A0A087XVN0_POEFO Loading...

Netrin G1

AlphaFold DB , UniProt , Accession A0A087XVN0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 427 aa.

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(Predicted Aligned Error values between residue pairs)

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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	46	Very low	43	Very low	236 Å²	236	151 Å²	151	100%	1.163	75%	0.753	S	S	*	*				0	58.2	0	-73	167.7	159.7	0	0	111.4
2	R	47.9	Very low	42.9	Very low	245 Å²	245	147.5 Å²	147.5	93%	0.925	74%	0.737	S	S	*	*			trans	-126.9	36.4	177.5	-78.6	-170	173.5	-175	-1.1	111.1
3	F	42	Very low	42.4	Very low	190 Å²	190	152.6 Å²	152.6	83%	0.833	74%	0.742	S	S	*	*	S	Bend	trans	-136.5	11	-177.1	-113.9	-85.3	0	0	0	113.6
4	Q	42.9	Very low	42.1	Very low	168 Å²	168	148.9 Å²	148.9	79%	0.785	73%	0.733	S	S	*	*	S	Bend	trans	-115.2	-3.6	177.2	-81.3	-169.2	-32.3	0	0	114.3
5	F	41.7	Very low	41.8	Very low	176 Å²	176	142.1 Å²	142.1	77%	0.772	72%	0.717	S	S	*	*	S	Bend	trans	-97.3	-5.7	179.9	-87.3	-81	0	0	0	114.5
6	A	43.6	Very low	41.4	Very low	77 Å²	77	141.9 Å²	141.9	64%	0.636	72%	0.715	S	S	*	*	S	Bend	trans	-92.4	-14.2	179.4	0	0	0	0	0	113.8
7	L	42.8	Very low	40.9	Very low	132 Å²	132	138.7 Å²	138.7	69%	0.691	71%	0.708	S	S	*	*	S	Bend	trans	-93.9	-11	-177.2	-88.1	152.2	0	0	0	114
8	T	43	Very low	40.6	Very low	83 Å²	83	138 Å²	138	51%	0.509	71%	0.706	S	S	.	*	S	Bend	trans	-91.2	-11.6	179.1	50.2	0	0	0	0	113.6
9	L	41.3	Very low	40.2	Very low	138 Å²	138	135.4 Å²	135.4	72%	0.723	71%	0.707	S	S	*	*	S	Bend	trans	-97.5	-9.7	179.1	-95.1	142.8	0	0	0	114.4
10	Q	40.2	Very low	39.8	Very low	151 Å²	151	132.8 Å²	132.8	71%	0.706	71%	0.706	S	S	*	*	S	Bend	trans	-91.2	-10.9	169	-97.3	178.7	-37.9	0	0	113.8	T14	Q10-T14 PolarHBondContact O-OG1 3.2Å
11	A	41.9	Very low	39.4	Very low	65 Å²	65	133.4 Å²	133.4	54%	0.537	71%	0.707	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.8	-10	178.6	0	0	0	0	0	113.9
12	I	41.4	Very low	38.6	Very low	109 Å²	109	129.6 Å²	129.6	56%	0.559	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-17.1	-177	-59.2	175.1	0	0	0	111.7
13	W	36.6	Very low	37.6	Very low	214 Å²	214	126.2 Å²	126.2	81%	0.811	68%	0.681	S	S	*	*	H	α-helix	trans	-91.4	-20.8	176	-123.7	35.9	0	0	0	114.4
14	T	37.5	Very low	36.9	Very low	100 Å²	100	126.5 Å²	126.5	61%	0.613	68%	0.677	S	S	*	*	H	α-helix	trans	-87.5	-15.8	170.7	47	0	0	0	0	113.2	Q10	Q10-T14 PolarHBondContact O-OG1 3.2Å
15	G	38.7	Very low	36.3	Very low	48 Å²	48	121.9 Å²	121.9	50%	0.495	66%	0.662	S	S	.	*	H	α-helix	trans	-83.1	-27.8	173.1	0	0	0	0	0	114.4
16	M	34.7	Very low	36	Very low	138 Å²	138	119.1 Å²	119.1	68%	0.68	67%	0.672	S	S	*	*	H	α-helix	trans	-95.6	-12	-176.9	-69.9	-173.2	69.2	0	0	114.7
17	C	33.5	Very low	35.4	Very low	88 Å²	88	119.6 Å²	119.6	60%	0.595	68%	0.675	S	S	*	*	S	Bend	trans	-86.2	-17.1	171	-66.8	0	0	0	0	113.4
18	N	34.3	Very low	34.9	Very low	126 Å²	126	122.4 Å²	122.4	67%	0.674	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-9.5	174.3	-81.2	-18	0	0	0	113.6
19	A	33.8	Very low	35.3	Very low	88 Å²	88	120.5 Å²	120.5	73%	0.727	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-1.2	178.2	0	0	0	0	0	113.8
20	A	32.6	Very low	36.8	Very low	84 Å²	84	119.1 Å²	119.1	69%	0.694	66%	0.663	S	S	*	*	S	Bend	trans	-117.7	12.6	178.2	0	0	0	0	0	113.4	Q22	A20-Q22 PolarHBondContact O-N 2.96Å
21	M	30.2	Very low	39.2	Very low	146 Å²	146	112.5 Å²	112.5	72%	0.719	63%	0.632	S	S	*	*	S	Bend	trans	-83	101.9	154.2	-80.9	-172.7	137.8	0	0	106.2	H23	M21-H23 PolarHBondContact O-N 2.92Å
22	Q	30.6	Very low	41.5	Very low	156 Å²	156	112.6 Å²	112.6	73%	0.729	62%	0.624	S	S	*	*			trans	-38	109.3	159.6	-75	169.2	-44.6	0	0	107.4	A20 Y24	A20-Q22 PolarHBondContact O-N 2.96Å; Q22-Y24 PolarHBondContact O-N 2.97Å
23	H	26.9	Very low	44	Very low	174 Å²	174	110.1 Å²	110.1	81%	0.806	61%	0.613	S	S	*	*			trans	-56.2	93.7	156.9	-77.8	3	0	0	0	104.9	M21 P25	M21-H23 PolarHBondContact O-N 2.92Å; H23-P25 VanDerWaalsContact C-N 3.34Å; H23-P25 WeakPolarHBondContact O-CD 3.27Å; H23-P25 VanDerWaalsContact O-N 3.17Å
24	Y	27.7	Very low	46.9	Very low	195 Å²	195	100.1 Å²	100.1	77%	0.765	58%	0.576	S	S	*	*			trans	-60.3	108	149.3	-89.1	-88	0	0	0	103.8	Q22 A26	Q22-Y24 PolarHBondContact O-N 2.97Å; Y24-A26 PolarHBondContact O-N 2.87Å; Y24-A26 VanDerWaalsContact O-N 3.09Å
25	P	30.3	Very low	49.6	Very low	72 Å²	72	98.6 Å²	98.6	47%	0.468	56%	0.561	S	S	.	*			trans	-60.1	123.7	175.2	-12.2	28.2	0	0	0	105.3	H23 A27 W28	H23-P25 VanDerWaalsContact C-N 3.34Å; H23-P25 WeakPolarHBondContact O-CD 3.27Å; H23-P25 VanDerWaalsContact O-N 3.17Å; P25-A27 PolarHBondContact O-N 2.78Å; P25-W28 PolarHBondContact O-N 3.04Å
26	A	33.8	Very low	52.2	Low	117 Å²	117	98.2 Å²	98.2	97%	0.967	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	22.4	172.8	0	0	0	0	0	112.7	Y24	Y24-A26 PolarHBondContact O-N 2.87Å; Y24-A26 VanDerWaalsContact O-N 3.09Å
27	A	31	Very low	54.9	Low	87 Å²	87	97.2 Å²	97.2	72%	0.719	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.7	20.9	-171.5	0	0	0	0	0	112.6	P25 G29	P25-A27 PolarHBondContact O-N 2.78Å; A27-G29 PolarHBondContact O-N 3.03Å
28	W	33.2	Very low	57.7	Low	192 Å²	192	95.3 Å²	95.3	73%	0.727	53%	0.53	S	S	*	.	S	Bend	trans	-75.1	107.9	154.1	-83.7	41.4	0	0	0	106.1	P25 H30	P25-W28 PolarHBondContact O-N 3.04Å; W28-H30 PolarHBondContact O-N 2.87Å
29	G	52	Low	60.4	Low	42 Å²	42	99 Å²	99	43%	0.433	54%	0.536	S	S	.	.			trans	-53.8	127.1	174.1	0	0	0	0	0	108.5	A27 Y31 D32	A27-G29 PolarHBondContact O-N 3.03Å; G29-Y31 PolarHBondContact O-N 3.45Å; G29-D32 VanDerWaalsContact O-CG 3.25Å; G29-D32 PolarHBondContact O-N 2.95Å
30	H	72.2	Confident	62.8	Low	109 Å²	109	97.2 Å²	97.2	51%	0.505	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	118.2	174.7	-74.1	-76.2	0	0	0	108.5	W28 Q52	W28-H30 PolarHBondContact O-N 2.87Å; H30-Q52 PolarHBondContact O-NE2 2.7Å
31	Y	89.8	Confident	65.3	Low	13 Å²	13	101.8 Å²	101.8	5%	0.051	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	42.7	177.8	-45.5	-82.4	0	0	0	114.1	G29 A50 C51 Q52 Y246 Y345 P349	G29-Y31 PolarHBondContact O-N 3.45Å; Y31-A50 WeakPolarHBondContact CB-O 3.28Å; Y31-A50 HydrophobicContact CD1-CB 3.88Å; Y31-A50 HydrophobicContact CE1-CB 4.36Å; Y31-C51 CarbonylContact O-C 3.48Å; Y31-C51 WeakPolarHBondContact O-CA 3.07Å; Y31-Q52 PolarHBondContact O-N 3.01Å; Y31-Y246 HydrophobicContact CE2-CD2 4.26Å; Y31-Y246 HydrophobicContact CE2-CE2 4.01Å; Y31-Y345 HydrophobicContact CD1-CD1 4.42Å; Y31-Y345 AromaticContact CD2-CD1 3.62Å; Y31-Y345 HydrophobicContact CD2-CD1 3.62Å; Y31-Y345 AromaticContact CD2-CE1 3.8Å; Y31-Y345 HydrophobicContact CD2-CE1 3.8Å; Y31-Y345 HydrophobicContact CE1-CD1 4.13Å; Y31-Y345 AromaticContact CE2-CD1 3.3Å; Y31-Y345 HydrophobicContact CE2-CD1 3.3Å; Y31-Y345 AromaticContact CE2-CE1 3.89Å; Y31-Y345 HydrophobicContact CE2-CE1 3.89Å; Y31-Y345 HydrophobicContact CE2-CG 4.27Å; Y31-Y345 HydrophobicContact CG-CD1 4.19Å; Y31-Y345 HydrophobicContact CG-CE1 4.43Å; Y31-Y345 AromaticContact CZ-CD1 3.59Å; Y31-Y345 PolarHBondContact OH-O 3.2Å; Y31-P349 WeakPolarHBondContact CE1-O 3.44Å
32	D	91.6	Very high	67.9	Low	67 Å²	67	103.9 Å²	103.9	36%	0.358	54%	0.539	S	S	.	.			trans	-83.5	-21.7	178.5	59.9	-17.1	0	0	0	114.5	G29 N306	G29-D32 VanDerWaalsContact O-CG 3.25Å; G29-D32 PolarHBondContact O-N 2.95Å; D32-N306 WeakPolarHBondContact O-CB 3.46Å; D32-N306 PolarHBondContact O-ND2 3.19Å
33	V	94	Very high	70.6	Confident	56 Å²	56	98 Å²	98	34%	0.339	52%	0.519	S	S	.	.			trans	-109.5	126.1	-178.9	179	0	0	0	0	110.8	K35 M49	V33-K35 VanDerWaalsContact CG1-O 3.27Å; V33-K35 WeakPolarHBondContact CG1-O 3.45Å; V33-M49 WeakPolarHBondContact O-CG 3.32Å
34	C	96.4	Very high	73.6	Confident	5 Å²	5	93.9 Å²	93.9	3%	0.034	50%	0.503	C	S	.	.	S	Bend	trans	-83.5	-32.3	176.1	-59.4	0	0	0	0	113.6	M49 C51 E320 H321	C34-M49 PolarHBondContact O-N 2.96Å; C34-C51 WeakPolarHBondContact CA-SG 3.33Å; C34-C51 HydrophobicContact CB-CB 3.79Å; C34-C51 WeakPolarHBondContact CB-SG 3.32Å; C34-C51 WeakPolarHBondContact SG-CB 3.32Å; C34-C51 CovalentContact SG-SG 2.03Å; C34-C51 PolarHBondContact SG-SG 3.31Å; C34-E320 HydrophobicContact CB-CB 4.01Å; C34-E320 HydrophobicContact CB-CG 4Å; C34-H321 PolarHBondContact O-NE2 2.84Å
35	K	94.3	Very high	76.7	Confident	67 Å²	67	87.1 Å²	87.1	29%	0.291	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	145	-177.2	64.5	-166.5	172.7	-151.8	0	111.7	V33 W46 D47 Y48 E320	V33-K35 VanDerWaalsContact CG1-O 3.27Å; V33-K35 WeakPolarHBondContact CG1-O 3.45Å; K35-W46 HydrophobicContact CB-CE3 3.98Å; K35-W46 HydrophobicContact CD-CD2 4.38Å; K35-W46 HydrophobicContact CD-CE3 4.05Å; K35-W46 HydrophobicContact CD-CZ3 4.25Å; K35-W46 HydrophobicContact CG-CE3 3.79Å; K35-W46 HydrophobicContact CG-CZ3 3.9Å; K35-D47 CarbonylContact C-O 3.48Å; K35-D47 WeakPolarHBondContact CA-O 3.34Å; K35-Y48 HydrophobicContact CB-CD1 3.72Å; K35-Y48 HydrophobicContact CB-CE1 3.94Å; K35-Y48 HydrophobicContact CD-CE1 4.03Å; K35-E320 IonicContact NZ-OE1 2.68Å; K35-E320 PolarHBondContact NZ-OE1 3.26Å; K35-E320 IonicContact NZ-OE2 2.78Å; K35-E320 PolarHBondContact NZ-OE2 3.36Å
36	S	93.4	Very high	79.6	Confident	40 Å²	40	89.5 Å²	89.5	28%	0.28	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	155.8	172.3	64.3	0	0	0	0	110.6	W46 D47	S36-W46 WeakPolarHBondContact O-CA 3.24Å; S36-D47 PolarHBondContact N-O 3.26Å; S36-D47 PolarHBondContact O-N 3.37Å
37	Q	91.9	Very high	82.4	Confident	117 Å²	117	86.3 Å²	86.3	55%	0.547	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.8	175.5	-66.8	-177.7	-14.3	0	0	109.4	L44 T45 W46	Q37-L44 HydrophobicContact CB-CD1 4.07Å; Q37-L44 HydrophobicContact CB-CG 4.32Å; Q37-T45 WeakPolarHBondContact CA-O 3.43Å; Q37-W46 HydrophobicContact CG-CD2 4.23Å; Q37-W46 HydrophobicContact CG-CE3 3.74Å; Q37-W46 HydrophobicContact CG-CH2 3.54Å; Q37-W46 HydrophobicContact CG-CZ2 4.03Å; Q37-W46 HydrophobicContact CG-CZ3 3.39Å; Q37-W46 VanDerWaalsContact NE2-CH2 3.33Å
38	V	91.8	Very high	85.5	Confident	49 Å²	49	85.7 Å²	85.7	30%	0.297	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.7	176.5	-64.9	0	0	0	0	109.8	T45 D47	V38-T45 PolarHBondContact N-O 2.04Å; V38-T45 PolarHBondContact O-N 3.1Å; V38-D47 HydrophobicContact CB-CB 4.4Å; V38-D47 HydrophobicContact CG1-CB 3.68Å; V38-D47 HydrophobicContact CG2-CB 3.79Å
39	Y	90.4	Very high	88.5	Confident	204 Å²	204	77.5 Å²	77.5	80%	0.8	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.1	123.8	171	-75.6	-87.4	0	0	0	108.9	L44	Y39-L44 HydrophobicContact CD1-CD1 4.19Å; Y39-L44 HydrophobicContact CD2-CD1 4.11Å; Y39-L44 HydrophobicContact CE1-CD1 3.95Å; Y39-L44 HydrophobicContact CE2-CD1 3.86Å; Y39-L44 HydrophobicContact CG-CD1 4.28Å
40	S	84.7	Confident	90.6	Very high	49 Å²	49	75.5 Å²	75.5	34%	0.343	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	170.3	172.1	66	0	0	0	0	109.9	E42 G43 T45	S40-E42 PolarHBondContact O-N 3.05Å; S40-E42 VanDerWaalsContact O-N 3.12Å; S40-G43 PolarHBondContact N-O 2.9Å; S40-G43 PolarHBondContact O-N 2.72Å; S40-G43 PolarHBondContact OG-O 3.44Å; S40-T45 VanDerWaalsContact OG-CG2 3.27Å; S40-T45 WeakPolarHBondContact OG-CG2 3.37Å; S40-T45 PolarHBondContact OG-OG1 3.5Å
41	D	85.3	Confident	91.8	Very high	180 Å²	180	70.3 Å²	70.3	96%	0.963	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.7	178.3	-61.9	-26.3	0	0	0	112.7
42	E	83.7	Confident	92.1	Very high	191 Å²	191	70.4 Å²	70.4	89%	0.893	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	5.6	176.6	-59.4	-172.8	177.3	0	0	113.4	S40	S40-E42 PolarHBondContact O-N 3.05Å; S40-E42 VanDerWaalsContact O-N 3.12Å
43	G	89.1	Confident	92.3	Very high	31 Å²	31	67.6 Å²	67.6	32%	0.32	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	106.2	-157.3	-178.3	0	0	0	0	0	113.5	S40 T45	S40-G43 PolarHBondContact N-O 2.9Å; S40-G43 PolarHBondContact O-N 2.72Å; S40-G43 PolarHBondContact OG-O 3.44Å; G43-T45 PolarHBondContact O-N 2.92Å
44	L	89.9	Confident	92.2	Very high	89 Å²	89	73.3 Å²	73.3	47%	0.466	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	117.8	-177.1	-165.6	75	0	0	0	110.5	Q37 Y39	Q37-L44 HydrophobicContact CB-CD1 4.07Å; Q37-L44 HydrophobicContact CB-CG 4.32Å; Y39-L44 HydrophobicContact CD1-CD1 4.19Å; Y39-L44 HydrophobicContact CD2-CD1 4.11Å; Y39-L44 HydrophobicContact CE1-CD1 3.95Å; Y39-L44 HydrophobicContact CE2-CD1 3.86Å; Y39-L44 HydrophobicContact CG-CD1 4.28Å
45	T	91.6	Very high	92.1	Very high	53 Å²	53	75.1 Å²	75.1	33%	0.325	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	163.1	-178.7	58.4	0	0	0	0	111.4	Q37 V38 S40 G43	Q37-T45 WeakPolarHBondContact CA-O 3.43Å; V38-T45 PolarHBondContact N-O 2.04Å; V38-T45 PolarHBondContact O-N 3.1Å; S40-T45 VanDerWaalsContact OG-CG2 3.27Å; S40-T45 WeakPolarHBondContact OG-CG2 3.37Å; S40-T45 PolarHBondContact OG-OG1 3.5Å; G43-T45 PolarHBondContact O-N 2.92Å
46	W	91.8	Very high	92.1	Very high	121 Å²	121	73.9 Å²	73.9	46%	0.458	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122	176.1	-69.8	106.7	0	0	0	110.3	K35 S36 Q37 Y48	K35-W46 HydrophobicContact CB-CE3 3.98Å; K35-W46 HydrophobicContact CD-CD2 4.38Å; K35-W46 HydrophobicContact CD-CE3 4.05Å; K35-W46 HydrophobicContact CD-CZ3 4.25Å; K35-W46 HydrophobicContact CG-CE3 3.79Å; K35-W46 HydrophobicContact CG-CZ3 3.9Å; S36-W46 WeakPolarHBondContact O-CA 3.24Å; Q37-W46 HydrophobicContact CG-CD2 4.23Å; Q37-W46 HydrophobicContact CG-CE3 3.74Å; Q37-W46 HydrophobicContact CG-CH2 3.54Å; Q37-W46 HydrophobicContact CG-CZ2 4.03Å; Q37-W46 HydrophobicContact CG-CZ3 3.39Å; Q37-W46 VanDerWaalsContact NE2-CH2 3.33Å; W46-Y48 HydrophobicContact CB-CD2 4.4Å; W46-Y48 HydrophobicContact CB-CE1 4.32Å; W46-Y48 HydrophobicContact CB-CE2 3.75Å
47	D	93.3	Very high	92.2	Very high	51 Å²	51	74.2 Å²	74.2	27%	0.273	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.7	165.3	-175.2	28.2	0	0	0	108.3	K35 S36 V38 M49 K350	K35-D47 CarbonylContact C-O 3.48Å; K35-D47 WeakPolarHBondContact CA-O 3.34Å; S36-D47 PolarHBondContact N-O 3.26Å; S36-D47 PolarHBondContact O-N 3.37Å; V38-D47 HydrophobicContact CB-CB 4.4Å; V38-D47 HydrophobicContact CG1-CB 3.68Å; V38-D47 HydrophobicContact CG2-CB 3.79Å; D47-M49 HydrophobicContact CB-CE 4.33Å; D47-M49 WeakPolarHBondContact OD2-CE 3.05Å; D47-K350 IonicContact OD2-NZ 2.81Å; D47-K350 PolarHBondContact OD2-NZ 3.03Å
48	Y	95.8	Very high	92.4	Very high	73 Å²	73	68.8 Å²	68.8	29%	0.286	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.3	-178.3	-63.3	-82.2	0	0	0	110.2	K35 W46 H321 I355	K35-Y48 HydrophobicContact CB-CD1 3.72Å; K35-Y48 HydrophobicContact CB-CE1 3.94Å; K35-Y48 HydrophobicContact CD-CE1 4.03Å; W46-Y48 HydrophobicContact CB-CD2 4.4Å; W46-Y48 HydrophobicContact CB-CE1 4.32Å; W46-Y48 HydrophobicContact CB-CE2 3.75Å; Y48-H321 AromaticContact CD1-CD2 3.67Å; Y48-I355 HydrophobicContact CD1-CG2 4.24Å; Y48-I355 HydrophobicContact CD2-CD1 3.83Å; Y48-I355 HydrophobicContact CD2-CG2 4.2Å; Y48-I355 HydrophobicContact CE2-CD1 4.03Å; Y48-I355 HydrophobicContact CG-CD1 4.47Å; Y48-I355 HydrophobicContact CG-CG2 3.79Å
49	M	95.8	Very high	92.6	Very high	20 Å²	20	67 Å²	67	10%	0.099	34%	0.343	C	S	.	.			trans	-131.3	164.7	-179.2	57.6	-151.6	65	0	0	111.6	V33 C34 D47 H321 K350	V33-M49 WeakPolarHBondContact O-CG 3.32Å; C34-M49 PolarHBondContact O-N 2.96Å; D47-M49 HydrophobicContact CB-CE 4.33Å; D47-M49 WeakPolarHBondContact OD2-CE 3.05Å; M49-H321 PolarHBondContact O-CE1 2.61Å; M49-H321 PolarHBondContact O-NE2 3.21Å; M49-K350 HydrophobicContact CB-CB 4.05Å; M49-K350 WeakPolarHBondContact CB-O 3.01Å; M49-K350 HydrophobicContact CE-CD 4.16Å; M49-K350 HydrophobicContact SD-CD 4.32Å; M49-K350 HydrophobicContact SD-CG 4.29Å
50	A	96.8	Very high	92.7	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.008	34%	0.336	C	S	.	.			trans	-63.8	141	178.7	0	0	0	0	0	109.7	Y31 L303 S344 K350	Y31-A50 WeakPolarHBondContact CB-O 3.28Å; Y31-A50 HydrophobicContact CD1-CB 3.88Å; Y31-A50 HydrophobicContact CE1-CB 4.36Å; A50-L303 HydrophobicContact CB-CB 4.18Å; A50-L303 HydrophobicContact CB-CD1 4.44Å; A50-L303 HydrophobicContact CB-CD2 4.34Å; A50-S344 WeakPolarHBondContact CB-O 3.37Å; A50-K350 PolarHBondContact N-O 3.47Å; A50-K350 VanDerWaalsContact N-O 3.11Å
51	C	96.8	Very high	93.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-144.3	142	178.8	63.6	0	0	0	0	113.5	Y31 C34 L303 H304 A305 N306	Y31-C51 CarbonylContact O-C 3.48Å; Y31-C51 WeakPolarHBondContact O-CA 3.07Å; C34-C51 WeakPolarHBondContact CA-SG 3.33Å; C34-C51 HydrophobicContact CB-CB 3.79Å; C34-C51 WeakPolarHBondContact CB-SG 3.32Å; C34-C51 WeakPolarHBondContact SG-CB 3.32Å; C34-C51 CovalentContact SG-SG 2.03Å; C34-C51 PolarHBondContact SG-SG 3.31Å; C51-L303 PolarHBondContact N-O 3.13Å; C51-L303 CarbonylContact O-C 3.56Å; C51-L303 WeakPolarHBondContact O-CA 3.48Å; C51-H304 PolarHBondContact O-N 2.84Å; C51-A305 CarbonylContact C-O 3.59Å; C51-A305 PolarHBondContact O-N 2.82Å; C51-A305 VanDerWaalsContact O-O 3.12Å; C51-A305 PolarHBondContact SG-N 3.28Å; C51-A305 VanDerWaalsContact SG-N 3.4Å; C51-N306 HydrophobicContact CB-CB 4.24Å
