	Very high	88.1	Confident	54 Å²	54	33.1 Å²	33.1	21%	0.212	18%	0.178	C	C	.	.			trans	-81.6	107.7	177.4	174.7	-119.9	0	0	0	111.5	L544 L554 L568 K621	L544-Y619 HydrophobicContact CD1-CD2 4.07Å; L544-Y619 HydrophobicContact CD1-CE2 3.86Å; L544-Y619 HydrophobicContact CD2-CE2 4.18Å; L554-Y619 HydrophobicContact CD1-CD1 3.85Å; L554-Y619 HydrophobicContact CD1-CD2 3.63Å; L554-Y619 HydrophobicContact CD1-CE1 3.99Å; L554-Y619 HydrophobicContact CD1-CE2 3.78Å; L554-Y619 HydrophobicContact CD1-CG 3.66Å; L568-Y619 HydrophobicContact CB-CD1 3.96Å; L568-Y619 HydrophobicContact CB-CG 4.37Å; L568-Y619 HydrophobicContact CD1-CD1 4.19Å; L568-Y619 HydrophobicContact CD1-CE1 4.37Å; L568-Y619 WeakPolarHBondContact O-CB 3.43Å; Y619-K621 HydrophobicContact CD1-CB 4.41Å; Y619-K621 HydrophobicContact CE1-CB 3.87Å; Y619-K621 PolarHBondContact O-N 3.5Å
620	M	89	Confident	88.7	Confident	12 Å²	12	33 Å²	33	6%	0.059	17%	0.171	C	C	.	.			trans	-87.6	98.5	176.5	-64.3	-65.6	-83.9	0	0	110.4	E618 H622 G623 L686 V687 G688 K694	E618-M620 HydrophobicContact CG-CG 4.22Å; E618-M620 HydrophobicContact CG-SD 4.13Å; E618-M620 PolarHBondContact O-N 3.25Å; M620-H622 VanDerWaalsContact C-N 3.25Å; M620-H622 PolarHBondContact O-N 3.29Å; M620-G623 PolarHBondContact O-N 3Å; M620-L686 HydrophobicContact CB-CB 3.63Å; M620-L686 HydrophobicContact CB-CD1 3.99Å; M620-L686 HydrophobicContact CB-CG 4.4Å; M620-L686 HydrophobicContact CE-CB 4.15Å; M620-L686 WeakPolarHBondContact CE-O 3.31Å; M620-L686 HydrophobicContact CG-CB 3.68Å; M620-L686 HydrophobicContact CG-CD1 3.87Å; M620-L686 HydrophobicContact CG-CG 4.44Å; M620-V687 CarbonylContact C-O 3.48Å; M620-G688 VanDerWaalsContact CE-N 3.33Å; M620-K694 HydrophobicContact CE-CB 3.97Å; M620-K694 HydrophobicContact CE-CD 3.85Å; M620-K694 HydrophobicContact CE-CG 3.63Å; M620-K694 HydrophobicContact SD-CD 4.21Å
621	K	82.4	Confident	89.2	Confident	101 Å²	101	33 Å²	33	44%	0.439	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-19.5	-161.7	77.9	-174.5	-169.6	-172.8	0	117	Y619 A689	Y619-K621 HydrophobicContact CD1-CB 4.41Å; Y619-K621 HydrophobicContact CE1-CB 3.87Å; Y619-K621 PolarHBondContact O-N 3.5Å; K621-A689 HydrophobicContact CD-CB 4.44Å
622	H	84.3	Confident	89.6	Confident	94 Å²	94	31.3 Å²	31.3	44%	0.435	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.7	0.5	179.4	-67.6	-51.2	0	0	0	113.2	M620 F628 V687 G688	M620-H622 VanDerWaalsContact C-N 3.25Å; M620-H622 PolarHBondContact O-N 3.29Å; H622-F628 HydrophobicContact CB-CD2 3.85Å; H622-F628 HydrophobicContact CB-CE2 4.09Å; H622-V687 HydrophobicContact CB-CB 3.92Å; H622-V687 HydrophobicContact CB-CG1 4.01Å; H622-V687 WeakPolarHBondContact CB-O 3.27Å; H622-V687 PolarHBondContact N-O 2.9Å; H622-G688 PolarHBondContact CD2-O 2.89Å
623	G	88.2	Confident	89.5	Confident	23 Å²	23	29.1 Å²	29.1	24%	0.237	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	78.8	-151.8	179.6	0	0	0	0	0	112.5	M620 L686 V687	M620-G623 PolarHBondContact O-N 3Å; G623-L686 CarbonylContact O-C 3.53Å; G623-L686 WeakPolarHBondContact O-CA 3.41Å; G623-V687 PolarHBondContact O-N 3.24Å
624	D	90.3	Very high	89.3	Confident	6 Å²	6	31.9 Å²	31.9	3%	0.032	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	151.2	178.6	57.3	104.6	0	0	0	113.1	N626 K627 F628 R683 C685 L686 R702 Y705	D624-N626 PolarHBondContact O-N 2.9Å; D624-K627 WeakPolarHBondContact OD1-CB 3.36Å; D624-K627 PolarHBondContact OD1-N 2.72Å; D624-F628 WeakPolarHBondContact O-CB 3.15Å; D624-F628 PolarHBondContact O-N 2.86Å; D624-F628 VanDerWaalsContact O-N 3.09Å; D624-R683 WeakPolarHBondContact CB-O 3.43Å; D624-C685 CarbonylContact C-O 3.57Å; D624-C685 VanDerWaalsContact CA-O 3.27Å; D624-C685 WeakPolarHBondContact CA-O 3.38Å; D624-L686 HydrophobicContact CB-CD2 4.26Å; D624-R702 IonicContact OD2-CZ 2.62Å; D624-R702 IonicContact OD2-NH1 2.66Å; D624-R702 PolarHBondContact OD2-NH1 3.44Å; D624-R702 IonicContact OD2-NH2 2.74Å; D624-Y705 PolarHBondContact OD1-OH 2.91Å
625	L	94.1	Very high	88.7	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-68.9	-31.6	-176.4	177.8	65.1	0	0	0	112	F628 L629 I659 I663 T682 C685 V687 V693	L625-F628 HydrophobicContact CD1-CD1 4.31Å; L625-F628 PolarHBondContact O-N 3.11Å; L625-L629 HydrophobicContact CD1-CD1 4.24Å; L625-L629 HydrophobicContact CD1-CD2 4.36Å; L625-L629 HydrophobicContact CD1-CG 3.9Å; L625-L629 HydrophobicContact CD2-CD1 4.48Å; L625-L629 HydrophobicContact CG-CD1 3.88Å; L625-L629 HydrophobicContact CG-CG 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.35Å; L625-L629 VanDerWaalsContact O-CG 3.24Å; L625-L629 WeakPolarHBondContact O-CG 3.45Å; L625-L629 PolarHBondContact O-N 3.12Å; L625-I659 HydrophobicContact CD1-CD1 4.31Å; L625-I659 HydrophobicContact CD1-CG2 3.95Å; L625-I659 HydrophobicContact CD2-CG2 3.65Å; L625-I659 HydrophobicContact CG-CG2 4.45Å; L625-I663 HydrophobicContact CD2-CD1 3.69Å; L625-T682 WeakPolarHBondContact CB-O 3.37Å; L625-T682 HydrophobicContact CD2-CG2 3.99Å; L625-T682 HydrophobicContact CG-CG2 4.35Å; L625-T682 PolarHBondContact N-O 3.04Å; L625-C685 HydrophobicContact CB-CB 3.83Å; L625-C685 HydrophobicContact CD2-CB 3.94Å; L625-C685 PolarHBondContact N-O 3.43Å; L625-V687 HydrophobicContact CB-CG2 3.9Å; L625-V687 HydrophobicContact CD1-CG2 3.71Å; L625-V687 HydrophobicContact CG-CG2 4.42Å; L625-V693 HydrophobicContact CD2-CG1 4.2Å
626	N	92.5	Very high	87.9	Confident	4 Å²	4	35.1 Å²	35.1	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-62.1	-50.6	177.6	-165.9	-83.5	0	0	0	111.8	D624 F628 L629 R630 T682 R683 Y705 E762 G767	D624-N626 PolarHBondContact O-N 2.9Å; N626-F628 VanDerWaalsContact C-N 3.31Å; N626-F628 PolarHBondContact O-N 3.01Å; N626-L629 PolarHBondContact O-N 3.07Å; N626-R630 WeakPolarHBondContact O-CG 3.46Å; N626-R630 PolarHBondContact O-N 3.43Å; N626-R630 WeakPolarHBondContact OD1-CD 3.41Å; N626-R630 PolarHBondContact OD1-NE 2.94Å; N626-T682 WeakPolarHBondContact CA-OG1 3.38Å; N626-T682 VanDerWaalsContact CB-OG1 3.26Å; N626-T682 WeakPolarHBondContact CB-OG1 3.34Å; N626-T682 PolarHBondContact N-O 3.05Å; N626-T682 VanDerWaalsContact N-O 3.16Å; N626-T682 PolarHBondContact ND2-OG1 3.32Å; N626-R683 HydrophobicContact CB-CB 4.42Å; N626-Y705 HydrophobicContact CB-CE1 4.27Å; N626-E762 PolarHBondContact ND2-OE1 2.87Å; N626-G767 PolarHBondContact ND2-O 3.44Å; N626-G767 PolarHBondContact OD1-O 3.34Å
627	K	88.5	Confident	86.5	Confident	79 Å²	79	43.9 Å²	43.9	34%	0.343	23%	0.225	S	C	.	.	H	α-helix	trans	-62.2	-37.5	172.6	-85.4	167.8	-163.3	-176.9	0	112.6	D624 R630 A631 Y705	D624-K627 WeakPolarHBondContact OD1-CB 3.36Å; D624-K627 PolarHBondContact OD1-N 2.72Å; K627-R630 PolarHBondContact O-N 3.43Å; K627-A631 VanDerWaalsContact O-CB 3.31Å; K627-A631 WeakPolarHBondContact O-CB 3.5Å; K627-A631 PolarHBondContact O-N 3.22Å; K627-Y705 WeakPolarHBondContact CE-OH 3.32Å; K627-Y705 WeakPolarHBondContact CG-OH 3.33Å
628	F	91.1	Very high	85	Confident	20 Å²	20	50.5 Å²	50.5	9%	0.088	26%	0.259	C	S	.	.	H	α-helix	trans	-62.2	-46.3	176.9	-172	-93.5	0	0	0	112	H622 D624 L625 N626 A631 H632 L651 V687 L691	H622-F628 HydrophobicContact CB-CD2 3.85Å; H622-F628 HydrophobicContact CB-CE2 4.09Å; D624-F628 WeakPolarHBondContact O-CB 3.15Å; D624-F628 PolarHBondContact O-N 2.86Å; D624-F628 VanDerWaalsContact O-N 3.09Å; L625-F628 HydrophobicContact CD1-CD1 4.31Å; L625-F628 PolarHBondContact O-N 3.11Å; N626-F628 VanDerWaalsContact C-N 3.31Å; N626-F628 PolarHBondContact O-N 3.01Å; F628-A631 PolarHBondContact O-N 3.26Å; F628-H632 AromaticContact CD2-CE1 3.88Å; F628-H632 AromaticContact CE1-CE1 3.76Å; F628-H632 AromaticContact CE1-ND1 3.87Å; F628-H632 AromaticContact CE2-CE1 3.39Å; F628-H632 WeakPolarHBondContact CE2-CE1 3.37Å; F628-H632 AromaticContact CZ-CE1 3.3Å; F628-H632 WeakPolarHBondContact CZ-CE1 3.48Å; F628-H632 AromaticContact CZ-ND1 3.89Å; F628-H632 AromaticContact CZ-NE2 3.81Å; F628-H632 PolarHBondContact O-N 3.09Å; F628-H632 PolarHBondContact O-ND1 3.28Å; F628-L651 HydrophobicContact CD1-CD1 4.32Å; F628-L651 HydrophobicContact CE1-CD1 4.03Å; F628-L651 HydrophobicContact CE1-CD2 4.16Å; F628-V687 HydrophobicContact CB-CG2 4.03Å; F628-V687 HydrophobicContact CD1-CG1 4.46Å; F628-V687 HydrophobicContact CD1-CG2 4.34Å; F628-V687 HydrophobicContact CD2-CB 4.46Å; F628-V687 HydrophobicContact CD2-CG1 4.18Å; F628-V687 HydrophobicContact CE2-CG1 4.22Å; F628-V687 HydrophobicContact CG-CB 4.42Å; F628-V687 HydrophobicContact CG-CG1 4.3Å; F628-V687 HydrophobicContact CG-CG2 4.06Å; F628-V687 HydrophobicContact CZ-CG1 4.4Å; F628-L691 HydrophobicContact CE1-CD2 3.48Å; F628-L691 VanDerWaalsContact CE1-CD2 3.48Å; F628-L691 HydrophobicContact CZ-CD2 3.42Å; F628-L691 VanDerWaalsContact CZ-CD2 3.42Å
629	L	93.4	Very high	83.4	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-49.4	176.1	-73.3	168.2	0	0	0	111.1	L625 N626 A631 H632 G633 L651 T682 I763 Y766	L625-L629 HydrophobicContact CD1-CD1 4.24Å; L625-L629 HydrophobicContact CD1-CD2 4.36Å; L625-L629 HydrophobicContact CD1-CG 3.9Å; L625-L629 HydrophobicContact CD2-CD1 4.48Å; L625-L629 HydrophobicContact CG-CD1 3.88Å; L625-L629 HydrophobicContact CG-CG 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.35Å; L625-L629 VanDerWaalsContact O-CG 3.24Å; L625-L629 WeakPolarHBondContact O-CG 3.45Å; L625-L629 PolarHBondContact O-N 3.12Å; N626-L629 PolarHBondContact O-N 3.07Å; L629-A631 VanDerWaalsContact C-N 3.26Å; L629-A631 PolarHBondContact O-N 3.01Å; L629-H632 CarbonylContact O-C 3.6Å; L629-H632 PolarHBondContact O-N 2.9Å; L629-G633 PolarHBondContact O-N 2.88Å; L629-L651 HydrophobicContact CD2-CD1 3.9Å; L629-T682 HydrophobicContact CD1-CG2 3.92Å; L629-I763 HydrophobicContact CD1-CG1 4.16Å; L629-I763 HydrophobicContact CD2-CG2 4.46Å; L629-Y766 CarbonylContact C-O 3.53Å
630	R	90.6	Very high	81.6	Confident	84 Å²	84	54.3 Å²	54.3	32%	0.317	29%	0.286	S	S	.	.	H	α-helix	trans	-59	-36.1	178.5	-73	176.2	179.1	-102.5	0.9	112.9	N626 K627 H632 G633 A636 Y766 G767	N626-R630 WeakPolarHBondContact O-CG 3.46Å; N626-R630 PolarHBondContact O-N 3.43Å; N626-R630 WeakPolarHBondContact OD1-CD 3.41Å; N626-R630 PolarHBondContact OD1-NE 2.94Å; K627-R630 PolarHBondContact O-N 3.43Å; R630-H632 VanDerWaalsContact C-N 3.26Å; R630-H632 PolarHBondContact O-N 3.08Å; R630-G633 PolarHBondContact O-N 3.12Å; R630-A636 WeakPolarHBondContact O-CB 3.36Å; R630-Y766 WeakPolarHBondContact CA-O 3.32Å; R630-Y766 VanDerWaalsContact CG-O 3.28Å; R630-Y766 WeakPolarHBondContact CG-O 3.5Å; R630-Y766 PolarHBondContact N-O 2.83Å; R630-G767 PolarHBondContact NE-O 3.48Å; R630-G767 PolarHBondContact NH2-O 3.1Å
631	A	86.7	Confident	79.7	Confident	42 Å²	42	61.4 Å²	61.4	35%	0.347	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.9	177	0	0	0	0	0	114.5	K627 F628 L629	K627-A631 VanDerWaalsContact O-CB 3.31Å; K627-A631 WeakPolarHBondContact O-CB 3.5Å; K627-A631 PolarHBondContact O-N 3.22Å; F628-A631 PolarHBondContact O-N 3.26Å; L629-A631 VanDerWaalsContact C-N 3.26Å; L629-A631 PolarHBondContact O-N 3.01Å
632	H	88.5	Confident	77.7	Confident	28 Å²	28	60.4 Å²	60.4	13%	0.13	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	10.7	174.6	-61.8	78	0	0	0	112.7	F628 L629 R630 G649 E650 L651 Y766	F628-H632 AromaticContact CD2-CE1 3.88Å; F628-H632 AromaticContact CE1-CE1 3.76Å; F628-H632 AromaticContact CE1-ND1 3.87Å; F628-H632 AromaticContact CE2-CE1 3.39Å; F628-H632 WeakPolarHBondContact CE2-CE1 3.37Å; F628-H632 AromaticContact CZ-CE1 3.3Å; F628-H632 WeakPolarHBondContact CZ-CE1 3.48Å; F628-H632 AromaticContact CZ-ND1 3.89Å; F628-H632 AromaticContact CZ-NE2 3.81Å; F628-H632 PolarHBondContact O-N 3.09Å; F628-H632 PolarHBondContact O-ND1 3.28Å; L629-H632 CarbonylContact O-C 3.6Å; L629-H632 PolarHBondContact O-N 2.9Å; R630-H632 VanDerWaalsContact C-N 3.26Å; R630-H632 PolarHBondContact O-N 3.08Å; H632-G649 PolarHBondContact CD2-O 2.84Å; H632-E650 WeakPolarHBondContact O-CA 3.47Å; H632-L651 HydrophobicContact CB-CD1 3.97Å; H632-L651 HydrophobicContact CB-CG 3.78Å; H632-Y766 VanDerWaalsContact O-CE1 3.23Å; H632-Y766 WeakPolarHBondContact O-CE1 3.4Å
633	G	84.8	Confident	75.6	Confident	7 Å²	7	62.1 Å²	62.1	7%	0.072	35%	0.351	C	S	.	.	S	Bend	trans	-89.9	165.7	176.1	0	0	0	0	0	113	L629 R630 D635 A636 Y766	L629-G633 PolarHBondContact O-N 2.88Å; R630-G633 PolarHBondContact O-N 3.12Å; G633-D635 PolarHBondContact O-N 3.11Å; G633-A636 WeakPolarHBondContact O-CB 3.22Å; G633-A636 PolarHBondContact O-N 3Å; G633-Y766 VanDerWaalsContact CA-CG 3.42Å
634	P	82	Confident	73.1	Confident	74 Å²	74	67.1 Å²	67.1	48%	0.481	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-32.1	178.7	24.3	-34.4	0	0	0	112.4	A636	P634-A636 PolarHBondContact O-N 3.13Å
635	D	79.2	Confident	70.9	Confident	59 Å²	59	76.9 Å²	76.9	32%	0.316	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-3.7	178.5	-56.6	-36.9	0	0	0	113.2	G633 M637 I638 L639 K768	G633-D635 PolarHBondContact O-N 3.11Å; D635-M637 VanDerWaalsContact C-N 3.25Å; D635-M637 PolarHBondContact O-N 2.8Å; D635-I638 PolarHBondContact O-N 2.87Å; D635-L639 HydrophobicContact CB-CD1 3.93Å; D635-L639 HydrophobicContact CB-CG 4.45Å; D635-L639 WeakPolarHBondContact O-CG 3.18Å; D635-L639 PolarHBondContact O-N 3.45Å; D635-L639 VanDerWaalsContact O-N 3.13Å; D635-K768 WeakPolarHBondContact OD2-CE 3.35Å; D635-K768 IonicContact OD2-NZ 2.71Å; D635-K768 PolarHBondContact OD2-NZ 3.32Å
636	A	73.4	Confident	68.4	Low	16 Å²	16	84.5 Å²	84.5	13%	0.132	45%	0.451	C	S	.	.	H	α-helix	trans	-60.3	-30.4	-175.3	0	0	0	0	0	113.7	R630 G633 P634 I638 L639 V640	R630-A636 WeakPolarHBondContact O-CB 3.36Å; G633-A636 WeakPolarHBondContact O-CB 3.22Å; G633-A636 PolarHBondContact O-N 3Å; P634-A636 PolarHBondContact O-N 3.13Å; A636-I638 PolarHBondContact O-N 3.24Å; A636-L639 PolarHBondContact O-N 3.5Å; A636-V640 PolarHBondContact O-N 2.9Å
637	M	61.7	Low	66.1	Low	183 Å²	183	88 Å²	88	90%	0.901	48%	0.481	S	S	*	.	H	α-helix	trans	-66.9	-20.2	176.4	-65.1	-164.3	74.3	0	0	113.4	D635	D635-M637 VanDerWaalsContact C-N 3.25Å; D635-M637 PolarHBondContact O-N 2.8Å
638	I	62	Low	64.5	Low	145 Å²	145	92.1 Å²	92.1	74%	0.744	50%	0.499	S	S	*	.	H	α-helix	trans	-96.1	-33.2	177.6	-55	174.6	0	0	0	110.3	D635 A636	D635-I638 PolarHBondContact O-N 2.87Å; A636-I638 PolarHBondContact O-N 3.24Å
639	L	57.1	Low	63.2	Low	96 Å²	96	93.5 Å²	93.5	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-88.8	-9.2	-171.6	-66	172.3	0	0	0	115.4	D635 A636	D635-L639 HydrophobicContact CB-CD1 3.93Å; D635-L639 HydrophobicContact CB-CG 4.45Å; D635-L639 WeakPolarHBondContact O-CG 3.18Å; D635-L639 PolarHBondContact O-N 3.45Å; D635-L639 VanDerWaalsContact O-N 3.13Å; A636-L639 PolarHBondContact O-N 3.5Å
640	V	53.8	Low	62.3	Low	68 Å²	68	99.1 Å²	99.1	41%	0.412	55%	0.545	S	S	.	.	S	Bend	trans	-119.8	104.8	-177.4	-176	0	0	0	0	110.4	A636 G642	A636-V640 PolarHBondContact O-N 2.9Å; V640-G642 PolarHBondContact O-N 3Å
641	D	48.9	Very low	62	Low	160 Å²	160	95.4 Å²	95.4	86%	0.856	53%	0.531	S	S	*	.			trans	-50.8	99.9	-178.9	-80.9	-46.1	0	0	0	113.8	Q643	D641-Q643 PolarHBondContact O-N 2.87Å
642	G	41.3	Very low	62	Low	81 Å²	81	95.1 Å²	95.1	84%	0.835	53%	0.532	S	S	*	.	S	Bend	trans	62.4	-4.7	154.6	0	0	0	0	0	118.8	V640	V640-G642 PolarHBondContact O-N 3Å
643	Q	39.2	Very low	62	Low	129 Å²	129	95.7 Å²	95.7	60%	0.603	54%	0.536	S	S	*	.			trans	-117.8	113.6	-179.1	-68.9	-166.6	0.2	0	0	111.6	D641 R645	D641-Q643 PolarHBondContact O-N 2.87Å; Q643-R645 PolarHBondContact O-N 3.03Å
644	P	37	Very low	62.3	Low	128 Å²	128	98.2 Å²	98.2	83%	0.831	55%	0.553	S	S	*	*			trans	-72.7	79.3	173.6	31.1	-34.6	0	0	0	110.2	Q646	P644-Q646 PolarHBondContact O-N 3.33Å
645	R	42.2	Very low	62.7	Low	211 Å²	211	98.2 Å²	98.2	80%	0.796	55%	0.546	S	S	*	.			trans	-71.5	73.8	169.3	-80	-168.8	171.3	-176.8	1.7	110.3	Q643 A647	Q643-R645 PolarHBondContact O-N 3.03Å; R645-A647 PolarHBondContact O-N 3.21Å; R645-A647 VanDerWaalsContact O-N 3.11Å
646	Q	42.7	Very low	63.5	Low	161 Å²	161	95.6 Å²	95.6	75%	0.752	53%	0.532	S	S	*	.			trans	31.2	65	172.5	-67.5	-172.2	-7.4	0	0	113.3	P644 K648	P644-Q646 PolarHBondContact O-N 3.33Å; Q646-K648 PolarHBondContact O-N 3.36Å
647	A	44.8	Very low	64.5	Low	78 Å²	78	94.9 Å²	94.9	65%	0.645	53%	0.526	S	S	*	.			trans	-59.2	104.4	169.2	0	0	0	0	0	107.6	R645 G649	R645-A647 PolarHBondContact O-N 3.21Å; R645-A647 VanDerWaalsContact O-N 3.11Å; A647-G649 PolarHBondContact O-N 2.98Å
648	K	53.9	Low	66	Low	165 Å²	165	90.4 Å²	90.4	72%	0.717	50%	0.503	S	S	*	.			trans	-81.3	58.1	-177.1	-81.1	-169.5	170.8	-171.9	0	110.3	Q646	Q646-K648 PolarHBondContact O-N 3.36Å
649	G	64.3	Low	67.7	Low	48 Å²	48	83.5 Å²	83.5	50%	0.495	47%	0.467	S	S	.	.			trans	64.7	-179.8	-174.2	0	0	0	0	0	113.4	H632 A647	H632-G649 PolarHBondContact CD2-O 2.84Å; A647-G649 PolarHBondContact O-N 2.98Å
650	E	73.5	Confident	69.6	Low	118 Å²	118	79 Å²	79	55%	0.551	44%	0.444	S	S	*	.			trans	-71.8	152.6	163.3	-63.3	-177.6	159	0	0	110.1	H632 G652	H632-E650 WeakPolarHBondContact O-CA 3.47Å; E650-G652 PolarHBondContact O-N 2.88Å
651	L	84.3	Confident	71.7	Confident	7 Å²	7	76.1 Å²	76.1	4%	0.037	43%	0.427	C	S	.	.			trans	-73.6	114.9	174.8	-70.8	165.9	0	0	0	109.9	F628 L629 H632 Q655 M656 I659 L691 Y766	F628-L651 HydrophobicContact CD1-CD1 4.32Å; F628-L651 HydrophobicContact CE1-CD1 4.03Å; F628-L651 HydrophobicContact CE1-CD2 4.16Å; L629-L651 HydrophobicContact CD2-CD1 3.9Å; H632-L651 HydrophobicContact CB-CD1 3.97Å; H632-L651 HydrophobicContact CB-CG 3.78Å; L651-Q655 HydrophobicContact CD2-CB 4.14Å; L651-M656 HydrophobicContact CB-CE 4.47Å; L651-M656 HydrophobicContact CB-CG 4.33Å; L651-I659 HydrophobicContact CD1-CD1 4.15Å; L651-L691 HydrophobicContact CD2-CD1 4.47Å; L651-L691 HydrophobicContact CD2-CD2 4.47Å; L651-Y766 HydrophobicContact CB-CE1 4.28Å
652	G	86.5	Confident	74	Confident	36 Å²	36	69 Å²	69	37%	0.371	39%	0.388	S	S	.	.			trans	-65.9	157.3	176.7	0	0	0	0	0	112.5	E650 S654 Q655 M656	E650-G652 PolarHBondContact O-N 2.88Å; G652-S654 PolarHBondContact O-N 3.43Å; G652-S654 VanDerWaalsContact O-N 3.1Å; G652-Q655 WeakPolarHBondContact O-CA 3.33Å; G652-Q655 WeakPolarHBondContact O-CB 3.45Å; G652-Q655 PolarHBondContact O-N 3.21Å; G652-M656 PolarHBondContact O-N 2.91Å