52	Q	95.8	Very high	93.6	Very high	14 Å²	14	57 Å²	57	7%	0.065	29%	0.293	C	S	.	.			trans	-137	153.2	-179.1	66.4	-164.7	-14.6	0	0	111.1	H30 Y31 L303 A305 Y345	H30-Q52 PolarHBondContact O-NE2 2.7Å; Y31-Q52 PolarHBondContact O-N 3.01Å; Q52-L303 HydrophobicContact CB-CD2 3.97Å; Q52-A305 CarbonylContact C-O 3.56Å; Q52-A305 VanDerWaalsContact C-O 3.26Å; Q52-A305 WeakPolarHBondContact CA-O 3.1Å; Q52-A305 PolarHBondContact N-O 3.2Å; Q52-Y345 VanDerWaalsContact OE1-CE1 3.3Å; Q52-Y345 PolarHBondContact OE1-OH 3.08Å
53	P	95.8	Very high	94.2	Very high	9 Å²	9	54.7 Å²	54.7	6%	0.058	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-69.7	156	174.8	-18.7	35.4	0	0	0	112.2	R298 C299 C301 A305 N306	P53-R298 WeakPolarHBondContact O-CD 3.39Å; P53-C299 HydrophobicContact CG-CB 4.16Å; P53-C301 HydrophobicContact CG-CB 4.48Å; P53-C301 VanDerWaalsContact CG-SG 3.6Å; P53-A305 WeakPolarHBondContact CD-O 3.36Å; P53-N306 WeakPolarHBondContact CA-O 3.37Å
54	E	92.6	Very high	94.6	Very high	176 Å²	176	54.8 Å²	54.8	82%	0.822	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-61	150.5	169.8	-161.8	176.2	176.5	0	0	110.7
55	A	93.8	Very high	95	Very high	42 Å²	42	53.6 Å²	53.6	35%	0.347	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-70.9	139.5	170.3	0	0	0	0	0	109.7	T146 G297	A55-T146 HydrophobicContact CB-CG2 4.2Å; A55-T146 WeakPolarHBondContact CB-OG1 3.36Å; A55-G297 CarbonylContact C-O 3.45Å; A55-G297 WeakPolarHBondContact CA-O 3.44Å
56	A	94.3	Very high	95.4	Very high	41 Å²	41	52.3 Å²	52.3	34%	0.339	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	165.9	179.1	0	0	0	0	0	110.4	M58 Q296 G297	A56-M58 HydrophobicContact CB-SD 4.44Å; A56-M58 PolarHBondContact O-N 3.27Å; A56-M58 VanDerWaalsContact O-N 3.16Å; A56-Q296 PolarHBondContact O-OE1 3.04Å; A56-Q296 VanDerWaalsContact O-OE1 3.14Å; A56-G297 PolarHBondContact N-O 2.83Å; A56-G297 PolarHBondContact O-N 2.88Å; A56-G297 VanDerWaalsContact O-N 3.08Å; A56-G297 VanDerWaalsContact O-O 3.11Å
57	D	95.6	Very high	95.7	Very high	48 Å²	48	50.7 Å²	50.7	26%	0.257	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	106.6	167.8	179	11.7	0	0	0	109.8	T59 Q60	D57-T59 PolarHBondContact O-N 3.46Å; D57-T59 WeakPolarHBondContact OD1-CB 3.48Å; D57-T59 VanDerWaalsContact OD1-CG2 3.25Å; D57-T59 WeakPolarHBondContact OD1-CG2 3.39Å; D57-T59 PolarHBondContact OD1-N 3.2Å; D57-T59 VanDerWaalsContact OD1-N 3.11Å; D57-T59 PolarHBondContact OD1-OG1 3.07Å; D57-T59 PolarHBondContact OD2-OG1 3.24Å; D57-T59 VanDerWaalsContact OD2-OG1 3.08Å; D57-Q60 PolarHBondContact OD2-NE2 3.28Å
58	M	96.4	Very high	95.9	Very high	3 Å²	3	50.5 Å²	50.5	2%	0.015	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-79.2	-8.3	-174.6	-57.5	-55.7	-74.5	0	0	112.2	A56 Q60 F61 W139 I143 V295 L315	A56-M58 HydrophobicContact CB-SD 4.44Å; A56-M58 PolarHBondContact O-N 3.27Å; A56-M58 VanDerWaalsContact O-N 3.16Å; M58-Q60 PolarHBondContact O-N 2.82Å; M58-F61 HydrophobicContact CE-CD2 4.43Å; M58-F61 PolarHBondContact O-N 3.47Å; M58-F61 HydrophobicContact SD-CD2 4.33Å; M58-W139 PolarHBondContact O-NE1 3.16Å; M58-I143 HydrophobicContact CB-CD1 4.41Å; M58-I143 HydrophobicContact CE-CB 4.28Å; M58-I143 HydrophobicContact CE-CD1 3.23Å; M58-I143 HydrophobicContact CE-CG1 3.47Å; M58-I143 VanDerWaalsContact CE-CG1 3.47Å; M58-I143 HydrophobicContact CE-CG2 3.84Å; M58-I143 HydrophobicContact CG-CD1 4.46Å; M58-I143 HydrophobicContact CG-CG2 4.04Å; M58-V295 HydrophobicContact CB-CG1 4.36Å; M58-V295 WeakPolarHBondContact CB-O 3.03Å; M58-V295 PolarHBondContact N-O 2.82Å; M58-L315 HydrophobicContact CE-CD2 3.63Å
59	T	95.1	Very high	95.9	Very high	12 Å²	12	52.2 Å²	52.2	7%	0.074	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-66.7	-24.3	178.8	68	0	0	0	0	112.4	D57 F61 L62 F108 I293 V295	D57-T59 PolarHBondContact O-N 3.46Å; D57-T59 WeakPolarHBondContact OD1-CB 3.48Å; D57-T59 VanDerWaalsContact OD1-CG2 3.25Å; D57-T59 WeakPolarHBondContact OD1-CG2 3.39Å; D57-T59 PolarHBondContact OD1-N 3.2Å; D57-T59 VanDerWaalsContact OD1-N 3.11Å; D57-T59 PolarHBondContact OD1-OG1 3.07Å; D57-T59 PolarHBondContact OD2-OG1 3.24Å; D57-T59 VanDerWaalsContact OD2-OG1 3.08Å; T59-F61 PolarHBondContact O-N 2.9Å; T59-L62 HydrophobicContact CG2-CD2 4.44Å; T59-L62 WeakPolarHBondContact O-CG 3.27Å; T59-F108 HydrophobicContact CG2-CD1 4.26Å; T59-I293 WeakPolarHBondContact CG2-O 3.28Å; T59-V295 HydrophobicContact CG2-CB 4.21Å; T59-V295 HydrophobicContact CG2-CG2 4.46Å
60	Q	92.9	Very high	95.8	Very high	138 Å²	138	56.7 Å²	56.7	65%	0.645	31%	0.308	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.3	178.4	-58.9	178.2	20.9	0	0	113.4	D57 M58	D57-Q60 PolarHBondContact OD2-NE2 3.28Å; M58-Q60 PolarHBondContact O-N 2.82Å
61	F	94.9	Very high	95.9	Very high	55 Å²	55	57.1 Å²	57.1	24%	0.241	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-114.3	2.5	-175.1	-49.2	-65.8	0	0	0	113.5	M58 T59 F310 L315	M58-F61 HydrophobicContact CE-CD2 4.43Å; M58-F61 PolarHBondContact O-N 3.47Å; M58-F61 HydrophobicContact SD-CD2 4.33Å; T59-F61 PolarHBondContact O-N 2.9Å; F61-F310 HydrophobicContact CB-CD2 4.33Å; F61-F310 HydrophobicContact CB-CE2 4.11Å; F61-F310 HydrophobicContact CD1-CB 4.13Å; F61-F310 HydrophobicContact CD1-CD1 4.3Å; F61-F310 AromaticContact CD1-CD2 3.58Å; F61-F310 HydrophobicContact CD1-CD2 3.58Å; F61-F310 AromaticContact CD1-CE2 3.96Å; F61-F310 HydrophobicContact CD1-CE2 3.96Å; F61-F310 AromaticContact CD1-CG 3.76Å; F61-F310 HydrophobicContact CD1-CG 3.76Å; F61-F310 HydrophobicContact CD1-CZ 4.44Å; F61-F310 HydrophobicContact CE1-CB 4.06Å; F61-F310 HydrophobicContact CE1-CD2 4.36Å; F61-F310 HydrophobicContact CE1-CG 4.13Å; F61-F310 HydrophobicContact CG-CD2 4.31Å; F61-L315 HydrophobicContact CB-CD2 4.43Å; F61-L315 HydrophobicContact CD1-CD1 4.43Å; F61-L315 HydrophobicContact CD2-CD2 4.18Å; F61-L315 HydrophobicContact CG-CD2 4.28Å
62	L	94.8	Very high	96	Very high	29 Å²	29	58.8 Å²	58.8	15%	0.152	32%	0.32	C	S	.	.			trans	-87.9	157	-177	72	80.4	0	0	0	112.3	T59 V64 F108 L137 S138 W139	T59-L62 HydrophobicContact CG2-CD2 4.44Å; T59-L62 WeakPolarHBondContact O-CG 3.27Å; L62-V64 HydrophobicContact CD1-CB 4Å; L62-F108 HydrophobicContact CD1-CD2 4.38Å; L62-F108 HydrophobicContact CD1-CE1 4.12Å; L62-F108 HydrophobicContact CD1-CE2 3.95Å; L62-F108 HydrophobicContact CD1-CZ 3.81Å; L62-F108 HydrophobicContact CD2-CD1 4.01Å; L62-F108 HydrophobicContact CD2-CE1 3.69Å; L62-F108 HydrophobicContact CD2-CZ 4.2Å; L62-F108 HydrophobicContact CG-CE1 4.48Å; L62-L137 HydrophobicContact CD1-CD2 4.2Å; L62-L137 HydrophobicContact CD2-CB 4.22Å; L62-L137 HydrophobicContact CD2-CD1 4.38Å; L62-L137 HydrophobicContact CD2-CD2 4.23Å; L62-S138 WeakPolarHBondContact CA-O 3.47Å; L62-W139 HydrophobicContact CB-CD2 4.34Å; L62-W139 HydrophobicContact CB-CG 4.38Å; L62-W139 HydrophobicContact CB-CZ2 4.31Å; L62-W139 HydrophobicContact CD2-CZ2 4.01Å
63	K	96.2	Very high	96.1	Very high	143 Å²	143	58.3 Å²	58.3	62%	0.622	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.1	123	162.3	-177.5	174.9	-179.7	172.4	0	108.7	S138	K63-S138 PolarHBondContact N-O 2.88Å; K63-S138 PolarHBondContact O-N 2.73Å
64	V	97.7	Very high	96.1	Very high	33 Å²	33	58.1 Å²	58.1	20%	0.2	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	139	175.1	64.4	0	0	0	0	110.7	L62 P104 M107 F108 I135 T136 L137	L62-V64 HydrophobicContact CD1-CB 4Å; V64-P104 HydrophobicContact CG1-CB 4.17Å; V64-M107 HydrophobicContact CG2-CE 3.91Å; V64-F108 HydrophobicContact CB-CE2 3.78Å; V64-F108 HydrophobicContact CB-CZ 4.1Å; V64-F108 HydrophobicContact CG1-CE2 3.97Å; V64-F108 HydrophobicContact CG2-CE2 4.05Å; V64-F108 HydrophobicContact CG2-CZ 4.12Å; V64-I135 HydrophobicContact CG2-CG2 3.96Å; V64-T136 CarbonylContact C-O 3.59Å; V64-T136 WeakPolarHBondContact CA-O 3.05Å; V64-L137 HydrophobicContact CB-CD2 4.4Å; V64-L137 HydrophobicContact CG2-CD2 4.07Å
65	T	98.1	Very high	96.3	Very high	63 Å²	63	56.8 Å²	56.8	39%	0.387	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.4	170.1	53.1	0	0	0	0	110.2	T136	T65-T136 PolarHBondContact N-O 3.23Å; T65-T136 PolarHBondContact O-N 2.93Å; T65-T136 WeakPolarHBondContact OG1-CB 3.32Å
66	L	98.6	Very high	96.4	Very high	26 Å²	26	59.6 Å²	59.6	14%	0.136	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	139.4	179.9	-61.3	178	0	0	0	110	I71 T72 P104 W119 N134 I135	L66-I71 HydrophobicContact CB-CG2 3.98Å; L66-I71 HydrophobicContact CD1-CG2 4.03Å; L66-T72 VanDerWaalsContact CD1-OG1 3.25Å; L66-T72 WeakPolarHBondContact CD1-OG1 3.41Å; L66-P104 HydrophobicContact CD1-CB 4.08Å; L66-P104 HydrophobicContact CD1-CG 4.21Å; L66-P104 HydrophobicContact CG-CB 4.5Å; L66-W119 HydrophobicContact CD1-CZ2 4.29Å; L66-W119 HydrophobicContact CD2-CZ2 4.36Å; L66-N134 WeakPolarHBondContact CA-O 3.43Å; L66-I135 HydrophobicContact CD2-CB 4.2Å; L66-I135 HydrophobicContact CD2-CG1 3.76Å; L66-I135 HydrophobicContact CD2-CG2 4.01Å
67	D	98.1	Very high	96.5	Very high	88 Å²	88	60.6 Å²	60.6	47%	0.471	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	122.1	171.7	170.2	67.4	0	0	0	110.1	N134	D67-N134 HydrophobicContact CB-CB 4.05Å; D67-N134 PolarHBondContact N-O 3.47Å; D67-N134 PolarHBondContact O-N 2.9Å; D67-N134 PolarHBondContact OD2-ND2 3.19Å
68	P	97.8	Very high	96.5	Very high	46 Å²	46	58.9 Å²	58.9	30%	0.299	32%	0.324	S	S	.	.	S	Bend	cis	-68.9	155.1	-1	28.9	-31.8	0	0	0	112.4	N70 I71	P68-N70 VanDerWaalsContact C-N 3.27Å; P68-N70 PolarHBondContact O-N 3.02Å; P68-I71 HydrophobicContact CG-CB 4.07Å; P68-I71 HydrophobicContact CG-CD1 4.19Å; P68-I71 HydrophobicContact CG-CG1 4.39Å; P68-I71 VanDerWaalsContact O-CB 3.22Å; P68-I71 WeakPolarHBondContact O-CB 3.38Å; P68-I71 WeakPolarHBondContact O-CG2 3.36Å; P68-I71 PolarHBondContact O-N 3.2Å
69	P	96.3	Very high	96.4	Very high	109 Å²	109	62 Å²	62	71%	0.708	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.7	-173.3	25.9	-34.9	0	0	0	114	I71	P69-I71 VanDerWaalsContact C-N 3.31Å; P69-I71 PolarHBondContact O-N 3.43Å
70	N	94.4	Very high	96.3	Very high	115 Å²	115	62.7 Å²	62.7	62%	0.615	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	26.7	179.4	68.3	-38.4	0	0	0	112.9	P68	P68-N70 VanDerWaalsContact C-N 3.27Å; P68-N70 PolarHBondContact O-N 3.02Å
71	I	97.9	Very high	96.1	Very high	10 Å²	10	56.4 Å²	56.4	5%	0.051	32%	0.316	C	S	.	.			trans	-86.3	-16.5	-176.4	-161.6	55.5	0	0	0	113.5	L66 P68 P69 W119 S121 T122 L131 V133	L66-I71 HydrophobicContact CB-CG2 3.98Å; L66-I71 HydrophobicContact CD1-CG2 4.03Å; P68-I71 HydrophobicContact CG-CB 4.07Å; P68-I71 HydrophobicContact CG-CD1 4.19Å; P68-I71 HydrophobicContact CG-CG1 4.39Å; P68-I71 VanDerWaalsContact O-CB 3.22Å; P68-I71 WeakPolarHBondContact O-CB 3.38Å; P68-I71 WeakPolarHBondContact O-CG2 3.36Å; P68-I71 PolarHBondContact O-N 3.2Å; P69-I71 VanDerWaalsContact C-N 3.31Å; P69-I71 PolarHBondContact O-N 3.43Å; I71-W119 HydrophobicContact CG2-CZ2 4.24Å; I71-S121 CarbonylContact O-C 3.43Å; I71-S121 WeakPolarHBondContact O-CA 3.34Å; I71-T122 PolarHBondContact O-N 3.47Å; I71-L131 HydrophobicContact CD1-CD1 4.03Å; I71-V133 HydrophobicContact CD1-CG2 3.96Å; I71-V133 HydrophobicContact CG1-CB 4.26Å; I71-V133 HydrophobicContact CG1-CG1 3.91Å; I71-V133 HydrophobicContact CG1-CG2 3.5Å; I71-V133 VanDerWaalsContact CG1-CG2 3.5Å; I71-V133 HydrophobicContact CG2-CG1 3.95Å
72	T	98.3	Very high	95.5	Very high	35 Å²	35	55.1 Å²	55.1	22%	0.215	32%	0.316	C	S	.	.	B	Isolated β-bridge	trans	-69.9	136.4	174.1	-55.4	0	0	0	0	109.5	L66 H102 W119 Q120	L66-T72 VanDerWaalsContact CD1-OG1 3.25Å; L66-T72 WeakPolarHBondContact CD1-OG1 3.41Å; T72-H102 WeakPolarHBondContact CG2-O 3.25Å; T72-W119 PolarHBondContact OG1-NE1 3.06Å; T72-W119 VanDerWaalsContact OG1-NE1 3.13Å; T72-Q120 WeakPolarHBondContact CA-O 3.43Å
73	C	97.8	Very high	94.4	Very high	3 Å²	3	57.4 Å²	57.4	2%	0.02	33%	0.328	C	S	.	.	S	Bend	trans	-67.9	164	178.5	66.5	0	0	0	0	112.4	E78 C93 Q120	C73-E78 HydrophobicContact CB-CG 4.15Å; C73-E78 WeakPolarHBondContact CB-OE1 3.41Å; C73-C93 HydrophobicContact CB-CB 3.78Å; C73-C93 WeakPolarHBondContact CB-SG 3.41Å; C73-C93 PolarHBondContact O-SG 3.44Å; C73-C93 WeakPolarHBondContact SG-CB 3.45Å; C73-C93 CovalentContact SG-SG 2.03Å; C73-C93 PolarHBondContact SG-SG 2.96Å; C73-Q120 HydrophobicContact CB-CG 4.48Å; C73-Q120 PolarHBondContact N-O 2.57Å; C73-Q120 VanDerWaalsContact N-O 3.07Å
74	G	97	Very high	93.2	Very high	5 Å²	5	59.6 Å²	59.6	5%	0.052	34%	0.34	C	S	.	.			trans	106.2	-1.4	170	0	0	0	0	0	116.1	P76 C93 A95	G74-P76 VanDerWaalsContact C-C 3.43Å; G74-P76 CarbonylContact C-O 3.59Å; G74-P76 CarbonylContact O-C 3.27Å; G74-C93 WeakPolarHBondContact CA-O 3.4Å; G74-C93 PolarHBondContact N-SG 3.12Å; G74-A95 WeakPolarHBondContact O-CB 3.47Å; G74-A95 PolarHBondContact O-N 2.81Å
75	D	95.9	Very high	91.7	Very high	149 Å²	149	61 Å²	61	80%	0.797	35%	0.346	S	S	*	.	S	Bend	trans	-134.9	95	171.5	-174	14.7	0	0	0	111.7
76	P	96.3	Very high	90.2	Very high	100 Å²	100	60.4 Å²	60.4	65%	0.649	34%	0.344	S	S	*	.	S	Bend	cis	-72.5	167	-3.6	32.9	-36.6	0	0	0	112.4	G74	G74-P76 VanDerWaalsContact C-C 3.43Å; G74-P76 CarbonylContact C-O 3.59Å; G74-P76 CarbonylContact O-C 3.27Å
77	P	96.6	Very high	88.8	Confident	62 Å²	62	68.6 Å²	68.6	40%	0.403	38%	0.375	S	S	.	.			trans	-52.5	143.4	173.7	-27.6	35.5	0	0	0	112.8	E92 C93 D94	P77-E92 HydrophobicContact CB-CG 4.49Å; P77-E92 WeakPolarHBondContact CB-OE1 3.45Å; P77-C93 CarbonylContact C-O 3.28Å; P77-C93 VanDerWaalsContact CA-O 3.24Å; P77-C93 WeakPolarHBondContact CA-O 3.16Å; P77-D94 HydrophobicContact CB-CB 4.07Å; P77-D94 HydrophobicContact CG-CB 4.11Å
78	E	95.1	Very high	87.5	Confident	13 Å²	13	69.4 Å²	69.4	6%	0.061	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147	-179.7	62.5	169.5	-176.3	0	0	114.7	C73 E92 C93 T122 T123 K125	C73-E78 HydrophobicContact CB-CG 4.15Å; C73-E78 WeakPolarHBondContact CB-OE1 3.41Å; E78-E92 WeakPolarHBondContact O-CA 3.34Å; E78-C93 PolarHBondContact N-O 3.3Å; E78-C93 PolarHBondContact O-N 2.9Å; E78-T122 WeakPolarHBondContact OE1-CA 3.36Å; E78-T123 PolarHBondContact OE1-N 2.8Å; E78-T123 PolarHBondContact OE2-OG1 3.11Å; E78-K125 WeakPolarHBondContact OE2-CE 3.33Å; E78-K125 IonicContact OE2-NZ 3.29Å; E78-K125 PolarHBondContact OE2-NZ 3.3Å
79	T	94	Very high	86.7	Confident	69 Å²	69	68.5 Å²	68.5	42%	0.423	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	142.1	175.7	56.4	0	0	0	0	112.2	N91 S284	T79-N91 CarbonylContact C-O 3.36Å; T79-N91 VanDerWaalsContact CA-O 3.24Å; T79-N91 WeakPolarHBondContact CA-O 3.4Å; T79-S284 WeakPolarHBondContact O-CB 3.12Å; T79-S284 PolarHBondContact O-OG 3.24Å; T79-S284 VanDerWaalsContact O-OG 3.08Å
80	Y	93.1	Very high	86.2	Confident	25 Å²	25	69.2 Å²	69.2	10%	0.098	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	160.9	178.1	71.6	-84.3	0	0	0	111.5	C89 N91 C93 S284 F287	Y80-C89 CarbonylContact O-C 3.59Å; Y80-C89 WeakPolarHBondContact O-CA 3.18Å; Y80-N91 HydrophobicContact CD1-CB 3.93Å; Y80-N91 HydrophobicContact CD2-CB 4.22Å; Y80-N91 HydrophobicContact CE1-CB 3.41Å; Y80-N91 VanDerWaalsContact CE1-CB 3.41Å; Y80-N91 HydrophobicContact CE2-CB 3.76Å; Y80-N91 HydrophobicContact CG-CB 4.31Å; Y80-N91 PolarHBondContact N-O 3.49Å; Y80-C93 HydrophobicContact CD1-CB 4.34Å; Y80-C93 HydrophobicContact CE1-CB 4.37Å; Y80-S284 WeakPolarHBondContact CA-O 3.47Å; Y80-F287 AromaticContact CD2-CE1 3.94Å; Y80-F287 HydrophobicContact CD2-CE1 3.94Å; Y80-F287 HydrophobicContact CD2-CE2 4.37Å; Y80-F287 AromaticContact CD2-CZ 3.64Å; Y80-F287 HydrophobicContact CD2-CZ 3.64Å; Y80-F287 HydrophobicContact CE2-CZ 4.32Å; Y80-F287 HydrophobicContact CG-CE1 4.42Å; Y80-F287 HydrophobicContact CG-CZ 4.44Å
81	C	89.5	Confident	86	Confident	6 Å²	6	66.7 Å²	66.7	4%	0.041	36%	0.356	C	S	.	.			trans	-103.8	121.1	179.1	-40.1	0	0	0	0	109.7	C89 N282 S284 R285 F287	C81-C89 HydrophobicContact CB-CB 3.95Å; C81-C89 WeakPolarHBondContact CB-SG 3.49Å; C81-C89 WeakPolarHBondContact SG-CB 3.17Å; C81-C89 CovalentContact SG-SG 2.03Å; C81-C89 PolarHBondContact SG-SG 2.87Å; C81-N282 PolarHBondContact SG-OD1 3.31Å; C81-S284 PolarHBondContact N-O 3.02Å; C81-S284 VanDerWaalsContact N-O 3.09Å; C81-R285 HydrophobicContact CB-CB 4.46Å; C81-R285 HydrophobicContact CB-CG 3.74Å; C81-R285 WeakPolarHBondContact SG-CG 3.26Å; C81-F287 WeakPolarHBondContact O-CE1 3.22Å
82	A	81.3	Confident	85.9	Confident	29 Å²	29	70.4 Å²	70.4	24%	0.24	37%	0.373	C	S	.	.			trans	-71.5	149	173.4	0	0	0	0	0	111.2	E84 N85 N91	A82-E84 PolarHBondContact O-N 2.73Å; A82-N85 CarbonylContact O-C 3.54Å; A82-N85 VanDerWaalsContact O-C 3.27Å; A82-N85 PolarHBondContact O-N 3.41Å; A82-N85 VanDerWaalsContact O-N 3.11Å; A82-N91 VanDerWaalsContact CB-ND2 3.31Å; A82-N91 WeakPolarHBondContact CB-ND2 3.47Å
83	L	73.1	Confident	85.8	Confident	77 Å²	77	68.8 Å²	68.8	40%	0.403	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-34.8	176.9	-89.8	158.4	0	0	0	113.4	N85 E154 W217	L83-N85 VanDerWaalsContact C-N 3.26Å; L83-N85 PolarHBondContact O-N 3.14Å; L83-E154 WeakPolarHBondContact CD1-O 3.4Å; L83-W217 HydrophobicContact CD2-CB 3.98Å
84	E	69.6	Low	85.8	Confident	189 Å²	189	69.5 Å²	69.5	88%	0.883	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-25.8	-179.4	-63.8	-167.6	155.1	0	0	112.9	A82	A82-E84 PolarHBondContact O-N 2.73Å
85	N	67.6	Low	85.8	Confident	61 Å²	61	72.1 Å²	72.1	33%	0.326	39%	0.387	S	S	.	.			trans	-142	74.5	-177.8	-160.4	-11.3	0	0	0	112.2	A82 L83 Y87 M88	A82-N85 CarbonylContact O-C 3.54Å; A82-N85 VanDerWaalsContact O-C 3.27Å; A82-N85 PolarHBondContact O-N 3.41Å; A82-N85 VanDerWaalsContact O-N 3.11Å; L83-N85 VanDerWaalsContact C-N 3.26Å; L83-N85 PolarHBondContact O-N 3.14Å; N85-Y87 PolarHBondContact O-N 3.14Å; N85-M88 VanDerWaalsContact ND2-CE 3.31Å; N85-M88 WeakPolarHBondContact ND2-CE 3.34Å; N85-M88 PolarHBondContact O-N 3.13Å; N85-M88 VanDerWaalsContact O-N 3.12Å; N85-M88 PolarHBondContact OD1-N 2.91Å
86	P	65.5	Low	85.9	Confident	51 Å²	51	70 Å²	70	33%	0.331	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-7.8	-175.7	26.4	-34.1	0	0	0	114.1	R285	P86-R285 PolarHBondContact O-NE 3.32Å; P86-R285 PolarHBondContact O-NH2 3.17Å
87	Y	68.9	Low	85.9	Confident	199 Å²	199	67.8 Å²	67.8	78%	0.78	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-19.6	177.9	-56.3	-75.7	0	0	0	113.1	N85	N85-Y87 PolarHBondContact O-N 3.14Å
88	M	71.8	Confident	85.7	Confident	104 Å²	104	73.6 Å²	73.6	51%	0.512	39%	0.391	S	S	.	.			trans	-115.4	98.6	175.5	-70.2	-149.8	-85.2	0	0	110.6	N85 N90	N85-M88 VanDerWaalsContact ND2-CE 3.31Å; N85-M88 WeakPolarHBondContact ND2-CE 3.34Å; N85-M88 PolarHBondContact O-N 3.13Å; N85-M88 VanDerWaalsContact O-N 3.12Å; N85-M88 PolarHBondContact OD1-N 2.91Å; M88-N90 PolarHBondContact O-N 3.32Å
89	C	81.6	Confident	85.6	Confident	27 Å²	27	81.8 Å²	81.8	18%	0.182	43%	0.429	C	S	.	.			trans	-90.4	54.4	177.4	-51.4	0	0	0	0	110.8	Y80 C81 N282	Y80-C89 CarbonylContact O-C 3.59Å; Y80-C89 WeakPolarHBondContact O-CA 3.18Å; C81-C89 HydrophobicContact CB-CB 3.95Å; C81-C89 WeakPolarHBondContact CB-SG 3.49Å; C81-C89 WeakPolarHBondContact SG-CB 3.17Å; C81-C89 CovalentContact SG-SG 2.03Å; C81-C89 PolarHBondContact SG-SG 2.87Å; C89-N282 PolarHBondContact SG-ND2 3.2Å
90	N	84.7	Confident	85.6	Confident	124 Å²	124	81.5 Å²	81.5	66%	0.663	42%	0.424	S	S	*	.			trans	-94.2	-5.2	-173.7	-62.5	-8.4	0	0	0	112.8	M88	M88-N90 PolarHBondContact O-N 3.32Å
91	N	90.8	Very high	85.8	Confident	63 Å²	63	81.2 Å²	81.2	34%	0.337	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	144.8	177.6	-55.9	-49	0	0	0	109.4	T79 Y80 A82	T79-N91 CarbonylContact C-O 3.36Å; T79-N91 VanDerWaalsContact CA-O 3.24Å; T79-N91 WeakPolarHBondContact CA-O 3.4Å; Y80-N91 HydrophobicContact CD1-CB 3.93Å; Y80-N91 HydrophobicContact CD2-CB 4.22Å; Y80-N91 HydrophobicContact CE1-CB 3.41Å; Y80-N91 VanDerWaalsContact CE1-CB 3.41Å; Y80-N91 HydrophobicContact CE2-CB 3.76Å; Y80-N91 HydrophobicContact CG-CB 4.31Å; Y80-N91 PolarHBondContact N-O 3.49Å; A82-N91 VanDerWaalsContact CB-ND2 3.31Å; A82-N91 WeakPolarHBondContact CB-ND2 3.47Å
92	E	94.6	Very high	86.2	Confident	88 Å²	88	81.9 Å²	81.9	41%	0.411	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.7	-178.2	-176.6	170.2	-175.8	0	0	109	P77 E78	P77-E92 HydrophobicContact CB-CG 4.49Å; P77-E92 WeakPolarHBondContact CB-OE1 3.45Å; E78-E92 WeakPolarHBondContact O-CA 3.34Å
93	C	97	Very high	87	Confident	0 Å²	0	82.7 Å²	82.7	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	121.5	167.3	176.1	0	0	0	0	108	C73 G74 P77 E78 Y80 L100	C73-C93 HydrophobicContact CB-CB 3.78Å; C73-C93 WeakPolarHBondContact CB-SG 3.41Å; C73-C93 PolarHBondContact O-SG 3.44Å; C73-C93 WeakPolarHBondContact SG-CB 3.45Å; C73-C93 CovalentContact SG-SG 2.03Å; C73-C93 PolarHBondContact SG-SG 2.96Å; G74-C93 WeakPolarHBondContact CA-O 3.4Å; G74-C93 PolarHBondContact N-SG 3.12Å; P77-C93 CarbonylContact C-O 3.28Å; P77-C93 VanDerWaalsContact CA-O 3.24Å; P77-C93 WeakPolarHBondContact CA-O 3.16Å; E78-C93 PolarHBondContact N-O 3.3Å; E78-C93 PolarHBondContact O-N 2.9Å; Y80-C93 HydrophobicContact CD1-CB 4.34Å; Y80-C93 HydrophobicContact CE1-CB 4.37Å; C93-L100 WeakPolarHBondContact CA-O 3.02Å
94	D	97.8	Very high	88.1	Confident	19 Å²	19	80.1 Å²	80.1	10%	0.102	42%	0.421	C	S	.	.			trans	-136.2	115.9	179.8	173.1	12	0	0	0	109	P77 S96 T97 L100 A101	P77-D94 HydrophobicContact CB-CB 4.07Å; P77-D94 HydrophobicContact CG-CB 4.11Å; D94-S96 VanDerWaalsContact CG-OG 3.24Å; D94-S96 PolarHBondContact O-N 2.65Å; D94-S96 WeakPolarHBondContact OD1-CB 3.27Å; D94-S96 PolarHBondContact OD1-N 3.36Å; D94-S96 PolarHBondContact OD1-OG 3.48Å; D94-S96 PolarHBondContact OD2-OG 3.25Å; D94-T97 PolarHBondContact O-N 3.16Å; D94-T97 VanDerWaalsContact O-O 3.11Å; D94-T97 WeakPolarHBondContact OD2-CB 3.49Å; D94-T97 PolarHBondContact OD2-OG1 3.32Å; D94-L100 HydrophobicContact CB-CB 4.13Å; D94-L100 HydrophobicContact CB-CD1 4.26Å; D94-L100 PolarHBondContact N-O 3.11Å; D94-L100 CarbonylContact O-C 3.55Å; D94-A101 WeakPolarHBondContact O-CA 3.45Å; D94-A101 PolarHBondContact O-N 2.78Å
95	A	97.3	Very high	89.4	Confident	59 Å²	59	76.9 Å²	76.9	49%	0.488	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.1	-177	0	0	0	0	0	112.8	G74	G74-A95 WeakPolarHBondContact O-CB 3.47Å; G74-A95 PolarHBondContact O-N 2.81Å
96	S	97.1	Very high	90.7	Very high	104 Å²	104	75.5 Å²	75.5	73%	0.727	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-19.4	178	74.6	0	0	0	0	113.5	D94	D94-S96 VanDerWaalsContact CG-OG 3.24Å; D94-S96 PolarHBondContact O-N 2.65Å; D94-S96 WeakPolarHBondContact OD1-CB 3.27Å; D94-S96 PolarHBondContact OD1-N 3.36Å; D94-S96 PolarHBondContact OD1-OG 3.48Å; D94-S96 PolarHBondContact OD2-OG 3.25Å
97	T	96.9	Very high	92.2	Very high	54 Å²	54	73 Å²	73	33%	0.331	38%	0.382	S	S	.	.	S	Bend	trans	-107.1	112.2	-179.9	-60.1	0	0	0	0	109.6	D94 E99 L100 A101	D94-T97 PolarHBondContact O-N 3.16Å; D94-T97 VanDerWaalsContact O-O 3.11Å; D94-T97 WeakPolarHBondContact OD2-CB 3.49Å; D94-T97 PolarHBondContact OD2-OG1 3.32Å; T97-E99 VanDerWaalsContact C-N 3.25Å; T97-E99 PolarHBondContact O-N 2.94Å; T97-E99 VanDerWaalsContact O-N 3.14Å; T97-L100 HydrophobicContact CG2-CB 4.3Å; T97-L100 HydrophobicContact CG2-CD1 4.03Å; T97-L100 HydrophobicContact CG2-CG 3.94Å; T97-L100 CarbonylContact O-C 3.46Å; T97-L100 PolarHBondContact O-N 2.83Å; T97-A101 WeakPolarHBondContact O-CB 3.39Å; T97-A101 PolarHBondContact O-N 2.91Å
98	E	93.4	Very high	93.5	Very high	185 Å²	185	65.5 Å²	65.5	86%	0.864	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-54.2	-37.5	-173.9	-173.6	172.2	-172.2	0	0	113.7	L100	E98-L100 VanDerWaalsContact C-N 3.28Å; E98-L100 PolarHBondContact O-N 3.26Å
99	E	91.9	Very high	94.4	Very high	184 Å²	184	62 Å²	62	86%	0.86	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-71.9	-18.5	179.5	-62.1	179.1	-176.2	0	0	114	T97	T97-E99 VanDerWaalsContact C-N 3.25Å; T97-E99 PolarHBondContact O-N 2.94Å; T97-E99 VanDerWaalsContact O-N 3.14Å
100	L	95.3	Very high	94.4	Very high	63 Å²	63	67 Å²	67	33%	0.33	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-112.5	-2.3	-178.7	-57	179.4	0	0	0	112.4	C93 D94 T97 E98 H102	C93-L100 WeakPolarHBondContact CA-O 3.02Å; D94-L100 HydrophobicContact CB-CB 4.13Å; D94-L100 HydrophobicContact CB-CD1 4.26Å; D94-L100 PolarHBondContact N-O 3.11Å; D94-L100 CarbonylContact O-C 3.55Å; T97-L100 HydrophobicContact CG2-CB 4.3Å; T97-L100 HydrophobicContact CG2-CD1 4.03Å; T97-L100 HydrophobicContact CG2-CG 3.94Å; T97-L100 CarbonylContact O-C 3.46Å; T97-L100 PolarHBondContact O-N 2.83Å; E98-L100 VanDerWaalsContact C-N 3.28Å; E98-L100 PolarHBondContact O-N 3.26Å; L100-H102 PolarHBondContact O-CD2 3.02Å
101	A	97.1	Very high	93.7	Very high	20 Å²	20	66.9 Å²	66.9	17%	0.165	36%	0.356	C	S	.	.			trans	-84	136	-178.5	0	0	0	0	0	110.6	D94 T97 P103	D94-A101 WeakPolarHBondContact O-CA 3.45Å; D94-A101 PolarHBondContact O-N 2.78Å; T97-A101 WeakPolarHBondContact O-CB 3.39Å; T97-A101 PolarHBondContact O-N 2.91Å; A101-P103 VanDerWaalsContact O-CD 3.24Å; A101-P103 WeakPolarHBondContact O-CD 3.43Å
102	H	97.3	Very high	92.6	Very high	19 Å²	19	67.5 Å²	67.5	9%	0.088	38%	0.377	C	S	.	.			trans	-120.5	61.8	-179.3	-67.3	-68.2	0	0	0	112.7	T72 L100 F118 W119 Q120	T72-H102 WeakPolarHBondContact CG2-O 3.25Å; L100-H102 PolarHBondContact O-CD2 3.02Å; H102-F118 WeakPolarHBondContact CB-O 3.35Å; H102-F118 AromaticContact CE1-CD2 3.92Å; H102-F118 AromaticContact CE1-CE1 3.88Å; H102-F118 AromaticContact CE1-CE2 3.23Å; H102-F118 WeakPolarHBondContact CE1-CE2 3.4Å; H102-F118 AromaticContact CE1-CZ 3.2Å; H102-F118 WeakPolarHBondContact CE1-CZ 3.49Å; H102-F118 AromaticContact CG-CE2 3.88Å; H102-F118 AromaticContact ND1-CD2 3.52Å; H102-F118 AromaticContact ND1-CE2 3.28Å; H102-F118 VanDerWaalsContact ND1-CE2 3.28Å; H102-F118 WeakPolarHBondContact ND1-CE2 3.23Å; H102-F118 AromaticContact ND1-CZ 3.7Å; H102-F118 PolarHBondContact ND1-O 2.99Å; H102-F118 AromaticContact NE2-CE2 3.76Å; H102-F118 AromaticContact NE2-CZ 3.84Å; H102-W119 WeakPolarHBondContact O-CA 3.34Å; H102-W119 VanDerWaalsContact O-CD1 3.31Å; H102-Q120 HydrophobicContact CB-CB 3.64Å; H102-Q120 PolarHBondContact O-N 2.8Å
103	P	97.6	Very high	91.4	Very high	46 Å²	46	68.9 Å²	68.9	30%	0.299	38%	0.378	S	S	.	.			trans	-76.7	159.3	-172.9	38.4	-41.9	0	0	0	112.1	A101 Q105 L106	A101-P103 VanDerWaalsContact O-CD 3.24Å; A101-P103 WeakPolarHBondContact O-CD 3.43Å; P103-Q105 VanDerWaalsContact CB-OE1 3.29Å; P103-Q105 PolarHBondContact O-N 3.36Å; P103-Q105 VanDerWaalsContact O-N 3.09Å; P103-L106 HydrophobicContact CG-CD1 4.4Å; P103-L106 HydrophobicContact CG-CG 4.12Å; P103-L106 WeakPolarHBondContact O-CB 3.22Å; P103-L106 PolarHBondContact O-N 3.02Å; P103-L106 VanDerWaalsContact O-N 3.13Å
104	P	97.5	Very high	90.3	Very high	24 Å²	24	76.4 Å²	76.4	16%	0.156	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-62.9	-19.8	-172.2	22.8	-33.7	0	0	0	115.3	V64 L66 L106 M107 W119	V64-P104 HydrophobicContact CG1-CB 4.17Å; L66-P104 HydrophobicContact CD1-CB 4.08Å; L66-P104 HydrophobicContact CD1-CG 4.21Å; L66-P104 HydrophobicContact CG-CB 4.5Å; P104-L106 PolarHBondContact O-N 2.76Å; P104-M107 HydrophobicContact CB-CE 3.78Å; P104-M107 WeakPolarHBondContact O-CE 3.43Å; P104-M107 PolarHBondContact O-N 3.41Å; P104-W119 HydrophobicContact CB-CG 4.49Å
105	Q	95.6	Very high	89.5	Confident	121 Å²	121	80.7 Å²	80.7	57%	0.565	45%	0.447	S	S	*	.	G	3₁₀ helix	trans	-63.4	-25.2	177.5	-64.1	78.2	4	0	0	111.9	P103 M107 F108	P103-Q105 VanDerWaalsContact CB-OE1 3.29Å; P103-Q105 PolarHBondContact O-N 3.36Å; P103-Q105 VanDerWaalsContact O-N 3.09Å; Q105-M107 PolarHBondContact O-N 3.01Å; Q105-F108 PolarHBondContact O-N 2.96Å
106	L	96.3	Very high	88.9	Confident	31 Å²	31	81.3 Å²	81.3	16%	0.162	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-69.3	-8.9	177.8	-60.2	-172.6	0	0	0	113.5	P103 P104 F108 T117 F118 S291	P103-L106 HydrophobicContact CG-CD1 4.4Å; P103-L106 HydrophobicContact CG-CG 4.12Å; P103-L106 WeakPolarHBondContact O-CB 3.22Å; P103-L106 PolarHBondContact O-N 3.02Å; P103-L106 VanDerWaalsContact O-N 3.13Å; P104-L106 PolarHBondContact O-N 2.76Å; L106-F108 PolarHBondContact O-N 3.24Å; L106-T117 HydrophobicContact CD1-CG2 4.42Å; L106-T117 HydrophobicContact CD2-CG2 4.23Å; L106-F118 WeakPolarHBondContact CD1-O 3.34Å; L106-S291 VanDerWaalsContact O-O 3.11Å
107	M	96.8	Very high	88.7	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-76.8	-8.5	172	-64.4	-174.9	-74.4	0	0	113.6	V64 P104 Q105 W119 I135 I290 D292 I293	V64-M107 HydrophobicContact CG2-CE 3.91Å; P104-M107 HydrophobicContact CB-CE 3.78Å; P104-M107 WeakPolarHBondContact O-CE 3.43Å; P104-M107 PolarHBondContact O-N 3.41Å; Q105-M107 PolarHBondContact O-N 3.01Å; M107-W119 HydrophobicContact CE-CB 4.34Å; M107-W119 HydrophobicContact CE-CD2 4.44Å; M107-W119 HydrophobicContact CE-CG 4.24Å; M107-W119 HydrophobicContact CG-CB 3.5Å; M107-W119 VanDerWaalsContact CG-CB 3.5Å; M107-W119 HydrophobicContact CG-CG 4.3Å; M107-W119 HydrophobicContact SD-CB 4.01Å; M107-W119 HydrophobicContact SD-CD2 4.16Å; M107-W119 HydrophobicContact SD-CE3 3.97Å; M107-W119 HydrophobicContact SD-CG 4.2Å; M107-I135 HydrophobicContact CE-CG2 3.99Å; M107-I135 HydrophobicContact SD-CD1 4.12Å; M107-I135 HydrophobicContact SD-CG2 4.45Å; M107-I290 HydrophobicContact CB-CG2 4.4Å; M107-I290 HydrophobicContact CG-CB 3.97Å; M107-I290 HydrophobicContact CG-CG2 3.87Å; M107-I290 HydrophobicContact SD-CB 3.91Å; M107-I290 HydrophobicContact SD-CD1 4.05Å; M107-I290 HydrophobicContact SD-CG2 3.97Å; M107-D292 CarbonylContact O-C 3.58Å; M107-D292 WeakPolarHBondContact O-CA 3.2Å; M107-I293 HydrophobicContact CB-CD1 4.09Å; M107-I293 HydrophobicContact CB-CG1 4.26Å; M107-I293 HydrophobicContact CG-CD1 4.43Å; M107-I293 PolarHBondContact O-N 3.23Å; M107-I293 HydrophobicContact SD-CD1 3.77Å
108	F	95.2	Very high	88.7	Confident	40 Å²	40	76.5 Å²	76.5	18%	0.175	41%	0.409	C	S	.	.	S	Bend	trans	-135.9	16.8	-172.5	-41.6	-73.2	0	0	0	112.2	T59 L62 V64 Q105 L106 L137 I293	T59-F108 HydrophobicContact CG2-CD1 4.26Å; L62-F108 HydrophobicContact CD1-CD2 4.38Å; L62-F108 HydrophobicContact CD1-CE1 4.12Å; L62-F108 HydrophobicContact CD1-CE2 3.95Å; L62-F108 HydrophobicContact CD1-CZ 3.81Å; L62-F108 HydrophobicContact CD2-CD1 4.01Å; L62-F108 HydrophobicContact CD2-CE1 3.69Å; L62-F108 HydrophobicContact CD2-CZ 4.2Å; L62-F108 HydrophobicContact CG-CE1 4.48Å; V64-F108 HydrophobicContact CB-CE2 3.78Å; V64-F108 HydrophobicContact CB-CZ 4.1Å; V64-F108 HydrophobicContact CG1-CE2 3.97Å; V64-F108 HydrophobicContact CG2-CE2 4.05Å; V64-F108 HydrophobicContact CG2-CZ 4.12Å; Q105-F108 PolarHBondContact O-N 2.96Å; L106-F108 PolarHBondContact O-N 3.24Å; F108-L137 HydrophobicContact CE1-CD2 3.94Å; F108-L137 HydrophobicContact CZ-CD2 3.52Å; F108-I293 HydrophobicContact CD1-CB 4.24Å; F108-I293 HydrophobicContact CE1-CB 3.88Å; F108-I293 HydrophobicContact CE1-CD1 3.96Å; F108-I293 HydrophobicContact CE1-CG1 4.37Å; F108-I293 HydrophobicContact CE1-CG2 4.33Å; F108-I293 HydrophobicContact CZ-CD1 4.2Å
109	D	90.7	Very high	88.9	Confident	31 Å²	31	67.7 Å²	67.7	17%	0.166	37%	0.368	C	S	.	.	S	Bend	trans	-83	-176	177.9	75.6	-11	0	0	0	111.4	E111 R113 T117	D109-E111 PolarHBondContact O-N 3.36Å; D109-R113 IonicContact OD2-CZ 3.72Å; D109-R113 VanDerWaalsContact OD2-CZ 3.29Å; D109-R113 IonicContact OD2-NH1 2.84Å; D109-R113 PolarHBondContact OD2-NH1 3.34Å; D109-R113 IonicContact OD2-NH2 2.69Å; D109-T117 VanDerWaalsContact CG-OG1 3.31Å; D109-T117 PolarHBondContact OD1-OG1 3.11Å; D109-T117 VanDerWaalsContact OD1-OG1 3.1Å; D109-T117 WeakPolarHBondContact OD2-CB 3.21Å; D109-T117 PolarHBondContact OD2-OG1 3.31Å
110	I	81.8	Confident	89.2	Confident	131 Å²	131	58.9 Å²	58.9	67%	0.672	33%	0.327	S	S	*	.			trans	-72.9	117.5	-174.6	-57.7	170.7	0	0	0	109.1
111	E	70.5	Confident	89.3	Confident	122 Å²	122	55.9 Å²	55.9	57%	0.57	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	150.6	175.8	-170	-175.6	-155.8	0	0	112.5	D109 K294	D109-E111 PolarHBondContact O-N 3.36Å; E111-K294 IonicContact OE1-NZ 3.47Å; E111-K294 PolarHBondContact OE1-NZ 2.53Å; E111-K294 WeakPolarHBondContact OE2-CE 3.42Å; E111-K294 IonicContact OE2-NZ 3.66Å; E111-K294 PolarHBondContact OE2-NZ 3.35Å
112	G	66.1	Low	89.4	Confident	76 Å²	76	56.8 Å²	56.8	78%	0.784	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.6	11.3	172.3	0	0	0	0	0	114.6
113	R	70.2	Confident	89.3	Confident	117 Å²	117	56.1 Å²	56.1	44%	0.442	31%	0.312	S	S	.	.			trans	-62.9	143.2	165.3	-72.9	-170.7	-169.7	151.9	11.8	110.8	D109 P115 T116	D109-R113 IonicContact OD2-CZ 3.72Å; D109-R113 VanDerWaalsContact OD2-CZ 3.29Å; D109-R113 IonicContact OD2-NH1 2.84Å; D109-R113 PolarHBondContact OD2-NH1 3.34Å; D109-R113 IonicContact OD2-NH2 2.69Å; R113-P115 CarbonylContact C-O 3.52Å; R113-P115 VanDerWaalsContact C-O 3.28Å; R113-P115 CarbonylContact O-C 3.49Å; R113-T116 PolarHBondContact O-N 3.45Å
114	N	73.5	Confident	89.2	Confident	159 Å²	159	54.4 Å²	54.4	85%	0.85	30%	0.3	S	S	*	.	S	Bend	trans	-127.9	110.5	172.5	-170.9	13.7	0	0	0	108.4
115	P	80.8	Confident	89	Confident	108 Å²	108	58.7 Å²	58.7	70%	0.701	32%	0.316	S	S	*	.	S	Bend	cis	-70.2	157.2	5.2	30.4	-35.3	0	0	0	113.5	R113	R113-P115 CarbonylContact C-O 3.52Å; R113-P115 VanDerWaalsContact C-O 3.28Å; R113-P115 CarbonylContact O-C 3.49Å