653	L	90.2	Very high	76.7	Confident	39 Å²	39	65.1 Å²	65.1	20%	0.204	35%	0.348	C	S	.	.	H	α-helix	trans	-50.1	-40.4	-178.2	176.7	61.1	0	0	0	113.7	Q655 M656 L657 F764 P796 T831 P832	L653-Q655 VanDerWaalsContact C-N 3.34Å; L653-Q655 PolarHBondContact O-N 2.92Å; L653-M656 PolarHBondContact O-N 2.97Å; L653-L657 HydrophobicContact CD1-CD1 3.96Å; L653-L657 HydrophobicContact CD1-CG 4.13Å; L653-L657 HydrophobicContact CG-CD1 3.94Å; L653-L657 WeakPolarHBondContact O-CB 3.37Å; L653-L657 WeakPolarHBondContact O-CG 3.35Å; L653-L657 PolarHBondContact O-N 2.92Å; L653-F764 HydrophobicContact CD1-CE1 3.47Å; L653-F764 VanDerWaalsContact CD1-CE1 3.47Å; L653-F764 HydrophobicContact CD1-CZ 3.72Å; L653-P796 HydrophobicContact CD1-CG 3.59Å; L653-P796 HydrophobicContact CD2-CG 3.75Å; L653-P796 HydrophobicContact CG-CG 4.35Å; L653-T831 HydrophobicContact CB-CG2 4.23Å; L653-T831 HydrophobicContact CD2-CG2 3.9Å; L653-T831 HydrophobicContact CG-CG2 3.76Å; L653-P832 VanDerWaalsContact CD2-O 3.29Å; L653-P832 WeakPolarHBondContact CD2-O 3.34Å
654	S	89.8	Confident	79.5	Confident	61 Å²	61	59 Å²	59	43%	0.427	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-37.3	176.4	-177.9	0	0	0	0	112.5	G652 H658	G652-S654 PolarHBondContact O-N 3.43Å; G652-S654 VanDerWaalsContact O-N 3.1Å; S654-H658 VanDerWaalsContact O-CB 3.25Å; S654-H658 WeakPolarHBondContact O-CB 3.34Å; S654-H658 PolarHBondContact O-N 3.25Å
655	Q	91.7	Very high	82.4	Confident	74 Å²	74	53.8 Å²	53.8	35%	0.346	29%	0.286	S	S	.	.	H	α-helix	trans	-71.1	-40.4	176.1	-63.2	170.9	-62.2	0	0	111.5	L651 G652 L653 H658 I659 L691	L651-Q655 HydrophobicContact CD2-CB 4.14Å; G652-Q655 WeakPolarHBondContact O-CA 3.33Å; G652-Q655 WeakPolarHBondContact O-CB 3.45Å; G652-Q655 PolarHBondContact O-N 3.21Å; L653-Q655 VanDerWaalsContact C-N 3.34Å; L653-Q655 PolarHBondContact O-N 2.92Å; Q655-H658 PolarHBondContact O-N 2.82Å; Q655-I659 VanDerWaalsContact O-CG1 3.3Å; Q655-I659 WeakPolarHBondContact O-CG1 3.26Å; Q655-I659 PolarHBondContact O-N 2.72Å; Q655-L691 HydrophobicContact CB-CD1 4.17Å; Q655-L691 HydrophobicContact CG-CD1 4.01Å
656	M	94.5	Very high	85	Confident	4 Å²	4	43.7 Å²	43.7	2%	0.02	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-47.8	173.2	-70.4	-176.8	170.6	0	0	112	L651 G652 L653 H658 I659 A660 I763 F764 Y766	L651-M656 HydrophobicContact CB-CE 4.47Å; L651-M656 HydrophobicContact CB-CG 4.33Å; G652-M656 PolarHBondContact O-N 2.91Å; L653-M656 PolarHBondContact O-N 2.97Å; M656-H658 VanDerWaalsContact C-N 3.3Å; M656-H658 PolarHBondContact O-N 2.97Å; M656-I659 PolarHBondContact O-N 2.66Å; M656-A660 WeakPolarHBondContact O-CB 3.42Å; M656-A660 PolarHBondContact O-N 2.97Å; M656-I763 HydrophobicContact CB-CG2 3.72Å; M656-I763 HydrophobicContact CG-CG2 3.91Å; M656-F764 HydrophobicContact CB-CE1 4.35Å; M656-F764 HydrophobicContact CB-CE2 4.27Å; M656-F764 HydrophobicContact CB-CZ 3.98Å; M656-F764 HydrophobicContact SD-CD1 3.8Å; M656-F764 HydrophobicContact SD-CE1 3.82Å; M656-F764 HydrophobicContact SD-CG 4.33Å; M656-F764 HydrophobicContact SD-CZ 4.34Å; M656-Y766 HydrophobicContact CE-CD1 3.98Å; M656-Y766 HydrophobicContact CE-CD2 4.37Å; M656-Y766 HydrophobicContact CE-CE1 3.32Å; M656-Y766 HydrophobicContact CE-CE2 3.79Å; M656-Y766 HydrophobicContact CE-CG 4.48Å; M656-Y766 WeakPolarHBondContact CE-OH 3.36Å
657	L	95.2	Very high	87.6	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-64.4	-34.2	176	-73.1	168.9	0	0	0	112.2	L653 S661 F764 V799 L824 L827 T831	L653-L657 HydrophobicContact CD1-CD1 3.96Å; L653-L657 HydrophobicContact CD1-CG 4.13Å; L653-L657 HydrophobicContact CG-CD1 3.94Å; L653-L657 WeakPolarHBondContact O-CB 3.37Å; L653-L657 WeakPolarHBondContact O-CG 3.35Å; L653-L657 PolarHBondContact O-N 2.92Å; L657-S661 VanDerWaalsContact O-CB 3.29Å; L657-S661 WeakPolarHBondContact O-CB 3.2Å; L657-S661 PolarHBondContact O-N 3.49Å; L657-S661 PolarHBondContact O-OG 2.74Å; L657-F764 HydrophobicContact CD2-CZ 4.33Å; L657-F764 HydrophobicContact CG-CZ 4.43Å; L657-V799 HydrophobicContact CD2-CG2 3.8Å; L657-L824 HydrophobicContact CD2-CD2 4.11Å; L657-L827 HydrophobicContact CD1-CB 4.1Å; L657-L827 HydrophobicContact CD2-CB 4.17Å; L657-T831 HydrophobicContact CD1-CG2 3.93Å
658	H	93.7	Very high	90.1	Very high	90 Å²	90	34.3 Å²	34.3	42%	0.417	19%	0.194	S	C	.	.	H	α-helix	trans	-67.2	-44.2	174.1	-176.2	56.9	0	0	0	112	S654 Q655 M656 S661 Q662	S654-H658 VanDerWaalsContact O-CB 3.25Å; S654-H658 WeakPolarHBondContact O-CB 3.34Å; S654-H658 PolarHBondContact O-N 3.25Å; Q655-H658 PolarHBondContact O-N 2.82Å; M656-H658 VanDerWaalsContact C-N 3.3Å; M656-H658 PolarHBondContact O-N 2.97Å; H658-S661 PolarHBondContact O-N 3.16Å; H658-Q662 PolarHBondContact CD2-NE2 3.18Å; H658-Q662 PolarHBondContact NE2-NE2 2.87Å; H658-Q662 VanDerWaalsContact O-CG 3.27Å; H658-Q662 WeakPolarHBondContact O-CG 3.44Å; H658-Q662 PolarHBondContact O-N 2.91Å; H658-Q662 VanDerWaalsContact O-N 3.11Å; H658-Q662 PolarHBondContact O-NE2 2.84Å
659	I	96.6	Very high	92.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.3	-50.8	172.6	-70.9	164.2	0	0	0	110.2	L625 L651 Q655 M656 S661 Q662 I663 V693 I763	L625-I659 HydrophobicContact CD1-CD1 4.31Å; L625-I659 HydrophobicContact CD1-CG2 3.95Å; L625-I659 HydrophobicContact CD2-CG2 3.65Å; L625-I659 HydrophobicContact CG-CG2 4.45Å; L651-I659 HydrophobicContact CD1-CD1 4.15Å; Q655-I659 VanDerWaalsContact O-CG1 3.3Å; Q655-I659 WeakPolarHBondContact O-CG1 3.26Å; Q655-I659 PolarHBondContact O-N 2.72Å; M656-I659 PolarHBondContact O-N 2.66Å; I659-S661 PolarHBondContact O-N 2.88Å; I659-Q662 PolarHBondContact O-N 3.45Å; I659-I663 HydrophobicContact CG2-CD1 4.16Å; I659-I663 WeakPolarHBondContact O-CG1 3.15Å; I659-I663 PolarHBondContact O-N 3.45Å; I659-V693 HydrophobicContact CB-CG2 4.38Å; I659-V693 HydrophobicContact CG1-CG2 3.96Å; I659-V693 HydrophobicContact CG2-CG2 4.15Å; I659-I763 HydrophobicContact CG2-CD1 3.78Å; I659-I763 HydrophobicContact CG2-CG1 4.12Å
660	A	97.8	Very high	93.4	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-59.8	-42.9	179.1	0	0	0	0	0	112.9	M656 Q662 I663 A664 L760 I763 L824	M656-A660 WeakPolarHBondContact O-CB 3.42Å; M656-A660 PolarHBondContact O-N 2.97Å; A660-Q662 VanDerWaalsContact C-N 3.34Å; A660-Q662 PolarHBondContact O-N 2.96Å; A660-I663 PolarHBondContact O-N 3.19Å; A660-A664 WeakPolarHBondContact O-CB 3.37Å; A660-A664 PolarHBondContact O-N 3.37Å; A660-L760 HydrophobicContact CB-CD2 3.53Å; A660-I763 HydrophobicContact CB-CD1 4.02Å; A660-L824 HydrophobicContact CB-CD1 4.15Å; A660-L824 HydrophobicContact CB-CD2 4.5Å
661	S	97.3	Very high	94.2	Very high	9 Å²	9	21.9 Å²	21.9	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-65	-35.4	179.3	-61	0	0	0	0	112.7	L657 H658 I659 S665 Y821 L824	L657-S661 VanDerWaalsContact O-CB 3.29Å; L657-S661 WeakPolarHBondContact O-CB 3.2Å; L657-S661 PolarHBondContact O-N 3.49Å; L657-S661 PolarHBondContact O-OG 2.74Å; H658-S661 PolarHBondContact O-N 3.16Å; I659-S661 PolarHBondContact O-N 2.88Å; S661-S665 WeakPolarHBondContact O-CB 3.25Å; S661-S665 PolarHBondContact O-N 2.62Å; S661-Y821 WeakPolarHBondContact O-CD2 3.46Å; S661-Y821 WeakPolarHBondContact O-CE2 3.42Å; S661-L824 PolarHBondContact OG-O 2.86Å
662	Q	97.7	Very high	94.7	Very high	9 Å²	9	24.1 Å²	24.1	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-68	-45.5	176.7	-71.7	179.7	86	0	0	111.8	H599 H658 I659 A660 S665 G666 L691 V693	H599-Q662 VanDerWaalsContact CB-O 3.25Å; H599-Q662 WeakPolarHBondContact CB-O 3.32Å; H599-Q662 VanDerWaalsContact CE1-CG 3.41Å; H599-Q662 WeakPolarHBondContact CE1-CG 3.18Å; H599-Q662 PolarHBondContact CE1-OE1 3.27Å; H599-Q662 VanDerWaalsContact CG-O 3.29Å; H658-Q662 PolarHBondContact CD2-NE2 3.18Å; H658-Q662 PolarHBondContact NE2-NE2 2.87Å; H658-Q662 VanDerWaalsContact O-CG 3.27Å; H658-Q662 WeakPolarHBondContact O-CG 3.44Å; H658-Q662 PolarHBondContact O-N 2.91Å; H658-Q662 VanDerWaalsContact O-N 3.11Å; H658-Q662 PolarHBondContact O-NE2 2.84Å; I659-Q662 PolarHBondContact O-N 3.45Å; A660-Q662 VanDerWaalsContact C-N 3.34Å; A660-Q662 PolarHBondContact O-N 2.96Å; Q662-S665 WeakPolarHBondContact O-CB 3.35Å; Q662-S665 PolarHBondContact O-N 3.41Å; Q662-G666 PolarHBondContact O-N 2.76Å; Q662-L691 PolarHBondContact NE2-O 2.91Å; Q662-L691 PolarHBondContact OE1-O 3.09Å; Q662-V693 HydrophobicContact CB-CB 4.25Å
663	I	98.1	Very high	94.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-62.2	-46.1	175.5	-60.8	168.5	0	0	0	110.1	L625 I659 A660 S665 G666 M667 C685 V693 I695 F756 I759 I763	L625-I663 HydrophobicContact CD2-CD1 3.69Å; I659-I663 HydrophobicContact CG2-CD1 4.16Å; I659-I663 WeakPolarHBondContact O-CG1 3.15Å; I659-I663 PolarHBondContact O-N 3.45Å; A660-I663 PolarHBondContact O-N 3.19Å; I663-S665 VanDerWaalsContact C-N 3.29Å; I663-S665 PolarHBondContact O-N 3.1Å; I663-G666 PolarHBondContact O-N 2.89Å; I663-G666 VanDerWaalsContact O-N 3.1Å; I663-M667 PolarHBondContact O-N 2.89Å; I663-C685 HydrophobicContact CD1-CB 4.48Å; I663-V693 HydrophobicContact CD1-CG1 4.11Å; I663-V693 HydrophobicContact CG1-CG1 3.73Å; I663-I695 HydrophobicContact CG2-CD1 4.07Å; I663-I695 HydrophobicContact CG2-CG1 4.06Å; I663-F756 HydrophobicContact CB-CE2 3.99Å; I663-F756 HydrophobicContact CG2-CD2 3.86Å; I663-F756 HydrophobicContact CG2-CE2 3.72Å; I663-I759 HydrophobicContact CD1-CG2 3.79Å; I663-I759 HydrophobicContact CG2-CD1 4.3Å; I663-I763 HydrophobicContact CD1-CD1 4.28Å
664	A	98.2	Very high	94.4	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.8	-39.9	176.1	0	0	0	0	0	112.3	A660 M667 V668 F756 I817 Y821 L824	A660-A664 WeakPolarHBondContact O-CB 3.37Å; A660-A664 PolarHBondContact O-N 3.37Å; A664-M667 PolarHBondContact O-N 2.89Å; A664-V668 WeakPolarHBondContact O-CG2 3.44Å; A664-V668 PolarHBondContact O-N 2.91Å; A664-F756 HydrophobicContact CB-CE1 4.42Å; A664-F756 HydrophobicContact CB-CE2 3.99Å; A664-F756 HydrophobicContact CB-CZ 3.72Å; A664-I817 HydrophobicContact CB-CD1 4.25Å; A664-Y821 HydrophobicContact CB-CD2 4.17Å; A664-L824 HydrophobicContact CB-CD1 4.24Å
665	S	97.8	Very high	94.1	Very high	19 Å²	19	30.7 Å²	30.7	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-43.6	174.1	-173	0	0	0	0	112.1	H597 H599 S661 Q662 I663 M667 V668 Y669	H597-S665 PolarHBondContact CE1-O 3.22Å; H599-S665 PolarHBondContact CD2-OG 2.78Å; S661-S665 WeakPolarHBondContact O-CB 3.25Å; S661-S665 PolarHBondContact O-N 2.62Å; Q662-S665 WeakPolarHBondContact O-CB 3.35Å; Q662-S665 PolarHBondContact O-N 3.41Å; I663-S665 VanDerWaalsContact C-N 3.29Å; I663-S665 PolarHBondContact O-N 3.1Å; S665-M667 PolarHBondContact O-N 2.77Å; S665-V668 PolarHBondContact O-N 3.06Å; S665-Y669 PolarHBondContact O-N 3Å
666	G	96.5	Very high	93.9	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-58.7	-44.2	173.1	0	0	0	0	0	112.8	Q662 I663 Y669 L670	Q662-G666 PolarHBondContact O-N 2.76Å; I663-G666 PolarHBondContact O-N 2.89Å; I663-G666 VanDerWaalsContact O-N 3.1Å; G666-Y669 WeakPolarHBondContact O-CB 3.19Å; G666-Y669 PolarHBondContact O-N 2.96Å; G666-L670 PolarHBondContact O-N 3.04Å
667	M	96.9	Very high	93.6	Very high	9 Å²	9	28.5 Å²	28.5	4%	0.044	15%	0.149	C	C	.	.	H	α-helix	trans	-68.7	-35	176.4	-69.1	177.8	72.8	0	0	114.1	I663 A664 S665 Y669 L670 A671 L680 I695 D752 F756 I817	I663-M667 PolarHBondContact O-N 2.89Å; A664-M667 PolarHBondContact O-N 2.89Å; S665-M667 PolarHBondContact O-N 2.77Å; M667-Y669 PolarHBondContact O-N 2.74Å; M667-L670 PolarHBondContact O-N 3.31Å; M667-A671 WeakPolarHBondContact O-CB 3.4Å; M667-A671 PolarHBondContact O-N 3.31Å; M667-L680 HydrophobicContact CE-CD2 3.76Å; M667-L680 HydrophobicContact CG-CD1 4.44Å; M667-L680 HydrophobicContact CG-CD2 4.02Å; M667-L680 HydrophobicContact SD-CD2 3.39Å; M667-L680 WeakPolarHBondContact SD-CD2 3.3Å; M667-I695 HydrophobicContact CG-CD1 3.83Å; M667-D752 HydrophobicContact CE-CB 3.83Å; M667-D752 VanDerWaalsContact CE-O 3.32Å; M667-D752 WeakPolarHBondContact CE-O 3.29Å; M667-F756 HydrophobicContact CE-CB 3.78Å; M667-F756 HydrophobicContact CE-CG 4.38Å; M667-F756 HydrophobicContact SD-CB 3.55Å; M667-F756 VanDerWaalsContact SD-CB 3.55Å; M667-F756 HydrophobicContact SD-CD2 3.33Å; M667-F756 WeakPolarHBondContact SD-CD2 3.46Å; M667-F756 HydrophobicContact SD-CE2 4.27Å; M667-F756 HydrophobicContact SD-CG 3.6Å; M667-I817 HydrophobicContact CB-CD1 4.08Å; M667-I817 HydrophobicContact CB-CG1 3.6Å; M667-I817 HydrophobicContact CE-CD1 3.85Å; M667-I817 HydrophobicContact CE-CG1 4.09Å; M667-I817 HydrophobicContact SD-CD1 3.65Å; M667-I817 HydrophobicContact SD-CG1 4.15Å
668	V	97.4	Very high	93.1	Very high	33 Å²	33	30.7 Å²	30.7	20%	0.2	16%	0.157	C	C	.	.	H	α-helix	trans	-56.4	-38.7	172	165.6	0	0	0	0	110.2	A664 S665 S672 I817 K818	A664-V668 WeakPolarHBondContact O-CG2 3.44Å; A664-V668 PolarHBondContact O-N 2.91Å; S665-V668 PolarHBondContact O-N 3.06Å; V668-S672 WeakPolarHBondContact O-CB 3.4Å; V668-S672 PolarHBondContact O-N 2.04Å; V668-I817 HydrophobicContact CG2-CG1 4.19Å; V668-I817 HydrophobicContact CG2-CG2 4.07Å; V668-K818 HydrophobicContact CG1-CG 3.94Å; V668-K818 HydrophobicContact CG2-CB 4.48Å; V668-K818 HydrophobicContact CG2-CG 3.94Å
669	Y	96	Very high	92.8	Very high	36 Å²	36	27.1 Å²	27.1	14%	0.141	14%	0.141	C	C	.	.	H	α-helix	trans	-68.3	-50.3	173.1	172.8	-98.2	0	0	0	112.4	N594 L595 Q596 H597 I600 S665 G666 M667 A671 S672 Q673	N594-Y669 PolarHBondContact O-OH 2.71Å; N594-Y669 VanDerWaalsContact O-OH 3.09Å; L595-Y669 HydrophobicContact CB-CE1 4.47Å; L595-Y669 HydrophobicContact CD2-CE1 4.04Å; Q596-Y669 PolarHBondContact N-OH 2.78Å; Q596-Y669 PolarHBondContact O-OH 2.64Å; H597-Y669 HydrophobicContact CB-CD1 3.47Å; H597-Y669 VanDerWaalsContact CB-CD1 3.47Å; H597-Y669 HydrophobicContact CB-CD2 3.9Å; H597-Y669 HydrophobicContact CB-CE1 3.78Å; H597-Y669 HydrophobicContact CB-CE2 4.19Å; H597-Y669 HydrophobicContact CB-CG 3.52Å; H597-Y669 AromaticContact CD2-CD2 3.95Å; H597-Y669 AromaticContact CD2-CG 3.89Å; H597-Y669 AromaticContact CG-CD1 4Å; H597-Y669 AromaticContact CG-CG 3.6Å; I600-Y669 HydrophobicContact CG1-CD1 3.88Å; I600-Y669 HydrophobicContact CG1-CE1 4.31Å; S665-Y669 PolarHBondContact O-N 3Å; G666-Y669 WeakPolarHBondContact O-CB 3.19Å; G666-Y669 PolarHBondContact O-N 2.96Å; M667-Y669 PolarHBondContact O-N 2.74Å; Y669-A671 PolarHBondContact O-N 2.85Å; Y669-S672 WeakPolarHBondContact O-CA 3.41Å; Y669-S672 WeakPolarHBondContact O-CB 3.32Å; Y669-S672 PolarHBondContact O-N 3.3Å; Y669-S672 PolarHBondContact O-OG 2.63Å; Y669-Q673 HydrophobicContact CD2-CG 4.44Å; Y669-Q673 HydrophobicContact CE1-CG 4.01Å; Y669-Q673 HydrophobicContact CE2-CG 3.91Å; Y669-Q673 PolarHBondContact O-N 3.31Å; Y669-Q673 VanDerWaalsContact O-N 3.11Å
670	L	91.9	Very high	92.6	Very high	7 Å²	7	27.2 Å²	27.2	4%	0.037	14%	0.142	C	C	.	.	H	α-helix	trans	-56.8	-46.8	179	-64.8	179.7	0	0	0	112.3	L595 I600 G666 M667 S672 Q673 H674 F675 I695	L595-L670 HydrophobicContact CD1-CD2 4.12Å; L595-L670 HydrophobicContact CD2-CD2 4.09Å; I600-L670 HydrophobicContact CD1-CD1 3.97Å; I600-L670 HydrophobicContact CD1-CD2 3.77Å; I600-L670 HydrophobicContact CD1-CG 3.78Å; I600-L670 HydrophobicContact CG1-CD2 4.3Å; G666-L670 PolarHBondContact O-N 3.04Å; M667-L670 PolarHBondContact O-N 3.31Å; L670-S672 PolarHBondContact O-N 2.97Å; L670-Q673 CarbonylContact O-C 3.56Å; L670-Q673 WeakPolarHBondContact O-CA 3.3Å; L670-Q673 PolarHBondContact O-N 2.93Å; L670-H674 PolarHBondContact O-N 2.87Å; L670-F675 HydrophobicContact CB-CB 4.36Å; L670-F675 HydrophobicContact CB-CD1 4.31Å; L670-F675 HydrophobicContact CD1-CD1 4.18Å; L670-F675 HydrophobicContact CD2-CB 4.42Å; L670-F675 HydrophobicContact CD2-CD1 3.8Å; L670-F675 HydrophobicContact CD2-CG 4.38Å; L670-F675 HydrophobicContact CG-CD1 4.3Å; L670-F675 PolarHBondContact O-N 2.9Å; L670-I695 HydrophobicContact CD1-CD1 4.4Å
671	A	91.1	Very high	92.5	Very high	27 Å²	27	27.2 Å²	27.2	22%	0.223	14%	0.142	C	C	.	.	H	α-helix	trans	-61	-30.5	175.3	0	0	0	0	0	112.8	M667 Y669 Q673 H674 T749 I817	M667-A671 WeakPolarHBondContact O-CB 3.4Å; M667-A671 PolarHBondContact O-N 3.31Å; Y669-A671 PolarHBondContact O-N 2.85Å; A671-Q673 VanDerWaalsContact C-N 3.34Å; A671-H674 PolarHBondContact O-N 3.48Å; A671-T749 HydrophobicContact CB-CG2 3.72Å; A671-I817 HydrophobicContact CB-CG2 4.19Å
672	S	92.9	Very high	92.4	Very high	54 Å²	54	26.8 Å²	26.8	38%	0.378	14%	0.139	S	C	.	.	H	α-helix	trans	-73.8	-22.2	173.9	81.8	0	0	0	0	114.1	V668 Y669 L670 H674	V668-S672 WeakPolarHBondContact O-CB 3.4Å; V668-S672 PolarHBondContact O-N 2.04Å; Y669-S672 WeakPolarHBondContact O-CA 3.41Å; Y669-S672 WeakPolarHBondContact O-CB 3.32Å; Y669-S672 PolarHBondContact O-N 3.3Å; Y669-S672 PolarHBondContact O-OG 2.63Å; L670-S672 PolarHBondContact O-N 2.97Å; S672-H674 VanDerWaalsContact C-N 3.32Å
673	Q	87.7	Confident	92	Very high	84 Å²	84	26.8 Å²	26.8	39%	0.393	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.2	8.4	173.2	-56.5	-49.2	-73.3	0	0	112	L595 Y669 L670 A671 F675	L595-Q673 HydrophobicContact CD2-CB 4.15Å; L595-Q673 HydrophobicContact CD2-CG 4.14Å; Y669-Q673 HydrophobicContact CD2-CG 4.44Å; Y669-Q673 HydrophobicContact CE1-CG 4.01Å; Y669-Q673 HydrophobicContact CE2-CG 3.91Å; Y669-Q673 PolarHBondContact O-N 3.31Å; Y669-Q673 VanDerWaalsContact O-N 3.11Å; L670-Q673 CarbonylContact O-C 3.56Å; L670-Q673 WeakPolarHBondContact O-CA 3.3Å; L670-Q673 PolarHBondContact O-N 2.93Å; A671-Q673 VanDerWaalsContact C-N 3.34Å; Q673-F675 PolarHBondContact O-N 2.03Å
674	H	83.7	Confident	91.7	Very high	146 Å²	146	27.5 Å²	27.5	68%	0.676	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	25.6	-171.9	-56.4	-77	0	0	0	113.9	L670 A671 S672	L670-H674 PolarHBondContact O-N 2.87Å; A671-H674 PolarHBondContact O-N 3.48Å; S672-H674 VanDerWaalsContact C-N 3.32Å
675	F	83.8	Confident	91.5	Very high	43 Å²	43	27.5 Å²	27.5	19%	0.189	14%	0.142	C	C	.	.			trans	-90	133.6	178.3	-172.4	-94.3	0	0	0	110.8	L591 L595 L670 Q673 H677	L591-F675 HydrophobicContact CD1-CD2 4.08Å; L591-F675 HydrophobicContact CD1-CE2 3.79Å; L591-F675 HydrophobicContact CD2-CD2 4.1Å; L591-F675 HydrophobicContact CD2-CE2 3.51Å; L591-F675 HydrophobicContact CD2-CZ 4.17Å; L591-F675 HydrophobicContact CG-CD2 4.49Å; L591-F675 HydrophobicContact CG-CE2 4.2Å; L595-F675 HydrophobicContact CD1-CD1 4.32Å; L595-F675 HydrophobicContact CD1-CD2 4.18Å; L595-F675 HydrophobicContact CD1-CE1 4.4Å; L595-F675 HydrophobicContact CD1-CE2 4.3Å; L595-F675 HydrophobicContact CD1-CG 4.2Å; L595-F675 HydrophobicContact CD1-CZ 4.39Å; L670-F675 HydrophobicContact CB-CB 4.36Å; L670-F675 HydrophobicContact CB-CD1 4.31Å; L670-F675 HydrophobicContact CD1-CD1 4.18Å; L670-F675 HydrophobicContact CD2-CB 4.42Å; L670-F675 HydrophobicContact CD2-CD1 3.8Å; L670-F675 HydrophobicContact CD2-CG 4.38Å; L670-F675 HydrophobicContact CG-CD1 4.3Å; L670-F675 PolarHBondContact O-N 2.9Å; Q673-F675 PolarHBondContact O-N 2.03Å; F675-H677 HydrophobicContact CE1-CB 4.42Å
676	V	86.6	Confident	91.3	Very high	31 Å²	31	28.8 Å²	28.8	19%	0.188	15%	0.147	C	C	.	.			trans	-116.4	121.2	176.6	-178.1	0	0	0	0	108	R678 F747 T748 D752	V676-R678 HydrophobicContact CG1-CG 3.93Å; V676-F747 HydrophobicContact CG1-CB 4.14Å; V676-T748 WeakPolarHBondContact CG1-O 3.34Å; V676-D752 WeakPolarHBondContact CA-OD2 3.04Å
677	H	87.8	Confident	91.1	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.009	15%	0.147	C	C	.	.			trans	-75.7	-37.8	-174	-172.5	-56.8	0	0	0	112.6	F675 D679 L680 N684 I695 G696 D697 D752	F675-H677 HydrophobicContact CE1-CB 4.42Å; H677-D679 PolarHBondContact CE1-O 3.31Å; H677-D679 PolarHBondContact ND1-N 3.16Å; H677-D679 PolarHBondContact O-N 3.45Å; H677-L680 HydrophobicContact CB-CB 4.36Å; H677-L680 HydrophobicContact CB-CD1 4.25Å; H677-L680 PolarHBondContact ND1-N 2.92Å; H677-N684 PolarHBondContact CE1-ND2 3.42Å; H677-I695 VanDerWaalsContact CD2-CG2 3.4Å; H677-I695 WeakPolarHBondContact CD2-CG2 3.3Å; H677-I695 WeakPolarHBondContact NE2-CG2 3.32Å; H677-G696 PolarHBondContact NE2-O 3.37Å; H677-D697 IonicContact CE1-OD1 3.18Å; H677-D697 PolarHBondContact CE1-OD1 2.87Å; H677-D697 IonicContact CE1-OD2 3.74Å; H677-D697 IonicContact CG-OD2 3.89Å; H677-D697 IonicContact ND1-OD2 3.67Å; H677-D697 WeakPolarHBondContact NE2-CA 3.29Å; H677-D697 WeakPolarHBondContact NE2-CB 3.11Å; H677-D752 PolarHBondContact N-OD2 2.84Å
678	R	85.2	Confident	90.6	Very high	46 Å²	46	28.5 Å²	28.5	17%	0.174	15%	0.146	C	C	.	.	S	Bend	trans	67.8	-26.2	176.9	-44.6	177	175.6	-178	-6.3	116.2	M505 V676 F747 D752	M505-R678 PolarHBondContact O-NH1 2.85Å; V676-R678 HydrophobicContact CG1-CG 3.93Å; R678-F747 HydrophobicContact CB-CD1 3.79Å; R678-F747 HydrophobicContact CB-CE1 4.11Å; R678-F747 HydrophobicContact CB-CG 4.33Å; R678-F747 HydrophobicContact CG-CB 3.96Å; R678-F747 HydrophobicContact CG-CD1 3.9Å; R678-F747 HydrophobicContact CG-CG 3.96Å; R678-D752 PolarHBondContact N-OD1 2.64Å
679	D	88.1	Confident	89.9	Confident	15 Å²	15	29 Å²	29	8%	0.08	16%	0.155	C	C	.	.			trans	-126.5	42.2	178.1	-171.7	24.9	0	0	0	112	M505 H677 A681 R683 N684 Y709 P733	M505-D679 HydrophobicContact CE-CB 3.93Å; H677-D679 PolarHBondContact CE1-O 3.31Å; H677-D679 PolarHBondContact ND1-N 3.16Å; H677-D679 PolarHBondContact O-N 3.45Å; D679-A681 PolarHBondContact O-N 3.44Å; D679-A681 VanDerWaalsContact O-N 3.08Å; D679-R683 IonicContact OD1-CZ 2.84Å; D679-R683 IonicContact OD1-NE 2.72Å; D679-R683 IonicContact OD1-NH2 2.89Å; D679-R683 PolarHBondContact OD1-NH2 2.85Å; D679-N684 PolarHBondContact O-ND2 3.02Å; D679-N684 PolarHBondContact OD2-ND2 2.9Å; D679-Y709 PolarHBondContact OD1-OH 2.83Å; D679-Y709 PolarHBondContact OD2-OH 3.08Å; D679-P733 HydrophobicContact CB-CG 4.27Å; D679-P733 WeakPolarHBondContact OD1-CB 3.47Å; D679-P733 WeakPolarHBondContact OD1-CG 3.28Å
680	L	92.5	Very high	89.3	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.187	C	C	.	.			trans	-74.5	102	-177.3	-166	86.1	0	0	0	111.1	M667 H677 I695 S755 F756 I759	M667-L680 HydrophobicContact CE-CD2 3.76Å; M667-L680 HydrophobicContact CG-CD1 4.44Å; M667-L680 HydrophobicContact CG-CD2 4.02Å; M667-L680 HydrophobicContact SD-CD2 3.39Å; M667-L680 WeakPolarHBondContact SD-CD2 3.3Å; H677-L680 HydrophobicContact CB-CB 4.36Å; H677-L680 HydrophobicContact CB-CD1 4.25Å; H677-L680 PolarHBondContact ND1-N 2.92Å; L680-I695 HydrophobicContact CD1-CD1 4.09Å; L680-I695 HydrophobicContact CD1-CG1 4.31Å; L680-I695 HydrophobicContact CD1-CG2 3.84Å; L680-S755 WeakPolarHBondContact O-CB 3.41Å; L680-F756 HydrophobicContact CD2-CB 4.1Å; L680-I759 HydrophobicContact CD2-CD1 3.93Å; L680-I759 HydrophobicContact CG-CD1 3.69Å
681	A	94.4	Very high	89.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	S	Bend	trans	-142.8	163.4	179.3	0	0	0	0	0	111.9	D679 R683 N684 C685 W736	D679-A681 PolarHBondContact O-N 3.44Å; D679-A681 VanDerWaalsContact O-N 3.08Å; A681-R683 HydrophobicContact CB-CG 3.91Å; A681-R683 VanDerWaalsContact CB-CZ 3.47Å; A681-R683 PolarHBondContact O-N 2.89Å; A681-N684 PolarHBondContact O-N 3.09Å; A681-C685 PolarHBondContact O-N 2.84Å; A681-W736 HydrophobicContact CB-CD2 4.06Å; A681-W736 HydrophobicContact CB-CG 4.09Å; A681-W736 HydrophobicContact CB-CZ2 4.28Å
682	T	95.2	Very high	89.2	Confident	0 Å²	0	37 Å²	37	0%	0	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-21.7	179.3	67.5	0	0	0	0	113.8	L625 N626 L629 N684 C685 I759 E762 I763	L625-T682 WeakPolarHBondContact CB-O 3.37Å; L625-T682 HydrophobicContact CD2-CG2 3.99Å; L625-T682 HydrophobicContact CG-CG2 4.35Å; L625-T682 PolarHBondContact N-O 3.04Å; N626-T682 WeakPolarHBondContact CA-OG1 3.38Å; N626-T682 VanDerWaalsContact CB-OG1 3.26Å; N626-T682 WeakPolarHBondContact CB-OG1 3.34Å; N626-T682 PolarHBondContact N-O 3.05Å; N626-T682 VanDerWaalsContact N-O 3.16Å; N626-T682 PolarHBondContact ND2-OG1 3.32Å; L629-T682 HydrophobicContact CD1-CG2 3.92Å; T682-N684 VanDerWaalsContact C-N 3.25Å; T682-N684 PolarHBondContact O-N 2.84Å; T682-C685 PolarHBondContact O-N 2.68Å; T682-I759 HydrophobicContact CG2-CG1 4.28Å; T682-I759 HydrophobicContact CG2-CG2 4.13Å; T682-E762 WeakPolarHBondContact CB-OE1 3.3Å; T682-E762 HydrophobicContact CG2-CB 3.6Å; T682-E762 HydrophobicContact CG2-CG 4.26Å; T682-E762 WeakPolarHBondContact CG2-OE2 3.33Å; T682-E762 PolarHBondContact N-OE2 3.23Å; T682-E762 VanDerWaalsContact OG1-CD 3.29Å; T682-E762 PolarHBondContact OG1-OE1 2.87Å; T682-I763 HydrophobicContact CG2-CG1 4.43Å
683	R	91.2	Very high	89.4	Confident	10 Å²	10	34.4 Å²	34.4	4%	0.038	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.1	171.4	61.1	174.7	173.8	-78	-14.3	113.7	D624 N626 D679 A681 Y705 D708 Y709 P733 W736	D624-R683 WeakPolarHBondContact CB-O 3.43Å; N626-R683 HydrophobicContact CB-CB 4.42Å; D679-R683 IonicContact OD1-CZ 2.84Å; D679-R683 IonicContact OD1-NE 2.72Å; D679-R683 IonicContact OD1-NH2 2.89Å; D679-R683 PolarHBondContact OD1-NH2 2.85Å; A681-R683 HydrophobicContact CB-CG 3.91Å; A681-R683 VanDerWaalsContact CB-CZ 3.47Å; A681-R683 PolarHBondContact O-N 2.89Å; R683-Y705 HydrophobicContact CB-CD1 4.33Å; R683-Y705 HydrophobicContact CB-CD2 3.96Å; R683-Y705 HydrophobicContact CB-CE1 4.3Å; R683-Y705 HydrophobicContact CB-CE2 3.88Å; R683-Y705 HydrophobicContact CB-CG 4.19Å; R683-D708 IonicContact CZ-OD2 3.5Å; R683-D708 IonicContact NE-OD2 3.51Å; R683-D708 VanDerWaalsContact NH1-CG 3.32Å; R683-D708 IonicContact NH1-OD2 2.79Å; R683-D708 PolarHBondContact NH1-OD2 3.34Å; R683-Y709 PolarHBondContact NE-OH 2.97Å; R683-P733 VanDerWaalsContact NH2-CB 3.35Å; R683-W736 VanDerWaalsContact NH1-CZ2 3.28Å
684	N	90.6	Very high	89.8	Confident	14 Å²	14	31.3 Å²	31.3	8%	0.075	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.9	180	-68.5	-20.7	0	0	0	112.7	H677 D679 A681 T682 G696	H677-N684 PolarHBondContact CE1-ND2 3.42Å; D679-N684 PolarHBondContact O-ND2 3.02Å; D679-N684 PolarHBondContact OD2-ND2 2.9Å; A681-N684 PolarHBondContact O-N 3.09Å; T682-N684 VanDerWaalsContact C-N 3.25Å; T682-N684 PolarHBondContact O-N 2.84Å; N684-G696 CarbonylContact O-C 3.41Å; N684-G696 WeakPolarHBondContact O-CA 3.42Å; N684-G696 PolarHBondContact O-N 3.06Å
685	C	94.4	Very high	90.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	140.3	168.3	-63.8	0	0	0	0	110.3	D624 L625 I663 A681 T682 V693 K694	D624-C685 CarbonylContact C-O 3.57Å; D624-C685 VanDerWaalsContact CA-O 3.27Å; D624-C685 WeakPolarHBondContact CA-O 3.38Å; L625-C685 HydrophobicContact CB-CB 3.83Å; L625-C685 HydrophobicContact CD2-CB 3.94Å; L625-C685 PolarHBondContact N-O 3.43Å; I663-C685 HydrophobicContact CD1-CB 4.48Å; A681-C685 PolarHBondContact O-N 2.84Å; T682-C685 PolarHBondContact O-N 2.68Å; C685-V693 HydrophobicContact CB-CG1 4.22Å; C685-K694 CarbonylContact C-O 3.56Å; C685-K694 WeakPolarHBondContact CA-O 3.28Å
686	L	93.3	Very high	90.2	Very high	46 Å²	46	22.8 Å²	22.8	24%	0.241	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	149	178.7	-61	-174.8	0	0	0	112.2	V601 M620 G623 D624 V693 K694	V601-L686 HydrophobicContact CG1-CD1 4.29Å; V601-L686 HydrophobicContact CG2-CB 4.22Å; V601-L686 HydrophobicContact CG2-CD1 3.81Å; V601-L686 HydrophobicContact CG2-CG 4.14Å; M620-L686 HydrophobicContact CB-CB 3.63Å; M620-L686 HydrophobicContact CB-CD1 3.99Å; M620-L686 HydrophobicContact CB-CG 4.4Å; M620-L686 HydrophobicContact CE-CB 4.15Å; M620-L686 WeakPolarHBondContact CE-O 3.31Å; M620-L686 HydrophobicContact CG-CB 3.68Å; M620-L686 HydrophobicContact CG-CD1 3.87Å; M620-L686 HydrophobicContact CG-CG 4.44Å; G623-L686 CarbonylContact O-C 3.53Å; G623-L686 WeakPolarHBondContact O-CA 3.41Å; D624-L686 HydrophobicContact CB-CD2 4.26Å; L686-V693 WeakPolarHBondContact O-CA 3.38Å; L686-K694 PolarHBondContact N-O 2.9Å; L686-K694 PolarHBondContact O-N 3.48Å
687	V	92.2	Very high	89.2	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.6	-176.7	-171.3	0	0	0	0	111.5	M620 H622 G623 L625 F628 V693	M620-V687 CarbonylContact C-O 3.48Å; H622-V687 HydrophobicContact CB-CB 3.92Å; H622-V687 HydrophobicContact CB-CG1 4.01Å; H622-V687 WeakPolarHBondContact CB-O 3.27Å; H622-V687 PolarHBondContact N-O 2.9Å; G623-V687 PolarHBondContact O-N 3.24Å; L625-V687 HydrophobicContact CB-CG2 3.9Å; L625-V687 HydrophobicContact CD1-CG2 3.71Å; L625-V687 HydrophobicContact CG-CG2 4.42Å; F628-V687 HydrophobicContact CB-CG2 4.03Å; F628-V687 HydrophobicContact CD1-CG1 4.46Å; F628-V687 HydrophobicContact CD1-CG2 4.34Å; F628-V687 HydrophobicContact CD2-CB 4.46Å; F628-V687 HydrophobicContact CD2-CG1 4.18Å; F628-V687 HydrophobicContact CE2-CG1 4.22Å; F628-V687 HydrophobicContact CG-CB 4.42Å; F628-V687 HydrophobicContact CG-CG1 4.3Å; F628-V687 HydrophobicContact CG-CG2 4.06Å; F628-V687 HydrophobicContact CZ-CG1 4.4Å; V687-V693 HydrophobicContact CG2-CG2 4.33Å
688	G	87	Confident	87.4	Confident	3 Å²	3	23.4 Å²	23.4	3%	0.031	13%	0.127	C	C	.	.			trans	-100.5	-158	-177.5	0	0	0	0	0	113.2	M620 H622 L692	M620-G688 VanDerWaalsContact CE-N 3.33Å; H622-G688 PolarHBondContact CD2-O 2.89Å; G688-L692 PolarHBondContact N-O 2.84Å
689	A	81.9	Confident	85.8	Confident	45 Å²	45	21.9 Å²	21.9	37%	0.372	13%	0.126	S	C	.	.	G	3₁₀ helix	trans	-66.5	152.3	171.4	0	0	0	0	0	111.7	K621 L691 L692	K621-A689 HydrophobicContact CD-CB 4.44Å; A689-L691 VanDerWaalsContact C-N 3.27Å; A689-L691 PolarHBondContact O-N 3.33Å; A689-L692 WeakPolarHBondContact O-CB 3.47Å; A689-L692 PolarHBondContact O-N 3.44Å
690	N	83.6	Confident	83.8	Confident	155 Å²	155	24 Å²	24	83%	0.829	14%	0.136	S	C	*	.	G	3₁₀ helix	trans	55.8	34	172.3	-53.6	-11.2	0	0	0	115	L692	N690-L692 PolarHBondContact O-N 2.79Å
691	L	88.3	Confident	81.6	Confident	32 Å²	32	25 Å²	25	17%	0.168	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	58.6	24.7	-173.8	-64.7	174.1	0	0	0	114.4	F628 L651 Q655 Q662 A689 V693	F628-L691 HydrophobicContact CE1-CD2 3.48Å; F628-L691 VanDerWaalsContact CE1-CD2 3.48Å; F628-L691 HydrophobicContact CZ-CD2 3.42Å; F628-L691 VanDerWaalsContact CZ-CD2 3.42Å; L651-L691 HydrophobicContact CD2-CD1 4.47Å; L651-L691 HydrophobicContact CD2-CD2 4.47Å; Q655-L691 HydrophobicContact CB-CD1 4.17Å; Q655-L691 HydrophobicContact CG-CD1 4.01Å; Q662-L691 PolarHBondContact NE2-O 2.91Å; Q662-L691 PolarHBondContact OE1-O 3.09Å; A689-L691 VanDerWaalsContact C-N 3.27Å; A689-L691 PolarHBondContact O-N 3.33Å; L691-V693 PolarHBondContact O-N 3.43Å; L691-V693 VanDerWaalsContact O-N 3.17Å
692	L	92.5	Very high	79.6	Confident	49 Å²	49	27.6 Å²	27.6	26%	0.257	15%	0.153	S	C	.	.			trans	-62	115.6	167.4	177.6	59.2	0	0	0	109.3	G688 A689 N690 K694	G688-L692 PolarHBondContact N-O 2.84Å; A689-L692 WeakPolarHBondContact O-CB 3.47Å; A689-L692 PolarHBondContact O-N 3.44Å; N690-L692 PolarHBondContact O-N 2.79Å; L692-K694 HydrophobicContact CD1-CG 4.48Å; L692-K694 HydrophobicContact CG-CG 4.29Å
693	V	96.6	Very high	77.6	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.1	176.7	-178.7	0	0	0	0	109.5	H599 L625 I659 Q662 I663 C685 L686 V687 L691	H599-V693 PolarHBondContact ND1-O 3.42Å; L625-V693 HydrophobicContact CD2-CG1 4.2Å; I659-V693 HydrophobicContact CB-CG2 4.38Å; I659-V693 HydrophobicContact CG1-CG2 3.96Å; I659-V693 HydrophobicContact CG2-CG2 4.15Å; Q662-V693 HydrophobicContact CB-CB 4.25Å; I663-V693 HydrophobicContact CD1-CG1 4.11Å; I663-V693 HydrophobicContact CG1-CG1 3.73Å; C685-V693 HydrophobicContact CB-CG1 4.22Å; L686-V693 WeakPolarHBondContact O-CA 3.38Å; V687-V693 HydrophobicContact CG2-CG2 4.33Å; L691-V693 PolarHBondContact O-N 3.43Å; L691-V693 VanDerWaalsContact O-N 3.17Å
694	K	96	Very high	75.8	Confident	19 Å²	19	36.9 Å²	36.9	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	141.9	177.6	-53.6	-170.9	177.5	-162.7	0	110.7	E598 H599 V601 E618 M620 C685 L686 L692	E598-K694 WeakPolarHBondContact O-CD 3.48Å; E598-K694 WeakPolarHBondContact O-CE 3.25Å; H599-K694 CarbonylContact O-C 3.56Å; H599-K694 VanDerWaalsContact O-CA 3.32Å; H599-K694 WeakPolarHBondContact O-CA 3.4Å; V601-K694 HydrophobicContact CG2-CB 3.8Å; E618-K694 WeakPolarHBondContact OE1-CD 3.42Å; E618-K694 VanDerWaalsContact OE1-CE 3.31Å; E618-K694 WeakPolarHBondContact OE1-CE 3.37Å; E618-K694 IonicContact OE1-NZ 2.64Å; E618-K694 PolarHBondContact OE1-NZ 3.17Å; E618-K694 IonicContact OE2-NZ 2.8Å; E618-K694 PolarHBondContact OE2-NZ 3.22Å; M620-K694 HydrophobicContact CE-CB 3.97Å; M620-K694 HydrophobicContact CE-CD 3.85Å; M620-K694 HydrophobicContact CE-CG 3.63Å; M620-K694 HydrophobicContact SD-CD 4.21Å; C685-K694 CarbonylContact C-O 3.56Å; C685-K694 WeakPolarHBondContact CA-O 3.28Å; L686-K694 PolarHBondContact N-O 2.9Å; L686-K694 PolarHBondContact O-N 3.48Å; L692-K694 HydrophobicContact CD1-CG 4.48Å; L692-K694 HydrophobicContact CG-CG 4.29Å
695	I	94.1	Very high	74.5	Confident	3 Å²	3	37 Å²	37	2%	0.015	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	123.1	170.8	-57.8	162.5	0	0	0	107.6	H599 I600 V601 I663 M667 L670 H677 L680	H599-I695 PolarHBondContact O-N 2.88Å; I600-I695 WeakPolarHBondContact CA-O 3.29Å; I600-I695 HydrophobicContact CD1-CB 3.98Å; I600-I695 HydrophobicContact CD1-CD1 4.2Å; V601-I695 WeakPolarHBondContact CG2-O 3.35Å; V601-I695 PolarHBondContact N-O 2.98Å; I663-I695 HydrophobicContact CG2-CD1 4.07Å; I663-I695 HydrophobicContact CG2-CG1 4.06Å; M667-I695 HydrophobicContact CG-CD1 3.83Å; L670-I695 HydrophobicContact CD1-CD1 4.4Å; H677-I695 VanDerWaalsContact CD2-CG2 3.4Å; H677-I695 WeakPolarHBondContact CD2-CG2 3.3Å; H677-I695 WeakPolarHBondContact NE2-CG2 3.32Å; L680-I695 HydrophobicContact CD1-CD1 4.09Å; L680-I695 HydrophobicContact CD1-CG1 4.31Å; L680-I695 HydrophobicContact CD1-CG2 3.84Å
696	G	83.7	Confident	73.1	Confident	8 Å²	8	40.3 Å²	40.3	8%	0.082	23%	0.23	C	C	.	.			trans	-101.8	161.4	162.4	0	0	0	0	0	109.7	H677 N684	H677-G696 PolarHBondContact NE2-O 3.37Å; N684-G696 CarbonylContact O-C 3.41Å; N684-G696 WeakPolarHBondContact O-CA 3.42Å; N684-G696 PolarHBondContact O-N 3.06Å
697	D	64.9	Low	72	Confident	28 Å²	28	42.3 Å²	42.3	15%	0.15	24%	0.244	C	C	.	.			trans	-151.7	90.7	167.8	-166.4	8.3	0	0	0	110.3	M505 H677	M505-D697 VanDerWaalsContact CE-OD1 3.25Å; M505-D697 WeakPolarHBondContact CE-OD1 3.32Å; H677-D697 IonicContact CE1-OD1 3.18Å; H677-D697 PolarHBondContact CE1-OD1 2.87Å; H677-D697 IonicContact CE1-OD2 3.74Å; H677-D697 IonicContact CG-OD2 3.89Å; H677-D697 IonicContact ND1-OD2 3.67Å; H677-D697 WeakPolarHBondContact NE2-CA 3.29Å; H677-D697 WeakPolarHBondContact NE2-CB 3.11Å
698	F	50.7	Low	71.1	Confident	18 Å²	18	42.7 Å²	42.7	8%	0.079	25%	0.246	C	C	.	.	S	Bend	trans	-134.3	141.3	169.7	-56.5	-57.7	0	0	0	106.5	K572 E588 L592 F617 M700	K572-F698 HydrophobicContact CD-CB 4Å; K572-F698 HydrophobicContact CD-CG 4.37Å; E588-F698 WeakPolarHBondContact OE1-CD1 3.45Å; L592-F698 HydrophobicContact CD1-CD1 4.19Å; L592-F698 HydrophobicContact CD1-CE1 3.27Å; L592-F698 HydrophobicContact CD1-CZ 3.92Å; L592-F698 HydrophobicContact CD2-CE1 3.44Å; L592-F698 VanDerWaalsContact CD2-CE1 3.44Å; L592-F698 HydrophobicContact CD2-CZ 3.6Å; L592-F698 HydrophobicContact CG-CE1 3.9Å; L592-F698 HydrophobicContact CG-CZ 4.34Å; F617-F698 HydrophobicContact CD1-CD2 4.39Å; F617-F698 AromaticContact CD1-CE2 3.61Å; F617-F698 HydrophobicContact CD1-CE2 3.61Å; F617-F698 AromaticContact CD1-CZ 3.83Å; F617-F698 HydrophobicContact CD1-CZ 3.83Å; F617-F698 HydrophobicContact CD2-CD2 4.45Å; F617-F698 HydrophobicContact CD2-CE2 4.44Å; F617-F698 HydrophobicContact CE1-CD1 4.17Å; F617-F698 AromaticContact CE1-CD2 3.95Å; F617-F698 HydrophobicContact CE1-CD2 3.95Å; F617-F698 AromaticContact CE1-CE1 3.55Å; F617-F698 HydrophobicContact CE1-CE1 3.55Å; F617-F698 AromaticContact CE1-CE2 3.21Å; F617-F698 HydrophobicContact CE1-CE2 3.21Å; F617-F698 HydrophobicContact CE1-CG 4.41Å; F617-F698 AromaticContact CE1-CZ 3.03Å; F617-F698 HydrophobicContact CE1-CZ 3.03Å; F617-F698 HydrophobicContact CE2-CD1 4.33Å; F617-F698 AromaticContact CE2-CD2 3.97Å; F617-F698 HydrophobicContact CE2-CD2 3.97Å; F617-F698 HydrophobicContact CE2-CE1 4.5Å; F617-F698 HydrophobicContact CE2-CE2 4.07Å; F617-F698 HydrophobicContact CE2-CG 4.16Å; F617-F698 HydrophobicContact CE2-CZ 4.39Å; F617-F698 HydrophobicContact CG-CE2 4.23Å; F617-F698 AromaticContact CZ-CD1 3.61Å; F617-F698 HydrophobicContact CZ-CD1 3.61Å; F617-F698 AromaticContact CZ-CD2 3.71Å; F617-F698 HydrophobicContact CZ-CD2 3.71Å; F617-F698 AromaticContact CZ-CE1 3.43Å; F617-F698 HydrophobicContact CZ-CE1 3.43Å; F617-F698 VanDerWaalsContact CZ-CE1 3.43Å; F617-F698 AromaticContact CZ-CE2 3.47Å; F617-F698 HydrophobicContact CZ-CE2 3.47Å; F617-F698 VanDerWaalsContact CZ-CE2 3.47Å; F617-F698 AromaticContact CZ-CG 3.82Å; F617-F698 HydrophobicContact CZ-CG 3.82Å; F617-F698 AromaticContact CZ-CZ 3.38Å; F617-F698 HydrophobicContact CZ-CZ 3.38Å; F698-M700 HydrophobicContact CB-CG 3.8Å; F698-M700 HydrophobicContact CB-SD 3.73Å; F698-M700 HydrophobicContact CD2-SD 4.38Å; F698-M700 HydrophobicContact CG-SD 4.43Å; F698-M700 VanDerWaalsContact O-CB 3.29Å; F698-M700 WeakPolarHBondContact O-CB 3.21Å; F698-M700 PolarHBondContact O-N 3.48Å
699	G	50.9	Low	70.3	Confident	13 Å²	13	44 Å²	44	13%	0.134	25%	0.25	C	S	.	.	S	Bend	trans	-54.3	81.9	170.8	0	0	0	0	0	112.9	F549	F549-G699 VanDerWaalsContact CB-O 3.23Å; F549-G699 WeakPolarHBondContact CB-O 3.3Å; F549-G699 WeakPolarHBondContact CD2-O 3.33Å; F549-G699 VanDerWaalsContact CG-O 3.26Å; F549-G699 WeakPolarHBondContact CG-O 3.27Å; F549-G699 VanDerWaalsContact CZ-CA 3.43Å
700	M	45.8	Very low	69.8	Low	59 Å²	59	45 Å²	45	29%	0.291	25%	0.245	S	C	.	.			trans	-145.4	6.3	-166.2	-76.8	-176.2	47.6	0	0	111.8	V552 K572 F698 R702	V552-M700 HydrophobicContact CB-CE 3.84Å; V552-M700 HydrophobicContact CG1-CE 3.84Å; V552-M700 HydrophobicContact CG2-CE 3.35Å; V552-M700 HydrophobicContact CG2-CG 3.91Å; V552-M700 HydrophobicContact CG2-SD 3.48Å; V552-M700 WeakPolarHBondContact CG2-SD 3.44Å; K572-M700 HydrophobicContact CD-CG 4.45Å; K572-M700 HydrophobicContact CD-SD 4.48Å; K572-M700 HydrophobicContact CG-SD 4.47Å; F698-M700 HydrophobicContact CB-CG 3.8Å; F698-M700 HydrophobicContact CB-SD 3.73Å; F698-M700 HydrophobicContact CD2-SD 4.38Å; F698-M700 HydrophobicContact CG-SD 4.43Å; F698-M700 VanDerWaalsContact O-CB 3.29Å; F698-M700 WeakPolarHBondContact O-CB 3.21Å; F698-M700 PolarHBondContact O-N 3.48Å; M700-R702 PolarHBondContact O-N 3.16Å