116	T	86.4	Confident	89	Confident	73 Å²	73	60.3 Å²	60.3	45%	0.448	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-67.2	130.5	176.2	-55.9	0	0	0	0	110.2	R113 F118	R113-T116 PolarHBondContact O-N 3.45Å; T116-F118 WeakPolarHBondContact O-CD1 3.16Å
117	T	92.9	Very high	88.9	Confident	32 Å²	32	62 Å²	62	20%	0.196	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-86.2	147.9	172.8	37.2	0	0	0	0	110.2	L106 D109 S291	L106-T117 HydrophobicContact CD1-CG2 4.42Å; L106-T117 HydrophobicContact CD2-CG2 4.23Å; D109-T117 VanDerWaalsContact CG-OG1 3.31Å; D109-T117 PolarHBondContact OD1-OG1 3.11Å; D109-T117 VanDerWaalsContact OD1-OG1 3.1Å; D109-T117 WeakPolarHBondContact OD2-CB 3.21Å; D109-T117 PolarHBondContact OD2-OG1 3.31Å; T117-S291 WeakPolarHBondContact O-CA 3.49Å; T117-S291 WeakPolarHBondContact O-CB 3.19Å
118	F	95.4	Very high	88.8	Confident	24 Å²	24	67.2 Å²	67.2	11%	0.105	36%	0.36	C	S	.	.			trans	-160.1	148.2	-179.7	52.7	-88.2	0	0	0	111.5	H102 L106 T116 Q120 E154 A289 I290	H102-F118 WeakPolarHBondContact CB-O 3.35Å; H102-F118 AromaticContact CE1-CD2 3.92Å; H102-F118 AromaticContact CE1-CE1 3.88Å; H102-F118 AromaticContact CE1-CE2 3.23Å; H102-F118 WeakPolarHBondContact CE1-CE2 3.4Å; H102-F118 AromaticContact CE1-CZ 3.2Å; H102-F118 WeakPolarHBondContact CE1-CZ 3.49Å; H102-F118 AromaticContact CG-CE2 3.88Å; H102-F118 AromaticContact ND1-CD2 3.52Å; H102-F118 AromaticContact ND1-CE2 3.28Å; H102-F118 VanDerWaalsContact ND1-CE2 3.28Å; H102-F118 WeakPolarHBondContact ND1-CE2 3.23Å; H102-F118 AromaticContact ND1-CZ 3.7Å; H102-F118 PolarHBondContact ND1-O 2.99Å; H102-F118 AromaticContact NE2-CE2 3.76Å; H102-F118 AromaticContact NE2-CZ 3.84Å; L106-F118 WeakPolarHBondContact CD1-O 3.34Å; T116-F118 WeakPolarHBondContact O-CD1 3.16Å; F118-Q120 HydrophobicContact CD2-CB 4.19Å; F118-Q120 HydrophobicContact CE2-CB 4.24Å; F118-E154 HydrophobicContact CB-CB 3.9Å; F118-E154 HydrophobicContact CB-CG 4.45Å; F118-E154 HydrophobicContact CD1-CB 4.01Å; F118-E154 HydrophobicContact CD1-CG 3.61Å; F118-E154 HydrophobicContact CD2-CB 4.33Å; F118-E154 HydrophobicContact CD2-CG 4.36Å; F118-E154 HydrophobicContact CE1-CG 3.84Å; F118-E154 HydrophobicContact CG-CB 3.82Å; F118-E154 HydrophobicContact CG-CG 3.89Å; F118-E154 HydrophobicContact CZ-CG 4.3Å; F118-A289 HydrophobicContact CD2-CB 3.78Å; F118-A289 HydrophobicContact CE2-CB 4.31Å; F118-A289 HydrophobicContact CG-CB 4.49Å; F118-I290 CarbonylContact C-O 3.53Å; F118-I290 VanDerWaalsContact CA-O 3.28Å; F118-I290 WeakPolarHBondContact CA-O 3.46Å; F118-I290 WeakPolarHBondContact CB-O 3.43Å
119	W	98	Very high	88.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	147.1	162.2	166.6	75	0	0	0	109.9	L66 I71 T72 H102 P104 M107 V133 I135 L268 A289 I290	L66-W119 HydrophobicContact CD1-CZ2 4.29Å; L66-W119 HydrophobicContact CD2-CZ2 4.36Å; I71-W119 HydrophobicContact CG2-CZ2 4.24Å; T72-W119 PolarHBondContact OG1-NE1 3.06Å; T72-W119 VanDerWaalsContact OG1-NE1 3.13Å; H102-W119 WeakPolarHBondContact O-CA 3.34Å; H102-W119 VanDerWaalsContact O-CD1 3.31Å; P104-W119 HydrophobicContact CB-CG 4.49Å; M107-W119 HydrophobicContact CE-CB 4.34Å; M107-W119 HydrophobicContact CE-CD2 4.44Å; M107-W119 HydrophobicContact CE-CG 4.24Å; M107-W119 HydrophobicContact CG-CB 3.5Å; M107-W119 VanDerWaalsContact CG-CB 3.5Å; M107-W119 HydrophobicContact CG-CG 4.3Å; M107-W119 HydrophobicContact SD-CB 4.01Å; M107-W119 HydrophobicContact SD-CD2 4.16Å; M107-W119 HydrophobicContact SD-CE3 3.97Å; M107-W119 HydrophobicContact SD-CG 4.2Å; W119-V133 HydrophobicContact CH2-CG1 3.94Å; W119-V133 HydrophobicContact CZ2-CG1 4.26Å; W119-I135 HydrophobicContact CE3-CD1 4.26Å; W119-I135 HydrophobicContact CH2-CD1 4.1Å; W119-I135 HydrophobicContact CZ3-CD1 3.79Å; W119-L268 HydrophobicContact CZ3-CD1 4.43Å; W119-A289 CarbonylContact O-C 3.37Å; W119-A289 WeakPolarHBondContact O-CA 3.38Å; W119-A289 WeakPolarHBondContact O-CB 3.4Å; W119-I290 HydrophobicContact CE3-CB 4.16Å; W119-I290 HydrophobicContact CE3-CD1 4.14Å; W119-I290 HydrophobicContact CE3-CG1 4.1Å; W119-I290 HydrophobicContact CZ3-CD1 4.03Å; W119-I290 HydrophobicContact CZ3-CG1 4.2Å; W119-I290 PolarHBondContact N-O 3.36Å; W119-I290 PolarHBondContact O-N 3.11Å
120	Q	98.1	Very high	89.1	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	134.8	178.1	178.2	172.6	-53.6	0	0	112	T72 C73 H102 F118 F287 Y288 A289	T72-Q120 WeakPolarHBondContact CA-O 3.43Å; C73-Q120 HydrophobicContact CB-CG 4.48Å; C73-Q120 PolarHBondContact N-O 2.57Å; C73-Q120 VanDerWaalsContact N-O 3.07Å; H102-Q120 HydrophobicContact CB-CB 3.64Å; H102-Q120 PolarHBondContact O-N 2.8Å; F118-Q120 HydrophobicContact CD2-CB 4.19Å; F118-Q120 HydrophobicContact CE2-CB 4.24Å; Q120-F287 HydrophobicContact CG-CD2 3.78Å; Q120-F287 HydrophobicContact CG-CE2 4.19Å; Q120-Y288 CarbonylContact C-O 3.59Å; Q120-Y288 WeakPolarHBondContact CA-O 3.3Å; Q120-A289 HydrophobicContact CB-CB 4.3Å; Q120-A289 HydrophobicContact CG-CB 4.46Å
121	S	98.4	Very high	89.8	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-79.3	166.2	172.2	79.9	0	0	0	0	112.1	I71 Y288	I71-S121 CarbonylContact O-C 3.43Å; I71-S121 WeakPolarHBondContact O-CA 3.34Å; S121-Y288 PolarHBondContact N-O 3.2Å; S121-Y288 PolarHBondContact OG-N 3.37Å; S121-Y288 PolarHBondContact OG-O 2.8Å
122	T	97.4	Very high	91.2	Very high	38 Å²	38	66.6 Å²	66.6	23%	0.233	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-59.4	149.3	167.7	60	0	0	0	0	111.4	I71 E78	I71-T122 PolarHBondContact O-N 3.47Å; E78-T122 WeakPolarHBondContact OE1-CA 3.36Å
123	T	95.9	Very high	92.7	Very high	5 Å²	5	63 Å²	63	3%	0.031	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-62.1	158.1	170.4	58.6	0	0	0	0	112.8	E78 K125 Y286	E78-T123 PolarHBondContact OE1-N 2.8Å; E78-T123 PolarHBondContact OE2-OG1 3.11Å; T123-K125 PolarHBondContact O-N 3.43Å; T123-K125 WeakPolarHBondContact OG1-CD 3.47Å; T123-K125 WeakPolarHBondContact OG1-CE 3.44Å; T123-K125 WeakPolarHBondContact OG1-CG 3.37Å; T123-Y286 CarbonylContact C-O 3.26Å; T123-Y286 WeakPolarHBondContact CA-O 3.19Å
124	W	96.1	Very high	94.1	Very high	11 Å²	11	58.8 Å²	58.8	4%	0.042	31%	0.312	C	S	.	.	S	Bend	trans	-76.7	37.9	-175.7	-158.1	-1.4	0	0	0	114.3	K126 Y127 K129 L131 R270 P271 T273 V278 Y286	W124-K126 PolarHBondContact O-N 3.4Å; W124-Y127 HydrophobicContact CD2-CD2 4.09Å; W124-Y127 AromaticContact CE2-CD2 3.77Å; W124-Y127 HydrophobicContact CE3-CD2 4.34Å; W124-Y127 HydrophobicContact CH2-CD2 4.08Å; W124-Y127 HydrophobicContact CH2-CE2 4.16Å; W124-Y127 AromaticContact CZ2-CD2 3.77Å; W124-Y127 HydrophobicContact CZ2-CD2 3.77Å; W124-Y127 HydrophobicContact CZ2-CE2 4.17Å; W124-Y127 HydrophobicContact CZ3-CD2 4.34Å; W124-Y127 WeakPolarHBondContact O-CB 3.35Å; W124-Y127 PolarHBondContact O-N 3.03Å; W124-K129 PolarHBondContact NE1-O 3.18Å; W124-L131 HydrophobicContact CB-CD2 4.25Å; W124-L131 HydrophobicContact CD2-CB 4.21Å; W124-L131 HydrophobicContact CG-CB 3.94Å; W124-L131 HydrophobicContact CG-CD2 4.45Å; W124-R270 HydrophobicContact CH2-CG 4.3Å; W124-P271 HydrophobicContact CD2-CG 4.11Å; W124-P271 HydrophobicContact CE3-CG 3.45Å; W124-P271 VanDerWaalsContact CE3-CG 3.45Å; W124-P271 HydrophobicContact CZ3-CG 3.68Å; W124-T273 HydrophobicContact CZ3-CG2 3.74Å; W124-V278 HydrophobicContact CZ3-CG2 4.12Å; W124-Y286 WeakPolarHBondContact CB-O 3.32Å; W124-Y286 HydrophobicContact CE3-CG 4.23Å; W124-Y286 PolarHBondContact N-O 2.98Å
125	K	93.4	Very high	95.3	Very high	114 Å²	114	51.2 Å²	51.2	50%	0.496	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-22.6	-178.9	-76	164.9	177.2	165.7	0	115.2	E78 T123 Y127	E78-K125 WeakPolarHBondContact OE2-CE 3.33Å; E78-K125 IonicContact OE2-NZ 3.29Å; E78-K125 PolarHBondContact OE2-NZ 3.3Å; T123-K125 PolarHBondContact O-N 3.43Å; T123-K125 WeakPolarHBondContact OG1-CD 3.47Å; T123-K125 WeakPolarHBondContact OG1-CE 3.44Å; T123-K125 WeakPolarHBondContact OG1-CG 3.37Å; K125-Y127 VanDerWaalsContact C-N 3.32Å
126	K	94.4	Very high	96.1	Very high	155 Å²	155	47 Å²	47	67%	0.674	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.6	8.9	-178.7	-64.8	175.9	-177.5	163.6	0	113.3	W124 K129	W124-K126 PolarHBondContact O-N 3.4Å; K126-K129 HydrophobicContact CB-CB 4.45Å; K126-K129 WeakPolarHBondContact O-CB 3.34Å; K126-K129 PolarHBondContact O-N 3.12Å
127	Y	95	Very high	96.7	Very high	66 Å²	66	43.6 Å²	43.6	26%	0.259	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	136.5	173.7	-173.6	-91	0	0	0	110.9	W124 K125 V278 E280 L283	W124-Y127 HydrophobicContact CD2-CD2 4.09Å; W124-Y127 AromaticContact CE2-CD2 3.77Å; W124-Y127 HydrophobicContact CE3-CD2 4.34Å; W124-Y127 HydrophobicContact CH2-CD2 4.08Å; W124-Y127 HydrophobicContact CH2-CE2 4.16Å; W124-Y127 AromaticContact CZ2-CD2 3.77Å; W124-Y127 HydrophobicContact CZ2-CD2 3.77Å; W124-Y127 HydrophobicContact CZ2-CE2 4.17Å; W124-Y127 HydrophobicContact CZ3-CD2 4.34Å; W124-Y127 WeakPolarHBondContact O-CB 3.35Å; W124-Y127 PolarHBondContact O-N 3.03Å; K125-Y127 VanDerWaalsContact C-N 3.32Å; Y127-V278 HydrophobicContact CD2-CG1 3.92Å; Y127-V278 HydrophobicContact CE1-CG1 4.45Å; Y127-V278 HydrophobicContact CE2-CB 3.96Å; Y127-V278 HydrophobicContact CE2-CG1 3.77Å; Y127-V278 HydrophobicContact CE2-CG2 3.91Å; Y127-V278 HydrophobicContact CG-CG1 4.34Å; Y127-E280 HydrophobicContact CD1-CG 3.99Å; Y127-E280 HydrophobicContact CE1-CG 3.75Å; Y127-L283 HydrophobicContact CD1-CD2 4.48Å; Y127-L283 HydrophobicContact CG-CD2 4.01Å
128	P	95.1	Very high	97	Very high	109 Å²	109	43.6 Å²	43.6	71%	0.708	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	cis	-86.1	6.1	10.3	34.7	-37.1	0	0	0	115.6	A130	P128-A130 PolarHBondContact O-N 3.16Å
129	K	96.4	Very high	97.1	Very high	154 Å²	154	42.7 Å²	42.7	67%	0.67	22%	0.22	S	C	*	.	S	Bend	trans	-66	125.9	175.5	-175	179.9	178.3	176.7	0	109.6	W124 K126	W124-K129 PolarHBondContact NE1-O 3.18Å; K126-K129 HydrophobicContact CB-CB 4.45Å; K126-K129 WeakPolarHBondContact O-CB 3.34Å; K126-K129 PolarHBondContact O-N 3.12Å
130	A	95.4	Very high	96.9	Very high	52 Å²	52	47.1 Å²	47.1	43%	0.43	24%	0.244	S	C	.	.			trans	-54	137.3	-177.9	0	0	0	0	0	113.4	P128 L132	P128-A130 PolarHBondContact O-N 3.16Å; A130-L132 HydrophobicContact CB-CD2 3.89Å; A130-L132 HydrophobicContact CB-CG 3.98Å; A130-L132 PolarHBondContact O-N 2.94Å
131	L	97.4	Very high	96.8	Very high	13 Å²	13	47.2 Å²	47.2	7%	0.068	24%	0.244	C	C	.	.			trans	-84.5	84.7	171.7	-173.9	66.7	0	0	0	108.9	I71 W124 P271 Y288	I71-L131 HydrophobicContact CD1-CD1 4.03Å; W124-L131 HydrophobicContact CB-CD2 4.25Å; W124-L131 HydrophobicContact CD2-CB 4.21Å; W124-L131 HydrophobicContact CG-CB 3.94Å; W124-L131 HydrophobicContact CG-CD2 4.45Å; L131-P271 HydrophobicContact CD2-CG 4.36Å; L131-Y288 HydrophobicContact CB-CE2 4.43Å; L131-Y288 HydrophobicContact CD2-CD2 4Å; L131-Y288 HydrophobicContact CD2-CE2 3.8Å; L131-Y288 HydrophobicContact CG-CD2 4.35Å; L131-Y288 HydrophobicContact CG-CE2 3.84Å; L131-Y288 WeakPolarHBondContact O-CE2 3.42Å; L131-Y288 PolarHBondContact O-OH 3.41Å
132	L	98.2	Very high	96.8	Very high	92 Å²	92	47.7 Å²	47.7	48%	0.482	25%	0.247	S	C	.	.			trans	-91.5	129	179	-55.8	-179.8	0	0	0	110.1	A130 L268 L269	A130-L132 HydrophobicContact CB-CD2 3.89Å; A130-L132 HydrophobicContact CB-CG 3.98Å; A130-L132 PolarHBondContact O-N 2.94Å; L132-L268 WeakPolarHBondContact CA-O 3.41Å; L132-L269 HydrophobicContact CD2-CB 4.32Å; L132-L269 HydrophobicContact CD2-CD2 4.04Å; L132-L269 WeakPolarHBondContact CD2-O 3.32Å
133	V	98.7	Very high	96.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	128.5	176.3	-169.6	0	0	0	0	110.1	I71 W119 I135 L268 Y288	I71-V133 HydrophobicContact CD1-CG2 3.96Å; I71-V133 HydrophobicContact CG1-CB 4.26Å; I71-V133 HydrophobicContact CG1-CG1 3.91Å; I71-V133 HydrophobicContact CG1-CG2 3.5Å; I71-V133 VanDerWaalsContact CG1-CG2 3.5Å; I71-V133 HydrophobicContact CG2-CG1 3.95Å; W119-V133 HydrophobicContact CH2-CG1 3.94Å; W119-V133 HydrophobicContact CZ2-CG1 4.26Å; V133-I135 HydrophobicContact CG1-CG1 4.27Å; V133-L268 HydrophobicContact CB-CB 4.16Å; V133-L268 HydrophobicContact CB-CD1 4.16Å; V133-L268 PolarHBondContact N-O 2.8Å; V133-L268 WeakPolarHBondContact O-CB 3.28Å; V133-L268 PolarHBondContact O-N 3.48Å; V133-Y288 HydrophobicContact CB-CD2 4.49Å; V133-Y288 HydrophobicContact CG2-CD2 3.72Å; V133-Y288 HydrophobicContact CG2-CE2 3.76Å
134	N	98.7	Very high	96.9	Very high	30 Å²	30	46.6 Å²	46.6	16%	0.16	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.6	173	-62.7	-33.2	0	0	0	108.9	L66 D67 R265 I266 R267	L66-N134 WeakPolarHBondContact CA-O 3.43Å; D67-N134 HydrophobicContact CB-CB 4.05Å; D67-N134 PolarHBondContact N-O 3.47Å; D67-N134 PolarHBondContact O-N 2.9Å; D67-N134 PolarHBondContact OD2-ND2 3.19Å; N134-R265 HydrophobicContact CB-CG 4.49Å; N134-I266 WeakPolarHBondContact CA-O 3.33Å; N134-R267 WeakPolarHBondContact OD1-CG 3.05Å
135	I	98.8	Very high	96.9	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	110.9	173.8	-50.4	176.9	0	0	0	107.1	V64 L66 M107 W119 V133 L137 R265 I266 L268 I290	V64-I135 HydrophobicContact CG2-CG2 3.96Å; L66-I135 HydrophobicContact CD2-CB 4.2Å; L66-I135 HydrophobicContact CD2-CG1 3.76Å; L66-I135 HydrophobicContact CD2-CG2 4.01Å; M107-I135 HydrophobicContact CE-CG2 3.99Å; M107-I135 HydrophobicContact SD-CD1 4.12Å; M107-I135 HydrophobicContact SD-CG2 4.45Å; W119-I135 HydrophobicContact CE3-CD1 4.26Å; W119-I135 HydrophobicContact CH2-CD1 4.1Å; W119-I135 HydrophobicContact CZ3-CD1 3.79Å; V133-I135 HydrophobicContact CG1-CG1 4.27Å; I135-L137 HydrophobicContact CG2-CD2 4.08Å; I135-R265 CarbonylContact O-C 3.58Å; I135-R265 WeakPolarHBondContact O-CA 3.17Å; I135-I266 HydrophobicContact CB-CB 4.26Å; I135-I266 PolarHBondContact N-O 3.17Å; I135-I266 PolarHBondContact O-N 2.88Å; I135-L268 HydrophobicContact CD1-CD1 3.99Å; I135-I290 HydrophobicContact CD1-CD1 3.41Å; I135-I290 VanDerWaalsContact CD1-CD1 3.41Å
136	T	98.8	Very high	97	Very high	19 Å²	19	42.3 Å²	42.3	12%	0.117	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	124.6	-177.9	-57.3	0	0	0	0	109.8	V64 T65 W173 L264	V64-T136 CarbonylContact C-O 3.59Å; V64-T136 WeakPolarHBondContact CA-O 3.05Å; T65-T136 PolarHBondContact N-O 3.23Å; T65-T136 PolarHBondContact O-N 2.93Å; T65-T136 WeakPolarHBondContact OG1-CB 3.32Å; T136-W173 HydrophobicContact CG2-CH2 3.75Å; T136-W173 HydrophobicContact CG2-CZ2 3.95Å; T136-L264 CarbonylContact C-O 3.41Å; T136-L264 WeakPolarHBondContact CA-O 3.09Å
137	L	98.6	Very high	97.1	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	113	178.9	-49.1	-178.9	0	0	0	108.1	L62 V64 F108 I135 W139 D263 L264 I293	L62-L137 HydrophobicContact CD1-CD2 4.2Å; L62-L137 HydrophobicContact CD2-CB 4.22Å; L62-L137 HydrophobicContact CD2-CD1 4.38Å; L62-L137 HydrophobicContact CD2-CD2 4.23Å; V64-L137 HydrophobicContact CB-CD2 4.4Å; V64-L137 HydrophobicContact CG2-CD2 4.07Å; F108-L137 HydrophobicContact CE1-CD2 3.94Å; F108-L137 HydrophobicContact CZ-CD2 3.52Å; I135-L137 HydrophobicContact CG2-CD2 4.08Å; L137-W139 HydrophobicContact CB-CH2 3.71Å; L137-W139 HydrophobicContact CB-CZ2 4.32Å; L137-W139 HydrophobicContact CB-CZ3 3.98Å; L137-W139 HydrophobicContact CD1-CH2 4.31Å; L137-W139 VanDerWaalsContact O-CZ3 3.24Å; L137-W139 WeakPolarHBondContact O-CZ3 3.43Å; L137-D263 CarbonylContact O-C 3.56Å; L137-D263 WeakPolarHBondContact O-CA 3.39Å; L137-D263 WeakPolarHBondContact O-CB 3.49Å; L137-L264 HydrophobicContact CB-CB 4.31Å; L137-L264 HydrophobicContact CD1-CB 4.41Å; L137-L264 PolarHBondContact N-O 2.92Å; L137-L264 PolarHBondContact O-N 2.91Å; L137-I293 HydrophobicContact CD1-CG2 4.02Å
138	S	98.1	Very high	97.2	Very high	32 Å²	32	35.3 Å²	35.3	22%	0.224	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.5	-173.7	-71.5	0	0	0	0	111.5	L62 K63 D263	L62-S138 WeakPolarHBondContact CA-O 3.47Å; K63-S138 PolarHBondContact N-O 2.88Å; K63-S138 PolarHBondContact O-N 2.73Å; S138-D263 WeakPolarHBondContact CA-OD1 3.33Å; S138-D263 WeakPolarHBondContact CB-OD1 3.43Å; S138-D263 PolarHBondContact OG-OD1 3.17Å
139	W	97.3	Very high	97.4	Very high	5 Å²	5	30.3 Å²	30.3	2%	0.019	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	-12.7	-179.6	-70.9	-87.5	0	0	0	114.4	M58 L62 L137 K141 I143 I261 T262 L264 V295	M58-W139 PolarHBondContact O-NE1 3.16Å; L62-W139 HydrophobicContact CB-CD2 4.34Å; L62-W139 HydrophobicContact CB-CG 4.38Å; L62-W139 HydrophobicContact CB-CZ2 4.31Å; L62-W139 HydrophobicContact CD2-CZ2 4.01Å; L137-W139 HydrophobicContact CB-CH2 3.71Å; L137-W139 HydrophobicContact CB-CZ2 4.32Å; L137-W139 HydrophobicContact CB-CZ3 3.98Å; L137-W139 HydrophobicContact CD1-CH2 4.31Å; L137-W139 VanDerWaalsContact O-CZ3 3.24Å; L137-W139 WeakPolarHBondContact O-CZ3 3.43Å; W139-K141 PolarHBondContact O-N 3.3Å; W139-I143 HydrophobicContact CB-CD1 3.44Å; W139-I143 VanDerWaalsContact CB-CD1 3.44Å; W139-I143 HydrophobicContact CB-CG1 4.5Å; W139-I143 HydrophobicContact CD2-CD1 3.66Å; W139-I143 HydrophobicContact CE3-CD1 4.45Å; W139-I143 HydrophobicContact CG-CD1 3.14Å; W139-I261 HydrophobicContact CE3-CD1 4.25Å; W139-I261 HydrophobicContact CH2-CD1 3.98Å; W139-I261 HydrophobicContact CZ3-CD1 3.7Å; W139-T262 PolarHBondContact N-O 2.81Å; W139-L264 HydrophobicContact CH2-CB 4.2Å; W139-L264 HydrophobicContact CH2-CD1 3.85Å; W139-L264 HydrophobicContact CH2-CG 3.92Å; W139-L264 HydrophobicContact CZ3-CB 4.11Å; W139-L264 HydrophobicContact CZ3-CD1 4.34Å; W139-L264 HydrophobicContact CZ3-CG 3.91Å; W139-V295 HydrophobicContact CH2-CG1 4.23Å; W139-V295 HydrophobicContact CH2-CG2 4.4Å; W139-V295 HydrophobicContact CZ2-CB 4.17Å; W139-V295 HydrophobicContact CZ2-CG1 3.88Å; W139-V295 HydrophobicContact CZ2-CG2 4.21Å