701	S	46.9	Very low	69.1	Low	24 Å²	24	43 Å²	43	17%	0.168	23%	0.225	C	C	.	.			trans	-52.4	108.4	169.4	-78.4	0	0	0	0	108.4	G547 Y709	G547-S701 WeakPolarHBondContact CA-O 3.19Å; S701-Y709 VanDerWaalsContact CB-CE2 3.5Å; S701-Y709 WeakPolarHBondContact CB-OH 3.47Å; S701-Y709 WeakPolarHBondContact OG-CE2 3.47Å; S701-Y709 PolarHBondContact OG-OH 2.84Å
702	R	52.1	Low	67.7	Low	54 Å²	54	42.2 Å²	42.2	20%	0.204	22%	0.221	C	C	.	.	B	Isolated β-bridge	trans	-66	157.9	-175.7	-61.5	179	177.7	127.8	-13.2	108.5	L544 E546 D624 M700 V704 Y705	L544-R702 PolarHBondContact O-NE 3.49Å; L544-R702 PolarHBondContact O-NH2 2.95Å; E546-R702 VanDerWaalsContact O-CA 3.24Å; E546-R702 WeakPolarHBondContact O-CA 3.45Å; E546-R702 WeakPolarHBondContact O-CB 3.32Å; D624-R702 IonicContact OD2-CZ 2.62Å; D624-R702 IonicContact OD2-NH1 2.66Å; D624-R702 PolarHBondContact OD2-NH1 3.44Å; D624-R702 IonicContact OD2-NH2 2.74Å; M700-R702 PolarHBondContact O-N 3.16Å; R702-V704 HydrophobicContact CB-CB 4.32Å; R702-V704 HydrophobicContact CB-CG2 4.36Å; R702-V704 PolarHBondContact O-N 3.47Å; R702-Y705 HydrophobicContact CB-CD2 4.4Å; R702-Y705 PolarHBondContact O-N 2.91Å
703	D	53.9	Low	65.6	Low	106 Å²	106	47 Å²	47	57%	0.567	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-56.5	-25.1	177.1	-47.4	-42.6	0	0	0	112.2	Y705 S706	D703-Y705 PolarHBondContact O-N 2.93Å; D703-S706 VanDerWaalsContact O-CB 3.24Å; D703-S706 WeakPolarHBondContact O-CB 3.28Å; D703-S706 PolarHBondContact O-N 3Å; D703-S706 VanDerWaalsContact O-N 3.11Å; D703-S706 PolarHBondContact O-OG 3.37Å
704	V	53	Low	63	Low	98 Å²	98	48.8 Å²	48.8	59%	0.594	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-56.7	-26.4	170.2	-173.3	0	0	0	0	114.2	R702	R702-V704 HydrophobicContact CB-CB 4.32Å; R702-V704 HydrophobicContact CB-CG2 4.36Å; R702-V704 PolarHBondContact O-N 3.47Å
705	Y	63.1	Low	60.3	Low	16 Å²	16	51.7 Å²	51.7	6%	0.063	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-108.2	13.6	178.7	-61	-60.7	0	0	0	112.7	D624 N626 K627 R683 R702 D703 T707 D708 Y709	D624-Y705 PolarHBondContact OD1-OH 2.91Å; N626-Y705 HydrophobicContact CB-CE1 4.27Å; K627-Y705 WeakPolarHBondContact CE-OH 3.32Å; K627-Y705 WeakPolarHBondContact CG-OH 3.33Å; R683-Y705 HydrophobicContact CB-CD1 4.33Å; R683-Y705 HydrophobicContact CB-CD2 3.96Å; R683-Y705 HydrophobicContact CB-CE1 4.3Å; R683-Y705 HydrophobicContact CB-CE2 3.88Å; R683-Y705 HydrophobicContact CB-CG 4.19Å; R702-Y705 HydrophobicContact CB-CD2 4.4Å; R702-Y705 PolarHBondContact O-N 2.91Å; D703-Y705 PolarHBondContact O-N 2.93Å; Y705-T707 PolarHBondContact O-N 3.23Å; Y705-T707 VanDerWaalsContact O-N 3.15Å; Y705-D708 WeakPolarHBondContact O-CB 3.26Å; Y705-D708 PolarHBondContact O-N 3.34Å; Y705-Y709 WeakPolarHBondContact O-CD2 3.49Å
706	S	65.2	Low	57.7	Low	71 Å²	71	53.4 Å²	53.4	50%	0.497	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-52.6	-36	179	49	0	0	0	0	113.3	D703 D708 Y709	D703-S706 VanDerWaalsContact O-CB 3.24Å; D703-S706 WeakPolarHBondContact O-CB 3.28Å; D703-S706 PolarHBondContact O-N 3Å; D703-S706 VanDerWaalsContact O-N 3.11Å; D703-S706 PolarHBondContact O-OG 3.37Å; S706-D708 VanDerWaalsContact C-N 3.26Å; S706-D708 PolarHBondContact O-N 3.27Å; S706-Y709 PolarHBondContact O-N 3.11Å
707	T	70.2	Confident	55.8	Low	88 Å²	88	56.2 Å²	56.2	54%	0.54	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-71	-12.8	178.4	58.6	0	0	0	0	115	Y705 Q769	Y705-T707 PolarHBondContact O-N 3.23Å; Y705-T707 VanDerWaalsContact O-N 3.15Å; T707-Q769 PolarHBondContact O-NE2 3.36Å
708	D	72.1	Confident	54.6	Low	8 Å²	8	60.2 Å²	60.2	4%	0.043	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-76.1	-15.6	173	-73.7	-12.4	0	0	0	112.5	R683 Y705 S706 W736 Q769	R683-D708 IonicContact CZ-OD2 3.5Å; R683-D708 IonicContact NE-OD2 3.51Å; R683-D708 VanDerWaalsContact NH1-CG 3.32Å; R683-D708 IonicContact NH1-OD2 2.79Å; R683-D708 PolarHBondContact NH1-OD2 3.34Å; Y705-D708 WeakPolarHBondContact O-CB 3.26Å; Y705-D708 PolarHBondContact O-N 3.34Å; S706-D708 VanDerWaalsContact C-N 3.26Å; S706-D708 PolarHBondContact O-N 3.27Å; D708-W736 HydrophobicContact CB-CH2 3.97Å; D708-W736 HydrophobicContact CB-CZ3 3.66Å; D708-W736 WeakPolarHBondContact OD1-CH2 3.47Å; D708-Q769 PolarHBondContact OD1-NE2 2.82Å
709	Y	70.8	Confident	54	Low	30 Å²	30	66.9 Å²	66.9	12%	0.118	37%	0.37	C	S	.	.			trans	-110.3	147.4	-177	-64.3	-89.1	0	0	0	111.8	D679 R683 S701 Y705 S706 M731 L732 P733	D679-Y709 PolarHBondContact OD1-OH 2.83Å; D679-Y709 PolarHBondContact OD2-OH 3.08Å; R683-Y709 PolarHBondContact NE-OH 2.97Å; S701-Y709 VanDerWaalsContact CB-CE2 3.5Å; S701-Y709 WeakPolarHBondContact CB-OH 3.47Å; S701-Y709 WeakPolarHBondContact OG-CE2 3.47Å; S701-Y709 PolarHBondContact OG-OH 2.84Å; Y705-Y709 WeakPolarHBondContact O-CD2 3.49Å; S706-Y709 PolarHBondContact O-N 3.11Å; Y709-M731 HydrophobicContact CD1-CB 4.46Å; Y709-L732 WeakPolarHBondContact CA-O 3.04Å; Y709-P733 HydrophobicContact CD1-CB 4.27Å; Y709-P733 HydrophobicContact CE1-CB 3.98Å
710	Y	70.8	Confident	53.5	Low	66 Å²	66	72.3 Å²	72.3	26%	0.259	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	136.1	176.3	-174.5	-124.2	0	0	0	110.9	L712 L732 I734 N776 I780	Y710-L712 HydrophobicContact CD1-CD2 3.88Å; Y710-L712 HydrophobicContact CE1-CD2 3.98Å; Y710-L732 PolarHBondContact N-O 3.19Å; Y710-L732 PolarHBondContact O-N 3.36Å; Y710-I734 HydrophobicContact CD1-CD1 3.93Å; Y710-I734 HydrophobicContact CD1-CG2 4.46Å; Y710-I734 HydrophobicContact CG-CD1 4.08Å; Y710-N776 HydrophobicContact CD1-CB 4.06Å; Y710-N776 HydrophobicContact CD2-CB 3.61Å; Y710-N776 WeakPolarHBondContact CD2-ND2 3.23Å; Y710-N776 HydrophobicContact CE1-CB 4.36Å; Y710-N776 HydrophobicContact CE2-CB 3.95Å; Y710-N776 HydrophobicContact CG-CB 3.67Å; Y710-I780 HydrophobicContact CD1-CD1 3.86Å; Y710-I780 HydrophobicContact CE1-CD1 3.71Å
711	R	69.4	Low	53.1	Low	112 Å²	112	70.8 Å²	70.8	42%	0.423	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	118.2	167.6	-178.7	176.5	-83.7	173.3	-6.8	108.3	F713 G728 H729 M731	R711-F713 PolarHBondContact O-N 2.82Å; R711-G728 WeakPolarHBondContact CG-O 3Å; R711-H729 PolarHBondContact NE-O 3.42Å; R711-H729 VanDerWaalsContact NE-O 3.09Å; R711-H729 PolarHBondContact NH2-O 3.16Å; R711-M731 HydrophobicContact CB-SD 3.8Å
712	L	58.3	Low	52.8	Low	16 Å²	16	75.3 Å²	75.3	8%	0.084	41%	0.406	C	S	.	.			trans	-73.3	91.7	172.3	-67.8	178.4	0	0	0	109.7	Y710 L732 I780	Y710-L712 HydrophobicContact CD1-CD2 3.88Å; Y710-L712 HydrophobicContact CE1-CD2 3.98Å; L712-L732 HydrophobicContact CD1-CD1 3.61Å; L712-L732 HydrophobicContact CG-CD1 4.09Å; L712-I780 HydrophobicContact CD2-CD1 3.48Å; L712-I780 VanDerWaalsContact CD2-CD1 3.48Å; L712-I780 HydrophobicContact CD2-CG1 4.49Å
713	F	49.3	Very low	52.6	Low	150 Å²	150	76.2 Å²	76.2	66%	0.658	41%	0.41	S	S	*	.			trans	-79.9	144.9	173.3	-170.2	-109.8	0	0	0	111.2	R711 P715	R711-F713 PolarHBondContact O-N 2.82Å; F713-P715 HydrophobicContact CD1-CB 4.5Å; F713-P715 VanDerWaalsContact O-CD 3.3Å; F713-P715 WeakPolarHBondContact O-CD 3.16Å
714	N	41.4	Very low	52	Low	38 Å²	38	72.4 Å²	72.4	20%	0.203	39%	0.391	C	S	.	.			trans	-88.5	106.6	165.1	-174.6	-7.2	0	0	0	108.6	S716 N718 C724	N714-S716 PolarHBondContact O-N 3.16Å; N714-S716 VanDerWaalsContact O-N 3.11Å; N714-S716 PolarHBondContact OD1-N 3.19Å; N714-S716 VanDerWaalsContact OD1-N 3.09Å; N714-S716 PolarHBondContact OD1-OG 2.78Å; N714-N718 PolarHBondContact ND2-O 3.24Å; N714-C724 HydrophobicContact CB-CB 4.33Å
715	P	40.8	Very low	51.4	Low	79 Å²	79	75.1 Å²	75.1	51%	0.513	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-4.7	-176.6	-14.7	31.9	0	0	0	113.9	F713	F713-P715 HydrophobicContact CD1-CB 4.5Å; F713-P715 VanDerWaalsContact O-CD 3.3Å; F713-P715 WeakPolarHBondContact O-CD 3.16Å
716	S	39.7	Very low	50.2	Low	39 Å²	39	79.5 Å²	79.5	27%	0.273	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-8.6	-160.4	72.9	0	0	0	0	116	N714 N718	N714-S716 PolarHBondContact O-N 3.16Å; N714-S716 VanDerWaalsContact O-N 3.11Å; N714-S716 PolarHBondContact OD1-N 3.19Å; N714-S716 VanDerWaalsContact OD1-N 3.09Å; N714-S716 PolarHBondContact OD1-OG 2.78Å; S716-N718 PolarHBondContact O-N 3.31Å; S716-N718 PolarHBondContact O-ND2 3.04Å
717	G	42.5	Very low	49	Very low	68 Å²	68	77.6 Å²	77.6	70%	0.701	42%	0.418	S	S	*	.			trans	62.3	-4.1	178	0	0	0	0	0	116.8
718	N	39.6	Very low	47.7	Very low	111 Å²	111	74.4 Å²	74.4	59%	0.594	40%	0.402	S	S	*	.	S	Bend	trans	-98	143.2	-176.7	-64.8	-47.1	0	0	0	111.3	N714 S716 F720	N714-N718 PolarHBondContact ND2-O 3.24Å; S716-N718 PolarHBondContact O-N 3.31Å; S716-N718 PolarHBondContact O-ND2 3.04Å; N718-F720 PolarHBondContact O-N 2.83Å
719	D	39.1	Very low	46.7	Very low	159 Å²	159	80.9 Å²	80.9	85%	0.85	43%	0.432	S	S	*	.	S	Bend	trans	-69.7	22.3	-173.6	-57.5	-45.7	0	0	0	115.7
720	F	39.5	Very low	46.2	Very low	126 Å²	126	82.3 Å²	82.3	55%	0.553	44%	0.443	S	S	*	.			trans	-113.8	22.5	-177.2	-149.7	-105.8	0	0	0	113.5	N718	N718-F720 PolarHBondContact O-N 2.83Å
721	C	37.1	Very low	46	Very low	28 Å²	28	83.2 Å²	83.2	19%	0.189	45%	0.451	C	S	.	.			trans	-104.6	91.7	175.4	-157.5	0	0	0	0	109.4	W723 C724	C721-W723 PolarHBondContact O-N 2.85Å; C721-C724 HydrophobicContact CB-CB 4.23Å; C721-C724 WeakPolarHBondContact O-CB 3.44Å; C721-C724 PolarHBondContact O-N 3.25Å; C721-C724 VanDerWaalsContact SG-SG 3.62Å
722	I	41.5	Very low	46.4	Very low	119 Å²	119	78.5 Å²	78.5	61%	0.61	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-26.2	178.9	-62	174.9	0	0	0	112.4	C724	I722-C724 PolarHBondContact O-N 2.81Å
723	W	46.5	Very low	47.8	Very low	72 Å²	72	78.1 Å²	78.1	27%	0.273	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.1	175.6	-53.7	89.7	0	0	0	115.5	C721 I742 M743 R745 I780 T784	C721-W723 PolarHBondContact O-N 2.85Å; W723-I742 VanDerWaalsContact CE3-O 3.24Å; W723-I742 HydrophobicContact CH2-CG2 3.86Å; W723-I742 HydrophobicContact CZ3-CB 4.37Å; W723-I742 HydrophobicContact CZ3-CG2 3.42Å; W723-I742 VanDerWaalsContact CZ3-CG2 3.42Å; W723-I742 WeakPolarHBondContact CZ3-O 3.18Å; W723-M743 HydrophobicContact CH2-CB 4.07Å; W723-M743 HydrophobicContact CH2-CG 3.48Å; W723-M743 VanDerWaalsContact CH2-CG 3.48Å; W723-M743 HydrophobicContact CZ2-CB 4.48Å; W723-M743 HydrophobicContact CZ2-CG 3.94Å; W723-M743 VanDerWaalsContact CZ3-CA 3.46Å; W723-M743 HydrophobicContact CZ3-CB 4.4Å; W723-M743 HydrophobicContact CZ3-CG 4.21Å; W723-R745 PolarHBondContact O-NE 3.38Å; W723-R745 PolarHBondContact O-NH2 2.85Å; W723-R745 VanDerWaalsContact O-NH2 3.13Å; W723-I780 HydrophobicContact CH2-CG2 4.18Å; W723-I780 HydrophobicContact CZ3-CG2 4.37Å; W723-T784 HydrophobicContact CH2-CG2 3.88Å
724	C	42.7	Very low	49.7	Very low	27 Å²	27	71 Å²	71	18%	0.182	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-17.2	-156.4	-63.5	0	0	0	0	115.7	N714 C721 I722 V726 G727	N714-C724 HydrophobicContact CB-CB 4.33Å; C721-C724 HydrophobicContact CB-CB 4.23Å; C721-C724 WeakPolarHBondContact O-CB 3.44Å; C721-C724 PolarHBondContact O-N 3.25Å; C721-C724 VanDerWaalsContact SG-SG 3.62Å; I722-C724 PolarHBondContact O-N 2.81Å; C724-V726 PolarHBondContact O-N 3.31Å; C724-G727 PolarHBondContact O-N 3.47Å
725	E	40.3	Very low	52.3	Low	154 Å²	154	69.6 Å²	69.6	72%	0.72	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-15.2	-172.6	-71.1	-177.3	122.4	0	0	115.2
726	V	38.5	Very low	54.9	Low	108 Å²	108	65.9 Å²	65.9	66%	0.655	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.9	47.2	-178	-152.1	0	0	0	0	113.4	C724 R745	C724-V726 PolarHBondContact O-N 3.31Å; V726-R745 PolarHBondContact O-NH1 3.41Å
727	G	40	Very low	57.5	Low	32 Å²	32	64.1 Å²	64.1	33%	0.33	36%	0.356	S	S	.	.			trans	120.4	81.1	158.7	0	0	0	0	0	116.1	C724 H729 R745	C724-G727 PolarHBondContact O-N 3.47Å; G727-H729 PolarHBondContact O-N 3.28Å; G727-H729 VanDerWaalsContact O-N 3.12Å; G727-R745 VanDerWaalsContact O-CZ 3.29Å; G727-R745 PolarHBondContact O-NH1 2.91Å; G727-R745 PolarHBondContact O-NH2 2.89Å
728	G	42.4	Very low	60	Low	21 Å²	21	60.9 Å²	60.9	22%	0.216	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	8.1	-179.9	0	0	0	0	0	117.1	R711	R711-G728 WeakPolarHBondContact CG-O 3Å
729	H	51.4	Low	62.5	Low	144 Å²	144	55.9 Å²	55.9	67%	0.667	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-15.4	-171.7	-58.3	-87.7	0	0	0	114.5	R711 G727	R711-H729 PolarHBondContact NE-O 3.42Å; R711-H729 VanDerWaalsContact NE-O 3.09Å; R711-H729 PolarHBondContact NH2-O 3.16Å; G727-H729 PolarHBondContact O-N 3.28Å; G727-H729 VanDerWaalsContact O-N 3.12Å
730	T	58.8	Low	64.9	Low	59 Å²	59	49.1 Å²	49.1	36%	0.362	26%	0.26	S	S	.	.			trans	-73.9	134.1	-175.2	-46.3	0	0	0	0	112.4	L732	T730-L732 HydrophobicContact CG2-CD2 4.1Å
731	M	68.3	Low	67.2	Low	86 Å²	86	43.2 Å²	43.2	42%	0.424	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	123.3	169.9	-71.5	-66.1	-86.7	0	0	109.7	Y709 R711	Y709-M731 HydrophobicContact CD1-CB 4.46Å; R711-M731 HydrophobicContact CB-SD 3.8Å
732	L	76	Confident	69.6	Low	13 Å²	13	42 Å²	42	7%	0.068	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	139.4	-172.9	-68.1	173.7	0	0	0	112.1	Y709 Y710 L712 T730 I734 M737	Y709-L732 WeakPolarHBondContact CA-O 3.04Å; Y710-L732 PolarHBondContact N-O 3.19Å; Y710-L732 PolarHBondContact O-N 3.36Å; L712-L732 HydrophobicContact CD1-CD1 3.61Å; L712-L732 HydrophobicContact CG-CD1 4.09Å; T730-L732 HydrophobicContact CG2-CD2 4.1Å; L732-I734 HydrophobicContact CB-CG2 4.1Å; L732-I734 PolarHBondContact O-N 3.19Å; L732-M737 HydrophobicContact CB-SD 3.89Å; L732-M737 HydrophobicContact CD1-CE 4.42Å
733	P	88	Confident	71.4	Confident	7 Å²	7	38.4 Å²	38.4	5%	0.045	21%	0.207	C	C	.	.			trans	-80.1	56.9	-179.6	35.8	-38.4	0	0	0	111.7	D679 R683 Y709 R735 W736 M737	D679-P733 HydrophobicContact CB-CG 4.27Å; D679-P733 WeakPolarHBondContact OD1-CB 3.47Å; D679-P733 WeakPolarHBondContact OD1-CG 3.28Å; R683-P733 VanDerWaalsContact NH2-CB 3.35Å; Y709-P733 HydrophobicContact CD1-CB 4.27Å; Y709-P733 HydrophobicContact CE1-CB 3.98Å; P733-R735 PolarHBondContact O-N 2.86Å; P733-W736 HydrophobicContact CB-CE3 4.37Å; P733-W736 PolarHBondContact O-N 3.15Å; P733-M737 HydrophobicContact CG-CG 4.17Å; P733-M737 HydrophobicContact CG-SD 4.2Å; P733-M737 PolarHBondContact O-N 3.47Å
734	I	89.8	Confident	72.9	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-27.9	-165.7	56.3	156.4	0	0	0	115.4	Y710 L732 W736 M737 N776 V779 I780 I783	Y710-I734 HydrophobicContact CD1-CD1 3.93Å; Y710-I734 HydrophobicContact CD1-CG2 4.46Å; Y710-I734 HydrophobicContact CG-CD1 4.08Å; L732-I734 HydrophobicContact CB-CG2 4.1Å; L732-I734 PolarHBondContact O-N 3.19Å; I734-W736 VanDerWaalsContact C-N 3.28Å; I734-W736 PolarHBondContact O-N 2.8Å; I734-M737 HydrophobicContact CG2-SD 4.39Å; I734-M737 PolarHBondContact O-N 3.47Å; I734-N776 HydrophobicContact CD1-CB 3.59Å; I734-N776 VanDerWaalsContact CD1-O 3.29Å; I734-N776 WeakPolarHBondContact CD1-O 3.31Å; I734-V779 HydrophobicContact CD1-CB 4.39Å; I734-V779 HydrophobicContact CD1-CG1 4.39Å; I734-I780 HydrophobicContact CD1-CD1 4.2Å; I734-I780 HydrophobicContact CD1-CG1 4.03Å; I734-I783 WeakPolarHBondContact O-CD1 3.46Å
735	R	95.2	Very high	74.4	Confident	9 Å²	9	42 Å²	42	3%	0.034	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-18.4	179.1	-70.8	164	-173.5	-80.9	-5.7	113.5	P733 P770 W771 L774 N776 V779	P733-R735 PolarHBondContact O-N 2.86Å; R735-P770 HydrophobicContact CB-CB 4.27Å; R735-P770 WeakPolarHBondContact CD-O 3.23Å; R735-P770 PolarHBondContact NH1-O 3.23Å; R735-W771 VanDerWaalsContact NH1-C 3.3Å; R735-W771 PolarHBondContact NH1-O 3.09Å; R735-L774 PolarHBondContact NH1-O 3.12Å; R735-L774 PolarHBondContact NH2-O 3.3Å; R735-N776 PolarHBondContact NE-OD1 3.27Å; R735-N776 PolarHBondContact NH2-OD1 2.93Å; R735-V779 HydrophobicContact CG-CG1 3.87Å; R735-V779 HydrophobicContact CG-CG2 4.18Å
736	W	96	Very high	76.3	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-12.2	176	-72.3	-100.6	0	0	0	113.2	A681 R683 D708 P733 I734 W754 S755 V758 E762 Q769 P770	A681-W736 HydrophobicContact CB-CD2 4.06Å; A681-W736 HydrophobicContact CB-CG 4.09Å; A681-W736 HydrophobicContact CB-CZ2 4.28Å; R683-W736 VanDerWaalsContact NH1-CZ2 3.28Å; D708-W736 HydrophobicContact CB-CH2 3.97Å; D708-W736 HydrophobicContact CB-CZ3 3.66Å; D708-W736 WeakPolarHBondContact OD1-CH2 3.47Å; P733-W736 HydrophobicContact CB-CE3 4.37Å; P733-W736 PolarHBondContact O-N 3.15Å; I734-W736 VanDerWaalsContact C-N 3.28Å; I734-W736 PolarHBondContact O-N 2.8Å; W736-W754 VanDerWaalsContact O-CD1 3.26Å; W736-S755 WeakPolarHBondContact O-CA 3.29Å; W736-S755 PolarHBondContact O-OG 3.33Å; W736-V758 VanDerWaalsContact CD1-CG1 3.5Å; W736-V758 HydrophobicContact CD2-CG1 4.41Å; W736-V758 HydrophobicContact CG-CB 4.41Å; W736-V758 HydrophobicContact CG-CG1 3.99Å; W736-E762 HydrophobicContact CZ2-CG 4.43Å; W736-E762 PolarHBondContact NE1-OE2 2.81Å; W736-Q769 HydrophobicContact CH2-CG 4.42Å; W736-P770 HydrophobicContact CD2-CG 4.38Å; W736-P770 VanDerWaalsContact CH2-CD 3.46Å; W736-P770 HydrophobicContact CH2-CG 4.05Å; W736-P770 HydrophobicContact CZ2-CG 3.65Å
737	M	93.7	Very high	78.5	Confident	2 Å²	2	35.5 Å²	35.5	1%	0.01	18%	0.178	C	C	.	.			trans	-84.9	147.4	-173.3	-67.5	168.8	62	0	0	112.6	L732 P733 I734 S741 I742 F747 W754	L732-M737 HydrophobicContact CB-SD 3.89Å; L732-M737 HydrophobicContact CD1-CE 4.42Å; P733-M737 HydrophobicContact CG-CG 4.17Å; P733-M737 HydrophobicContact CG-SD 4.2Å; P733-M737 PolarHBondContact O-N 3.47Å; I734-M737 HydrophobicContact CG2-SD 4.39Å; I734-M737 PolarHBondContact O-N 3.47Å; M737-S741 VanDerWaalsContact CE-C 3.48Å; M737-S741 VanDerWaalsContact CE-O 3.28Å; M737-S741 WeakPolarHBondContact CE-O 3.23Å; M737-I742 HydrophobicContact CB-CD1 3.92Å; M737-I742 HydrophobicContact CB-CG1 3.57Å; M737-I742 HydrophobicContact CE-CG1 4.04Å; M737-I742 WeakPolarHBondContact O-CD1 3.25Å; M737-F747 HydrophobicContact CE-CE1 3.98Å; M737-F747 HydrophobicContact CE-CZ 3.82Å; M737-W754 PolarHBondContact O-NE1 3.38Å; M737-W754 VanDerWaalsContact O-NE1 3.12Å
738	P	95.6	Very high	80.9	Confident	1 Å²	1	34.5 Å²	34.5	1%	0.006	17%	0.166	C	C	.	.			trans	-79.3	167.7	170.9	34.8	-39.8	0	0	0	112.8	E740 S741 I742 W754	P738-E740 VanDerWaalsContact C-N 3.31Å; P738-E740 WeakPolarHBondContact CB-OE2 3.47Å; P738-E740 WeakPolarHBondContact CG-OE1 3.48Å; P738-E740 PolarHBondContact O-N 2.78Å; P738-S741 WeakPolarHBondContact CD-OG 3.33Å; P738-S741 WeakPolarHBondContact CG-OG 3.39Å; P738-S741 PolarHBondContact O-N 3.19Å; P738-I742 WeakPolarHBondContact O-CG1 3.46Å; P738-I742 PolarHBondContact O-N 3.09Å; P738-W754 HydrophobicContact CB-CB 3.79Å; P738-W754 HydrophobicContact CB-CD2 3.51Å; P738-W754 HydrophobicContact CB-CE3 3.81Å; P738-W754 HydrophobicContact CB-CG 3.5Å; P738-W754 HydrophobicContact CG-CB 4.26Å; P738-W754 HydrophobicContact CG-CG 4.31Å
739	P	92.5	Very high	83.2	Confident	6 Å²	6	34.9 Å²	34.9	4%	0.039	16%	0.164	C	C	.	.	H	α-helix	trans	-52.9	-41.5	-179.9	-25.4	33.2	0	0	0	114.2	I742 M743 W754 I783	P739-I742 PolarHBondContact O-N 2.79Å; P739-M743 VanDerWaalsContact O-CB 3.25Å; P739-M743 WeakPolarHBondContact O-CB 3.26Å; P739-M743 WeakPolarHBondContact O-CG 3.47Å; P739-M743 PolarHBondContact O-N 3.24Å; P739-W754 HydrophobicContact CG-CH2 4.11Å; P739-W754 HydrophobicContact CG-CZ3 4.31Å; P739-I783 HydrophobicContact CB-CG2 4.46Å; P739-I783 HydrophobicContact CG-CG2 3.78Å
740	E	89.1	Confident	85.4	Confident	16 Å²	16	29.7 Å²	29.7	8%	0.075	14%	0.14	C	C	.	.	H	α-helix	trans	-74.9	-28.1	-178	75.8	-71.8	175.2	0	0	114.2	P738 Y744 R745 K746 P811 R814	P738-E740 VanDerWaalsContact C-N 3.31Å; P738-E740 WeakPolarHBondContact CB-OE2 3.47Å; P738-E740 WeakPolarHBondContact CG-OE1 3.48Å; P738-E740 PolarHBondContact O-N 2.78Å; E740-Y744 HydrophobicContact CB-CD2 4.07Å; E740-Y744 CarbonylContact O-C 3.56Å; E740-Y744 WeakPolarHBondContact O-CA 3.45Å; E740-Y744 WeakPolarHBondContact O-CB 3.44Å; E740-Y744 PolarHBondContact O-N 3.05Å; E740-R745 PolarHBondContact O-N 3.31Å; E740-K746 HydrophobicContact CG-CB 4.24Å; E740-K746 HydrophobicContact CG-CD 4.5Å; E740-K746 PolarHBondContact O-N 2.91Å; E740-P811 HydrophobicContact CG-CG 3.96Å; E740-R814 IonicContact OE1-CZ 3.43Å; E740-R814 IonicContact OE1-NH1 2.71Å; E740-R814 PolarHBondContact OE1-NH1 2.83Å; E740-R814 IonicContact OE1-NH2 3.28Å; E740-R814 PolarHBondContact OE1-NH2 3.34Å; E740-R814 IonicContact OE2-CZ 3.68Å; E740-R814 IonicContact OE2-NH1 3.71Å; E740-R814 IonicContact OE2-NH2 2.75Å; E740-R814 PolarHBondContact OE2-NH2 2.95Å
741	S	88.8	Confident	87.1	Confident	2 Å²	2	26.9 Å²	26.9	1%	0.014	12%	0.123	C	C	.	.	H	α-helix	trans	-74.8	-33.9	172.6	-53.6	0	0	0	0	111	M737 P738 R745 K746 S751	M737-S741 VanDerWaalsContact CE-C 3.48Å; M737-S741 VanDerWaalsContact CE-O 3.28Å; M737-S741 WeakPolarHBondContact CE-O 3.23Å; P738-S741 WeakPolarHBondContact CD-OG 3.33Å; P738-S741 WeakPolarHBondContact CG-OG 3.39Å; P738-S741 PolarHBondContact O-N 3.19Å; S741-R745 WeakPolarHBondContact O-CA 3.35Å; S741-R745 PolarHBondContact O-N 3.46Å; S741-K746 WeakPolarHBondContact CA-O 3.43Å; S741-K746 WeakPolarHBondContact CB-O 3.39Å; S741-K746 PolarHBondContact OG-O 2.94Å; S741-S751 WeakPolarHBondContact OG-CB 3.3Å
742	I	85.8	Confident	88.4	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-69.6	-57.5	174.3	-65.5	169.9	0	0	0	108.9	W723 M737 P738 P739 I780 I783 T784	W723-I742 VanDerWaalsContact CE3-O 3.24Å; W723-I742 HydrophobicContact CH2-CG2 3.86Å; W723-I742 HydrophobicContact CZ3-CB 4.37Å; W723-I742 HydrophobicContact CZ3-CG2 3.42Å; W723-I742 VanDerWaalsContact CZ3-CG2 3.42Å; W723-I742 WeakPolarHBondContact CZ3-O 3.18Å; M737-I742 HydrophobicContact CB-CD1 3.92Å; M737-I742 HydrophobicContact CB-CG1 3.57Å; M737-I742 HydrophobicContact CE-CG1 4.04Å; M737-I742 WeakPolarHBondContact O-CD1 3.25Å; P738-I742 WeakPolarHBondContact O-CG1 3.46Å; P738-I742 PolarHBondContact O-N 3.09Å; P739-I742 PolarHBondContact O-N 2.79Å; I742-I780 HydrophobicContact CG2-CG1 4.39Å; I742-I780 HydrophobicContact CG2-CG2 3.95Å; I742-I783 HydrophobicContact CD1-CB 4.08Å; I742-I783 HydrophobicContact CD1-CD1 3.82Å; I742-I783 HydrophobicContact CD1-CG2 3.73Å; I742-T784 HydrophobicContact CG2-CG2 4.2Å
743	M	80.1	Confident	89.4	Confident	44 Å²	44	22.9 Å²	22.9	22%	0.217	10%	0.104	C	C	.	.	H	α-helix	trans	-71.9	-38	-173.7	-66.6	176.9	75.3	0	0	115.4	W723 P739 T784	W723-M743 HydrophobicContact CH2-CB 4.07Å; W723-M743 HydrophobicContact CH2-CG 3.48Å; W723-M743 VanDerWaalsContact CH2-CG 3.48Å; W723-M743 HydrophobicContact CZ2-CB 4.48Å; W723-M743 HydrophobicContact CZ2-CG 3.94Å; W723-M743 VanDerWaalsContact CZ3-CA 3.46Å; W723-M743 HydrophobicContact CZ3-CB 4.4Å; W723-M743 HydrophobicContact CZ3-CG 4.21Å; P739-M743 VanDerWaalsContact O-CB 3.25Å; P739-M743 WeakPolarHBondContact O-CB 3.26Å; P739-M743 WeakPolarHBondContact O-CG 3.47Å; P739-M743 PolarHBondContact O-N 3.24Å; M743-T784 HydrophobicContact CG-CG2 3.79Å; M743-T784 HydrophobicContact SD-CG2 4.09Å
744	Y	77.5	Confident	89.9	Confident	143 Å²	143	23 Å²	23	56%	0.561	10%	0.103	S	C	*	.	H	α-helix	trans	-128	11.5	-167.1	-47.3	-61.7	0	0	0	113.2	E740 K746	E740-Y744 HydrophobicContact CB-CD2 4.07Å; E740-Y744 CarbonylContact O-C 3.56Å; E740-Y744 WeakPolarHBondContact O-CA 3.45Å; E740-Y744 WeakPolarHBondContact O-CB 3.44Å; E740-Y744 PolarHBondContact O-N 3.05Å; Y744-K746 PolarHBondContact O-N 3.04Å
745	R	74.7	Confident	90.3	Very high	31 Å²	31	23.1 Å²	23.1	12%	0.117	10%	0.104	C	C	.	.			trans	50.4	26	-174.7	-60.1	-178	178.5	-131.6	-10.3	113.8	W723 V726 G727 E740 S741 F747	W723-R745 PolarHBondContact O-NE 3.38Å; W723-R745 PolarHBondContact O-NH2 2.85Å; W723-R745 VanDerWaalsContact O-NH2 3.13Å; V726-R745 PolarHBondContact O-NH1 3.41Å; G727-R745 VanDerWaalsContact O-CZ 3.29Å; G727-R745 PolarHBondContact O-NH1 2.91Å; G727-R745 PolarHBondContact O-NH2 2.89Å; E740-R745 PolarHBondContact O-N 3.31Å; S741-R745 WeakPolarHBondContact O-CA 3.35Å; S741-R745 PolarHBondContact O-N 3.46Å; R745-F747 WeakPolarHBondContact O-CD2 3.3Å; R745-F747 WeakPolarHBondContact O-CE2 3.23Å; R745-F747 PolarHBondContact O-N 3.49Å
746	K	80.4	Confident	90.4	Very high	98 Å²	98	22.7 Å²	22.7	43%	0.426	10%	0.103	S	C	.	.			trans	-86.2	113	-176.9	-172.7	176.6	-177.9	179.6	0	110.2	E740 S741 Y744 T748	E740-K746 HydrophobicContact CG-CB 4.24Å; E740-K746 HydrophobicContact CG-CD 4.5Å; E740-K746 PolarHBondContact O-N 2.91Å; S741-K746 WeakPolarHBondContact CA-O 3.43Å; S741-K746 WeakPolarHBondContact CB-O 3.39Å; S741-K746 PolarHBondContact OG-O 2.94Å; Y744-K746 PolarHBondContact O-N 3.04Å; K746-T748 HydrophobicContact CG-CG2 4.24Å
747	F	84.8	Confident	90.5	Very high	28 Å²	28	22.7 Å²	22.7	12%	0.123	10%	0.103	C	C	.	.			trans	-110.4	134.5	175.3	-60.6	-87.3	0	0	0	110.3	I508 V676 R678 M737 R745 S751	I508-F747 HydrophobicContact CD1-CE2 4.23Å; V676-F747 HydrophobicContact CG1-CB 4.14Å; R678-F747 HydrophobicContact CB-CD1 3.79Å; R678-F747 HydrophobicContact CB-CE1 4.11Å; R678-F747 HydrophobicContact CB-CG 4.33Å; R678-F747 HydrophobicContact CG-CB 3.96Å; R678-F747 HydrophobicContact CG-CD1 3.9Å; R678-F747 HydrophobicContact CG-CG 3.96Å; M737-F747 HydrophobicContact CE-CE1 3.98Å; M737-F747 HydrophobicContact CE-CZ 3.82Å; R745-F747 WeakPolarHBondContact O-CD2 3.3Å; R745-F747 WeakPolarHBondContact O-CE2 3.23Å; R745-F747 PolarHBondContact O-N 3.49Å; F747-S751 WeakPolarHBondContact CA-OG 3.43Å
748	T	90.1	Very high	90.8	Very high	11 Å²	11	22.7 Å²	22.7	7%	0.067	10%	0.103	C	C	.	.			trans	-151.9	169.8	-172.7	52.5	0	0	0	0	110.5	V676 K746 E750 S751 D752	V676-T748 WeakPolarHBondContact CG1-O 3.34Å; K746-T748 HydrophobicContact CG-CG2 4.24Å; T748-E750 WeakPolarHBondContact CB-OE2 3.35Å; T748-E750 PolarHBondContact O-N 3.24Å; T748-E750 PolarHBondContact OG1-N 2.84Å; T748-S751 PolarHBondContact N-OG 2.83Å; T748-S751 PolarHBondContact O-N 3.41Å; T748-S751 PolarHBondContact O-OG 2.8Å; T748-S751 PolarHBondContact OG1-N 3.42Å; T748-S751 VanDerWaalsContact OG1-N 3.13Å; T748-D752 PolarHBondContact O-N 2.04Å; T748-D752 VanDerWaalsContact O-N 3.15Å
749	T	91.7	Very high	90.9	Very high	30 Å²	30	22.6 Å²	22.6	18%	0.184	10%	0.102	C	C	.	.	H	α-helix	trans	-55.7	-31.3	167.4	32.8	0	0	0	0	112.4	A671 D752 V753	A671-T749 HydrophobicContact CB-CG2 3.72Å; T749-D752 PolarHBondContact O-N 3.29Å; T749-V753 WeakPolarHBondContact O-CG2 3.48Å; T749-V753 PolarHBondContact O-N 3.06Å; T749-V753 VanDerWaalsContact O-N 3.11Å
750	E	95.9	Very high	91.2	Very high	34 Å²	34	22.3 Å²	22.3	16%	0.159	10%	0.101	C	C	.	.	H	α-helix	trans	-75.1	-25.3	177	-60.3	70	-112.4	0	0	112.5	T748 W754 P811 R814	T748-E750 WeakPolarHBondContact CB-OE2 3.35Å; T748-E750 PolarHBondContact O-N 3.24Å; T748-E750 PolarHBondContact OG1-N 2.84Å; E750-W754 PolarHBondContact O-N 3.23Å; E750-P811 HydrophobicContact CB-CB 3.73Å; E750-P811 HydrophobicContact CG-CB 4.23Å; E750-P811 WeakPolarHBondContact CG-O 3.39Å; E750-R814 VanDerWaalsContact O-CD 3.27Å; E750-R814 WeakPolarHBondContact O-CD 3.46Å; E750-R814 PolarHBondContact O-NH1 2.86Å
751	S	94.5	Very high	91.6	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.007	10%	0.1	C	C	.	.	H	α-helix	trans	-75.7	-38.4	171.4	65.9	0	0	0	0	111.8	S741 F747 T748 V753 W754 S755	S741-S751 WeakPolarHBondContact OG-CB 3.3Å; F747-S751 WeakPolarHBondContact CA-OG 3.43Å; T748-S751 PolarHBondContact N-OG 2.83Å; T748-S751 PolarHBondContact O-N 3.41Å; T748-S751 PolarHBondContact O-OG 2.8Å; T748-S751 PolarHBondContact OG1-N 3.42Å; T748-S751 VanDerWaalsContact OG1-N 3.13Å; S751-V753 VanDerWaalsContact C-N 3.27Å; S751-V753 PolarHBondContact O-N 3.05Å; S751-W754 WeakPolarHBondContact O-CB 3.4Å; S751-W754 PolarHBondContact O-N 3.34Å; S751-W754 VanDerWaalsContact O-N 3.13Å; S751-S755 PolarHBondContact O-N 2.87Å; S751-S755 VanDerWaalsContact O-N 3.11Å; S751-S755 PolarHBondContact O-OG 2.96Å
752	D	95.7	Very high	92	Very high	7 Å²	7	22.3 Å²	22.3	4%	0.037	10%	0.099	C	C	.	.	H	α-helix	trans	-63.7	-34.2	173.2	-72.9	-7.4	0	0	0	111.5	M667 V676 H677 R678 T748 T749 W754 S755 F756	M667-D752 HydrophobicContact CE-CB 3.83Å; M667-D752 VanDerWaalsContact CE-O 3.32Å; M667-D752 WeakPolarHBondContact CE-O 3.29Å; V676-D752 WeakPolarHBondContact CA-OD2 3.04Å; H677-D752 PolarHBondContact N-OD2 2.84Å; R678-D752 PolarHBondContact N-OD1 2.64Å; T748-D752 PolarHBondContact O-N 2.04Å; T748-D752 VanDerWaalsContact O-N 3.15Å; T749-D752 PolarHBondContact O-N 3.29Å; D752-W754 VanDerWaalsContact C-N 3.34Å; D752-W754 PolarHBondContact O-N 3.48Å; D752-S755 PolarHBondContact O-N 2.87Å; D752-F756 WeakPolarHBondContact O-CB 3.45Å; D752-F756 PolarHBondContact O-N 2.99Å
753	V	98.2	Very high	92.6	Very high	8 Å²	8	22.2 Å²	22.2	5%	0.048	10%	0.099	C	C	.	.	H	α-helix	trans	-60	-40.6	171.5	163.2	0	0	0	0	112.1	T749 S751 F756 G757 C806 R814 L815 I817 I820	T749-V753 WeakPolarHBondContact O-CG2 3.48Å; T749-V753 PolarHBondContact O-N 3.06Å; T749-V753 VanDerWaalsContact O-N 3.11Å; S751-V753 VanDerWaalsContact C-N 3.27Å; S751-V753 PolarHBondContact O-N 3.05Å; V753-F756 WeakPolarHBondContact O-CB 3.18Å; V753-F756 PolarHBondContact O-N 2.77Å; V753-G757 PolarHBondContact O-N 2.96Å; V753-C806 HydrophobicContact CG1-CB 4.13Å; V753-C806 WeakPolarHBondContact O-CB 3.48Å; V753-R814 HydrophobicContact CG1-CB 4.01Å; V753-L815 WeakPolarHBondContact CG1-O 3.46Å; V753-I817 HydrophobicContact CG2-CB 4.02Å; V753-I820 HydrophobicContact CG1-CD1 3.87Å
754	W	98.3	Very high	93.3	Very high	9 Å²	9	20.2 Å²	20.2	3%	0.034	9%	0.089	C	C	.	.	H	α-helix	trans	-62	-48.3	174	176.4	-72.9	0	0	0	111	W736 M737 P738 P739 E750 S751 D752 F756 G757 V758 I783 W807	W736-W754 VanDerWaalsContact O-CD1 3.26Å; M737-W754 PolarHBondContact O-NE1 3.38Å; M737-W754 VanDerWaalsContact O-NE1 3.12Å; P738-W754 HydrophobicContact CB-CB 3.79Å; P738-W754 HydrophobicContact CB-CD2 3.51Å; P738-W754 HydrophobicContact CB-CE3 3.81Å; P738-W754 HydrophobicContact CB-CG 3.5Å; P738-W754 HydrophobicContact CG-CB 4.26Å; P738-W754 HydrophobicContact CG-CG 4.31Å; P739-W754 HydrophobicContact CG-CH2 4.11Å; P739-W754 HydrophobicContact CG-CZ3 4.31Å; E750-W754 PolarHBondContact O-N 3.23Å; S751-W754 WeakPolarHBondContact O-CB 3.4Å; S751-W754 PolarHBondContact O-N 3.34Å; S751-W754 VanDerWaalsContact O-N 3.13Å; D752-W754 VanDerWaalsContact C-N 3.34Å; D752-W754 PolarHBondContact O-N 3.48Å; W754-F756 PolarHBondContact O-N 2.98Å; W754-G757 WeakPolarHBondContact O-CA 3.3Å; W754-G757 PolarHBondContact O-N 3.33Å; W754-V758 PolarHBondContact O-N 2.96Å; W754-V758 VanDerWaalsContact O-N 3.15Å; W754-I783 HydrophobicContact CH2-CG2 4.37Å; W754-I783 HydrophobicContact CZ2-CG2 3.86Å; W754-W807 AromaticContact CD2-CD1 3.57Å; W754-W807 HydrophobicContact CD2-CG 4.41Å; W754-W807 AromaticContact CE2-CD1 3.72Å; W754-W807 HydrophobicContact CE3-CB 4.12Å; W754-W807 AromaticContact CE3-CD1 3.94Å; W754-W807 HydrophobicContact CE3-CG 4.42Å; W754-W807 AromaticContact CG-CD1 3.87Å; W754-W807 HydrophobicContact CH2-CB 4.14Å; W754-W807 HydrophobicContact CZ3-CB 3.89Å; W754-W807 HydrophobicContact CZ3-CG 4.48Å; W754-W807 WeakPolarHBondContact CZ3-O 3.47Å; W754-W807 PolarHBondContact O-NE1 3.39Å
755	S	97.4	Very high	94.2	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.021	7%	0.067	C	C	.	.	H	α-helix	trans	-58.9	-35.5	176.2	-49.9	0	0	0	0	112	L680 W736 S751 D752 V758 I759	L680-S755 WeakPolarHBondContact O-CB 3.41Å; W736-S755 WeakPolarHBondContact O-CA 3.29Å; W736-S755 PolarHBondContact O-OG 3.33Å; S751-S755 PolarHBondContact O-N 2.87Å; S751-S755 VanDerWaalsContact O-N 3.11Å; S751-S755 PolarHBondContact O-OG 2.96Å; D752-S755 PolarHBondContact O-N 2.87Å; S755-V758 CarbonylContact O-C 3.16Å; S755-V758 WeakPolarHBondContact O-CA 3.44Å; S755-V758 WeakPolarHBondContact O-CB 3.32Å; S755-V758 PolarHBondContact O-N 2.98Å; S755-V758 VanDerWaalsContact O-N 3.11Å; S755-I759 PolarHBondContact O-N 3.43Å
756	F	98.4	Very high	95.1	Very high	0 Å²	0	14 Å²	14	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-65.2	-38	172.7	-177.1	-97	0	0	0	113.1	I663 A664 M667 L680 D752 V753 W754 V758 I759 L760 I817 I820 L824	I663-F756 HydrophobicContact CB-CE2 3.99Å; I663-F756 HydrophobicContact CG2-CD2 3.86Å; I663-F756 HydrophobicContact CG2-CE2 3.72Å; A664-F756 HydrophobicContact CB-CE1 4.42Å; A664-F756 HydrophobicContact CB-CE2 3.99Å; A664-F756 HydrophobicContact CB-CZ 3.72Å; M667-F756 HydrophobicContact CE-CB 3.78Å; M667-F756 HydrophobicContact CE-CG 4.38Å; M667-F756 HydrophobicContact SD-CB 3.55Å; M667-F756 VanDerWaalsContact SD-CB 3.55Å; M667-F756 HydrophobicContact SD-CD2 3.33Å; M667-F756 WeakPolarHBondContact SD-CD2 3.46Å; M667-F756 HydrophobicContact SD-CE2 4.27Å; M667-F756 HydrophobicContact SD-CG 3.6Å; L680-F756 HydrophobicContact CD2-CB 4.1Å; D752-F756 WeakPolarHBondContact O-CB 3.45Å; D752-F756 PolarHBondContact O-N 2.99Å; V753-F756 WeakPolarHBondContact O-CB 3.18Å; V753-F756 PolarHBondContact O-N 2.77Å; W754-F756 PolarHBondContact O-N 2.98Å; F756-V758 PolarHBondContact O-N 3.05Å; F756-I759 WeakPolarHBondContact O-CB 3.28Å; F756-I759 PolarHBondContact O-N 3.4Å; F756-I759 VanDerWaalsContact O-N 3.16Å; F756-L760 HydrophobicContact CD1-CD1 4.28Å; F756-L760 HydrophobicContact CD1-CG 4.24Å; F756-L760 HydrophobicContact CE1-CD1 3.77Å; F756-L760 HydrophobicContact CE1-CD2 3.89Å; F756-L760 HydrophobicContact CE1-CG 3.7Å; F756-L760 HydrophobicContact CZ-CD2 3.82Å; F756-L760 HydrophobicContact CZ-CG 4.07Å; F756-L760 PolarHBondContact O-N 3.43Å; F756-I817 HydrophobicContact CD1-CD1 4.16Å; F756-I817 HydrophobicContact CG-CD1 4.19Å; F756-I820 HydrophobicContact CD1-CG2 3.92Å; F756-I820 HydrophobicContact CE1-CG2 3.4Å; F756-I820 HydrophobicContact CZ-CG2 4.29Å; F756-L824 HydrophobicContact CE1-CD1 3.73Å; F756-L824 HydrophobicContact CZ-CD1 3.59Å
757	G	98.3	Very high	95.7	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-56.7	-39.6	169.1	0	0	0	0	0	112	V753 W754 L760 W761 W807	V753-G757 PolarHBondContact O-N 2.96Å; W754-G757 WeakPolarHBondContact O-CA 3.3Å; W754-G757 PolarHBondContact O-N 3.33Å; G757-L760 WeakPolarHBondContact O-CB 3.45Å; G757-L760 PolarHBondContact O-N 2.92Å; G757-W761 PolarHBondContact O-N 3.05Å; G757-W761 VanDerWaalsContact O-N 3.15Å; G757-W807 VanDerWaalsContact C-CZ2 3.42Å; G757-W807 VanDerWaalsContact O-CZ2 3.25Å; G757-W807 WeakPolarHBondContact O-CZ2 3.5Å
758	V	98.4	Very high	96.1	Very high	2 Å²	2	11.6 Å²	11.6	1%	0.012	6%	0.056	C	C	.	.	H	α-helix	trans	-68.8	-39	174.4	-173.5	0	0	0	0	111.8	W736 W754 S755 F756 L760 W761 E762 P770 L789 W807	W736-V758 VanDerWaalsContact CD1-CG1 3.5Å; W736-V758 HydrophobicContact CD2-CG1 4.41Å; W736-V758 HydrophobicContact CG-CB 4.41Å; W736-V758 HydrophobicContact CG-CG1 3.99Å; W754-V758 PolarHBondContact O-N 2.96Å; W754-V758 VanDerWaalsContact O-N 3.15Å; S755-V758 CarbonylContact O-C 3.16Å; S755-V758 WeakPolarHBondContact O-CA 3.44Å; S755-V758 WeakPolarHBondContact O-CB 3.32Å; S755-V758 PolarHBondContact O-N 2.98Å; S755-V758 VanDerWaalsContact O-N 3.11Å; F756-V758 PolarHBondContact O-N 3.05Å; V758-L760 VanDerWaalsContact C-N 3.34Å; V758-L760 PolarHBondContact O-N 3.01Å; V758-W761 CarbonylContact O-C 3.57Å; V758-W761 WeakPolarHBondContact O-CA 3.37Å; V758-W761 WeakPolarHBondContact O-CB 3.39Å; V758-W761 PolarHBondContact O-N 2.94Å; V758-W761 VanDerWaalsContact O-N 3.07Å; V758-E762 WeakPolarHBondContact O-CG 3.3Å; V758-E762 PolarHBondContact O-N 3.38Å; V758-P770 HydrophobicContact CG1-CB 3.83Å; V758-P770 HydrophobicContact CG1-CG 3.31Å; V758-L789 HydrophobicContact CG1-CD1 4.22Å; V758-L789 HydrophobicContact CG2-CD1 4.34Å; V758-W807 HydrophobicContact CG2-CZ2 4.23Å
759	I	98.3	Very high	96.3	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-59.3	-41.7	171.2	-77.6	-176.4	0	0	0	112.1	I663 L680 T682 S755 F756 W761 E762 I763	I663-I759 HydrophobicContact CD1-CG2 3.79Å; I663-I759 HydrophobicContact CG2-CD1 4.3Å; L680-I759 HydrophobicContact CD2-CD1 3.93Å; L680-I759 HydrophobicContact CG-CD1 3.69Å; T682-I759 HydrophobicContact CG2-CG1 4.28Å; T682-I759 HydrophobicContact CG2-CG2 4.13Å; S755-I759 PolarHBondContact O-N 3.43Å; F756-I759 WeakPolarHBondContact O-CB 3.28Å; F756-I759 PolarHBondContact O-N 3.4Å; F756-I759 VanDerWaalsContact O-N 3.16Å; I759-W761 VanDerWaalsContact C-N 3.27Å; I759-W761 PolarHBondContact O-N 3.31Å; I759-E762 PolarHBondContact O-N 2.94Å; I759-I763 HydrophobicContact CG2-CD1 3.74Å; I759-I763 HydrophobicContact CG2-CG1 4.36Å; I759-I763 VanDerWaalsContact O-CG1 3.31Å; I759-I763 WeakPolarHBondContact O-CG1 3.3Å; I759-I763 PolarHBondContact O-N 3.39Å