140	N	94.9	Very high	97.5	Very high	94 Å²	94	23.8 Å²	23.8	50%	0.503	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	50.6	26.6	-173.4	-165.6	23.2	0	0	0	113.2
141	K	96.5	Very high	97.6	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	144.4	-177.2	176.8	60	177.7	83.5	0	108	W139 K300 L315 P326 D327	W139-K141 PolarHBondContact O-N 3.3Å; K141-K300 PolarHBondContact NZ-O 3.02Å; K141-L315 HydrophobicContact CB-CB 4.05Å; K141-L315 WeakPolarHBondContact CD-O 3.28Å; K141-L315 HydrophobicContact CG-CB 4.06Å; K141-L315 HydrophobicContact CG-CD2 4.3Å; K141-L315 HydrophobicContact CG-CG 4.28Å; K141-P326 VanDerWaalsContact CE-O 3.24Å; K141-P326 WeakPolarHBondContact CE-O 3.04Å; K141-D327 VanDerWaalsContact CE-OD1 3.32Å; K141-D327 WeakPolarHBondContact CE-OD1 3.4Å; K141-D327 IonicContact NZ-OD1 3.86Å; K141-D327 PolarHBondContact NZ-OD1 3.18Å
142	T	97.9	Very high	97.4	Very high	11 Å²	11	22.2 Å²	22.2	7%	0.067	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.1	175.3	-40.7	0	0	0	0	110.2	Y169 T260 T262 K300 D327	T142-Y169 PolarHBondContact OG1-OH 3.27Å; T142-T260 HydrophobicContact CG2-CG2 3.26Å; T142-T262 HydrophobicContact CG2-CG2 4.41Å; T142-K300 HydrophobicContact CG2-CB 3.91Å; T142-K300 HydrophobicContact CG2-CD 3.5Å; T142-K300 VanDerWaalsContact CG2-CD 3.5Å; T142-K300 HydrophobicContact CG2-CG 4.3Å; T142-K300 WeakPolarHBondContact O-CB 3.17Å; T142-K300 PolarHBondContact O-N 3.11Å; T142-D327 WeakPolarHBondContact CB-OD2 3.25Å; T142-D327 PolarHBondContact OG1-OD2 2.92Å
143	I	97.6	Very high	97.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	144.3	-173.8	-62.9	168.3	0	0	0	108.9	M58 W139 T260 I261 R298	M58-I143 HydrophobicContact CB-CD1 4.41Å; M58-I143 HydrophobicContact CE-CB 4.28Å; M58-I143 HydrophobicContact CE-CD1 3.23Å; M58-I143 HydrophobicContact CE-CG1 3.47Å; M58-I143 VanDerWaalsContact CE-CG1 3.47Å; M58-I143 HydrophobicContact CE-CG2 3.84Å; M58-I143 HydrophobicContact CG-CD1 4.46Å; M58-I143 HydrophobicContact CG-CG2 4.04Å; W139-I143 HydrophobicContact CB-CD1 3.44Å; W139-I143 VanDerWaalsContact CB-CD1 3.44Å; W139-I143 HydrophobicContact CB-CG1 4.5Å; W139-I143 HydrophobicContact CD2-CD1 3.66Å; W139-I143 HydrophobicContact CE3-CD1 4.45Å; W139-I143 HydrophobicContact CG-CD1 3.14Å; I143-T260 CarbonylContact O-C 3.51Å; I143-T260 VanDerWaalsContact O-CA 3.28Å; I143-T260 WeakPolarHBondContact O-CA 3.24Å; I143-I261 HydrophobicContact CB-CG1 4.32Å; I143-I261 PolarHBondContact N-O 2.87Å; I143-I261 PolarHBondContact O-N 2.77Å; I143-R298 CarbonylContact C-O 3.6Å; I143-R298 WeakPolarHBondContact CA-O 3.08Å; I143-R298 WeakPolarHBondContact CG2-O 3.2Å
144	E	97	Very high	96.9	Very high	19 Å²	19	20.2 Å²	20.2	9%	0.089	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	120.1	171.2	-69.2	171.6	169.2	0	0	108.4	R256 F259 G297 R298 K300	E144-R256 IonicContact OE1-CZ 3.24Å; E144-R256 VanDerWaalsContact OE1-CZ 3.24Å; E144-R256 IonicContact OE1-NE 2.8Å; E144-R256 PolarHBondContact OE1-NE 2.92Å; E144-R256 IonicContact OE1-NH2 2.8Å; E144-R256 PolarHBondContact OE1-NH2 3.26Å; E144-F259 WeakPolarHBondContact CA-O 3.34Å; E144-G297 CarbonylContact O-C 3.33Å; E144-G297 VanDerWaalsContact O-CA 3.23Å; E144-G297 WeakPolarHBondContact O-CA 3.32Å; E144-R298 HydrophobicContact CB-CG 4.26Å; E144-R298 PolarHBondContact N-O 2.84Å; E144-R298 PolarHBondContact O-N 2.87Å; E144-K300 HydrophobicContact CG-CB 4.06Å; E144-K300 HydrophobicContact CG-CG 4.29Å; E144-K300 WeakPolarHBondContact OE1-CG 3.25Å
145	L	97.7	Very high	96.5	Very high	4 Å²	4	19.1 Å²	19.1	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	143.8	-178.5	-62.3	165.4	0	0	0	111	I149 Y176 I227 F259 I261 V295	L145-I149 HydrophobicContact CD1-CD1 3.97Å; L145-Y176 HydrophobicContact CD1-CE1 4.09Å; L145-I227 HydrophobicContact CB-CD1 3.74Å; L145-I227 HydrophobicContact CD1-CD1 3.77Å; L145-I227 HydrophobicContact CG-CD1 4.28Å; L145-F259 PolarHBondContact N-O 2.81Å; L145-I261 HydrophobicContact CD1-CD1 4.14Å; L145-I261 HydrophobicContact CD1-CG1 4.36Å; L145-I261 HydrophobicContact CD1-CG2 4.08Å; L145-I261 HydrophobicContact CD2-CD1 3.77Å; L145-I261 HydrophobicContact CD2-CG1 4.32Å; L145-I261 HydrophobicContact CG-CD1 4.1Å; L145-I261 HydrophobicContact CG-CG1 4.2Å; L145-V295 HydrophobicContact CD2-CG1 3.59Å
146	T	94.8	Very high	96.1	Very high	32 Å²	32	19.4 Å²	19.4	20%	0.196	11%	0.109	C	C	.	.			trans	-127.7	-19.9	-174.5	55.5	0	0	0	0	114.4	A55 Q296 G297 R298	A55-T146 HydrophobicContact CB-CG2 4.2Å; A55-T146 WeakPolarHBondContact CB-OG1 3.36Å; T146-Q296 PolarHBondContact N-O 2.89Å; T146-Q296 PolarHBondContact OG1-O 2.83Å; T146-G297 WeakPolarHBondContact OG1-CA 3.28Å; T146-G297 PolarHBondContact OG1-N 2.8Å; T146-R298 HydrophobicContact CG2-CG 4.16Å
147	D	96.3	Very high	95.8	Very high	54 Å²	54	18.7 Å²	18.7	29%	0.289	11%	0.105	S	C	.	.	S	Bend	trans	-133.8	173.6	174.7	-146.6	-54	0	0	0	109.2	I227 K228 Q296	D147-I227 WeakPolarHBondContact O-CD1 3.13Å; D147-K228 HydrophobicContact CB-CD 4.4Å; D147-K228 WeakPolarHBondContact OD1-CD 3.37Å; D147-K228 IonicContact OD1-NZ 2.61Å; D147-K228 PolarHBondContact OD1-NZ 2.86Å; D147-K228 WeakPolarHBondContact OD2-CD 3.41Å; D147-K228 IonicContact OD2-NZ 2.84Å; D147-K228 PolarHBondContact OD2-NZ 3.12Å; D147-Q296 HydrophobicContact CB-CB 3.66Å; D147-Q296 HydrophobicContact CB-CG 4.25Å
148	D	97.7	Very high	95.6	Very high	19 Å²	19	18.6 Å²	18.6	10%	0.102	10%	0.104	C	C	.	.			trans	-59.6	145.8	179.3	-61.7	-18	0	0	0	111.2	V150 F225 E226 I227 K228	D148-V150 HydrophobicContact CB-CG2 4.19Å; D148-F225 WeakPolarHBondContact CA-O 3.39Å; D148-F225 WeakPolarHBondContact CB-O 3.37Å; D148-E226 WeakPolarHBondContact OD1-CA 3.18Å; D148-I227 PolarHBondContact OD1-N 2.95Å; D148-K228 PolarHBondContact OD1-N 3.13Å
149	I	98.5	Very high	95.4	Very high	4 Å²	4	17.8 Å²	17.8	2%	0.021	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	123.3	165.4	-58.3	160.5	0	0	0	106.6	L145 L163 Y176 R224 F225 I227 L264 K294 V295	L145-I149 HydrophobicContact CD1-CD1 3.97Å; I149-L163 HydrophobicContact CD1-CD2 4.13Å; I149-Y176 HydrophobicContact CD1-CE1 4.35Å; I149-R224 CarbonylContact O-C 3.45Å; I149-R224 WeakPolarHBondContact O-CA 3.36Å; I149-F225 HydrophobicContact CB-CB 4.07Å; I149-F225 HydrophobicContact CD1-CB 4.42Å; I149-F225 HydrophobicContact CD1-CD1 3.92Å; I149-F225 HydrophobicContact CD1-CG 4.47Å; I149-F225 HydrophobicContact CG1-CD1 4.47Å; I149-F225 PolarHBondContact N-O 2.66Å; I149-F225 PolarHBondContact O-N 2.94Å; I149-I227 HydrophobicContact CD1-CD1 4.42Å; I149-I227 HydrophobicContact CG1-CD1 4.18Å; I149-L264 HydrophobicContact CD1-CD1 3.63Å; I149-L264 HydrophobicContact CD1-CD2 4.36Å; I149-L264 HydrophobicContact CG1-CD1 4.38Å; I149-K294 WeakPolarHBondContact CA-O 3.49Å; I149-V295 HydrophobicContact CG2-CG2 4.24Å
150	V	97.8	Very high	95.4	Very high	18 Å²	18	19.4 Å²	19.4	11%	0.109	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.5	-178	-174.6	0	0	0	0	108.9	D148 T222 R224 I293 K294	D148-V150 HydrophobicContact CB-CG2 4.19Å; V150-T222 HydrophobicContact CG1-CG2 4.33Å; V150-R224 HydrophobicContact CG1-CG 4.47Å; V150-R224 HydrophobicContact CG2-CG 4.35Å; V150-I293 CarbonylContact O-C 3.55Å; V150-I293 WeakPolarHBondContact O-CA 3.24Å; V150-K294 HydrophobicContact CB-CB 4.33Å; V150-K294 PolarHBondContact N-O 3.3Å; V150-K294 VanDerWaalsContact N-O 3.16Å; V150-K294 PolarHBondContact O-N 2.89Å
151	I	97.6	Very high	95.6	Very high	5 Å²	5	15 Å²	15	3%	0.026	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.8	175.7	-55.7	162	0	0	0	107	F153 M161 T222 V223 I266 I290 I293	I151-F153 HydrophobicContact CB-CE2 4.14Å; I151-F153 HydrophobicContact CG2-CD2 4.07Å; I151-F153 HydrophobicContact CG2-CE2 3.45Å; I151-F153 VanDerWaalsContact CG2-CE2 3.45Å; I151-F153 HydrophobicContact CG2-CZ 3.82Å; I151-M161 HydrophobicContact CD1-CE 4.08Å; I151-T222 CarbonylContact O-C 3.53Å; I151-T222 WeakPolarHBondContact O-CA 3.41Å; I151-V223 PolarHBondContact N-O 2.7Å; I151-V223 PolarHBondContact O-N 3.42Å; I151-I266 HydrophobicContact CD1-CD1 3.66Å; I151-I266 HydrophobicContact CD1-CG1 3.98Å; I151-I266 HydrophobicContact CD1-CG2 4.4Å; I151-I266 HydrophobicContact CG1-CD1 4.19Å; I151-I290 HydrophobicContact CG2-CD1 4.3Å; I151-I290 HydrophobicContact CG2-CG2 4.06Å; I151-I293 HydrophobicContact CG2-CG1 4.3Å
152	T	94.9	Very high	95.7	Very high	27 Å²	27	15 Å²	15	17%	0.166	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	118	178.4	-50.7	0	0	0	0	108.8	K221 T222 I290 S291 D292	T152-K221 HydrophobicContact CG2-CB 4.46Å; T152-T222 HydrophobicContact CG2-CG2 4.22Å; T152-I290 WeakPolarHBondContact O-CA 3.49Å; T152-I290 WeakPolarHBondContact O-CG2 3.07Å; T152-S291 WeakPolarHBondContact CG2-OG 3.25Å; T152-S291 PolarHBondContact O-N 3.16Å; T152-S291 PolarHBondContact O-OG 3.07Å; T152-D292 PolarHBondContact N-O 3.34Å; T152-D292 PolarHBondContact O-N 2.88Å
153	F	93.8	Very high	95.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	146.3	175.8	-71.3	-96.5	0	0	0	109.9	I151 S155 R157 P158 M161 K221 V223 L268 A289 I290	I151-F153 HydrophobicContact CB-CE2 4.14Å; I151-F153 HydrophobicContact CG2-CD2 4.07Å; I151-F153 HydrophobicContact CG2-CE2 3.45Å; I151-F153 VanDerWaalsContact CG2-CE2 3.45Å; I151-F153 HydrophobicContact CG2-CZ 3.82Å; F153-S155 WeakPolarHBondContact CB-O 3.47Å; F153-R157 HydrophobicContact CD2-CB 4.42Å; F153-R157 HydrophobicContact CD2-CG 4.2Å; F153-P158 HydrophobicContact CE1-CG 3.68Å; F153-P158 HydrophobicContact CE2-CG 4.46Å; F153-P158 HydrophobicContact CZ-CG 3.64Å; F153-M161 HydrophobicContact CE2-SD 4.5Å; F153-M161 HydrophobicContact CZ-SD 4.29Å; F153-K221 PolarHBondContact N-O 2.89Å; F153-K221 WeakPolarHBondContact O-CB 3.4Å; F153-K221 WeakPolarHBondContact O-CD 3.44Å; F153-V223 HydrophobicContact CD2-CG2 3.96Å; F153-V223 HydrophobicContact CE2-CB 4.18Å; F153-V223 HydrophobicContact CE2-CG2 3.55Å; F153-L268 HydrophobicContact CE1-CD2 4.24Å; F153-L268 HydrophobicContact CZ-CD2 4.14Å; F153-A289 CarbonylContact C-O 3.58Å; F153-A289 VanDerWaalsContact CA-O 3.28Å; F153-A289 WeakPolarHBondContact CA-O 3.26Å; F153-A289 WeakPolarHBondContact CD1-O 3.47Å; F153-I290 HydrophobicContact CD1-CG1 3.86Å; F153-I290 HydrophobicContact CE1-CD1 4.07Å; F153-I290 HydrophobicContact CE1-CG1 3.7Å; F153-I290 HydrophobicContact CZ-CD1 4.37Å; F153-I290 HydrophobicContact CZ-CG1 4.3Å
154	E	90.8	Very high	95.8	Very high	49 Å²	49	15.2 Å²	15.2	23%	0.229	8%	0.082	C	C	.	.	S	Bend	trans	-92.6	-34.5	162.5	-177	53.8	-145.9	0	0	110.8	L83 F118 K221 A289	L83-E154 WeakPolarHBondContact CD1-O 3.4Å; F118-E154 HydrophobicContact CB-CB 3.9Å; F118-E154 HydrophobicContact CB-CG 4.45Å; F118-E154 HydrophobicContact CD1-CB 4.01Å; F118-E154 HydrophobicContact CD1-CG 3.61Å; F118-E154 HydrophobicContact CD2-CB 4.33Å; F118-E154 HydrophobicContact CD2-CG 4.36Å; F118-E154 HydrophobicContact CE1-CG 3.84Å; F118-E154 HydrophobicContact CG-CB 3.82Å; F118-E154 HydrophobicContact CG-CG 3.89Å; F118-E154 HydrophobicContact CZ-CG 4.3Å; E154-K221 PolarHBondContact O-NZ 2.79Å; E154-K221 IonicContact OE1-NZ 2.81Å; E154-K221 PolarHBondContact OE1-NZ 3.42Å; E154-K221 IonicContact OE2-NZ 2.78Å; E154-K221 PolarHBondContact OE2-NZ 2.81Å; E154-A289 HydrophobicContact CB-CB 3.96Å; E154-A289 PolarHBondContact N-O 3.44Å
155	S	91	Very high	95.8	Very high	7 Å²	7	14.9 Å²	14.9	5%	0.049	8%	0.08	C	C	.	.	S	Bend	trans	-73.5	-177.8	167.6	68.3	0	0	0	0	111.2	F153 A289	F153-S155 WeakPolarHBondContact CB-O 3.47Å; S155-A289 PolarHBondContact N-O 2.66Å; S155-A289 PolarHBondContact OG-N 2.95Å; S155-A289 PolarHBondContact OG-O 3.08Å
156	G	89.8	Confident	95.9	Very high	6 Å²	6	14.8 Å²	14.8	6%	0.062	8%	0.08	C	C	.	.	P	Polyproline II helix	trans	-62.4	146.9	164.9	0	0	0	0	0	110	W217	G156-W217 VanDerWaalsContact CA-CE3 3.45Å
157	R	93.2	Very high	96	Very high	4 Å²	4	16.2 Å²	16.2	2%	0.015	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-62.4	145.9	172.8	-48	175.3	-70.3	-173.7	4.3	110	F153 Y211 R213 W217 D220 T222 V223 A272	F153-R157 HydrophobicContact CD2-CB 4.42Å; F153-R157 HydrophobicContact CD2-CG 4.2Å; R157-Y211 WeakPolarHBondContact CB-O 3.49Å; R157-Y211 VanDerWaalsContact CD-O 3.24Å; R157-Y211 WeakPolarHBondContact CD-O 3.28Å; R157-Y211 PolarHBondContact NE-O 3.2Å; R157-R213 PolarHBondContact NH2-O 2.93Å; R157-W217 HydrophobicContact CB-CE3 4.39Å; R157-W217 HydrophobicContact CB-CZ3 3.75Å; R157-W217 HydrophobicContact CG-CZ3 4.31Å; R157-W217 VanDerWaalsContact N-CE3 3.27Å; R157-W217 VanDerWaalsContact O-CH2 3.28Å; R157-W217 WeakPolarHBondContact O-CH2 3.38Å; R157-W217 WeakPolarHBondContact O-CZ3 3.28Å; R157-D220 IonicContact CZ-OD2 2.75Å; R157-D220 IonicContact NH1-OD1 3.47Å; R157-D220 IonicContact NH1-OD2 2.8Å; R157-D220 PolarHBondContact NH1-OD2 3.1Å; R157-T222 WeakPolarHBondContact CD-O 3.47Å; R157-T222 PolarHBondContact NH1-O 2.99Å; R157-V223 HydrophobicContact CB-CG2 4.07Å; R157-V223 HydrophobicContact CG-CG2 4.14Å; R157-A272 WeakPolarHBondContact O-CB 3.28Å
158	P	94.7	Very high	96	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.083	C	C	.	.	P	Polyproline II helix	trans	-59.7	143.2	-176	-25.1	35.2	0	0	0	113.1	F153 Q160 M161 S212 L268 R270 Y288	F153-P158 HydrophobicContact CE1-CG 3.68Å; F153-P158 HydrophobicContact CE2-CG 4.46Å; F153-P158 HydrophobicContact CZ-CG 3.64Å; P158-Q160 VanDerWaalsContact C-N 3.27Å; P158-M161 HydrophobicContact CB-CB 3.95Å; P158-M161 HydrophobicContact CB-CG 4.11Å; P158-M161 HydrophobicContact CB-SD 4.19Å; P158-M161 HydrophobicContact CG-CB 4.21Å; P158-M161 HydrophobicContact CG-CG 4.28Å; P158-M161 HydrophobicContact CG-SD 3.74Å; P158-S212 WeakPolarHBondContact O-CB 3.45Å; P158-S212 PolarHBondContact O-OG 3.28Å; P158-L268 HydrophobicContact CB-CD2 4.47Å; P158-L268 HydrophobicContact CG-CD2 3.59Å; P158-R270 WeakPolarHBondContact CA-O 3.38Å; P158-R270 WeakPolarHBondContact CB-O 3.23Å; P158-Y288 HydrophobicContact CB-CE1 4.07Å; P158-Y288 HydrophobicContact CG-CD1 4.15Å; P158-Y288 HydrophobicContact CG-CE1 3.99Å
159	E	94.1	Very high	96	Very high	14 Å²	14	19.6 Å²	19.6	7%	0.065	10%	0.097	C	C	.	.	S	Bend	trans	-70.8	-28.4	169	-73.4	-176.5	-178.7	0	0	112.2	A180 T181 R270 P271 T273 G274	E159-A180 CarbonylContact O-C 3.16Å; E159-A180 WeakPolarHBondContact O-CA 3.43Å; E159-T181 HydrophobicContact CB-CG2 4.13Å; E159-T181 HydrophobicContact CG-CG2 3.91Å; E159-T181 PolarHBondContact O-N 3.03Å; E159-R270 HydrophobicContact CB-CB 4.21Å; E159-R270 HydrophobicContact CB-CG 4.11Å; E159-R270 PolarHBondContact N-O 3.5Å; E159-R270 WeakPolarHBondContact OE2-CD 3.5Å; E159-R270 IonicContact OE2-CZ 3.57Å; E159-R270 IonicContact OE2-NE 2.73Å; E159-R270 PolarHBondContact OE2-NE 3.25Å; E159-R270 IonicContact OE2-NH2 2.9Å; E159-P271 WeakPolarHBondContact CG-O 3.49Å; E159-T273 VanDerWaalsContact OE1-CA 3.28Å; E159-T273 WeakPolarHBondContact OE1-CA 3.04Å; E159-T273 VanDerWaalsContact OE1-CB 3.24Å; E159-T273 WeakPolarHBondContact OE1-CB 3.34Å; E159-T273 PolarHBondContact OE1-N 3.23Å; E159-T273 PolarHBondContact OE1-OG1 2.92Å; E159-T273 PolarHBondContact OE2-OG1 3.41Å; E159-G274 PolarHBondContact OE1-N 3.24Å
160	Q	97	Very high	95.9	Very high	40 Å²	40	20.7 Å²	20.7	19%	0.187	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	121.7	176.5	-64.6	177	-28.1	0	0	108.8	P158 Y179 A186 L269 R270	P158-Q160 VanDerWaalsContact C-N 3.27Å; Q160-Y179 WeakPolarHBondContact CA-O 3.03Å; Q160-A186 HydrophobicContact CG-CB 4.03Å; Q160-L269 HydrophobicContact CB-CB 3.87Å; Q160-L269 WeakPolarHBondContact O-CB 3.49Å; Q160-L269 PolarHBondContact O-N 3.14Å; Q160-R270 HydrophobicContact CB-CB 3.89Å; Q160-R270 HydrophobicContact CG-CB 4.17Å; Q160-R270 PolarHBondContact N-O 3.28Å; Q160-R270 PolarHBondContact O-N 2.95Å; Q160-R270 VanDerWaalsContact O-N 3.17Å