760	L	98.3	Very high	96.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-58.5	-44.3	173.8	-68.3	179	0	0	0	110.1	A660 F756 G757 V758 I763 F764 V802 M803 L824	A660-L760 HydrophobicContact CB-CD2 3.53Å; F756-L760 HydrophobicContact CD1-CD1 4.28Å; F756-L760 HydrophobicContact CD1-CG 4.24Å; F756-L760 HydrophobicContact CE1-CD1 3.77Å; F756-L760 HydrophobicContact CE1-CD2 3.89Å; F756-L760 HydrophobicContact CE1-CG 3.7Å; F756-L760 HydrophobicContact CZ-CD2 3.82Å; F756-L760 HydrophobicContact CZ-CG 4.07Å; F756-L760 PolarHBondContact O-N 3.43Å; G757-L760 WeakPolarHBondContact O-CB 3.45Å; G757-L760 PolarHBondContact O-N 2.92Å; V758-L760 VanDerWaalsContact C-N 3.34Å; V758-L760 PolarHBondContact O-N 3.01Å; L760-I763 PolarHBondContact O-N 3.48Å; L760-F764 WeakPolarHBondContact O-CD2 3.36Å; L760-F764 PolarHBondContact O-N 2.87Å; L760-V802 HydrophobicContact CD1-CB 4.48Å; L760-V802 HydrophobicContact CD1-CG1 3.8Å; L760-M803 HydrophobicContact CB-CE 3.82Å; L760-M803 HydrophobicContact CB-CG 3.88Å; L760-M803 HydrophobicContact CB-SD 4.44Å; L760-M803 HydrophobicContact CD1-CG 4.07Å; L760-L824 HydrophobicContact CD2-CD1 4.08Å; L760-L824 HydrophobicContact CD2-CD2 4.18Å
761	W	98.3	Very high	96.5	Very high	17 Å²	17	10.6 Å²	10.6	6%	0.064	5%	0.048	C	C	.	.	H	α-helix	trans	-62.1	-42.1	176.2	-168.7	94.5	0	0	0	112.5	G757 V758 I759 F764 T765 K768 P770 F772 L789 E790 P792 M803 W807	G757-W761 PolarHBondContact O-N 3.05Å; G757-W761 VanDerWaalsContact O-N 3.15Å; V758-W761 CarbonylContact O-C 3.57Å; V758-W761 WeakPolarHBondContact O-CA 3.37Å; V758-W761 WeakPolarHBondContact O-CB 3.39Å; V758-W761 PolarHBondContact O-N 2.94Å; V758-W761 VanDerWaalsContact O-N 3.07Å; I759-W761 VanDerWaalsContact C-N 3.27Å; I759-W761 PolarHBondContact O-N 3.31Å; W761-F764 PolarHBondContact O-N 2.93Å; W761-T765 HydrophobicContact CD2-CG2 3.89Å; W761-T765 HydrophobicContact CE3-CG2 4.01Å; W761-T765 HydrophobicContact CH2-CG2 3.91Å; W761-T765 HydrophobicContact CZ2-CG2 3.78Å; W761-T765 HydrophobicContact CZ3-CG2 4.01Å; W761-T765 WeakPolarHBondContact CZ3-OG1 3.02Å; W761-T765 WeakPolarHBondContact O-CB 3.46Å; W761-T765 WeakPolarHBondContact O-CG2 2.92Å; W761-T765 PolarHBondContact O-N 2.9Å; W761-T765 PolarHBondContact O-OG1 3.38Å; W761-K768 HydrophobicContact CH2-CB 4.42Å; W761-K768 HydrophobicContact CZ3-CB 4.25Å; W761-P770 HydrophobicContact CE3-CB 4.48Å; W761-P770 HydrophobicContact CE3-CG 4.48Å; W761-P770 HydrophobicContact CZ3-CB 4.46Å; W761-F772 HydrophobicContact CH2-CD1 4.3Å; W761-F772 HydrophobicContact CH2-CE1 4.45Å; W761-L789 HydrophobicContact CB-CD1 4.17Å; W761-L789 HydrophobicContact CD2-CB 4.43Å; W761-L789 HydrophobicContact CD2-CD1 4.02Å; W761-L789 HydrophobicContact CD2-CD2 4.39Å; W761-L789 HydrophobicContact CE3-CD1 4.45Å; W761-L789 HydrophobicContact CG-CB 4.16Å; W761-L789 HydrophobicContact CG-CD1 3.89Å; W761-L789 HydrophobicContact CZ2-CD2 4.22Å; W761-E790 PolarHBondContact NE1-O 2.89Å; W761-P792 HydrophobicContact CG-CG 4.25Å; W761-M803 HydrophobicContact CB-SD 4.15Å; W761-W807 HydrophobicContact CB-CH2 4.13Å; W761-W807 HydrophobicContact CB-CZ2 4.28Å; W761-W807 HydrophobicContact CG-CH2 4.42Å
762	E	97.7	Very high	96.4	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.6	-46.2	173.8	-69.5	-176.8	85.1	0	0	112.1	N626 T682 W736 V758 I759 F764 T765 Y766 G767 P770	N626-E762 PolarHBondContact ND2-OE1 2.87Å; T682-E762 WeakPolarHBondContact CB-OE1 3.3Å; T682-E762 HydrophobicContact CG2-CB 3.6Å; T682-E762 HydrophobicContact CG2-CG 4.26Å; T682-E762 WeakPolarHBondContact CG2-OE2 3.33Å; T682-E762 PolarHBondContact N-OE2 3.23Å; T682-E762 VanDerWaalsContact OG1-CD 3.29Å; T682-E762 PolarHBondContact OG1-OE1 2.87Å; W736-E762 HydrophobicContact CZ2-CG 4.43Å; W736-E762 PolarHBondContact NE1-OE2 2.81Å; V758-E762 WeakPolarHBondContact O-CG 3.3Å; V758-E762 PolarHBondContact O-N 3.38Å; I759-E762 PolarHBondContact O-N 2.94Å; E762-F764 PolarHBondContact O-N 3.4Å; E762-T765 WeakPolarHBondContact CA-OG1 3.5Å; E762-T765 CarbonylContact O-C 3.58Å; E762-T765 PolarHBondContact O-N 3.36Å; E762-T765 PolarHBondContact O-OG1 2.8Å; E762-Y766 PolarHBondContact O-N 2.92Å; E762-Y766 VanDerWaalsContact O-N 3.08Å; E762-G767 PolarHBondContact O-N 3.36Å; E762-P770 HydrophobicContact CG-CG 4.33Å
763	I	97.3	Very high	96.1	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-58.7	-48.6	178.6	-69.2	162.4	0	0	0	110.4	L629 M656 I659 A660 I663 T682 I759 L760 T765 Y766	L629-I763 HydrophobicContact CD1-CG1 4.16Å; L629-I763 HydrophobicContact CD2-CG2 4.46Å; M656-I763 HydrophobicContact CB-CG2 3.72Å; M656-I763 HydrophobicContact CG-CG2 3.91Å; I659-I763 HydrophobicContact CG2-CD1 3.78Å; I659-I763 HydrophobicContact CG2-CG1 4.12Å; A660-I763 HydrophobicContact CB-CD1 4.02Å; I663-I763 HydrophobicContact CD1-CD1 4.28Å; T682-I763 HydrophobicContact CG2-CG1 4.43Å; I759-I763 HydrophobicContact CG2-CD1 3.74Å; I759-I763 HydrophobicContact CG2-CG1 4.36Å; I759-I763 VanDerWaalsContact O-CG1 3.31Å; I759-I763 WeakPolarHBondContact O-CG1 3.3Å; I759-I763 PolarHBondContact O-N 3.39Å; L760-I763 PolarHBondContact O-N 3.48Å; I763-T765 PolarHBondContact O-N 3.41Å; I763-Y766 PolarHBondContact O-N 2.81Å
764	F	96.1	Very high	95.8	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.009	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	3	-178.6	-78.1	-88.2	0	0	0	114.4	L653 M656 L657 L760 W761 E762 P792 V794 C795 V799 M803	L653-F764 HydrophobicContact CD1-CE1 3.47Å; L653-F764 VanDerWaalsContact CD1-CE1 3.47Å; L653-F764 HydrophobicContact CD1-CZ 3.72Å; M656-F764 HydrophobicContact CB-CE1 4.35Å; M656-F764 HydrophobicContact CB-CE2 4.27Å; M656-F764 HydrophobicContact CB-CZ 3.98Å; M656-F764 HydrophobicContact SD-CD1 3.8Å; M656-F764 HydrophobicContact SD-CE1 3.82Å; M656-F764 HydrophobicContact SD-CG 4.33Å; M656-F764 HydrophobicContact SD-CZ 4.34Å; L657-F764 HydrophobicContact CD2-CZ 4.33Å; L657-F764 HydrophobicContact CG-CZ 4.43Å; L760-F764 WeakPolarHBondContact O-CD2 3.36Å; L760-F764 PolarHBondContact O-N 2.87Å; W761-F764 PolarHBondContact O-N 2.93Å; E762-F764 PolarHBondContact O-N 3.4Å; F764-P792 HydrophobicContact CB-CB 4.19Å; F764-P792 HydrophobicContact CB-CG 4.07Å; F764-P792 VanDerWaalsContact O-CB 3.28Å; F764-P792 WeakPolarHBondContact O-CB 3.18Å; F764-V794 WeakPolarHBondContact O-CG2 3.42Å; F764-C795 HydrophobicContact CB-CB 4.08Å; F764-C795 HydrophobicContact CD1-CB 3.92Å; F764-C795 HydrophobicContact CG-CB 4.14Å; F764-V799 HydrophobicContact CD2-CG1 4.12Å; F764-V799 HydrophobicContact CE2-CG1 3.65Å; F764-V799 HydrophobicContact CZ-CG1 4.04Å; F764-V799 HydrophobicContact CZ-CG2 4.18Å; F764-M803 HydrophobicContact CB-CE 4.41Å; F764-M803 HydrophobicContact CD2-CE 4.33Å
765	T	95.2	Very high	95.3	Very high	17 Å²	17	24.5 Å²	24.5	10%	0.104	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.7	10.9	169.7	56.4	0	0	0	0	113	W761 E762 I763 G767 K768 P792	W761-T765 HydrophobicContact CD2-CG2 3.89Å; W761-T765 HydrophobicContact CE3-CG2 4.01Å; W761-T765 HydrophobicContact CH2-CG2 3.91Å; W761-T765 HydrophobicContact CZ2-CG2 3.78Å; W761-T765 HydrophobicContact CZ3-CG2 4.01Å; W761-T765 WeakPolarHBondContact CZ3-OG1 3.02Å; W761-T765 WeakPolarHBondContact O-CB 3.46Å; W761-T765 WeakPolarHBondContact O-CG2 2.92Å; W761-T765 PolarHBondContact O-N 2.9Å; W761-T765 PolarHBondContact O-OG1 3.38Å; E762-T765 WeakPolarHBondContact CA-OG1 3.5Å; E762-T765 CarbonylContact O-C 3.58Å; E762-T765 PolarHBondContact O-N 3.36Å; E762-T765 PolarHBondContact O-OG1 2.8Å; I763-T765 PolarHBondContact O-N 3.41Å; T765-G767 VanDerWaalsContact C-N 3.33Å; T765-G767 PolarHBondContact O-N 2.88Å; T765-K768 WeakPolarHBondContact O-CG 3.41Å; T765-P792 HydrophobicContact CG2-CB 3.71Å; T765-P792 HydrophobicContact CG2-CG 3.61Å
766	Y	94.2	Very high	94.7	Very high	27 Å²	27	26 Å²	26	11%	0.106	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	40.6	-177.4	-61.3	-84.7	0	0	0	114.1	L629 R630 H632 G633 L651 M656 E762 I763	L629-Y766 CarbonylContact C-O 3.53Å; R630-Y766 WeakPolarHBondContact CA-O 3.32Å; R630-Y766 VanDerWaalsContact CG-O 3.28Å; R630-Y766 WeakPolarHBondContact CG-O 3.5Å; R630-Y766 PolarHBondContact N-O 2.83Å; H632-Y766 VanDerWaalsContact O-CE1 3.23Å; H632-Y766 WeakPolarHBondContact O-CE1 3.4Å; G633-Y766 VanDerWaalsContact CA-CG 3.42Å; L651-Y766 HydrophobicContact CB-CE1 4.28Å; M656-Y766 HydrophobicContact CE-CD1 3.98Å; M656-Y766 HydrophobicContact CE-CD2 4.37Å; M656-Y766 HydrophobicContact CE-CE1 3.32Å; M656-Y766 HydrophobicContact CE-CE2 3.79Å; M656-Y766 HydrophobicContact CE-CG 4.48Å; M656-Y766 WeakPolarHBondContact CE-OH 3.36Å; E762-Y766 PolarHBondContact O-N 2.92Å; E762-Y766 VanDerWaalsContact O-N 3.08Å; I763-Y766 PolarHBondContact O-N 2.81Å
767	G	93	Very high	94.1	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	83.1	16.9	173.2	0	0	0	0	0	115	N626 R630 E762 T765	N626-G767 PolarHBondContact ND2-O 3.44Å; N626-G767 PolarHBondContact OD1-O 3.34Å; R630-G767 PolarHBondContact NE-O 3.48Å; R630-G767 PolarHBondContact NH2-O 3.1Å; E762-G767 PolarHBondContact O-N 3.36Å; T765-G767 VanDerWaalsContact C-N 3.33Å; T765-G767 PolarHBondContact O-N 2.88Å
768	K	93.8	Very high	93.7	Very high	75 Å²	75	30.4 Å²	30.4	33%	0.326	15%	0.148	S	C	.	.	P	Polyproline II helix	trans	-59.5	147.9	171.7	-72.6	179.9	-173.5	-165.3	0	110.5	D635 W761 T765	D635-K768 WeakPolarHBondContact OD2-CE 3.35Å; D635-K768 IonicContact OD2-NZ 2.71Å; D635-K768 PolarHBondContact OD2-NZ 3.32Å; W761-K768 HydrophobicContact CH2-CB 4.42Å; W761-K768 HydrophobicContact CZ3-CB 4.25Å; T765-K768 WeakPolarHBondContact O-CG 3.41Å
769	Q	94	Very high	93.3	Very high	33 Å²	33	30.3 Å²	30.3	15%	0.154	15%	0.148	C	C	.	.	P	Polyproline II helix	trans	-68.6	132.6	177.8	-171.7	-179	68.7	0	0	109.2	T707 D708 W736 W771 F772	T707-Q769 PolarHBondContact O-NE2 3.36Å; D708-Q769 PolarHBondContact OD1-NE2 2.82Å; W736-Q769 HydrophobicContact CH2-CG 4.42Å; Q769-W771 PolarHBondContact O-N 3.22Å; Q769-F772 HydrophobicContact CB-CB 4.24Å; Q769-F772 WeakPolarHBondContact O-CB 3.37Å; Q769-F772 PolarHBondContact O-N 3.37Å
770	P	96.9	Very high	92.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.1	133.3	173.4	-18.7	30.1	0	0	0	110.1	R735 W736 V758 W761 E762 F772 L789	R735-P770 HydrophobicContact CB-CB 4.27Å; R735-P770 WeakPolarHBondContact CD-O 3.23Å; R735-P770 PolarHBondContact NH1-O 3.23Å; W736-P770 HydrophobicContact CD2-CG 4.38Å; W736-P770 VanDerWaalsContact CH2-CD 3.46Å; W736-P770 HydrophobicContact CH2-CG 4.05Å; W736-P770 HydrophobicContact CZ2-CG 3.65Å; V758-P770 HydrophobicContact CG1-CB 3.83Å; V758-P770 HydrophobicContact CG1-CG 3.31Å; W761-P770 HydrophobicContact CE3-CB 4.48Å; W761-P770 HydrophobicContact CE3-CG 4.48Å; W761-P770 HydrophobicContact CZ3-CB 4.46Å; E762-P770 HydrophobicContact CG-CG 4.33Å; P770-F772 VanDerWaalsContact C-N 3.29Å; P770-F772 PolarHBondContact O-N 2.78Å; P770-L789 HydrophobicContact CB-CD1 3.98Å; P770-L789 HydrophobicContact CB-CD2 4.1Å
771	W	95.1	Very high	92.3	Very high	21 Å²	21	34.7 Å²	34.7	8%	0.08	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	36.5	-175.5	-49.9	106.7	0	0	0	114.2	R735 Q769 Q773 L774 V779 C782 R787 V788 L789	R735-W771 VanDerWaalsContact NH1-C 3.3Å; R735-W771 PolarHBondContact NH1-O 3.09Å; Q769-W771 PolarHBondContact O-N 3.22Å; W771-Q773 VanDerWaalsContact C-OE1 3.24Å; W771-Q773 PolarHBondContact O-N 2.65Å; W771-L774 HydrophobicContact CB-CB 4.24Å; W771-L774 HydrophobicContact CB-CD1 4.19Å; W771-L774 HydrophobicContact CB-CG 4.35Å; W771-L774 HydrophobicContact CD2-CD1 4.2Å; W771-L774 HydrophobicContact CE3-CD1 3.73Å; W771-L774 HydrophobicContact CG-CD1 4.44Å; W771-L774 HydrophobicContact CZ3-CD1 4.42Å; W771-L774 PolarHBondContact O-N 3.05Å; W771-V779 HydrophobicContact CB-CG2 3.64Å; W771-V779 HydrophobicContact CG-CG2 4.09Å; W771-C782 WeakPolarHBondContact CH2-SG 3.31Å; W771-C782 VanDerWaalsContact CZ3-SG 3.53Å; W771-R787 HydrophobicContact CH2-CB 4.34Å; W771-V788 VanDerWaalsContact CH2-O 3.23Å; W771-V788 WeakPolarHBondContact CH2-O 3.49Å; W771-L789 HydrophobicContact CD2-CD2 3.52Å; W771-L789 HydrophobicContact CD2-CG 4.28Å; W771-L789 HydrophobicContact CE3-CD2 4.04Å; W771-L789 HydrophobicContact CG-CD2 3.76Å; W771-L789 HydrophobicContact CZ2-CD2 4.07Å; W771-L789 HydrophobicContact CZ2-CG 3.95Å
772	F	91.5	Very high	91.9	Very high	129 Å²	129	34 Å²	34	57%	0.566	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.3	-22.2	-178.3	64.6	-88	0	0	0	114.9	W761 Q769 P770	W761-F772 HydrophobicContact CH2-CD1 4.3Å; W761-F772 HydrophobicContact CH2-CE1 4.45Å; Q769-F772 HydrophobicContact CB-CB 4.24Å; Q769-F772 WeakPolarHBondContact O-CB 3.37Å; Q769-F772 PolarHBondContact O-N 3.37Å; P770-F772 VanDerWaalsContact C-N 3.29Å; P770-F772 PolarHBondContact O-N 2.78Å
773	Q	90.4	Very high	91.6	Very high	105 Å²	105	34 Å²	34	49%	0.491	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	-2.8	177.3	74.9	-80.8	29.7	0	0	114.9	W771	W771-Q773 VanDerWaalsContact C-OE1 3.24Å; W771-Q773 PolarHBondContact O-N 2.65Å
774	L	91.1	Very high	91.2	Very high	39 Å²	39	35.4 Å²	35.4	20%	0.204	18%	0.175	C	C	.	.	S	Bend	trans	-118.5	143	-177	-58.6	-175.4	0	0	0	111.7	R735 W771 E778 V779 C782	R735-L774 PolarHBondContact NH1-O 3.12Å; R735-L774 PolarHBondContact NH2-O 3.3Å; W771-L774 HydrophobicContact CB-CB 4.24Å; W771-L774 HydrophobicContact CB-CD1 4.19Å; W771-L774 HydrophobicContact CB-CG 4.35Å; W771-L774 HydrophobicContact CD2-CD1 4.2Å; W771-L774 HydrophobicContact CE3-CD1 3.73Å; W771-L774 HydrophobicContact CG-CD1 4.44Å; W771-L774 HydrophobicContact CZ3-CD1 4.42Å; W771-L774 PolarHBondContact O-N 3.05Å; L774-E778 HydrophobicContact CB-CB 3.96Å; L774-E778 HydrophobicContact CD2-CB 4.4Å; L774-V779 HydrophobicContact CB-CG2 3.93Å; L774-C782 HydrophobicContact CD1-CB 4.17Å
775	S	88.7	Confident	90.9	Very high	45 Å²	45	40.5 Å²	40.5	32%	0.315	20%	0.199	S	C	.	.			trans	-70	163.7	169.2	71.2	0	0	0	0	112.1	R153 T777 E778 V779	R153-S775 PolarHBondContact NH2-OG 3.36Å; R153-S775 VanDerWaalsContact NH2-OG 3.15Å; S775-T777 VanDerWaalsContact C-N 3.29Å; S775-T777 PolarHBondContact O-N 2.55Å; S775-E778 WeakPolarHBondContact CB-OE2 3.35Å; S775-E778 PolarHBondContact N-OE2 3.43Å; S775-E778 WeakPolarHBondContact O-CB 3.5Å; S775-E778 PolarHBondContact O-N 2.88Å; S775-E778 PolarHBondContact OG-OE2 3.45Å; S775-V779 WeakPolarHBondContact O-CG2 3.39Å; S775-V779 PolarHBondContact O-N 2.87Å
776	N	83.7	Confident	90.7	Very high	33 Å²	33	41.5 Å²	41.5	18%	0.176	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-35.7	-177.9	-72.9	-13.1	0	0	0	113.5	Y710 I734 R735 V779 I780	Y710-N776 HydrophobicContact CD1-CB 4.06Å; Y710-N776 HydrophobicContact CD2-CB 3.61Å; Y710-N776 WeakPolarHBondContact CD2-ND2 3.23Å; Y710-N776 HydrophobicContact CE1-CB 4.36Å; Y710-N776 HydrophobicContact CE2-CB 3.95Å; Y710-N776 HydrophobicContact CG-CB 3.67Å; I734-N776 HydrophobicContact CD1-CB 3.59Å; I734-N776 VanDerWaalsContact CD1-O 3.29Å; I734-N776 WeakPolarHBondContact CD1-O 3.31Å; R735-N776 PolarHBondContact NE-OD1 3.27Å; R735-N776 PolarHBondContact NH2-OD1 2.93Å; N776-V779 PolarHBondContact O-N 2.75Å; N776-I780 WeakPolarHBondContact O-CG1 3.49Å; N776-I780 PolarHBondContact O-N 2.91Å
777	T	85.7	Confident	90.7	Very high	49 Å²	49	45.9 Å²	45.9	30%	0.301	23%	0.229	S	C	.	.	H	α-helix	trans	-67.6	-40.9	173.4	-42.4	0	0	0	0	112.3	S775 V779 I780 E781	S775-T777 VanDerWaalsContact C-N 3.29Å; S775-T777 PolarHBondContact O-N 2.55Å; T777-V779 VanDerWaalsContact C-N 3.31Å; T777-V779 PolarHBondContact O-N 3.45Å; T777-I780 PolarHBondContact O-N 2.89Å; T777-E781 PolarHBondContact O-N 2.79Å
778	E	89.9	Confident	90.8	Very high	45 Å²	45	48.1 Å²	48.1	21%	0.21	24%	0.242	C	C	.	.	H	α-helix	trans	-67	-33	178	-74.7	161.3	131.1	0	0	112	R153 L774 S775 E781 C782	R153-E778 IonicContact CZ-OE1 3.43Å; R153-E778 IonicContact CZ-OE2 2.74Å; R153-E778 IonicContact NH1-OE1 3.87Å; R153-E778 PolarHBondContact NH1-OE1 3.09Å; R153-E778 IonicContact NH1-OE2 3.17Å; R153-E778 IonicContact NH2-OE1 3.98Å; R153-E778 PolarHBondContact NH2-OE1 3.32Å; R153-E778 IonicContact NH2-OE2 2.71Å; R153-E778 PolarHBondContact NH2-OE2 3.23Å; L774-E778 HydrophobicContact CB-CB 3.96Å; L774-E778 HydrophobicContact CD2-CB 4.4Å; S775-E778 WeakPolarHBondContact CB-OE2 3.35Å; S775-E778 PolarHBondContact N-OE2 3.43Å; S775-E778 WeakPolarHBondContact O-CB 3.5Å; S775-E778 PolarHBondContact O-N 2.88Å; S775-E778 PolarHBondContact OG-OE2 3.45Å; E778-E781 PolarHBondContact O-N 2.91Å; E778-C782 WeakPolarHBondContact O-CB 3.43Å; E778-C782 PolarHBondContact O-N 3.07Å
779	V	89.9	Confident	91	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63	-44.7	172.9	171.5	0	0	0	0	111.2	I734 R735 W771 L774 S775 N776 T777 C782 I783	I734-V779 HydrophobicContact CD1-CB 4.39Å; I734-V779 HydrophobicContact CD1-CG1 4.39Å; R735-V779 HydrophobicContact CG-CG1 3.87Å; R735-V779 HydrophobicContact CG-CG2 4.18Å; W771-V779 HydrophobicContact CB-CG2 3.64Å; W771-V779 HydrophobicContact CG-CG2 4.09Å; L774-V779 HydrophobicContact CB-CG2 3.93Å; S775-V779 WeakPolarHBondContact O-CG2 3.39Å; S775-V779 PolarHBondContact O-N 2.87Å; N776-V779 PolarHBondContact O-N 2.75Å; T777-V779 VanDerWaalsContact C-N 3.31Å; T777-V779 PolarHBondContact O-N 3.45Å; V779-C782 WeakPolarHBondContact O-CB 3.32Å; V779-C782 PolarHBondContact O-N 2.88Å; V779-I783 HydrophobicContact CG1-CD1 3.63Å; V779-I783 HydrophobicContact CG1-CG1 4.37Å; V779-I783 WeakPolarHBondContact O-CG1 3.16Å; V779-I783 PolarHBondContact O-N 3.28Å
780	I	87.9	Confident	91.1	Very high	24 Å²	24	50.4 Å²	50.4	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-59.7	-48.3	176.1	-67.3	161.1	0	0	0	110	Y710 L712 W723 I734 I742 N776 T777 C782 T784	Y710-I780 HydrophobicContact CD1-CD1 3.86Å; Y710-I780 HydrophobicContact CE1-CD1 3.71Å; L712-I780 HydrophobicContact CD2-CD1 3.48Å; L712-I780 VanDerWaalsContact CD2-CD1 3.48Å; L712-I780 HydrophobicContact CD2-CG1 4.49Å; W723-I780 HydrophobicContact CH2-CG2 4.18Å; W723-I780 HydrophobicContact CZ3-CG2 4.37Å; I734-I780 HydrophobicContact CD1-CD1 4.2Å; I734-I780 HydrophobicContact CD1-CG1 4.03Å; I742-I780 HydrophobicContact CG2-CG1 4.39Å; I742-I780 HydrophobicContact CG2-CG2 3.95Å; N776-I780 WeakPolarHBondContact O-CG1 3.49Å; N776-I780 PolarHBondContact O-N 2.91Å; T777-I780 PolarHBondContact O-N 2.89Å; I780-C782 PolarHBondContact O-N 2.8Å; I780-T784 HydrophobicContact CG2-CG2 4.33Å; I780-T784 WeakPolarHBondContact O-CB 3.36Å; I780-T784 WeakPolarHBondContact O-CG2 3.41Å; I780-T784 PolarHBondContact O-N 3.45Å; I780-T784 PolarHBondContact O-OG1 2.84Å
781	E	87.8	Confident	91	Very high	68 Å²	68	54.7 Å²	54.7	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-59.9	-44.8	175.7	-171	-168.2	165.2	0	0	111.6	T777 E778 T784 Q785	T777-E781 PolarHBondContact O-N 2.79Å; E778-E781 PolarHBondContact O-N 2.91Å; E781-T784 WeakPolarHBondContact CA-OG1 3.29Å; E781-T784 PolarHBondContact O-N 3.27Å; E781-T784 PolarHBondContact O-OG1 2.87Å; E781-T784 VanDerWaalsContact O-OG1 3.11Å; E781-Q785 HydrophobicContact CG-CG 4.39Å; E781-Q785 VanDerWaalsContact O-CB 3.26Å; E781-Q785 WeakPolarHBondContact O-CB 3.45Å; E781-Q785 WeakPolarHBondContact O-CG 3.17Å; E781-Q785 PolarHBondContact O-N 2.02Å; E781-Q785 PolarHBondContact OE1-NE2 2.89Å