161	M	98.2	Very high	95.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	156.7	171.3	62.9	177.3	-79.3	0	0	112	I151 F153 P158 Y179 V223 I266 R267 L268	I151-M161 HydrophobicContact CD1-CE 4.08Å; F153-M161 HydrophobicContact CE2-SD 4.5Å; F153-M161 HydrophobicContact CZ-SD 4.29Å; P158-M161 HydrophobicContact CB-CB 3.95Å; P158-M161 HydrophobicContact CB-CG 4.11Å; P158-M161 HydrophobicContact CB-SD 4.19Å; P158-M161 HydrophobicContact CG-CB 4.21Å; P158-M161 HydrophobicContact CG-CG 4.28Å; P158-M161 HydrophobicContact CG-SD 3.74Å; M161-Y179 HydrophobicContact CE-CD2 4.03Å; M161-Y179 HydrophobicContact CE-CE2 4.25Å; M161-Y179 HydrophobicContact CG-CD2 3.8Å; M161-Y179 HydrophobicContact CG-CG 3.92Å; M161-Y179 PolarHBondContact N-O 3.39Å; M161-Y179 PolarHBondContact O-N 3.39Å; M161-Y179 VanDerWaalsContact O-O 3.13Å; M161-Y179 HydrophobicContact SD-CD2 4.34Å; M161-Y179 HydrophobicContact SD-CG 4.4Å; M161-V223 HydrophobicContact CE-CG1 3.98Å; M161-V223 HydrophobicContact SD-CB 4.48Å; M161-V223 HydrophobicContact SD-CG1 4Å; M161-V223 HydrophobicContact SD-CG2 4.08Å; M161-I266 HydrophobicContact CE-CG2 4Å; M161-R267 CarbonylContact C-O 2.95Å; M161-R267 WeakPolarHBondContact CA-O 3.43Å; M161-R267 WeakPolarHBondContact CB-O 3.3Å; M161-L268 HydrophobicContact CB-CD2 4.2Å
162	V	98.8	Very high	95.9	Very high	3 Å²	3	32.8 Å²	32.8	2%	0.018	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	128.9	175.7	-170	0	0	0	0	108.7	E164 P175 F178 F187 R267 L269	V162-E164 HydrophobicContact CG1-CG 3.92Å; V162-P175 HydrophobicContact CG1-CB 4.49Å; V162-F178 HydrophobicContact CB-CD1 4.31Å; V162-F178 HydrophobicContact CB-CE1 4.45Å; V162-F178 HydrophobicContact CG1-CD1 3.83Å; V162-F178 HydrophobicContact CG1-CE1 3.72Å; V162-F178 HydrophobicContact CG1-CG 4.43Å; V162-F178 HydrophobicContact CG1-CZ 4.26Å; V162-F178 HydrophobicContact CG2-CD1 3.6Å; V162-F178 HydrophobicContact CG2-CE1 3.83Å; V162-F187 HydrophobicContact CG2-CE1 3.81Å; V162-F187 HydrophobicContact CG2-CZ 3.7Å; V162-R267 HydrophobicContact CB-CB 4.24Å; V162-R267 PolarHBondContact N-O 3.22Å; V162-R267 PolarHBondContact O-N 3.47Å; V162-L269 HydrophobicContact CG2-CD1 3.94Å
163	L	98.9	Very high	96.1	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.5	165.2	-177.2	65.6	0	0	0	108	I149 Y176 Q177 Y179 F225 L264 I266	I149-L163 HydrophobicContact CD1-CD2 4.13Å; L163-Y176 HydrophobicContact CD2-CD1 4.14Å; L163-Y176 HydrophobicContact CG-CD1 4.41Å; L163-Y176 WeakPolarHBondContact O-CA 3.27Å; L163-Y176 VanDerWaalsContact O-CB 3.28Å; L163-Y176 WeakPolarHBondContact O-CB 3.49Å; L163-Y176 PolarHBondContact O-N 2.68Å; L163-Q177 PolarHBondContact N-O 3.23Å; L163-Q177 PolarHBondContact O-N 3.43Å; L163-Y179 HydrophobicContact CB-CE2 4Å; L163-F225 HydrophobicContact CD2-CB 3.79Å; L163-F225 HydrophobicContact CD2-CD2 4.16Å; L163-F225 HydrophobicContact CD2-CG 3.92Å; L163-L264 HydrophobicContact CD1-CD2 4.47Å; L163-I266 HydrophobicContact CD1-CG1 4.06Å
164	E	98.8	Very high	96.3	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.065	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	156.1	176.1	-63.6	176.6	158.5	0	0	110.2	V162 W173 Q174 L264 R265 R267	V162-E164 HydrophobicContact CG1-CG 3.92Å; E164-W173 HydrophobicContact CB-CE3 4.02Å; E164-Q174 CarbonylContact C-O 3.48Å; E164-Q174 VanDerWaalsContact CA-O 3.25Å; E164-Q174 WeakPolarHBondContact CA-O 3.1Å; E164-Q174 WeakPolarHBondContact CB-O 3.41Å; E164-L264 CarbonylContact O-C 3.53Å; E164-L264 WeakPolarHBondContact O-CA 3.45Å; E164-R265 HydrophobicContact CB-CB 4.32Å; E164-R265 PolarHBondContact N-O 2.95Å; E164-R265 PolarHBondContact O-N 2.86Å; E164-R265 IonicContact OE1-NH2 3.08Å; E164-R265 IonicContact OE2-CZ 2.8Å; E164-R265 IonicContact OE2-NE 2.65Å; E164-R265 PolarHBondContact OE2-NE 2.78Å; E164-R265 IonicContact OE2-NH2 2.79Å; E164-R265 PolarHBondContact OE2-NH2 3.16Å; E164-R267 WeakPolarHBondContact OE1-CD 3.34Å; E164-R267 IonicContact OE1-CZ 3.84Å; E164-R267 IonicContact OE1-NE 3.73Å; E164-R267 IonicContact OE1-NH1 2.7Å; E164-R267 PolarHBondContact OE1-NH1 3.08Å; E164-R267 WeakPolarHBondContact OE2-CD 3.49Å
165	K	98.4	Very high	96.7	Very high	12 Å²	12	38.6 Å²	38.6	5%	0.052	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.8	173.8	65.8	167	-176	168.5	0	112	Q174 Y176 D257 F258 I261 D263 L264	K165-Q174 PolarHBondContact N-O 2.67Å; K165-Q174 PolarHBondContact O-N 2.84Å; K165-Y176 HydrophobicContact CB-CD1 3.91Å; K165-Y176 HydrophobicContact CB-CE1 4.36Å; K165-Y176 HydrophobicContact CB-CG 4.35Å; K165-Y176 HydrophobicContact CD-CD1 3.98Å; K165-Y176 HydrophobicContact CD-CD2 4.08Å; K165-Y176 HydrophobicContact CD-CE1 3.96Å; K165-Y176 HydrophobicContact CD-CE2 4Å; K165-Y176 HydrophobicContact CD-CG 4.06Å; K165-Y176 HydrophobicContact CG-CD1 4.08Å; K165-Y176 HydrophobicContact CG-CD2 4.49Å; K165-Y176 HydrophobicContact CG-CG 4.08Å; K165-D257 PolarHBondContact NZ-O 2.9Å; K165-D257 VanDerWaalsContact NZ-O 3.11Å; K165-F258 VanDerWaalsContact NZ-CA 3.32Å; K165-F258 PolarHBondContact NZ-O 2.89Å; K165-I261 HydrophobicContact CB-CG2 3.9Å; K165-I261 HydrophobicContact CD-CG2 3.96Å; K165-D263 WeakPolarHBondContact CA-O 3.5Å; K165-L264 HydrophobicContact CB-CD2 3.9Å
166	S	98.5	Very high	97	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.014	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	150.3	169.2	158.1	0	0	0	0	110.1	D168 Y169 G170 T172 T262 D263	S166-D168 PolarHBondContact OG-N 3.15Å; S166-D168 VanDerWaalsContact OG-N 3.15Å; S166-D168 PolarHBondContact OG-OD1 3.37Å; S166-Y169 PolarHBondContact OG-N 2.91Å; S166-G170 PolarHBondContact OG-N 3.35Å; S166-T172 WeakPolarHBondContact CB-O 3.14Å; S166-T262 PolarHBondContact O-N 2.84Å; S166-T262 PolarHBondContact O-OG1 2.56Å; S166-T262 PolarHBondContact OG-OG1 2.99Å; S166-D263 PolarHBondContact N-O 3.2Å; S166-D263 PolarHBondContact OG-OD2 3.27Å
167	L	97	Very high	97.4	Very high	61 Å²	61	38 Å²	38	32%	0.319	18%	0.182	S	C	.	.	S	Bend	trans	-115.6	-4.2	170.9	-73.2	171.9	0	0	0	112.7	T260	L167-T260 HydrophobicContact CD2-CG2 3.72Å; L167-T260 WeakPolarHBondContact CD2-O 2.99Å
168	D	97	Very high	97.7	Very high	45 Å²	45	39.5 Å²	39.5	24%	0.241	19%	0.189	C	C	.	.	S	Bend	trans	-130.8	34.2	-169	63.7	3.6	0	0	0	113.1	S166 R171 T172	S166-D168 PolarHBondContact OG-N 3.15Å; S166-D168 VanDerWaalsContact OG-N 3.15Å; S166-D168 PolarHBondContact OG-OD1 3.37Å; D168-R171 WeakPolarHBondContact O-CD 3.03Å; D168-R171 VanDerWaalsContact O-CG 3.28Å; D168-R171 WeakPolarHBondContact O-CG 3.19Å; D168-R171 PolarHBondContact OD1-N 3.28Å; D168-T172 VanDerWaalsContact CG-OG1 3.25Å; D168-T172 PolarHBondContact OD1-N 2.89Å; D168-T172 PolarHBondContact OD1-OG1 2.94Å; D168-T172 WeakPolarHBondContact OD2-CB 3.4Å; D168-T172 WeakPolarHBondContact OD2-CG2 3.41Å; D168-T172 PolarHBondContact OD2-N 3.01Å; D168-T172 PolarHBondContact OD2-OG1 2.91Å
169	Y	97.3	Very high	97.9	Very high	99 Å²	99	39.7 Å²	39.7	39%	0.388	19%	0.189	S	C	.	.	S	Bend	trans	63	46.6	175.7	-49.5	-82.4	0	0	0	113.1	T142 S166 R171 T262 D263	T142-Y169 PolarHBondContact OG1-OH 3.27Å; S166-Y169 PolarHBondContact OG-N 2.91Å; Y169-R171 VanDerWaalsContact C-N 3.33Å; Y169-R171 PolarHBondContact O-N 2.05Å; Y169-T262 WeakPolarHBondContact CA-OG1 3.4Å; Y169-T262 HydrophobicContact CD1-CG2 3.99Å; Y169-T262 HydrophobicContact CE1-CG2 3.88Å; Y169-T262 HydrophobicContact CG-CG2 4.37Å; Y169-T262 PolarHBondContact N-OG1 3.33Å; Y169-D263 VanDerWaalsContact C-OD2 3.29Å; Y169-D263 WeakPolarHBondContact CA-OD2 3.45Å
170	G	97	Very high	98	Very high	27 Å²	27	39 Å²	39	28%	0.278	19%	0.186	S	C	.	.	S	Bend	trans	79.5	9.1	173.7	0	0	0	0	0	114.9	S166 W173 D263	S166-G170 PolarHBondContact OG-N 3.35Å; G170-W173 PolarHBondContact O-NE1 3.27Å; G170-W173 VanDerWaalsContact O-NE1 3.13Å; G170-D263 PolarHBondContact N-OD2 2.99Å
171	R	97.8	Very high	97.9	Very high	208 Å²	208	39.3 Å²	39.3	79%	0.785	19%	0.191	S	C	*	.	S	Bend	trans	-77.6	-41.7	-179.1	-63.3	174.2	-178.5	-163.1	-0.8	111.5	D168 Y169	D168-R171 WeakPolarHBondContact O-CD 3.03Å; D168-R171 VanDerWaalsContact O-CG 3.28Å; D168-R171 WeakPolarHBondContact O-CG 3.19Å; D168-R171 PolarHBondContact OD1-N 3.28Å; Y169-R171 VanDerWaalsContact C-N 3.33Å; Y169-R171 PolarHBondContact O-N 2.05Å
172	T	98.1	Very high	97.7	Very high	69 Å²	69	42.6 Å²	42.6	42%	0.423	21%	0.208	S	C	.	.	S	Bend	trans	-125.7	147.5	174.8	66.2	0	0	0	0	110.7	S166 D168	S166-T172 WeakPolarHBondContact CB-O 3.14Å; D168-T172 VanDerWaalsContact CG-OG1 3.25Å; D168-T172 PolarHBondContact OD1-N 2.89Å; D168-T172 PolarHBondContact OD1-OG1 2.94Å; D168-T172 WeakPolarHBondContact OD2-CB 3.4Å; D168-T172 WeakPolarHBondContact OD2-CG2 3.41Å; D168-T172 PolarHBondContact OD2-N 3.01Å; D168-T172 PolarHBondContact OD2-OG1 2.91Å
173	W	98.4	Very high	97.7	Very high	60 Å²	60	42.4 Å²	42.4	23%	0.227	21%	0.207	C	C	.	.			trans	-124.3	133.3	-176	-67.8	89.8	0	0	0	109.2	T136 E164 G170 D263 R265	T136-W173 HydrophobicContact CG2-CH2 3.75Å; T136-W173 HydrophobicContact CG2-CZ2 3.95Å; E164-W173 HydrophobicContact CB-CE3 4.02Å; G170-W173 PolarHBondContact O-NE1 3.27Å; G170-W173 VanDerWaalsContact O-NE1 3.13Å; W173-D263 HydrophobicContact CH2-CB 3.6Å; W173-D263 HydrophobicContact CZ2-CB 4.38Å; W173-D263 HydrophobicContact CZ3-CB 4.19Å; W173-R265 VanDerWaalsContact CB-NH2 3.34Å; W173-R265 HydrophobicContact CD2-CB 4.38Å; W173-R265 HydrophobicContact CE3-CB 3.64Å; W173-R265 VanDerWaalsContact CG-CZ 3.47Å; W173-R265 HydrophobicContact CH2-CB 3.62Å; W173-R265 HydrophobicContact CZ2-CB 4.34Å; W173-R265 HydrophobicContact CZ3-CB 3.23Å; W173-R265 HydrophobicContact CZ3-CG 4.49Å
174	Q	97.9	Very high	97.6	Very high	92 Å²	92	46.4 Å²	46.4	43%	0.43	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.9	176.6	-63.3	173.7	32.6	0	0	108.6	E164 K165	E164-Q174 CarbonylContact C-O 3.48Å; E164-Q174 VanDerWaalsContact CA-O 3.25Å; E164-Q174 WeakPolarHBondContact CA-O 3.1Å; E164-Q174 WeakPolarHBondContact CB-O 3.41Å; K165-Q174 PolarHBondContact N-O 2.67Å; K165-Q174 PolarHBondContact O-N 2.84Å
175	P	98.3	Very high	97.5	Very high	47 Å²	47	51.7 Å²	51.7	31%	0.305	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	145.4	172.8	23	-26.5	0	0	0	109.7	V162 F178 I205	V162-P175 HydrophobicContact CG1-CB 4.49Å; P175-F178 HydrophobicContact CB-CE2 3.6Å; P175-F178 HydrophobicContact CB-CZ 3.57Å; P175-F178 HydrophobicContact CG-CE2 4.2Å; P175-F178 HydrophobicContact CG-CZ 4.12Å; P175-I205 HydrophobicContact CB-CD1 4.4Å; P175-I205 HydrophobicContact CB-CG2 4.27Å; P175-I205 HydrophobicContact CG-CD1 3.99Å; P175-I205 WeakPolarHBondContact O-CD1 3.39Å
176	Y	98.3	Very high	97.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-43.4	179.4	-150.7	-177.9	0	0	0	110.5	L145 I149 L163 K165 F225 F258 I261 L264	L145-Y176 HydrophobicContact CD1-CE1 4.09Å; I149-Y176 HydrophobicContact CD1-CE1 4.35Å; L163-Y176 HydrophobicContact CD2-CD1 4.14Å; L163-Y176 HydrophobicContact CG-CD1 4.41Å; L163-Y176 WeakPolarHBondContact O-CA 3.27Å; L163-Y176 VanDerWaalsContact O-CB 3.28Å; L163-Y176 WeakPolarHBondContact O-CB 3.49Å; L163-Y176 PolarHBondContact O-N 2.68Å; K165-Y176 HydrophobicContact CB-CD1 3.91Å; K165-Y176 HydrophobicContact CB-CE1 4.36Å; K165-Y176 HydrophobicContact CB-CG 4.35Å; K165-Y176 HydrophobicContact CD-CD1 3.98Å; K165-Y176 HydrophobicContact CD-CD2 4.08Å; K165-Y176 HydrophobicContact CD-CE1 3.96Å; K165-Y176 HydrophobicContact CD-CE2 4Å; K165-Y176 HydrophobicContact CD-CG 4.06Å; K165-Y176 HydrophobicContact CG-CD1 4.08Å; K165-Y176 HydrophobicContact CG-CD2 4.49Å; K165-Y176 HydrophobicContact CG-CG 4.08Å; Y176-F225 HydrophobicContact CD1-CE1 4.19Å; Y176-F225 HydrophobicContact CD1-CE2 4.47Å; Y176-F225 HydrophobicContact CD1-CZ 4.16Å; Y176-F225 HydrophobicContact CD2-CE1 4.17Å; Y176-F225 AromaticContact CD2-CE2 3.78Å; Y176-F225 HydrophobicContact CD2-CE2 3.78Å; Y176-F225 AromaticContact CD2-CZ 3.43Å; Y176-F225 HydrophobicContact CD2-CZ 3.43Å; Y176-F225 VanDerWaalsContact CD2-CZ 3.43Å; Y176-F225 HydrophobicContact CE1-CD1 4.15Å; Y176-F225 AromaticContact CE1-CE1 3.61Å; Y176-F225 HydrophobicContact CE1-CE1 3.61Å; Y176-F225 AromaticContact CE1-CZ 3.89Å; Y176-F225 HydrophobicContact CE1-CZ 3.89Å; Y176-F225 AromaticContact CE2-CE1 3.63Å; Y176-F225 HydrophobicContact CE2-CE1 3.63Å; Y176-F225 HydrophobicContact CE2-CE2 4Å; Y176-F225 AromaticContact CE2-CZ 3.16Å; Y176-F225 HydrophobicContact CE2-CZ 3.16Å; Y176-F225 HydrophobicContact CG-CE1 4.44Å; Y176-F225 HydrophobicContact CG-CE2 4.05Å; Y176-F225 AromaticContact CG-CZ 3.94Å; Y176-F225 HydrophobicContact CG-CZ 3.94Å; Y176-F225 AromaticContact CZ-CE1 3.27Å; Y176-F225 AromaticContact CZ-CZ 3.37Å; Y176-F225 WeakPolarHBondContact OH-CE1 3.31Å; Y176-F258 HydrophobicContact CD2-CE2 4.13Å; Y176-F258 AromaticContact CD2-CZ 3.97Å; Y176-F258 HydrophobicContact CD2-CZ 3.97Å; Y176-F258 HydrophobicContact CE2-CD1 4.05Å; Y176-F258 HydrophobicContact CE2-CD2 4.21Å; Y176-F258 AromaticContact CE2-CE1 3.62Å; Y176-F258 HydrophobicContact CE2-CE1 3.62Å; Y176-F258 AromaticContact CE2-CE2 3.8Å; Y176-F258 HydrophobicContact CE2-CE2 3.8Å; Y176-F258 HydrophobicContact CE2-CG 4.33Å; Y176-F258 AromaticContact CE2-CZ 3.49Å; Y176-F258 HydrophobicContact CE2-CZ 3.49Å; Y176-F258 VanDerWaalsContact CE2-CZ 3.49Å; Y176-F258 PolarHBondContact OH-O 2.86Å; Y176-I261 HydrophobicContact CE1-CG2 4.33Å; Y176-L264 HydrophobicContact CD1-CD2 4.13Å; Y176-L264 HydrophobicContact CE1-CD2 4.36Å
177	Q	98.7	Very high	97.4	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	146.1	169.9	-167.9	150.2	-61.7	0	0	110.5	L163 Y179 I206 T208 F225 E226 R230	L163-Q177 PolarHBondContact N-O 3.23Å; L163-Q177 PolarHBondContact O-N 3.43Å; Q177-Y179 HydrophobicContact CB-CE2 3.84Å; Q177-Y179 HydrophobicContact CG-CE1 4.16Å; Q177-Y179 HydrophobicContact CG-CE2 3.98Å; Q177-Y179 PolarHBondContact NE2-OH 3.12Å; Q177-I206 HydrophobicContact CG-CG1 4.3Å; Q177-T208 HydrophobicContact CG-CG2 4.45Å; Q177-F225 HydrophobicContact CB-CD2 3.77Å; Q177-F225 HydrophobicContact CB-CE2 4.04Å; Q177-F225 HydrophobicContact CG-CD2 4.43Å; Q177-E226 PolarHBondContact NE2-OE2 2.81Å; Q177-R230 VanDerWaalsContact OE1-NH2 3.08Å
178	F	98.8	Very high	97.4	Very high	36 Å²	36	57.2 Å²	57.2	16%	0.158	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	144.7	173.9	-64.8	-94.2	0	0	0	110.1	V162 P175 F187 M189 I205 I206 C207 T208	V162-F178 HydrophobicContact CB-CD1 4.31Å; V162-F178 HydrophobicContact CB-CE1 4.45Å; V162-F178 HydrophobicContact CG1-CD1 3.83Å; V162-F178 HydrophobicContact CG1-CE1 3.72Å; V162-F178 HydrophobicContact CG1-CG 4.43Å; V162-F178 HydrophobicContact CG1-CZ 4.26Å; V162-F178 HydrophobicContact CG2-CD1 3.6Å; V162-F178 HydrophobicContact CG2-CE1 3.83Å; P175-F178 HydrophobicContact CB-CE2 3.6Å; P175-F178 HydrophobicContact CB-CZ 3.57Å; P175-F178 HydrophobicContact CG-CE2 4.2Å; P175-F178 HydrophobicContact CG-CZ 4.12Å; F178-F187 HydrophobicContact CB-CD2 3.84Å; F178-F187 HydrophobicContact CB-CE2 3.97Å; F178-F187 HydrophobicContact CB-CG 4.42Å; F178-F187 HydrophobicContact CD1-CB 4.41Å; F178-F187 AromaticContact CD1-CD1 3.67Å; F178-F187 HydrophobicContact CD1-CD1 3.67Å; F178-F187 AromaticContact CD1-CD2 3.87Å; F178-F187 HydrophobicContact CD1-CD2 3.87Å; F178-F187 AromaticContact CD1-CE1 3.79Å; F178-F187 HydrophobicContact CD1-CE1 3.79Å; F178-F187 AromaticContact CD1-CE2 3.95Å; F178-F187 HydrophobicContact CD1-CE2 3.95Å; F178-F187 AromaticContact CD1-CG 3.71Å; F178-F187 HydrophobicContact CD1-CG 3.71Å; F178-F187 AromaticContact CD1-CZ 3.92Å; F178-F187 HydrophobicContact CD1-CZ 3.92Å; F178-F187 HydrophobicContact CE1-CD1 4.02Å; F178-F187 HydrophobicContact CE1-CE1 4.24Å; F178-F187 HydrophobicContact CE1-CG 4.37Å; F178-F187 HydrophobicContact CG-CD2 4.23Å; F178-F187 HydrophobicContact CG-CE2 4.45Å; F178-F187 HydrophobicContact CG-CG 4.34Å; F178-M189 HydrophobicContact CB-SD 4.5Å; F178-M189 HydrophobicContact CD2-CE 4.11Å; F178-M189 HydrophobicContact CD2-SD 3.64Å; F178-M189 HydrophobicContact CE2-CE 4.48Å; F178-M189 HydrophobicContact CE2-SD 3.96Å; F178-M189 HydrophobicContact CG-SD 4.05Å; F178-I205 HydrophobicContact CD2-CG2 3.82Å; F178-I205 HydrophobicContact CE2-CG2 3.71Å; F178-I206 PolarHBondContact N-O 2.93Å; F178-C207 HydrophobicContact CB-CB 3.82Å; F178-C207 WeakPolarHBondContact O-CA 3.46Å; F178-T208 PolarHBondContact O-N 3.35Å