782	C	90.3	Very high	91	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.007	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-51.8	-178.9	-166.4	0	0	0	0	112	W771 L774 E778 V779 I780 G786 R787	W771-C782 WeakPolarHBondContact CH2-SG 3.31Å; W771-C782 VanDerWaalsContact CZ3-SG 3.53Å; L774-C782 HydrophobicContact CD1-CB 4.17Å; E778-C782 WeakPolarHBondContact O-CB 3.43Å; E778-C782 PolarHBondContact O-N 3.07Å; V779-C782 WeakPolarHBondContact O-CB 3.32Å; V779-C782 PolarHBondContact O-N 2.88Å; I780-C782 PolarHBondContact O-N 2.8Å; C782-G786 PolarHBondContact O-N 3.31Å; C782-R787 WeakPolarHBondContact O-CB 3.26Å; C782-R787 PolarHBondContact O-N 3.13Å; C782-R787 WeakPolarHBondContact SG-CB 3.43Å; C782-R787 PolarHBondContact SG-NE 2.99Å; C782-R787 VanDerWaalsContact SG-NE 3.44Å
783	I	91.7	Very high	90.9	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-43.8	-179	-64.1	169	0	0	0	110.8	I734 P739 I742 W754 V779 Q785 G786	I734-I783 WeakPolarHBondContact O-CD1 3.46Å; P739-I783 HydrophobicContact CB-CG2 4.46Å; P739-I783 HydrophobicContact CG-CG2 3.78Å; I742-I783 HydrophobicContact CD1-CB 4.08Å; I742-I783 HydrophobicContact CD1-CD1 3.82Å; I742-I783 HydrophobicContact CD1-CG2 3.73Å; W754-I783 HydrophobicContact CH2-CG2 4.37Å; W754-I783 HydrophobicContact CZ2-CG2 3.86Å; V779-I783 HydrophobicContact CG1-CD1 3.63Å; V779-I783 HydrophobicContact CG1-CG1 4.37Å; V779-I783 WeakPolarHBondContact O-CG1 3.16Å; V779-I783 PolarHBondContact O-N 3.28Å; I783-Q785 VanDerWaalsContact C-N 3.33Å; I783-Q785 PolarHBondContact O-N 2.82Å; I783-G786 WeakPolarHBondContact O-CA 3.42Å; I783-G786 PolarHBondContact O-N 2.82Å
784	T	88.4	Confident	90.7	Very high	29 Å²	29	54 Å²	54	18%	0.178	27%	0.267	C	S	.	.	H	α-helix	trans	-66.1	-33.6	-179.9	55	0	0	0	0	112.9	W723 I742 M743 I780 E781 G786 R809	W723-T784 HydrophobicContact CH2-CG2 3.88Å; I742-T784 HydrophobicContact CG2-CG2 4.2Å; M743-T784 HydrophobicContact CG-CG2 3.79Å; M743-T784 HydrophobicContact SD-CG2 4.09Å; I780-T784 HydrophobicContact CG2-CG2 4.33Å; I780-T784 WeakPolarHBondContact O-CB 3.36Å; I780-T784 WeakPolarHBondContact O-CG2 3.41Å; I780-T784 PolarHBondContact O-N 3.45Å; I780-T784 PolarHBondContact O-OG1 2.84Å; E781-T784 WeakPolarHBondContact CA-OG1 3.29Å; E781-T784 PolarHBondContact O-N 3.27Å; E781-T784 PolarHBondContact O-OG1 2.87Å; E781-T784 VanDerWaalsContact O-OG1 3.11Å; T784-G786 PolarHBondContact O-N 3.43Å; T784-R809 VanDerWaalsContact O-CZ 3.32Å; T784-R809 PolarHBondContact O-NH1 3.39Å; T784-R809 PolarHBondContact O-NH2 3.43Å
785	Q	90.3	Very high	90.8	Very high	109 Å²	109	52.1 Å²	52.1	51%	0.509	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-10.5	170	-71.6	169.5	-7.9	0	0	113.6	E781 I783	E781-Q785 HydrophobicContact CG-CG 4.39Å; E781-Q785 VanDerWaalsContact O-CB 3.26Å; E781-Q785 WeakPolarHBondContact O-CB 3.45Å; E781-Q785 WeakPolarHBondContact O-CG 3.17Å; E781-Q785 PolarHBondContact O-N 2.02Å; E781-Q785 PolarHBondContact OE1-NE2 2.89Å; I783-Q785 VanDerWaalsContact C-N 3.33Å; I783-Q785 PolarHBondContact O-N 2.82Å
786	G	90.6	Very high	91	Very high	38 Å²	38	50 Å²	50	39%	0.392	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.3	20	177.9	0	0	0	0	0	114.9	C782 I783 T784	C782-G786 PolarHBondContact O-N 3.31Å; I783-G786 WeakPolarHBondContact O-CA 3.42Å; I783-G786 PolarHBondContact O-N 2.82Å; T784-G786 PolarHBondContact O-N 3.43Å
787	R	93.4	Very high	91.5	Very high	120 Å²	120	53.9 Å²	53.9	45%	0.453	26%	0.258	S	S	.	.			trans	-76.5	143.9	168.6	-67.2	-176.3	-76	-174.4	-5	109.7	W771 C782	W771-R787 HydrophobicContact CH2-CB 4.34Å; C782-R787 WeakPolarHBondContact O-CB 3.26Å; C782-R787 PolarHBondContact O-N 3.13Å; C782-R787 WeakPolarHBondContact SG-CB 3.43Å; C782-R787 PolarHBondContact SG-NE 2.99Å; C782-R787 VanDerWaalsContact SG-NE 3.44Å
788	V	95.9	Very high	91.9	Very high	47 Å²	47	55.8 Å²	55.8	29%	0.285	26%	0.263	S	S	.	.			trans	-124.1	156.9	-177.5	-61.4	0	0	0	0	111	W771 L804 W807	W771-V788 VanDerWaalsContact CH2-O 3.23Å; W771-V788 WeakPolarHBondContact CH2-O 3.49Å; V788-L804 HydrophobicContact CG2-CD2 4.05Å; V788-W807 HydrophobicContact CB-CD2 4.44Å; V788-W807 HydrophobicContact CB-CE3 3.83Å; V788-W807 HydrophobicContact CB-CZ3 4.43Å; V788-W807 HydrophobicContact CG1-CB 3.81Å; V788-W807 HydrophobicContact CG1-CE3 4.34Å; V788-W807 HydrophobicContact CG1-CG 4.43Å; V788-W807 HydrophobicContact CG2-CE3 4.41Å
789	L	97.1	Very high	92.2	Very high	7 Å²	7	53.6 Å²	53.6	4%	0.037	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-62.3	139.4	-177.1	-69.3	157.5	0	0	0	111.4	V758 W761 P770 W771 Y800 W807	V758-L789 HydrophobicContact CG1-CD1 4.22Å; V758-L789 HydrophobicContact CG2-CD1 4.34Å; W761-L789 HydrophobicContact CB-CD1 4.17Å; W761-L789 HydrophobicContact CD2-CB 4.43Å; W761-L789 HydrophobicContact CD2-CD1 4.02Å; W761-L789 HydrophobicContact CD2-CD2 4.39Å; W761-L789 HydrophobicContact CE3-CD1 4.45Å; W761-L789 HydrophobicContact CG-CB 4.16Å; W761-L789 HydrophobicContact CG-CD1 3.89Å; W761-L789 HydrophobicContact CZ2-CD2 4.22Å; P770-L789 HydrophobicContact CB-CD1 3.98Å; P770-L789 HydrophobicContact CB-CD2 4.1Å; W771-L789 HydrophobicContact CD2-CD2 3.52Å; W771-L789 HydrophobicContact CD2-CG 4.28Å; W771-L789 HydrophobicContact CE3-CD2 4.04Å; W771-L789 HydrophobicContact CG-CD2 3.76Å; W771-L789 HydrophobicContact CZ2-CD2 4.07Å; W771-L789 HydrophobicContact CZ2-CG 3.95Å; L789-Y800 PolarHBondContact O-OH 2.86Å; L789-Y800 VanDerWaalsContact O-OH 3.07Å; L789-W807 HydrophobicContact CB-CH2 3.71Å; L789-W807 HydrophobicContact CB-CZ2 4.37Å; L789-W807 HydrophobicContact CB-CZ3 4.06Å; L789-W807 HydrophobicContact CD1-CH2 3.97Å; L789-W807 HydrophobicContact CD1-CZ2 3.82Å; L789-W807 HydrophobicContact CG-CH2 4.39Å
790	E	95.9	Very high	92.5	Very high	148 Å²	148	55.4 Å²	55.4	69%	0.692	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-66	151	178.4	-63.1	178	-175.4	0	0	112.5	W761 P792	W761-E790 PolarHBondContact NE1-O 2.89Å; E790-P792 WeakPolarHBondContact O-CD 3.42Å
791	R	96.7	Very high	93	Very high	91 Å²	91	57.9 Å²	57.9	34%	0.343	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-62.6	121.6	177.7	-178.5	171.1	166.4	-155.6	-11.4	111.4	C795 Y800 Y834	R791-C795 HydrophobicContact CG-CB 4.26Å; R791-C795 VanDerWaalsContact CZ-O 3.23Å; R791-C795 PolarHBondContact NE-O 3.34Å; R791-C795 PolarHBondContact NH2-O 2.59Å; R791-Y800 HydrophobicContact CB-CD1 3.94Å; R791-Y800 HydrophobicContact CB-CD2 3.57Å; R791-Y800 HydrophobicContact CB-CE1 3.94Å; R791-Y800 HydrophobicContact CB-CE2 3.59Å; R791-Y800 HydrophobicContact CB-CG 3.74Å; R791-Y800 HydrophobicContact CG-CD1 4.15Å; R791-Y800 HydrophobicContact CG-CD2 3.79Å; R791-Y800 HydrophobicContact CG-CE2 4.33Å; R791-Y800 HydrophobicContact CG-CG 3.67Å; R791-Y834 VanDerWaalsContact NH2-CE2 3.32Å
792	P	94.1	Very high	93.5	Very high	11 Å²	11	54.8 Å²	54.8	7%	0.071	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-61.8	143.5	174.4	-22	33.3	0	0	0	111.9	W761 F764 T765 E790 V794 C795	W761-P792 HydrophobicContact CG-CG 4.25Å; F764-P792 HydrophobicContact CB-CB 4.19Å; F764-P792 HydrophobicContact CB-CG 4.07Å; F764-P792 VanDerWaalsContact O-CB 3.28Å; F764-P792 WeakPolarHBondContact O-CB 3.18Å; T765-P792 HydrophobicContact CG2-CB 3.71Å; T765-P792 HydrophobicContact CG2-CG 3.61Å; E790-P792 WeakPolarHBondContact O-CD 3.42Å; P792-V794 VanDerWaalsContact C-N 3.27Å; P792-V794 PolarHBondContact O-N 2.79Å; P792-C795 HydrophobicContact CB-CB 3.94Å; P792-C795 HydrophobicContact CG-CB 4.15Å; P792-C795 WeakPolarHBondContact O-CB 3.32Å; P792-C795 PolarHBondContact O-N 2.85Å
793	R	88.9	Confident	93.8	Very high	173 Å²	173	54.8 Å²	54.8	65%	0.653	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-38.9	-176.5	-67.8	-168.5	-173.2	-179.1	3.2	113.8	C795 Y834	R793-C795 VanDerWaalsContact C-N 3.34Å; R793-Y834 WeakPolarHBondContact O-CE1 3.41Å; R793-Y834 VanDerWaalsContact O-CZ 3.26Å; R793-Y834 PolarHBondContact O-OH 3.12Å
794	V	87.6	Confident	94.1	Very high	56 Å²	56	57.5 Å²	57.5	34%	0.339	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	0.9	179.9	-59.8	0	0	0	0	114.2	F764 P792 P796	F764-V794 WeakPolarHBondContact O-CG2 3.42Å; P792-V794 VanDerWaalsContact C-N 3.27Å; P792-V794 PolarHBondContact O-N 2.79Å; V794-P796 WeakPolarHBondContact O-CD 3.29Å
795	C	92.5	Very high	94.6	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.27	C	S	.	.			trans	-85.4	122.6	-176.9	-173.5	0	0	0	0	111.2	F764 R791 P792 R793 M803	F764-C795 HydrophobicContact CB-CB 4.08Å; F764-C795 HydrophobicContact CD1-CB 3.92Å; F764-C795 HydrophobicContact CG-CB 4.14Å; R791-C795 HydrophobicContact CG-CB 4.26Å; R791-C795 VanDerWaalsContact CZ-O 3.23Å; R791-C795 PolarHBondContact NE-O 3.34Å; R791-C795 PolarHBondContact NH2-O 2.59Å; P792-C795 HydrophobicContact CB-CB 3.94Å; P792-C795 HydrophobicContact CG-CB 4.15Å; P792-C795 WeakPolarHBondContact O-CB 3.32Å; P792-C795 PolarHBondContact O-N 2.85Å; R793-C795 VanDerWaalsContact C-N 3.34Å; C795-M803 VanDerWaalsContact SG-CE 3.53Å
796	P	93.2	Very high	95	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.246	C	C	.	.			trans	-59.7	154.7	170	-20.6	32.3	0	0	0	111.7	L653 V794 E798 V799 Y800 Y834	L653-P796 HydrophobicContact CD1-CG 3.59Å; L653-P796 HydrophobicContact CD2-CG 3.75Å; L653-P796 HydrophobicContact CG-CG 4.35Å; V794-P796 WeakPolarHBondContact O-CD 3.29Å; P796-E798 VanDerWaalsContact C-N 3.26Å; P796-E798 VanDerWaalsContact CB-OE2 3.26Å; P796-E798 WeakPolarHBondContact CB-OE2 3.36Å; P796-E798 PolarHBondContact O-N 2.85Å; P796-V799 HydrophobicContact CB-CG2 4.24Å; P796-V799 HydrophobicContact CG-CG2 4.19Å; P796-V799 PolarHBondContact O-N 3.45Å; P796-Y800 PolarHBondContact O-N 2.84Å; P796-Y834 HydrophobicContact CG-CG 4.48Å
797	K	93.9	Very high	95.3	Very high	114 Å²	114	50.1 Å²	50.1	50%	0.496	23%	0.229	S	C	.	.	H	α-helix	trans	-62.4	-41.4	-177	-179.6	-179.8	169	179.5	0	110.6	V799 Y800 D801	K797-V799 PolarHBondContact O-N 2.71Å; K797-Y800 CarbonylContact O-C 3.57Å; K797-Y800 PolarHBondContact O-N 3.42Å; K797-D801 WeakPolarHBondContact CE-OD2 3.12Å; K797-D801 VanDerWaalsContact O-CG 3.31Å; K797-D801 PolarHBondContact O-N 2.88Å
798	E	93.6	Very high	95.5	Very high	89 Å²	89	47.9 Å²	47.9	42%	0.416	22%	0.224	S	C	.	.	H	α-helix	trans	-60	-32.7	-177	-56.6	70.2	-154.9	0	0	111.7	P796 V802 L827	P796-E798 VanDerWaalsContact C-N 3.26Å; P796-E798 VanDerWaalsContact CB-OE2 3.26Å; P796-E798 WeakPolarHBondContact CB-OE2 3.36Å; P796-E798 PolarHBondContact O-N 2.85Å; E798-V802 WeakPolarHBondContact O-CG2 3.48Å; E798-V802 PolarHBondContact O-N 2.82Å; E798-L827 HydrophobicContact CB-CD1 4.02Å; E798-L827 HydrophobicContact CB-CD2 3.9Å; E798-L827 HydrophobicContact CG-CD2 4.3Å
799	V	96	Very high	95.4	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-79.9	-38.3	176.2	-174.1	0	0	0	0	110.9	L657 F764 P796 K797 V802 M803 L827	L657-V799 HydrophobicContact CD2-CG2 3.8Å; F764-V799 HydrophobicContact CD2-CG1 4.12Å; F764-V799 HydrophobicContact CE2-CG1 3.65Å; F764-V799 HydrophobicContact CZ-CG1 4.04Å; F764-V799 HydrophobicContact CZ-CG2 4.18Å; P796-V799 HydrophobicContact CB-CG2 4.24Å; P796-V799 HydrophobicContact CG-CG2 4.19Å; P796-V799 PolarHBondContact O-N 3.45Å; K797-V799 PolarHBondContact O-N 2.71Å; V799-V802 WeakPolarHBondContact O-CB 3.23Å; V799-V802 PolarHBondContact O-N 2.93Å; V799-M803 HydrophobicContact CG1-CE 4.19Å; V799-M803 PolarHBondContact O-N 2.9Å; V799-L827 HydrophobicContact CG2-CD1 4.05Å
800	Y	97.7	Very high	95.2	Very high	38 Å²	38	55.9 Å²	55.9	15%	0.149	25%	0.253	C	S	.	.	H	α-helix	trans	-67.2	-36	174.8	-172.3	-109.1	0	0	0	112.4	L789 R791 P796 K797 V802 M803 L804 W807	L789-Y800 PolarHBondContact O-OH 2.86Å; L789-Y800 VanDerWaalsContact O-OH 3.07Å; R791-Y800 HydrophobicContact CB-CD1 3.94Å; R791-Y800 HydrophobicContact CB-CD2 3.57Å; R791-Y800 HydrophobicContact CB-CE1 3.94Å; R791-Y800 HydrophobicContact CB-CE2 3.59Å; R791-Y800 HydrophobicContact CB-CG 3.74Å; R791-Y800 HydrophobicContact CG-CD1 4.15Å; R791-Y800 HydrophobicContact CG-CD2 3.79Å; R791-Y800 HydrophobicContact CG-CE2 4.33Å; R791-Y800 HydrophobicContact CG-CG 3.67Å; P796-Y800 PolarHBondContact O-N 2.84Å; K797-Y800 CarbonylContact O-C 3.57Å; K797-Y800 PolarHBondContact O-N 3.42Å; Y800-V802 PolarHBondContact O-N 2.84Å; Y800-M803 HydrophobicContact CD2-CB 4.43Å; Y800-M803 HydrophobicContact CD2-SD 3.76Å; Y800-M803 HydrophobicContact CE2-SD 4.41Å; Y800-M803 WeakPolarHBondContact O-CA 3.48Å; Y800-M803 WeakPolarHBondContact O-CB 3.3Å; Y800-M803 PolarHBondContact O-N 2.79Å; Y800-L804 HydrophobicContact CD1-CD1 3.92Å; Y800-L804 HydrophobicContact CD1-CG 4.13Å; Y800-L804 HydrophobicContact CE1-CD1 3.71Å; Y800-L804 HydrophobicContact CE1-CD2 4.02Å; Y800-L804 HydrophobicContact CE1-CG 3.87Å; Y800-L804 WeakPolarHBondContact O-CG 3.44Å; Y800-L804 PolarHBondContact O-N 2.82Å; Y800-W807 HydrophobicContact CE2-CZ3 4.23Å
801	D	97.4	Very high	95.1	Very high	75 Å²	75	49.7 Å²	49.7	40%	0.401	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-32.8	173	-67.9	-18	0	0	0	111	K797 G805	K797-D801 WeakPolarHBondContact CE-OD2 3.12Å; K797-D801 VanDerWaalsContact O-CG 3.31Å; K797-D801 PolarHBondContact O-N 2.88Å; D801-G805 PolarHBondContact O-N 2.87Å
802	V	97.8	Very high	95	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.024	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-42.7	168.7	173.5	0	0	0	0	111.7	L760 E798 V799 Y800 L804 G805 C806 I820 I823	L760-V802 HydrophobicContact CD1-CB 4.48Å; L760-V802 HydrophobicContact CD1-CG1 3.8Å; E798-V802 WeakPolarHBondContact O-CG2 3.48Å; E798-V802 PolarHBondContact O-N 2.82Å; V799-V802 WeakPolarHBondContact O-CB 3.23Å; V799-V802 PolarHBondContact O-N 2.93Å; Y800-V802 PolarHBondContact O-N 2.84Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-L804 PolarHBondContact O-N 2.92Å; V802-G805 CarbonylContact O-C 3.59Å; V802-G805 WeakPolarHBondContact O-CA 3.29Å; V802-G805 PolarHBondContact O-N 2.82Å; V802-G805 VanDerWaalsContact O-N 3.11Å; V802-C806 PolarHBondContact O-N 3.44Å; V802-C806 PolarHBondContact O-SG 3.18Å; V802-C806 VanDerWaalsContact O-SG 3.39Å; V802-I820 HydrophobicContact CG1-CG1 4.29Å; V802-I820 HydrophobicContact CG1-CG2 3.9Å; V802-I823 HydrophobicContact CG2-CB 4.35Å; V802-I823 HydrophobicContact CG2-CD1 4.38Å; V802-I823 HydrophobicContact CG2-CG2 3.62Å
803	M	98.4	Very high	95.1	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-44.8	174.8	-59	177.7	-165.3	0	0	111.5	L760 W761 F764 C795 V799 Y800 G805 C806 W807	L760-M803 HydrophobicContact CB-CE 3.82Å; L760-M803 HydrophobicContact CB-CG 3.88Å; L760-M803 HydrophobicContact CB-SD 4.44Å; L760-M803 HydrophobicContact CD1-CG 4.07Å; W761-M803 HydrophobicContact CB-SD 4.15Å; F764-M803 HydrophobicContact CB-CE 4.41Å; F764-M803 HydrophobicContact CD2-CE 4.33Å; C795-M803 VanDerWaalsContact SG-CE 3.53Å; V799-M803 HydrophobicContact CG1-CE 4.19Å; V799-M803 PolarHBondContact O-N 2.9Å; Y800-M803 HydrophobicContact CD2-CB 4.43Å; Y800-M803 HydrophobicContact CD2-SD 3.76Å; Y800-M803 HydrophobicContact CE2-SD 4.41Å; Y800-M803 WeakPolarHBondContact O-CA 3.48Å; Y800-M803 WeakPolarHBondContact O-CB 3.3Å; Y800-M803 PolarHBondContact O-N 2.79Å; M803-G805 VanDerWaalsContact C-N 3.27Å; M803-G805 PolarHBondContact O-N 3.36Å; M803-C806 WeakPolarHBondContact O-CA 3.35Å; M803-C806 WeakPolarHBondContact O-CB 3.49Å; M803-C806 PolarHBondContact O-N 2.79Å; M803-W807 HydrophobicContact CB-CD2 4.42Å; M803-W807 HydrophobicContact CB-CE3 4Å; M803-W807 HydrophobicContact CB-CH2 3.73Å; M803-W807 HydrophobicContact CB-CZ2 4.17Å; M803-W807 HydrophobicContact CB-CZ3 3.65Å; M803-W807 HydrophobicContact CG-CH2 4.21Å; M803-W807 VanDerWaalsContact O-CD2 3.31Å; M803-W807 PolarHBondContact O-N 3.07Å; M803-W807 HydrophobicContact SD-CH2 3.87Å; M803-W807 HydrophobicContact SD-CZ3 4.35Å
804	L	98	Very high	95.5	Very high	58 Å²	58	50.4 Å²	50.4	30%	0.304	24%	0.239	S	C	.	.	H	α-helix	trans	-61.7	-35.2	174.5	-66.5	177	0	0	0	112.1	V788 Y800 V802 C806 W807 Q808	V788-L804 HydrophobicContact CG2-CD2 4.05Å; Y800-L804 HydrophobicContact CD1-CD1 3.92Å; Y800-L804 HydrophobicContact CD1-CG 4.13Å; Y800-L804 HydrophobicContact CE1-CD1 3.71Å; Y800-L804 HydrophobicContact CE1-CD2 4.02Å; Y800-L804 HydrophobicContact CE1-CG 3.87Å; Y800-L804 WeakPolarHBondContact O-CG 3.44Å; Y800-L804 PolarHBondContact O-N 2.82Å; V802-L804 VanDerWaalsContact C-N 3.35Å; V802-L804 PolarHBondContact O-N 2.92Å; L804-C806 VanDerWaalsContact C-N 3.34Å; L804-W807 PolarHBondContact O-N 3.2Å; L804-Q808 PolarHBondContact O-NE2 2.61Å
805	G	97.6	Very high	96	Very high	10 Å²	10	50.4 Å²	50.4	10%	0.103	24%	0.236	C	C	.	.	H	α-helix	trans	-66.8	-29.9	171.4	0	0	0	0	0	114.1	D801 V802 M803 R814 L815	D801-G805 PolarHBondContact O-N 2.87Å; V802-G805 CarbonylContact O-C 3.59Å; V802-G805 WeakPolarHBondContact O-CA 3.29Å; V802-G805 PolarHBondContact O-N 2.82Å; V802-G805 VanDerWaalsContact O-N 3.11Å; M803-G805 VanDerWaalsContact C-N 3.27Å; M803-G805 PolarHBondContact O-N 3.36Å; G805-R814 VanDerWaalsContact O-CA 3.3Å; G805-R814 WeakPolarHBondContact O-CA 3.24Å; G805-L815 PolarHBondContact O-N 3.02Å
806	C	98.3	Very high	96	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-74.4	-33.1	170	-63.7	0	0	0	0	112.5	V753 V802 M803 L804 Q808 R814 I820	V753-C806 HydrophobicContact CG1-CB 4.13Å; V753-C806 WeakPolarHBondContact O-CB 3.48Å; V802-C806 PolarHBondContact O-N 3.44Å; V802-C806 PolarHBondContact O-SG 3.18Å; V802-C806 VanDerWaalsContact O-SG 3.39Å; M803-C806 WeakPolarHBondContact O-CA 3.35Å; M803-C806 WeakPolarHBondContact O-CB 3.49Å; M803-C806 PolarHBondContact O-N 2.79Å; L804-C806 VanDerWaalsContact C-N 3.34Å; C806-Q808 PolarHBondContact O-N 2.7Å; C806-R814 VanDerWaalsContact O-CD 3.25Å; C806-R814 WeakPolarHBondContact O-CD 3.43Å; C806-R814 WeakPolarHBondContact O-CG 3.38Å; C806-I820 VanDerWaalsContact SG-CD1 3.57Å