179	Y	98.2	Very high	97.5	Very high	3 Å²	3	57.3 Å²	57.3	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	124.5	178.5	-51.9	-97.3	0	0	0	108.8	Q160 M161 L163 Q177 T208 Y211 V223 R224	Q160-Y179 WeakPolarHBondContact CA-O 3.03Å; M161-Y179 HydrophobicContact CE-CD2 4.03Å; M161-Y179 HydrophobicContact CE-CE2 4.25Å; M161-Y179 HydrophobicContact CG-CD2 3.8Å; M161-Y179 HydrophobicContact CG-CG 3.92Å; M161-Y179 PolarHBondContact N-O 3.39Å; M161-Y179 PolarHBondContact O-N 3.39Å; M161-Y179 VanDerWaalsContact O-O 3.13Å; M161-Y179 HydrophobicContact SD-CD2 4.34Å; M161-Y179 HydrophobicContact SD-CG 4.4Å; L163-Y179 HydrophobicContact CB-CE2 4Å; Q177-Y179 HydrophobicContact CB-CE2 3.84Å; Q177-Y179 HydrophobicContact CG-CE1 4.16Å; Q177-Y179 HydrophobicContact CG-CE2 3.98Å; Q177-Y179 PolarHBondContact NE2-OH 3.12Å; Y179-T208 WeakPolarHBondContact CA-O 3.3Å; Y179-T208 HydrophobicContact CD1-CG2 3.55Å; Y179-T208 HydrophobicContact CE1-CG2 3.77Å; Y179-T208 HydrophobicContact CG-CG2 4.44Å; Y179-Y211 AromaticContact CD1-CD2 3.77Å; Y179-Y211 HydrophobicContact CD1-CD2 3.77Å; Y179-Y211 HydrophobicContact CD1-CG 4.42Å; Y179-Y211 AromaticContact CE1-CD2 3.69Å; Y179-Y211 HydrophobicContact CE1-CD2 3.69Å; Y179-Y211 HydrophobicContact CE1-CE2 4.2Å; Y179-V223 HydrophobicContact CD1-CG1 3.69Å; Y179-V223 HydrophobicContact CE1-CG1 3.5Å; Y179-V223 HydrophobicContact CE2-CG1 4.41Å; Y179-V223 HydrophobicContact CG-CG1 4.22Å; Y179-R224 VanDerWaalsContact CE1-O 3.3Å; Y179-R224 WeakPolarHBondContact CE1-O 3.37Å; Y179-R224 PolarHBondContact OH-O 2.96Å
180	A	96.9	Very high	97.5	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	155.8	179.3	0	0	0	0	0	112.5	E159 D182 A186 F187 T208 E209 S212	E159-A180 CarbonylContact O-C 3.16Å; E159-A180 WeakPolarHBondContact O-CA 3.43Å; A180-D182 VanDerWaalsContact C-N 3.29Å; A180-A186 HydrophobicContact CB-CB 3.66Å; A180-F187 HydrophobicContact CB-CD2 4.07Å; A180-F187 HydrophobicContact CB-CE2 3.86Å; A180-T208 PolarHBondContact N-O 2.67Å; A180-E209 VanDerWaalsContact O-CA 3.28Å; A180-E209 WeakPolarHBondContact O-CA 3.42Å; A180-E209 WeakPolarHBondContact O-CG 3.06Å; A180-S212 WeakPolarHBondContact O-CB 3.49Å
181	T	93.9	Very high	97.6	Very high	46 Å²	46	59.8 Å²	59.8	28%	0.282	31%	0.306	S	S	.	.	S	Bend	trans	-67.2	-33.3	166.2	42	0	0	0	0	112.4	E159 S212 R213	E159-T181 HydrophobicContact CB-CG2 4.13Å; E159-T181 HydrophobicContact CG-CG2 3.91Å; E159-T181 PolarHBondContact O-N 3.03Å; T181-S212 VanDerWaalsContact CG2-O 3.23Å; T181-S212 WeakPolarHBondContact CG2-O 3.44Å; T181-R213 WeakPolarHBondContact O-CG 3.34Å; T181-R213 PolarHBondContact O-NE 2.82Å; T181-R213 PolarHBondContact O-NH2 3.31Å
182	D	95	Very high	97.5	Very high	69 Å²	69	54.2 Å²	54.2	37%	0.369	29%	0.287	S	S	.	.	S	Bend	trans	-136.7	103.8	173.6	-172.7	-31.3	0	0	0	108.9	A180 L184 D185 A186 E209	A180-D182 VanDerWaalsContact C-N 3.29Å; D182-L184 VanDerWaalsContact C-N 3.34Å; D182-L184 PolarHBondContact OD1-N 2.8Å; D182-D185 HydrophobicContact CB-CB 4.05Å; D182-D185 PolarHBondContact OD1-N 2.74Å; D182-A186 WeakPolarHBondContact O-CB 3.16Å; D182-A186 PolarHBondContact O-N 2.7Å; D182-E209 WeakPolarHBondContact CA-OE1 3.47Å
183	C	97.8	Very high	97.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-68.1	-32.1	-177.5	-81.8	0	0	0	0	113.3	F187 T188 M189 P191 C207 E209	C183-F187 PolarHBondContact O-N 2.88Å; C183-F187 VanDerWaalsContact O-N 3.08Å; C183-T188 PolarHBondContact O-N 2.88Å; C183-M189 CarbonylContact C-O 3.49Å; C183-M189 VanDerWaalsContact CB-O 3.3Å; C183-M189 WeakPolarHBondContact CB-O 3.46Å; C183-M189 PolarHBondContact O-N 3.06Å; C183-P191 HydrophobicContact CB-CB 4.18Å; C183-C207 VanDerWaalsContact CA-SG 3.58Å; C183-C207 HydrophobicContact CB-CB 3.72Å; C183-C207 WeakPolarHBondContact CB-SG 3.15Å; C183-C207 WeakPolarHBondContact SG-CB 3.42Å; C183-C207 CovalentContact SG-SG 2.03Å; C183-C207 PolarHBondContact SG-SG 3.35Å; C183-E209 HydrophobicContact CB-CG 4.18Å; C183-E209 PolarHBondContact N-OE1 3.32Å; C183-E209 VanDerWaalsContact SG-CG 3.51Å
184	L	98.1	Very high	97.3	Very high	84 Å²	84	49.7 Å²	49.7	44%	0.44	27%	0.266	S	S	.	.	H	α-helix	trans	-71.5	-44.3	-179.3	-76.8	169.9	0	0	0	110.5	D182 T188 M189 E190	D182-L184 VanDerWaalsContact C-N 3.34Å; D182-L184 PolarHBondContact OD1-N 2.8Å; L184-T188 WeakPolarHBondContact O-CA 3.44Å; L184-T188 PolarHBondContact O-N 3.32Å; L184-M189 WeakPolarHBondContact CD2-O 3.44Å; L184-M189 PolarHBondContact N-O 2.79Å; L184-E190 HydrophobicContact CD2-CG 4.5Å
185	D	96.1	Very high	97	Very high	126 Å²	126	51.5 Å²	51.5	67%	0.674	28%	0.275	S	S	*	.	H	α-helix	trans	-68.8	-47.8	176.6	-177.4	70.8	0	0	0	112	D182	D182-D185 HydrophobicContact CB-CB 4.05Å; D182-D185 PolarHBondContact OD1-N 2.74Å
186	A	96.8	Very high	96.9	Very high	26 Å²	26	54.3 Å²	54.3	22%	0.215	29%	0.287	C	S	.	.	H	α-helix	trans	-71.9	-42.2	-172.3	0	0	0	0	0	113.6	Q160 A180 D182	Q160-A186 HydrophobicContact CG-CB 4.03Å; A180-A186 HydrophobicContact CB-CB 3.66Å; D182-A186 WeakPolarHBondContact O-CB 3.16Å; D182-A186 PolarHBondContact O-N 2.7Å
187	F	98.1	Very high	96.8	Very high	37 Å²	37	54.9 Å²	54.9	16%	0.162	29%	0.29	C	S	.	.	H	α-helix	trans	-133.1	3.6	-168	-58.2	-60.4	0	0	0	113.7	V162 F178 A180 C183 M189 L269	V162-F187 HydrophobicContact CG2-CE1 3.81Å; V162-F187 HydrophobicContact CG2-CZ 3.7Å; F178-F187 HydrophobicContact CB-CD2 3.84Å; F178-F187 HydrophobicContact CB-CE2 3.97Å; F178-F187 HydrophobicContact CB-CG 4.42Å; F178-F187 HydrophobicContact CD1-CB 4.41Å; F178-F187 AromaticContact CD1-CD1 3.67Å; F178-F187 HydrophobicContact CD1-CD1 3.67Å; F178-F187 AromaticContact CD1-CD2 3.87Å; F178-F187 HydrophobicContact CD1-CD2 3.87Å; F178-F187 AromaticContact CD1-CE1 3.79Å; F178-F187 HydrophobicContact CD1-CE1 3.79Å; F178-F187 AromaticContact CD1-CE2 3.95Å; F178-F187 HydrophobicContact CD1-CE2 3.95Å; F178-F187 AromaticContact CD1-CG 3.71Å; F178-F187 HydrophobicContact CD1-CG 3.71Å; F178-F187 AromaticContact CD1-CZ 3.92Å; F178-F187 HydrophobicContact CD1-CZ 3.92Å; F178-F187 HydrophobicContact CE1-CD1 4.02Å; F178-F187 HydrophobicContact CE1-CE1 4.24Å; F178-F187 HydrophobicContact CE1-CG 4.37Å; F178-F187 HydrophobicContact CG-CD2 4.23Å; F178-F187 HydrophobicContact CG-CE2 4.45Å; F178-F187 HydrophobicContact CG-CG 4.34Å; A180-F187 HydrophobicContact CB-CD2 4.07Å; A180-F187 HydrophobicContact CB-CE2 3.86Å; C183-F187 PolarHBondContact O-N 2.88Å; C183-F187 VanDerWaalsContact O-N 3.08Å; F187-M189 HydrophobicContact CB-CG 4.16Å; F187-M189 HydrophobicContact CB-SD 4.18Å; F187-M189 WeakPolarHBondContact O-CG 3.42Å; F187-M189 PolarHBondContact O-N 2.86Å; F187-L269 HydrophobicContact CE1-CD1 3.77Å; F187-L269 HydrophobicContact CZ-CD1 3.86Å
188	T	98.1	Very high	96.6	Very high	127 Å²	127	57.2 Å²	57.2	78%	0.779	31%	0.306	S	S	*	.	S	Bend	trans	55.5	37.3	-175.4	60.3	0	0	0	0	112.7	C183 L184	C183-T188 PolarHBondContact O-N 2.88Å; L184-T188 WeakPolarHBondContact O-CA 3.44Å; L184-T188 PolarHBondContact O-N 3.32Å
189	M	98.2	Very high	96.2	Very high	47 Å²	47	60.4 Å²	60.4	23%	0.232	32%	0.322	C	S	.	.			trans	-120.5	139.8	-179.2	-66.9	179.2	74.8	0	0	110.5	F178 C183 L184 F187 I205 C207	F178-M189 HydrophobicContact CB-SD 4.5Å; F178-M189 HydrophobicContact CD2-CE 4.11Å; F178-M189 HydrophobicContact CD2-SD 3.64Å; F178-M189 HydrophobicContact CE2-CE 4.48Å; F178-M189 HydrophobicContact CE2-SD 3.96Å; F178-M189 HydrophobicContact CG-SD 4.05Å; C183-M189 CarbonylContact C-O 3.49Å; C183-M189 VanDerWaalsContact CB-O 3.3Å; C183-M189 WeakPolarHBondContact CB-O 3.46Å; C183-M189 PolarHBondContact O-N 3.06Å; L184-M189 WeakPolarHBondContact CD2-O 3.44Å; L184-M189 PolarHBondContact N-O 2.79Å; F187-M189 HydrophobicContact CB-CG 4.16Å; F187-M189 HydrophobicContact CB-SD 4.18Å; F187-M189 WeakPolarHBondContact O-CG 3.42Å; F187-M189 PolarHBondContact O-N 2.86Å; M189-I205 WeakPolarHBondContact CE-O 3.13Å; M189-C207 HydrophobicContact CB-CB 3.79Å; M189-C207 HydrophobicContact CE-CB 4.23Å; M189-C207 HydrophobicContact SD-CB 4.01Å
190	E	97.9	Very high	95.8	Very high	127 Å²	127	68.7 Å²	68.7	59%	0.593	36%	0.36	S	S	*	.			trans	-65.4	135.1	168.5	-67.7	-65.2	159.5	0	0	109.9	L184 K192	L184-E190 HydrophobicContact CD2-CG 4.5Å; E190-K192 PolarHBondContact O-N 3.4Å
191	P	97.5	Very high	95.7	Very high	51 Å²	51	70.8 Å²	70.8	33%	0.331	37%	0.373	S	S	.	.	B	Isolated β-bridge	trans	-67.5	133.1	177.2	29.3	-34.5	0	0	0	110.5	C183 C207 E209	C183-P191 HydrophobicContact CB-CB 4.18Å; P191-C207 WeakPolarHBondContact CA-O 3.36Å; P191-E209 VanDerWaalsContact CB-CD 3.4Å; P191-E209 HydrophobicContact CB-CG 3.78Å; P191-E209 VanDerWaalsContact CB-OE2 3.31Å; P191-E209 WeakPolarHBondContact CB-OE2 3.46Å
192	K	97.3	Very high	95.7	Very high	92 Å²	92	68.7 Å²	68.7	40%	0.4	36%	0.36	S	S	.	.			trans	-141.1	154.7	177.9	-68.2	-175	179	-177.8	0	110.6	E190 I206 C207 T208	E190-K192 PolarHBondContact O-N 3.4Å; K192-I206 HydrophobicContact CB-CB 4.17Å; K192-I206 HydrophobicContact CB-CG2 4.09Å; K192-I206 HydrophobicContact CD-CG2 4.17Å; K192-C207 PolarHBondContact N-O 3.14Å; K192-C207 VanDerWaalsContact O-O 3.13Å; K192-T208 WeakPolarHBondContact O-CA 3.19Å; K192-T208 WeakPolarHBondContact O-CB 3.49Å
193	T	95.9	Very high	95.6	Very high	30 Å²	30	68.3 Å²	68.3	18%	0.184	36%	0.358	C	S	.	.			trans	-108.4	166.9	170.3	69.1	0	0	0	0	110.4	Q195 D196 D210	T193-Q195 PolarHBondContact O-N 3.32Å; T193-Q195 PolarHBondContact OG1-N 2.03Å; T193-Q195 PolarHBondContact OG1-OE1 3.5Å; T193-D196 PolarHBondContact N-OD2 3.03Å; T193-D196 WeakPolarHBondContact O-CB 3.13Å; T193-D196 PolarHBondContact O-N 3.01Å; T193-D196 VanDerWaalsContact O-N 3.14Å; T193-D196 PolarHBondContact OG1-OD2 2.99Å; T193-D210 VanDerWaalsContact CG2-OD2 3.23Å; T193-D210 WeakPolarHBondContact CG2-OD2 3.04Å
194	V	94.9	Very high	95.6	Very high	4 Å²	4	71.5 Å²	71.5	2%	0.024	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-67.1	-23.3	175.7	176	0	0	0	0	111.3	D196 L197 I206 E226 D229 R230	V194-D196 PolarHBondContact O-N 3.21Å; V194-L197 HydrophobicContact CG1-CD1 4.28Å; V194-L197 HydrophobicContact CG2-CD1 4.49Å; V194-L197 WeakPolarHBondContact O-CB 3.34Å; V194-L197 PolarHBondContact O-N 3.06Å; V194-L197 VanDerWaalsContact O-N 3.1Å; V194-I206 HydrophobicContact CG2-CD1 3.91Å; V194-E226 HydrophobicContact CB-CB 4.37Å; V194-E226 HydrophobicContact CG1-CB 4.45Å; V194-E226 HydrophobicContact CG2-CB 4.01Å; V194-E226 HydrophobicContact CG2-CG 4.29Å; V194-E226 WeakPolarHBondContact CG2-OE2 3.18Å; V194-D229 HydrophobicContact CB-CB 4.4Å; V194-D229 HydrophobicContact CG1-CB 3.59Å; V194-R230 HydrophobicContact CG1-CG 3.91Å
195	Q	93.1	Very high	95.6	Very high	130 Å²	130	70.5 Å²	70.5	61%	0.607	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-68	-21.6	174.4	-63.3	76.7	10.5	0	0	112.6	T193 L197	T193-Q195 PolarHBondContact O-N 3.32Å; T193-Q195 PolarHBondContact OG1-N 2.03Å; T193-Q195 PolarHBondContact OG1-OE1 3.5Å; Q195-L197 VanDerWaalsContact C-N 3.27Å
196	D	95.5	Very high	95.7	Very high	105 Å²	105	64.8 Å²	64.8	56%	0.561	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-80.4	-8.2	173.8	-57.9	-51	0	0	0	112.8	T193 V194	T193-D196 PolarHBondContact N-OD2 3.03Å; T193-D196 WeakPolarHBondContact O-CB 3.13Å; T193-D196 PolarHBondContact O-N 3.01Å; T193-D196 VanDerWaalsContact O-N 3.14Å; T193-D196 PolarHBondContact OG1-OD2 2.99Å; V194-D196 PolarHBondContact O-N 3.21Å
197	L	95.7	Very high	95.8	Very high	12 Å²	12	63.6 Å²	63.6	6%	0.063	33%	0.328	C	S	.	.			trans	-82.2	153.7	179	-59.1	-177.6	0	0	0	111.9	V194 Q195 D204 I206 L233	V194-L197 HydrophobicContact CG1-CD1 4.28Å; V194-L197 HydrophobicContact CG2-CD1 4.49Å; V194-L197 WeakPolarHBondContact O-CB 3.34Å; V194-L197 PolarHBondContact O-N 3.06Å; V194-L197 VanDerWaalsContact O-N 3.1Å; Q195-L197 VanDerWaalsContact C-N 3.27Å; L197-D204 HydrophobicContact CD2-CB 4.36Å; L197-I206 HydrophobicContact CD2-CG2 3.89Å; L197-L233 HydrophobicContact CB-CD1 4.26Å
198	S	94.8	Very high	95.7	Very high	49 Å²	49	61.9 Å²	61.9	34%	0.343	32%	0.321	S	S	.	.			trans	-119.7	171.4	175.9	73.7	0	0	0	0	110.2	H200 T201 L202	S198-H200 PolarHBondContact O-N 3.26Å; S198-H200 VanDerWaalsContact O-N 3.11Å; S198-H200 PolarHBondContact OG-N 3.08Å; S198-T201 PolarHBondContact N-OG1 2.91Å; S198-T201 CarbonylContact O-C 3.33Å; S198-T201 PolarHBondContact O-N 2.98Å; S198-T201 VanDerWaalsContact O-N 3.11Å; S198-T201 PolarHBondContact OG-N 2.71Å; S198-T201 PolarHBondContact OG-OG1 2.82Å; S198-L202 PolarHBondContact O-N 3.07Å
199	Q	90.9	Very high	95.6	Very high	104 Å²	104	56.6 Å²	56.6	49%	0.486	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-31.1	173.4	-70.2	-179.5	-6.4	0	0	113.2	L233 F234	Q199-L233 HydrophobicContact CG-CB 4.25Å; Q199-L233 WeakPolarHBondContact CG-O 3.44Å; Q199-L233 PolarHBondContact NE2-O 3.22Å; Q199-F234 HydrophobicContact CB-CD1 4.47Å; Q199-F234 HydrophobicContact CB-CE1 3.75Å; Q199-F234 HydrophobicContact CB-CZ 4.22Å; Q199-F234 HydrophobicContact CG-CD1 3.9Å; Q199-F234 HydrophobicContact CG-CE1 3.68Å; Q199-F234 HydrophobicContact CG-CZ 4.42Å
200	H	90.4	Very high	95.3	Very high	177 Å²	177	58.6 Å²	58.6	82%	0.819	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-26.7	-179.5	-60.3	-62.8	0	0	0	113.5	S198	S198-H200 PolarHBondContact O-N 3.26Å; S198-H200 VanDerWaalsContact O-N 3.11Å; S198-H200 PolarHBondContact OG-N 3.08Å
201	T	94.1	Very high	95.1	Very high	44 Å²	44	53.9 Å²	53.9	27%	0.27	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	11	-177.4	53.2	0	0	0	0	112.6	S198 L203 D204	S198-T201 PolarHBondContact N-OG1 2.91Å; S198-T201 CarbonylContact O-C 3.33Å; S198-T201 PolarHBondContact O-N 2.98Å; S198-T201 VanDerWaalsContact O-N 3.11Å; S198-T201 PolarHBondContact OG-N 2.71Å; S198-T201 PolarHBondContact OG-OG1 2.82Å; T201-L203 PolarHBondContact O-N 3.48Å; T201-L203 VanDerWaalsContact O-N 3.12Å; T201-D204 VanDerWaalsContact CB-OD2 3.25Å; T201-D204 WeakPolarHBondContact CB-OD2 3.24Å; T201-D204 WeakPolarHBondContact CG2-OD2 3.13Å; T201-D204 WeakPolarHBondContact O-CB 3.45Å; T201-D204 PolarHBondContact O-N 2.87Å
202	L	93	Very high	94.7	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.6	-178.1	178.8	158.9	0	0	0	113.2	S198 D204 R230 L233 F234 L255 F259	S198-L202 PolarHBondContact O-N 3.07Å; L202-D204 VanDerWaalsContact C-N 3.29Å; L202-R230 HydrophobicContact CD1-CB 4.15Å; L202-R230 WeakPolarHBondContact CD1-O 3.46Å; L202-R230 HydrophobicContact CD2-CB 4.37Å; L202-R230 HydrophobicContact CG-CB 4.01Å; L202-R230 HydrophobicContact CG-CG 4.3Å; L202-R230 PolarHBondContact O-NH1 3.25Å; L202-L233 HydrophobicContact CB-CD1 4.12Å; L202-L233 HydrophobicContact CD1-CB 4.31Å; L202-L233 HydrophobicContact CD1-CD1 3.9Å; L202-L233 HydrophobicContact CG-CD1 4.16Å; L202-F234 HydrophobicContact CD1-CD2 4.01Å; L202-F234 HydrophobicContact CD1-CE2 3.48Å; L202-F234 VanDerWaalsContact CD1-CE2 3.48Å; L202-F234 HydrophobicContact CD1-CZ 4.24Å; L202-L255 HydrophobicContact CD1-CD1 4.17Å; L202-L255 HydrophobicContact CD2-CD1 3.36Å; L202-L255 HydrophobicContact CG-CD1 4.41Å; L202-F259 HydrophobicContact CD2-CE2 4.22Å; L202-F259 HydrophobicContact CD2-CZ 4.01Å
203	L	94.5	Very high	94	Very high	60 Å²	60	53.2 Å²	53.2	31%	0.314	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-5.1	179.2	-50.3	-179.4	0	0	0	112.9	T201 I205 N254 L255 F258	T201-L203 PolarHBondContact O-N 3.48Å; T201-L203 VanDerWaalsContact O-N 3.12Å; L203-I205 PolarHBondContact O-N 2.82Å; L203-N254 HydrophobicContact CD1-CB 3.72Å; L203-L255 HydrophobicContact CD2-CD1 3.9Å; L203-F258 HydrophobicContact CB-CD2 4.32Å; L203-F258 HydrophobicContact CD2-CB 3.6Å; L203-F258 HydrophobicContact CD2-CD1 4.37Å; L203-F258 HydrophobicContact CD2-CD2 3.94Å; L203-F258 HydrophobicContact CD2-CG 3.73Å
204	D	96.1	Very high	92.5	Very high	68 Å²	68	53.7 Å²	53.7	36%	0.364	28%	0.276	S	S	.	.			trans	-64.9	136.1	-179.7	-68.7	-0.7	0	0	0	109.7	L197 T201 L202 R230	L197-D204 HydrophobicContact CD2-CB 4.36Å; T201-D204 VanDerWaalsContact CB-OD2 3.25Å; T201-D204 WeakPolarHBondContact CB-OD2 3.24Å; T201-D204 WeakPolarHBondContact CG2-OD2 3.13Å; T201-D204 WeakPolarHBondContact O-CB 3.45Å; T201-D204 PolarHBondContact O-N 2.87Å; L202-D204 VanDerWaalsContact C-N 3.29Å; D204-R230 PolarHBondContact O-NH1 3.04Å
205	I	98	Very high	90.7	Very high	63 Å²	63	62.3 Å²	62.3	32%	0.323	31%	0.309	S	S	.	.			trans	-88.4	120.2	173.2	-60.6	167.1	0	0	0	106.7	P175 F178 M189 L203	P175-I205 HydrophobicContact CB-CD1 4.4Å; P175-I205 HydrophobicContact CB-CG2 4.27Å; P175-I205 HydrophobicContact CG-CD1 3.99Å; P175-I205 WeakPolarHBondContact O-CD1 3.39Å; F178-I205 HydrophobicContact CD2-CG2 3.82Å; F178-I205 HydrophobicContact CE2-CG2 3.71Å; M189-I205 WeakPolarHBondContact CE-O 3.13Å; L203-I205 PolarHBondContact O-N 2.82Å
206	I	98.3	Very high	88.6	Confident	6 Å²	6	59 Å²	59	3%	0.031	30%	0.298	C	S	.	.			trans	-110	162.3	-176	61.4	174.3	0	0	0	111.3	Q177 F178 K192 V194 L197	Q177-I206 HydrophobicContact CG-CG1 4.3Å; F178-I206 PolarHBondContact N-O 2.93Å; K192-I206 HydrophobicContact CB-CB 4.17Å; K192-I206 HydrophobicContact CB-CG2 4.09Å; K192-I206 HydrophobicContact CD-CG2 4.17Å; V194-I206 HydrophobicContact CG2-CD1 3.91Å; L197-I206 HydrophobicContact CD2-CG2 3.89Å