807	W	98.1	Very high	96.2	Very high	11 Å²	11	54.5 Å²	54.5	4%	0.042	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	26.6	-174.1	-57.1	-35.2	0	0	0	114.7	W754 G757 V758 W761 V788 L789 Y800 M803 L804 R809	W754-W807 AromaticContact CD2-CD1 3.57Å; W754-W807 HydrophobicContact CD2-CG 4.41Å; W754-W807 AromaticContact CE2-CD1 3.72Å; W754-W807 HydrophobicContact CE3-CB 4.12Å; W754-W807 AromaticContact CE3-CD1 3.94Å; W754-W807 HydrophobicContact CE3-CG 4.42Å; W754-W807 AromaticContact CG-CD1 3.87Å; W754-W807 HydrophobicContact CH2-CB 4.14Å; W754-W807 HydrophobicContact CZ3-CB 3.89Å; W754-W807 HydrophobicContact CZ3-CG 4.48Å; W754-W807 WeakPolarHBondContact CZ3-O 3.47Å; W754-W807 PolarHBondContact O-NE1 3.39Å; G757-W807 VanDerWaalsContact C-CZ2 3.42Å; G757-W807 VanDerWaalsContact O-CZ2 3.25Å; G757-W807 WeakPolarHBondContact O-CZ2 3.5Å; V758-W807 HydrophobicContact CG2-CZ2 4.23Å; W761-W807 HydrophobicContact CB-CH2 4.13Å; W761-W807 HydrophobicContact CB-CZ2 4.28Å; W761-W807 HydrophobicContact CG-CH2 4.42Å; V788-W807 HydrophobicContact CB-CD2 4.44Å; V788-W807 HydrophobicContact CB-CE3 3.83Å; V788-W807 HydrophobicContact CB-CZ3 4.43Å; V788-W807 HydrophobicContact CG1-CB 3.81Å; V788-W807 HydrophobicContact CG1-CE3 4.34Å; V788-W807 HydrophobicContact CG1-CG 4.43Å; V788-W807 HydrophobicContact CG2-CE3 4.41Å; L789-W807 HydrophobicContact CB-CH2 3.71Å; L789-W807 HydrophobicContact CB-CZ2 4.37Å; L789-W807 HydrophobicContact CB-CZ3 4.06Å; L789-W807 HydrophobicContact CD1-CH2 3.97Å; L789-W807 HydrophobicContact CD1-CZ2 3.82Å; L789-W807 HydrophobicContact CG-CH2 4.39Å; Y800-W807 HydrophobicContact CE2-CZ3 4.23Å; M803-W807 HydrophobicContact CB-CD2 4.42Å; M803-W807 HydrophobicContact CB-CE3 4Å; M803-W807 HydrophobicContact CB-CH2 3.73Å; M803-W807 HydrophobicContact CB-CZ2 4.17Å; M803-W807 HydrophobicContact CB-CZ3 3.65Å; M803-W807 HydrophobicContact CG-CH2 4.21Å; M803-W807 VanDerWaalsContact O-CD2 3.31Å; M803-W807 PolarHBondContact O-N 3.07Å; M803-W807 HydrophobicContact SD-CH2 3.87Å; M803-W807 HydrophobicContact SD-CZ3 4.35Å; L804-W807 PolarHBondContact O-N 3.2Å; W807-R809 PolarHBondContact O-N 3.39Å
808	Q	97.5	Very high	96.3	Very high	73 Å²	73	54.2 Å²	54.2	34%	0.341	26%	0.257	S	S	.	.			trans	-62.9	134.1	167.7	-62.2	-58.8	-54.7	0	0	109.9	L804 C806 E810 Q813 R814	L804-Q808 PolarHBondContact O-NE2 2.61Å; C806-Q808 PolarHBondContact O-N 2.7Å; Q808-E810 PolarHBondContact O-N 2.99Å; Q808-Q813 HydrophobicContact CB-CB 3.89Å; Q808-Q813 HydrophobicContact CG-CB 4.24Å; Q808-Q813 WeakPolarHBondContact CG-O 3.46Å; Q808-R814 HydrophobicContact CB-CG 3.9Å; Q808-R814 PolarHBondContact O-NE 2.91Å; Q808-R814 PolarHBondContact O-NH2 2.7Å
809	R	92.5	Very high	96.4	Very high	115 Å²	115	54.6 Å²	54.6	43%	0.434	26%	0.259	S	S	.	.	S	Bend	trans	-59.6	-49.7	-176.1	-173.7	179	-175.3	86.3	2.4	110.9	T784 W807 R814	T784-R809 VanDerWaalsContact O-CZ 3.32Å; T784-R809 PolarHBondContact O-NH1 3.39Å; T784-R809 PolarHBondContact O-NH2 3.43Å; W807-R809 PolarHBondContact O-N 3.39Å; R809-R814 PolarHBondContact O-NH2 2.85Å
810	E	93.9	Very high	96.5	Very high	107 Å²	107	54.6 Å²	54.6	50%	0.5	26%	0.259	S	S	.	.	S	Bend	trans	-76.2	123.8	175.4	-65.4	-53.6	142.3	0	0	110.7	Q808 Q812 Q813	Q808-E810 PolarHBondContact O-N 2.99Å; E810-Q812 PolarHBondContact O-N 2.77Å; E810-Q812 VanDerWaalsContact O-N 3.14Å; E810-Q813 HydrophobicContact CB-CB 4.34Å; E810-Q813 HydrophobicContact CB-CG 4.01Å; E810-Q813 PolarHBondContact O-N 2.94Å
811	P	94.7	Very high	96.5	Very high	19 Å²	19	56.1 Å²	56.1	12%	0.123	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-55.6	-36.4	-177.3	-27.5	34.9	0	0	0	113.8	E740 E750 Q813 R814	E740-P811 HydrophobicContact CG-CG 3.96Å; E750-P811 HydrophobicContact CB-CB 3.73Å; E750-P811 HydrophobicContact CG-CB 4.23Å; E750-P811 WeakPolarHBondContact CG-O 3.39Å; P811-Q813 PolarHBondContact O-N 2.91Å; P811-R814 WeakPolarHBondContact O-CB 3.39Å; P811-R814 PolarHBondContact O-N 2.81Å
812	Q	94.3	Very high	96.4	Very high	144 Å²	144	59.3 Å²	59.3	67%	0.673	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-73.2	-9.6	-178.9	-56.8	-57.4	-49.7	0	0	114.1	E810	E810-Q812 PolarHBondContact O-N 2.77Å; E810-Q812 VanDerWaalsContact O-N 3.14Å
813	Q	96.4	Very high	96.3	Very high	127 Å²	127	62.2 Å²	62.2	59%	0.593	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-96.5	-8.8	175.3	-66.8	178.4	-6.6	0	0	112.5	Q808 E810 P811	Q808-Q813 HydrophobicContact CB-CB 3.89Å; Q808-Q813 HydrophobicContact CG-CB 4.24Å; Q808-Q813 WeakPolarHBondContact CG-O 3.46Å; E810-Q813 HydrophobicContact CB-CB 4.34Å; E810-Q813 HydrophobicContact CB-CG 4.01Å; E810-Q813 PolarHBondContact O-N 2.94Å; P811-Q813 PolarHBondContact O-N 2.91Å
814	R	97.4	Very high	96.1	Very high	19 Å²	19	62.2 Å²	62.2	7%	0.072	29%	0.289	C	S	.	.	S	Bend	trans	-69	144.6	179.5	-61.5	176.5	-171.1	150.6	12.7	110.4	E740 E750 V753 G805 C806 Q808 R809 P811	E740-R814 IonicContact OE1-CZ 3.43Å; E740-R814 IonicContact OE1-NH1 2.71Å; E740-R814 PolarHBondContact OE1-NH1 2.83Å; E740-R814 IonicContact OE1-NH2 3.28Å; E740-R814 PolarHBondContact OE1-NH2 3.34Å; E740-R814 IonicContact OE2-CZ 3.68Å; E740-R814 IonicContact OE2-NH1 3.71Å; E740-R814 IonicContact OE2-NH2 2.75Å; E740-R814 PolarHBondContact OE2-NH2 2.95Å; E750-R814 VanDerWaalsContact O-CD 3.27Å; E750-R814 WeakPolarHBondContact O-CD 3.46Å; E750-R814 PolarHBondContact O-NH1 2.86Å; V753-R814 HydrophobicContact CG1-CB 4.01Å; G805-R814 VanDerWaalsContact O-CA 3.3Å; G805-R814 WeakPolarHBondContact O-CA 3.24Å; C806-R814 VanDerWaalsContact O-CD 3.25Å; C806-R814 WeakPolarHBondContact O-CD 3.43Å; C806-R814 WeakPolarHBondContact O-CG 3.38Å; Q808-R814 HydrophobicContact CB-CG 3.9Å; Q808-R814 PolarHBondContact O-NE 2.91Å; Q808-R814 PolarHBondContact O-NH2 2.7Å; R809-R814 PolarHBondContact O-NH2 2.85Å; P811-R814 WeakPolarHBondContact O-CB 3.39Å; P811-R814 PolarHBondContact O-N 2.81Å
815	L	96.3	Very high	95.8	Very high	55 Å²	55	62.8 Å²	62.8	29%	0.288	29%	0.29	S	S	.	.	P	Polyproline II helix	trans	-58.8	140.3	176.2	-68.3	176.9	0	0	0	111	V753 G805 I820	V753-L815 WeakPolarHBondContact CG1-O 3.46Å; G805-L815 PolarHBondContact O-N 3.02Å; L815-I820 HydrophobicContact CB-CD1 3.86Å; L815-I820 HydrophobicContact CB-CG1 3.68Å; L815-I820 HydrophobicContact CD1-CG1 4.28Å; L815-I820 WeakPolarHBondContact O-CD1 3.26Å
816	N	93.8	Very high	95.6	Very high	79 Å²	79	65 Å²	65	42%	0.422	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-68.8	137.5	176.5	-173.5	-34.5	0	0	0	109.8	K818 E819 I820	N816-K818 PolarHBondContact O-N 2.89Å; N816-K818 VanDerWaalsContact O-N 3.07Å; N816-K818 WeakPolarHBondContact OD1-CB 3.38Å; N816-K818 PolarHBondContact OD1-N 2.84Å; N816-E819 HydrophobicContact CB-CB 4.42Å; N816-E819 HydrophobicContact CB-CG 4.02Å; N816-E819 WeakPolarHBondContact CB-OE2 3.39Å; N816-E819 PolarHBondContact N-OE2 3.22Å; N816-E819 WeakPolarHBondContact O-CA 3.39Å; N816-E819 WeakPolarHBondContact O-CB 3.34Å; N816-E819 PolarHBondContact O-N 2.8Å; N816-I820 WeakPolarHBondContact O-CG1 3.33Å; N816-I820 PolarHBondContact O-N 2.89Å
817	I	97.2	Very high	95.2	Very high	8 Å²	8	66.1 Å²	66.1	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-56	-29.4	177.6	-165.6	58.5	0	0	0	113.5	A664 M667 V668 A671 V753 F756 E819 I820 Y821	A664-I817 HydrophobicContact CB-CD1 4.25Å; M667-I817 HydrophobicContact CB-CD1 4.08Å; M667-I817 HydrophobicContact CB-CG1 3.6Å; M667-I817 HydrophobicContact CE-CD1 3.85Å; M667-I817 HydrophobicContact CE-CG1 4.09Å; M667-I817 HydrophobicContact SD-CD1 3.65Å; M667-I817 HydrophobicContact SD-CG1 4.15Å; V668-I817 HydrophobicContact CG2-CG1 4.19Å; V668-I817 HydrophobicContact CG2-CG2 4.07Å; A671-I817 HydrophobicContact CB-CG2 4.19Å; V753-I817 HydrophobicContact CG2-CB 4.02Å; F756-I817 HydrophobicContact CD1-CD1 4.16Å; F756-I817 HydrophobicContact CG-CD1 4.19Å; I817-E819 VanDerWaalsContact C-N 3.32Å; I817-E819 PolarHBondContact O-N 2.97Å; I817-I820 HydrophobicContact CD1-CB 4.3Å; I817-I820 HydrophobicContact CD1-CD1 4.29Å; I817-I820 HydrophobicContact CD1-CG2 4.27Å; I817-Y821 WeakPolarHBondContact O-CB 3.31Å; I817-Y821 PolarHBondContact O-N 2.76Å
818	K	96.4	Very high	94.5	Very high	107 Å²	107	66.6 Å²	66.6	47%	0.465	32%	0.322	S	S	.	.	H	α-helix	trans	-67.8	-28.2	173	-68.7	176.6	-180	174	0	113.4	V668 N816 K822	V668-K818 HydrophobicContact CG1-CG 3.94Å; V668-K818 HydrophobicContact CG2-CB 4.48Å; V668-K818 HydrophobicContact CG2-CG 3.94Å; N816-K818 PolarHBondContact O-N 2.89Å; N816-K818 VanDerWaalsContact O-N 3.07Å; N816-K818 WeakPolarHBondContact OD1-CB 3.38Å; N816-K818 PolarHBondContact OD1-N 2.84Å; K818-K822 WeakPolarHBondContact O-CG 3.42Å
819	E	95.9	Very high	93.7	Very high	97 Å²	97	70.7 Å²	70.7	45%	0.453	34%	0.339	S	S	.	.	H	α-helix	trans	-84	-45.1	176.4	-63.2	169.9	150.4	0	0	110.1	N816 I817 Y821 K822 I823	N816-E819 HydrophobicContact CB-CB 4.42Å; N816-E819 HydrophobicContact CB-CG 4.02Å; N816-E819 WeakPolarHBondContact CB-OE2 3.39Å; N816-E819 PolarHBondContact N-OE2 3.22Å; N816-E819 WeakPolarHBondContact O-CA 3.39Å; N816-E819 WeakPolarHBondContact O-CB 3.34Å; N816-E819 PolarHBondContact O-N 2.8Å; I817-E819 VanDerWaalsContact C-N 3.32Å; I817-E819 PolarHBondContact O-N 2.97Å; E819-Y821 VanDerWaalsContact C-N 3.31Å; E819-Y821 PolarHBondContact O-N 3.41Å; E819-K822 WeakPolarHBondContact O-CB 3.3Å; E819-K822 PolarHBondContact O-N 2.84Å; E819-I823 WeakPolarHBondContact O-CG1 3.26Å; E819-I823 PolarHBondContact O-N 2.89Å
820	I	97.3	Very high	92.7	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-52.5	-49.2	172.5	-66.1	165.5	0	0	0	110.6	V753 F756 V802 C806 L815 N816 I817 K822 I823 L824	V753-I820 HydrophobicContact CG1-CD1 3.87Å; F756-I820 HydrophobicContact CD1-CG2 3.92Å; F756-I820 HydrophobicContact CE1-CG2 3.4Å; F756-I820 HydrophobicContact CZ-CG2 4.29Å; V802-I820 HydrophobicContact CG1-CG1 4.29Å; V802-I820 HydrophobicContact CG1-CG2 3.9Å; C806-I820 VanDerWaalsContact SG-CD1 3.57Å; L815-I820 HydrophobicContact CB-CD1 3.86Å; L815-I820 HydrophobicContact CB-CG1 3.68Å; L815-I820 HydrophobicContact CD1-CG1 4.28Å; L815-I820 WeakPolarHBondContact O-CD1 3.26Å; N816-I820 WeakPolarHBondContact O-CG1 3.33Å; N816-I820 PolarHBondContact O-N 2.89Å; I817-I820 HydrophobicContact CD1-CB 4.3Å; I817-I820 HydrophobicContact CD1-CD1 4.29Å; I817-I820 HydrophobicContact CD1-CG2 4.27Å; I820-K822 PolarHBondContact O-N 2.88Å; I820-I823 PolarHBondContact O-N 2.95Å; I820-L824 HydrophobicContact CG2-CD1 3.74Å; I820-L824 HydrophobicContact CG2-CG 4.33Å; I820-L824 WeakPolarHBondContact O-CG 3.5Å; I820-L824 PolarHBondContact O-N 2.85Å
821	Y	97.2	Very high	91.1	Very high	70 Å²	70	66.4 Å²	66.4	28%	0.275	34%	0.34	S	S	.	.	H	α-helix	trans	-56.7	-45.3	175.5	170.6	-106.4	0	0	0	112.4	S661 A664 I817 E819 I823 H825	S661-Y821 WeakPolarHBondContact O-CD2 3.46Å; S661-Y821 WeakPolarHBondContact O-CE2 3.42Å; A664-Y821 HydrophobicContact CB-CD2 4.17Å; I817-Y821 WeakPolarHBondContact O-CB 3.31Å; I817-Y821 PolarHBondContact O-N 2.76Å; E819-Y821 VanDerWaalsContact C-N 3.31Å; E819-Y821 PolarHBondContact O-N 3.41Å; Y821-I823 PolarHBondContact O-N 2.92Å; Y821-H825 HydrophobicContact CE2-CB 4.43Å; Y821-H825 WeakPolarHBondContact O-CB 3.29Å; Y821-H825 PolarHBondContact O-N 3.41Å
822	K	95.8	Very high	89.6	Confident	143 Å²	143	67.1 Å²	67.1	62%	0.622	35%	0.345	S	S	*	.	H	α-helix	trans	-62.3	-42.3	177.6	-73.7	171.2	-178.3	178.1	0	111.9	K818 E819 I820 A826	K818-K822 WeakPolarHBondContact O-CG 3.42Å; E819-K822 WeakPolarHBondContact O-CB 3.3Å; E819-K822 PolarHBondContact O-N 2.84Å; I820-K822 PolarHBondContact O-N 2.88Å; K822-A826 VanDerWaalsContact O-CB 3.3Å; K822-A826 WeakPolarHBondContact O-CB 3.25Å; K822-A826 PolarHBondContact O-N 2.86Å
823	I	95.6	Very high	87.9	Confident	64 Å²	64	68.1 Å²	68.1	33%	0.328	35%	0.353	S	S	.	.	H	α-helix	trans	-65.1	-51.5	179.2	-63.9	162	0	0	0	110	V802 E819 I820 Y821 H825 A826 L827	V802-I823 HydrophobicContact CG2-CB 4.35Å; V802-I823 HydrophobicContact CG2-CD1 4.38Å; V802-I823 HydrophobicContact CG2-CG2 3.62Å; E819-I823 WeakPolarHBondContact O-CG1 3.26Å; E819-I823 PolarHBondContact O-N 2.89Å; I820-I823 PolarHBondContact O-N 2.95Å; Y821-I823 PolarHBondContact O-N 2.92Å; I823-H825 PolarHBondContact O-N 2.92Å; I823-A826 PolarHBondContact O-N 2.84Å; I823-L827 HydrophobicContact CG2-CD1 3.98Å; I823-L827 HydrophobicContact CG2-CG 4.42Å; I823-L827 WeakPolarHBondContact O-CG 3.41Å; I823-L827 PolarHBondContact O-N 3.28Å
824	L	95.2	Very high	85.9	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-62.3	-41	179.9	-68.2	172.1	0	0	0	112.5	L657 A660 S661 A664 F756 L760 I820 A826 L827 G828	L657-L824 HydrophobicContact CD2-CD2 4.11Å; A660-L824 HydrophobicContact CB-CD1 4.15Å; A660-L824 HydrophobicContact CB-CD2 4.5Å; S661-L824 PolarHBondContact OG-O 2.86Å; A664-L824 HydrophobicContact CB-CD1 4.24Å; F756-L824 HydrophobicContact CE1-CD1 3.73Å; F756-L824 HydrophobicContact CZ-CD1 3.59Å; L760-L824 HydrophobicContact CD2-CD1 4.08Å; L760-L824 HydrophobicContact CD2-CD2 4.18Å; I820-L824 HydrophobicContact CG2-CD1 3.74Å; I820-L824 HydrophobicContact CG2-CG 4.33Å; I820-L824 WeakPolarHBondContact O-CG 3.5Å; I820-L824 PolarHBondContact O-N 2.85Å; L824-A826 VanDerWaalsContact C-N 3.35Å; L824-L827 PolarHBondContact O-N 3.29Å; L824-G828 PolarHBondContact O-N 2.94Å
825	H	91.5	Very high	83.7	Confident	70 Å²	70	71.5 Å²	71.5	32%	0.324	37%	0.37	S	S	.	.	H	α-helix	trans	-68.2	-32.8	176.5	176.6	-116	0	0	0	112.5	Y821 I823 K829	Y821-H825 HydrophobicContact CE2-CB 4.43Å; Y821-H825 WeakPolarHBondContact O-CB 3.29Å; Y821-H825 PolarHBondContact O-N 3.41Å; I823-H825 PolarHBondContact O-N 2.92Å; H825-K829 PolarHBondContact CE1-NZ 3.4Å; H825-K829 VanDerWaalsContact NE2-CE 3.3Å; H825-K829 WeakPolarHBondContact NE2-CE 3.12Å; H825-K829 WeakPolarHBondContact O-CG 3.39Å; H825-K829 PolarHBondContact O-N 3.1Å
826	A	92.2	Very high	81.6	Confident	56 Å²	56	72.2 Å²	72.2	46%	0.463	38%	0.375	S	S	.	.	H	α-helix	trans	-68.4	-47.6	171.6	0	0	0	0	0	111.6	K822 I823 L824 G828 K829 A830	K822-A826 VanDerWaalsContact O-CB 3.3Å; K822-A826 WeakPolarHBondContact O-CB 3.25Å; K822-A826 PolarHBondContact O-N 2.86Å; I823-A826 PolarHBondContact O-N 2.84Å; L824-A826 VanDerWaalsContact C-N 3.35Å; A826-G828 VanDerWaalsContact C-N 3.3Å; A826-G828 PolarHBondContact O-N 3.44Å; A826-K829 PolarHBondContact O-N 2.77Å; A826-K829 VanDerWaalsContact O-N 3.16Å; A826-A830 PolarHBondContact O-N 2.78Å
827	L	90.5	Very high	79.7	Confident	25 Å²	25	75.7 Å²	75.7	13%	0.131	39%	0.391	C	S	.	.	H	α-helix	trans	-60.6	-37.5	174.9	-68.3	173.1	0	0	0	111.9	L657 E798 V799 I823 L824 K829 A830 T831 P832	L657-L827 HydrophobicContact CD1-CB 4.1Å; L657-L827 HydrophobicContact CD2-CB 4.17Å; E798-L827 HydrophobicContact CB-CD1 4.02Å; E798-L827 HydrophobicContact CB-CD2 3.9Å; E798-L827 HydrophobicContact CG-CD2 4.3Å; V799-L827 HydrophobicContact CG2-CD1 4.05Å; I823-L827 HydrophobicContact CG2-CD1 3.98Å; I823-L827 HydrophobicContact CG2-CG 4.42Å; I823-L827 WeakPolarHBondContact O-CG 3.41Å; I823-L827 PolarHBondContact O-N 3.28Å; L824-L827 PolarHBondContact O-N 3.29Å; L827-K829 VanDerWaalsContact C-N 3.31Å; L827-K829 PolarHBondContact O-N 3.09Å; L827-A830 CarbonylContact O-C 3.43Å; L827-A830 PolarHBondContact O-N 3.01Å; L827-T831 WeakPolarHBondContact O-CA 3.37Å; L827-T831 PolarHBondContact O-N 2.83Å; L827-T831 VanDerWaalsContact O-N 3.07Å; L827-P832 HydrophobicContact CD2-CG 3.86Å
828	G	83.2	Confident	77.1	Confident	21 Å²	21	82.1 Å²	82.1	22%	0.216	43%	0.425	C	S	.	.	H	α-helix	trans	-67.8	-27.5	176.6	0	0	0	0	0	113.9	L824 A826	L824-G828 PolarHBondContact O-N 2.94Å; A826-G828 VanDerWaalsContact C-N 3.3Å; A826-G828 PolarHBondContact O-N 3.44Å
829	K	80.5	Confident	74.2	Confident	158 Å²	158	83.2 Å²	83.2	69%	0.687	47%	0.467	S	S	*	.	H	α-helix	trans	-83.8	-30.8	173.5	-75.6	-176.8	175.1	-176.8	0	113.3	H825 A826 L827	H825-K829 PolarHBondContact CE1-NZ 3.4Å; H825-K829 VanDerWaalsContact NE2-CE 3.3Å; H825-K829 WeakPolarHBondContact NE2-CE 3.12Å; H825-K829 WeakPolarHBondContact O-CG 3.39Å; H825-K829 PolarHBondContact O-N 3.1Å; A826-K829 PolarHBondContact O-N 2.77Å; A826-K829 VanDerWaalsContact O-N 3.16Å; L827-K829 VanDerWaalsContact C-N 3.31Å; L827-K829 PolarHBondContact O-N 3.09Å
830	A	71.6	Confident	73.1	Confident	73 Å²	73	82.6 Å²	82.6	60%	0.603	47%	0.468	S	S	*	.	S	Bend	trans	-122.3	62.7	180	0	0	0	0	0	109.8	A826 L827 P832	A826-A830 PolarHBondContact O-N 2.78Å; L827-A830 CarbonylContact O-C 3.43Å; L827-A830 PolarHBondContact O-N 3.01Å; A830-P832 WeakPolarHBondContact O-CD 3.36Å; A830-P832 VanDerWaalsContact O-N 3.15Å
831	T	60.8	Low	71.8	Confident	60 Å²	60	86.9 Å²	86.9	37%	0.368	49%	0.492	S	S	.	.			trans	-51.6	117.9	-173.1	-9	0	0	0	0	111.5	L653 L657 L827	L653-T831 HydrophobicContact CB-CG2 4.23Å; L653-T831 HydrophobicContact CD2-CG2 3.9Å; L653-T831 HydrophobicContact CG-CG2 3.76Å; L657-T831 HydrophobicContact CD1-CG2 3.93Å; L827-T831 WeakPolarHBondContact O-CA 3.37Å; L827-T831 PolarHBondContact O-N 2.83Å; L827-T831 VanDerWaalsContact O-N 3.07Å
832	P	61.9	Low	70.4	Confident	33 Å²	33	87.8 Å²	87.8	21%	0.214	51%	0.505	C	S	.	.			trans	-59.3	141.2	177.3	-25.3	34.5	0	0	0	111.5	L653 L827 A830 Y834	L653-P832 VanDerWaalsContact CD2-O 3.29Å; L653-P832 WeakPolarHBondContact CD2-O 3.34Å; L827-P832 HydrophobicContact CD2-CG 3.86Å; A830-P832 WeakPolarHBondContact O-CD 3.36Å; A830-P832 VanDerWaalsContact O-N 3.15Å; P832-Y834 PolarHBondContact O-N 2.7Å
833	I	59.2	Low	68.9	Low	166 Å²	166	84.6 Å²	84.6	85%	0.851	50%	0.498	S	S	*	.			trans	-76.1	99	170.8	-57.7	177.8	0	0	0	107.3
834	Y	54.6	Low	67.2	Low	84 Å²	84	85.9 Å²	85.9	33%	0.329	51%	0.508	S	S	.	.			trans	-108	126.9	171.7	-169.5	-100.2	0	0	0	109.9	R791 R793 P796 P832 D836	R791-Y834 VanDerWaalsContact NH2-CE2 3.32Å; R793-Y834 WeakPolarHBondContact O-CE1 3.41Å; R793-Y834 VanDerWaalsContact O-CZ 3.26Å; R793-Y834 PolarHBondContact O-OH 3.12Å; P796-Y834 HydrophobicContact CG-CG 4.48Å; P832-Y834 PolarHBondContact O-N 2.7Å; Y834-D836 HydrophobicContact CE1-CB 4.42Å
835	L	51.2	Low	65.4	Low	132 Å²	132	91.6 Å²	91.6	69%	0.691	54%	0.542	S	S	*	.			trans	-124.7	121.3	173.5	-73.9	166.7	0	0	0	107.1	I837	L835-I837 HydrophobicContact CB-CG1 4.34Å; L835-I837 PolarHBondContact O-N 3.43Å
836	D	52.9	Low	63.5	Low	71 Å²	71	93.1 Å²	93.1	38%	0.38	56%	0.558	S	S	.	*			trans	-77.9	111.7	164.4	-164.8	-11.6	0	0	0	107.6	Y834 L838	Y834-D836 HydrophobicContact CE1-CB 4.42Å; D836-L838 VanDerWaalsContact C-N 3.28Å; D836-L838 PolarHBondContact OD1-N 3.09Å
837	I	52.7	Low	61.3	Low	151 Å²	151	96 Å²	96	77%	0.774	57%	0.565	S	S	*	*	S	Bend	trans	-87.9	-3.8	-174.4	-52.9	179	0	0	0	110.3	L835	L835-I837 HydrophobicContact CB-CG1 4.34Å; L835-I837 PolarHBondContact O-N 3.43Å
838	L	43.3	Very low	58.9	Low	143 Å²	143	101.9 Å²	101.9	75%	0.749	60%	0.601	S	S	*	*			trans	-133.1	70.2	-173.6	-62.8	173.2	0	0	0	111.3	D836	D836-L838 VanDerWaalsContact C-N 3.28Å; D836-L838 PolarHBondContact OD1-N 3.09Å
839	G	34.7	Very low	56.7	Low	131 Å²	131	109.3 Å²	109.3	100%	1.351	64%	0.636	S	S	*	*			trans	-64.8	0	170.2	0	0	0	0	0	113

Retrieved 839 of 839 residues in 1812.5 ms (Link to these results)

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