207	C	98.6	Very high	86.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	126.6	162.1	-173.5	0	0	0	0	108.6	F178 C183 M189 P191 K192	F178-C207 HydrophobicContact CB-CB 3.82Å; F178-C207 WeakPolarHBondContact O-CA 3.46Å; C183-C207 VanDerWaalsContact CA-SG 3.58Å; C183-C207 HydrophobicContact CB-CB 3.72Å; C183-C207 WeakPolarHBondContact CB-SG 3.15Å; C183-C207 WeakPolarHBondContact SG-CB 3.42Å; C183-C207 CovalentContact SG-SG 2.03Å; C183-C207 PolarHBondContact SG-SG 3.35Å; M189-C207 HydrophobicContact CB-CB 3.79Å; M189-C207 HydrophobicContact CE-CB 4.23Å; M189-C207 HydrophobicContact SD-CB 4.01Å; P191-C207 WeakPolarHBondContact CA-O 3.36Å; K192-C207 PolarHBondContact N-O 3.14Å; K192-C207 VanDerWaalsContact O-O 3.13Å
208	T	97.4	Very high	84.8	Confident	1 Å²	1	63 Å²	63	1%	0.006	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.6	176.8	177.3	0	0	0	0	110.9	Q177 F178 Y179 A180 K192 D210 Y211	Q177-T208 HydrophobicContact CG-CG2 4.45Å; F178-T208 PolarHBondContact O-N 3.35Å; Y179-T208 WeakPolarHBondContact CA-O 3.3Å; Y179-T208 HydrophobicContact CD1-CG2 3.55Å; Y179-T208 HydrophobicContact CE1-CG2 3.77Å; Y179-T208 HydrophobicContact CG-CG2 4.44Å; A180-T208 PolarHBondContact N-O 2.67Å; K192-T208 WeakPolarHBondContact O-CA 3.19Å; K192-T208 WeakPolarHBondContact O-CB 3.49Å; T208-D210 PolarHBondContact OG1-N 3.48Å; T208-Y211 HydrophobicContact CG2-CD2 3.82Å; T208-Y211 HydrophobicContact CG2-CE2 4.08Å
209	E	95.4	Very high	83.2	Confident	17 Å²	17	70.1 Å²	70.1	8%	0.079	33%	0.329	C	S	.	.			trans	-105	-6.4	177.9	-56.9	177.2	139.7	0	0	112.4	A180 D182 C183 P191 Y211 S212 R213	A180-E209 VanDerWaalsContact O-CA 3.28Å; A180-E209 WeakPolarHBondContact O-CA 3.42Å; A180-E209 WeakPolarHBondContact O-CG 3.06Å; D182-E209 WeakPolarHBondContact CA-OE1 3.47Å; C183-E209 HydrophobicContact CB-CG 4.18Å; C183-E209 PolarHBondContact N-OE1 3.32Å; C183-E209 VanDerWaalsContact SG-CG 3.51Å; P191-E209 VanDerWaalsContact CB-CD 3.4Å; P191-E209 HydrophobicContact CB-CG 3.78Å; P191-E209 VanDerWaalsContact CB-OE2 3.31Å; P191-E209 WeakPolarHBondContact CB-OE2 3.46Å; E209-Y211 VanDerWaalsContact C-N 3.26Å; E209-Y211 PolarHBondContact O-N 3.43Å; E209-S212 PolarHBondContact O-N 3.46Å; E209-R213 HydrophobicContact CB-CG 4.03Å; E209-R213 WeakPolarHBondContact O-CB 3.03Å; E209-R213 WeakPolarHBondContact O-CG 2.86Å; E209-R213 PolarHBondContact O-N 2.82Å; E209-R213 IonicContact OE1-CZ 2.92Å; E209-R213 IonicContact OE1-NE 3.94Å; E209-R213 IonicContact OE1-NH2 3.9Å; E209-R213 PolarHBondContact OE1-NH2 3.14Å; E209-R213 IonicContact OE2-CZ 3.87Å; E209-R213 IonicContact OE2-NE 3.96Å; E209-R213 PolarHBondContact OE2-NE 3.33Å; E209-R213 IonicContact OE2-NH1 4Å; E209-R213 PolarHBondContact OE2-NH1 3.28Å; E209-R213 IonicContact OE2-NH2 2.79Å; E209-R213 PolarHBondContact OE2-NH2 3.09Å
210	D	92.7	Very high	82.7	Confident	88 Å²	88	67.7 Å²	67.7	47%	0.471	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-31.7	-172.9	-70.6	-19.6	0	0	0	113.1	T193 T208	T193-D210 VanDerWaalsContact CG2-OD2 3.23Å; T193-D210 WeakPolarHBondContact CG2-OD2 3.04Å; T208-D210 PolarHBondContact OG1-N 3.48Å
211	Y	92.4	Very high	82.6	Confident	28 Å²	28	61.8 Å²	61.8	11%	0.11	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-4.2	-176.4	-51.9	-74.6	0	0	0	114.4	R157 Y179 T208 E209 V223 R224 E226	R157-Y211 WeakPolarHBondContact CB-O 3.49Å; R157-Y211 VanDerWaalsContact CD-O 3.24Å; R157-Y211 WeakPolarHBondContact CD-O 3.28Å; R157-Y211 PolarHBondContact NE-O 3.2Å; Y179-Y211 AromaticContact CD1-CD2 3.77Å; Y179-Y211 HydrophobicContact CD1-CD2 3.77Å; Y179-Y211 HydrophobicContact CD1-CG 4.42Å; Y179-Y211 AromaticContact CE1-CD2 3.69Å; Y179-Y211 HydrophobicContact CE1-CD2 3.69Å; Y179-Y211 HydrophobicContact CE1-CE2 4.2Å; T208-Y211 HydrophobicContact CG2-CD2 3.82Å; T208-Y211 HydrophobicContact CG2-CE2 4.08Å; E209-Y211 VanDerWaalsContact C-N 3.26Å; E209-Y211 PolarHBondContact O-N 3.43Å; Y211-V223 HydrophobicContact CG-CG1 4.24Å; Y211-R224 HydrophobicContact CE1-CB 3.98Å; Y211-R224 HydrophobicContact CE1-CG 4.06Å; Y211-E226 WeakPolarHBondContact CE2-OE1 3.36Å; Y211-E226 VanDerWaalsContact CZ-OE1 3.24Å; Y211-E226 PolarHBondContact OH-OE1 3.26Å
212	S	89.3	Confident	82.6	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.007	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-25.5	179.5	-71.1	0	0	0	0	112.4	P158 A180 T181 E209	P158-S212 WeakPolarHBondContact O-CB 3.45Å; P158-S212 PolarHBondContact O-OG 3.28Å; A180-S212 WeakPolarHBondContact O-CB 3.49Å; T181-S212 VanDerWaalsContact CG2-O 3.23Å; T181-S212 WeakPolarHBondContact CG2-O 3.44Å; E209-S212 PolarHBondContact O-N 3.46Å
213	R	81.9	Confident	82.8	Confident	128 Å²	128	60.8 Å²	60.8	48%	0.483	29%	0.286	S	S	.	.	S	Bend	trans	-77.6	152.5	175.7	-74.6	-175.7	169.9	168.5	3.4	112.9	R157 T181 E209	R157-R213 PolarHBondContact NH2-O 2.93Å; T181-R213 WeakPolarHBondContact O-CG 3.34Å; T181-R213 PolarHBondContact O-NE 2.82Å; T181-R213 PolarHBondContact O-NH2 3.31Å; E209-R213 HydrophobicContact CB-CG 4.03Å; E209-R213 WeakPolarHBondContact O-CB 3.03Å; E209-R213 WeakPolarHBondContact O-CG 2.86Å; E209-R213 PolarHBondContact O-N 2.82Å; E209-R213 IonicContact OE1-CZ 2.92Å; E209-R213 IonicContact OE1-NE 3.94Å; E209-R213 IonicContact OE1-NH2 3.9Å; E209-R213 PolarHBondContact OE1-NH2 3.14Å; E209-R213 IonicContact OE2-CZ 3.87Å; E209-R213 IonicContact OE2-NE 3.96Å; E209-R213 PolarHBondContact OE2-NE 3.33Å; E209-R213 IonicContact OE2-NH1 4Å; E209-R213 PolarHBondContact OE2-NH1 3.28Å; E209-R213 IonicContact OE2-NH2 2.79Å; E209-R213 PolarHBondContact OE2-NH2 3.09Å
214	G	64.9	Low	82.9	Confident	41 Å²	41	62.6 Å²	62.6	42%	0.423	29%	0.288	S	S	.	.	S	Bend	trans	101.8	158.6	161.3	0	0	0	0	0	116.1	V216 W217	G214-V216 PolarHBondContact O-N 2.86Å; G214-V216 VanDerWaalsContact O-N 3.13Å; G214-W217 PolarHBondContact O-NE1 3.43Å
215	Y	56.7	Low	83	Confident	185 Å²	185	59.4 Å²	59.4	73%	0.725	27%	0.271	S	S	*	.	S	Bend	trans	-76.8	19.2	172.6	-75.4	-92	0	0	0	112.9	W217 A275	Y215-W217 PolarHBondContact O-N 2.92Å; Y215-A275 HydrophobicContact CE1-CB 4.3Å; Y215-A275 HydrophobicContact CE2-CB 4.07Å; Y215-A275 WeakPolarHBondContact OH-CB 2.98Å
216	V	50.2	Low	83	Confident	60 Å²	60	56.6 Å²	56.6	36%	0.364	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-84.9	14	-170.2	-158.8	0	0	0	0	112	G214 K218 Y219 D220	G214-V216 PolarHBondContact O-N 2.86Å; G214-V216 VanDerWaalsContact O-N 3.13Å; V216-K218 PolarHBondContact O-N 3.12Å; V216-Y219 PolarHBondContact O-N 3.1Å; V216-D220 HydrophobicContact CG1-CB 3.82Å; V216-D220 PolarHBondContact O-N 2.98Å
217	W	56.4	Low	82.9	Confident	39 Å²	39	56.3 Å²	56.3	15%	0.148	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-54.2	-20.6	175	-41	112	0	0	0	113.6	L83 G156 R157 G214 Y215 A272	L83-W217 HydrophobicContact CD2-CB 3.98Å; G156-W217 VanDerWaalsContact CA-CE3 3.45Å; R157-W217 HydrophobicContact CB-CE3 4.39Å; R157-W217 HydrophobicContact CB-CZ3 3.75Å; R157-W217 HydrophobicContact CG-CZ3 4.31Å; R157-W217 VanDerWaalsContact N-CE3 3.27Å; R157-W217 VanDerWaalsContact O-CH2 3.28Å; R157-W217 WeakPolarHBondContact O-CH2 3.38Å; R157-W217 WeakPolarHBondContact O-CZ3 3.28Å; G214-W217 PolarHBondContact O-NE1 3.43Å; Y215-W217 PolarHBondContact O-N 2.92Å; W217-A272 HydrophobicContact CE3-CB 4.48Å; W217-A272 HydrophobicContact CH2-CB 3.9Å; W217-A272 HydrophobicContact CZ2-CB 4.22Å; W217-A272 HydrophobicContact CZ3-CB 4.07Å
218	K	54.3	Low	82.7	Confident	162 Å²	162	60 Å²	60	70%	0.704	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-87.7	-25.1	180	-166.8	169.9	-177	175.2	0	114.6	V216	V216-K218 PolarHBondContact O-N 3.12Å
219	Y	62.4	Low	82.6	Confident	198 Å²	198	63.2 Å²	63.2	78%	0.776	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-122.7	-24.6	-170.9	-59.9	-69.5	0	0	0	114.3	V216	V216-Y219 PolarHBondContact O-N 3.1Å
220	D	80.6	Confident	82.6	Confident	53 Å²	53	62.4 Å²	62.4	28%	0.283	29%	0.285	S	S	.	.			trans	-134.5	105.4	175.5	179.4	17.4	0	0	0	109.7	R157 V216 T222	R157-D220 IonicContact CZ-OD2 2.75Å; R157-D220 IonicContact NH1-OD1 3.47Å; R157-D220 IonicContact NH1-OD2 2.8Å; R157-D220 PolarHBondContact NH1-OD2 3.1Å; V216-D220 HydrophobicContact CG1-CB 3.82Å; V216-D220 PolarHBondContact O-N 2.98Å; D220-T222 PolarHBondContact OD1-N 3.13Å; D220-T222 PolarHBondContact OD1-OG1 2.65Å
221	K	88.4	Confident	82.7	Confident	53 Å²	53	59.3 Å²	59.3	23%	0.23	27%	0.267	C	S	.	.			trans	-100.1	9.5	177.5	-45.7	-169.6	-175.5	-175.9	0	112.6	T152 F153 E154	T152-K221 HydrophobicContact CG2-CB 4.46Å; F153-K221 PolarHBondContact N-O 2.89Å; F153-K221 WeakPolarHBondContact O-CB 3.4Å; F153-K221 WeakPolarHBondContact O-CD 3.44Å; E154-K221 PolarHBondContact O-NZ 2.79Å; E154-K221 IonicContact OE1-NZ 2.81Å; E154-K221 PolarHBondContact OE1-NZ 3.42Å; E154-K221 IonicContact OE2-NZ 2.78Å; E154-K221 PolarHBondContact OE2-NZ 2.81Å
222	T	93.2	Very high	82.8	Confident	25 Å²	25	59 Å²	59	15%	0.153	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	143.4	-172.4	67.6	0	0	0	0	112.6	V150 I151 T152 R157 D220	V150-T222 HydrophobicContact CG1-CG2 4.33Å; I151-T222 CarbonylContact O-C 3.53Å; I151-T222 WeakPolarHBondContact O-CA 3.41Å; T152-T222 HydrophobicContact CG2-CG2 4.22Å; R157-T222 WeakPolarHBondContact CD-O 3.47Å; R157-T222 PolarHBondContact NH1-O 2.99Å; D220-T222 PolarHBondContact OD1-N 3.13Å; D220-T222 PolarHBondContact OD1-OG1 2.65Å
223	V	96.4	Very high	83	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.006	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	134.7	165.1	179.8	0	0	0	0	107.1	I151 F153 R157 M161 Y179 Y211	I151-V223 PolarHBondContact N-O 2.7Å; I151-V223 PolarHBondContact O-N 3.42Å; F153-V223 HydrophobicContact CD2-CG2 3.96Å; F153-V223 HydrophobicContact CE2-CB 4.18Å; F153-V223 HydrophobicContact CE2-CG2 3.55Å; R157-V223 HydrophobicContact CB-CG2 4.07Å; R157-V223 HydrophobicContact CG-CG2 4.14Å; M161-V223 HydrophobicContact CE-CG1 3.98Å; M161-V223 HydrophobicContact SD-CB 4.48Å; M161-V223 HydrophobicContact SD-CG1 4Å; M161-V223 HydrophobicContact SD-CG2 4.08Å; Y179-V223 HydrophobicContact CD1-CG1 3.69Å; Y179-V223 HydrophobicContact CE1-CG1 3.5Å; Y179-V223 HydrophobicContact CE2-CG1 4.41Å; Y179-V223 HydrophobicContact CG-CG1 4.22Å; Y211-V223 HydrophobicContact CG-CG1 4.24Å
224	R	97.3	Very high	83.5	Confident	98 Å²	98	56 Å²	56	37%	0.37	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	150.8	-176.3	-57.5	178.6	177.7	-118.6	-3.2	112.2	I149 V150 Y179 Y211 E226	I149-R224 CarbonylContact O-C 3.45Å; I149-R224 WeakPolarHBondContact O-CA 3.36Å; V150-R224 HydrophobicContact CG1-CG 4.47Å; V150-R224 HydrophobicContact CG2-CG 4.35Å; Y179-R224 VanDerWaalsContact CE1-O 3.3Å; Y179-R224 WeakPolarHBondContact CE1-O 3.37Å; Y179-R224 PolarHBondContact OH-O 2.96Å; Y211-R224 HydrophobicContact CE1-CB 3.98Å; Y211-R224 HydrophobicContact CE1-CG 4.06Å; R224-E226 HydrophobicContact CB-CG 4.4Å
225	F	98.3	Very high	84.8	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	111.7	160.4	177.8	-102.1	0	0	0	108	D148 I149 L163 Y176 Q177 I227 F258	D148-F225 WeakPolarHBondContact CA-O 3.39Å; D148-F225 WeakPolarHBondContact CB-O 3.37Å; I149-F225 HydrophobicContact CB-CB 4.07Å; I149-F225 HydrophobicContact CD1-CB 4.42Å; I149-F225 HydrophobicContact CD1-CD1 3.92Å; I149-F225 HydrophobicContact CD1-CG 4.47Å; I149-F225 HydrophobicContact CG1-CD1 4.47Å; I149-F225 PolarHBondContact N-O 2.66Å; I149-F225 PolarHBondContact O-N 2.94Å; L163-F225 HydrophobicContact CD2-CB 3.79Å; L163-F225 HydrophobicContact CD2-CD2 4.16Å; L163-F225 HydrophobicContact CD2-CG 3.92Å; Y176-F225 HydrophobicContact CD1-CE1 4.19Å; Y176-F225 HydrophobicContact CD1-CE2 4.47Å; Y176-F225 HydrophobicContact CD1-CZ 4.16Å; Y176-F225 HydrophobicContact CD2-CE1 4.17Å; Y176-F225 AromaticContact CD2-CE2 3.78Å; Y176-F225 HydrophobicContact CD2-CE2 3.78Å; Y176-F225 AromaticContact CD2-CZ 3.43Å; Y176-F225 HydrophobicContact CD2-CZ 3.43Å; Y176-F225 VanDerWaalsContact CD2-CZ 3.43Å; Y176-F225 HydrophobicContact CE1-CD1 4.15Å; Y176-F225 AromaticContact CE1-CE1 3.61Å; Y176-F225 HydrophobicContact CE1-CE1 3.61Å; Y176-F225 AromaticContact CE1-CZ 3.89Å; Y176-F225 HydrophobicContact CE1-CZ 3.89Å; Y176-F225 AromaticContact CE2-CE1 3.63Å; Y176-F225 HydrophobicContact CE2-CE1 3.63Å; Y176-F225 HydrophobicContact CE2-CE2 4Å; Y176-F225 AromaticContact CE2-CZ 3.16Å; Y176-F225 HydrophobicContact CE2-CZ 3.16Å; Y176-F225 HydrophobicContact CG-CE1 4.44Å; Y176-F225 HydrophobicContact CG-CE2 4.05Å; Y176-F225 AromaticContact CG-CZ 3.94Å; Y176-F225 HydrophobicContact CG-CZ 3.94Å; Y176-F225 AromaticContact CZ-CE1 3.27Å; Y176-F225 AromaticContact CZ-CZ 3.37Å; Y176-F225 WeakPolarHBondContact OH-CE1 3.31Å; Q177-F225 HydrophobicContact CB-CD2 3.77Å; Q177-F225 HydrophobicContact CB-CE2 4.04Å; Q177-F225 HydrophobicContact CG-CD2 4.43Å; F225-I227 HydrophobicContact CD1-CD1 3.66Å; F225-I227 HydrophobicContact CD1-CG1 3.54Å; F225-I227 HydrophobicContact CE1-CD1 3.84Å; F225-I227 HydrophobicContact CE1-CG1 3.46Å; F225-I227 VanDerWaalsContact CE1-CG1 3.46Å; F225-I227 PolarHBondContact O-N 2.97Å; F225-I227 VanDerWaalsContact O-N 3.1Å; F225-F258 AromaticContact CZ-CE1 3.92Å; F225-F258 HydrophobicContact CZ-CE1 3.92Å; F225-F258 AromaticContact CZ-CZ 3.98Å; F225-F258 HydrophobicContact CZ-CZ 3.98Å
226	E	97.4	Very high	86.4	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.019	22%	0.222	C	C	.	.			trans	-87.6	82.6	-159.7	-48.6	88.9	151.2	0	0	111.5	D148 Q177 V194 Y211 R224 D229 R230	D148-E226 WeakPolarHBondContact OD1-CA 3.18Å; Q177-E226 PolarHBondContact NE2-OE2 2.81Å; V194-E226 HydrophobicContact CB-CB 4.37Å; V194-E226 HydrophobicContact CG1-CB 4.45Å; V194-E226 HydrophobicContact CG2-CB 4.01Å; V194-E226 HydrophobicContact CG2-CG 4.29Å; V194-E226 WeakPolarHBondContact CG2-OE2 3.18Å; Y211-E226 WeakPolarHBondContact CE2-OE1 3.36Å; Y211-E226 VanDerWaalsContact CZ-OE1 3.24Å; Y211-E226 PolarHBondContact OH-OE1 3.26Å; R224-E226 HydrophobicContact CB-CG 4.4Å; E226-D229 HydrophobicContact CB-CB 3.98Å; E226-R230 WeakPolarHBondContact O-CG 2.99Å; E226-R230 PolarHBondContact O-N 2.61Å
227	I	96.3	Very high	88.3	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-74.8	-38.9	179.6	-73.4	160.8	0	0	0	110.5	L145 D147 D148 I149 F225 R230 F231 F259	L145-I227 HydrophobicContact CB-CD1 3.74Å; L145-I227 HydrophobicContact CD1-CD1 3.77Å; L145-I227 HydrophobicContact CG-CD1 4.28Å; D147-I227 WeakPolarHBondContact O-CD1 3.13Å; D148-I227 PolarHBondContact OD1-N 2.95Å; I149-I227 HydrophobicContact CD1-CD1 4.42Å; I149-I227 HydrophobicContact CG1-CD1 4.18Å; F225-I227 HydrophobicContact CD1-CD1 3.66Å; F225-I227 HydrophobicContact CD1-CG1 3.54Å; F225-I227 HydrophobicContact CE1-CD1 3.84Å; F225-I227 HydrophobicContact CE1-CG1 3.46Å; F225-I227 VanDerWaalsContact CE1-CG1 3.46Å; F225-I227 PolarHBondContact O-N 2.97Å; F225-I227 VanDerWaalsContact O-N 3.1Å; I227-R230 PolarHBondContact O-N 3.24Å; I227-F231 HydrophobicContact CG2-CD2 3.87Å; I227-F231 HydrophobicContact CG2-CE1 4.38Å; I227-F231 HydrophobicContact CG2-CE2 3.4Å; I227-F231 VanDerWaalsContact CG2-CE2 3.4Å; I227-F231 HydrophobicContact CG2-CZ 3.7Å; I227-F231 WeakPolarHBondContact O-CG 3.18Å; I227-F231 PolarHBondContact O-N 3.22Å; I227-F259 HydrophobicContact CB-CE1 4.38Å; I227-F259 HydrophobicContact CG1-CD1 4.17Å; I227-F259 HydrophobicContact CG1-CE1 4.17Å; I227-F259 HydrophobicContact CG2-CD1 3.92Å; I227-F259 HydrophobicContact CG2-CE1 3.89Å
228	K	94.8	Very high	89.8	Confident	77 Å²	77	57.5 Å²	57.5	34%	0.335	27%	0.273	S	S	.	.	H	α-helix	trans	-68.7	-36.6	-179.3	-77.7	167.7	80	166.4	0	112.5	D147 D148 R230 F231 A232 L239	D147-K228 HydrophobicContact CB-CD 4.4Å; D147-K228 WeakPolarHBondContact OD1-CD 3.37Å; D147-K228 IonicContact OD1-NZ 2.61Å; D147-K228 PolarHBondContact OD1-NZ 2.86Å; D147-K228 WeakPolarHBondContact OD2-CD 3.41Å; D147-K228 IonicContact OD2-NZ 2.84Å; D147-K228 PolarHBondContact OD2-NZ 3.12Å; D148-K228 PolarHBondContact OD1-N 3.13Å; K228-R230 VanDerWaalsContact C-N 3.33Å; K228-F231 PolarHBondContact O-N 2.79Å; K228-A232 WeakPolarHBondContact O-CB 3.13Å; K228-A232 PolarHBondContact O-N 2.84Å; K228-L239 HydrophobicContact CB-CD1 4.49Å; K228-L239 HydrophobicContact CG-CD1 4.22Å
229	D	95.6	Very high	91.4	Very high	69 Å²	69	52 Å²	52	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-65.5	-39	174	-69.1	-28	0	0	0	111	V194 E226 A232 L233	V194-D229 HydrophobicContact CB-CB 4.4Å; V194-D229 HydrophobicContact CG1-CB 3.59Å; E226-D229 HydrophobicContact CB-CB 3.98Å; D229-A232 WeakPolarHBondContact O-CB 3.17Å; D229-A232 PolarHBondContact O-N 2.87Å; D229-L233 PolarHBondContact O-N 2.03Å
230	R	95.6	Very high	92.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-64.5	-42.4	172.3	-68.5	176.9	-167	-102.4	1.1	111.9	Q177 V194 L202 D204 E226 I227 K228 A232 L233 F259	Q177-R230 VanDerWaalsContact OE1-NH2 3.08Å; V194-R230 HydrophobicContact CG1-CG 3.91Å; L202-R230 HydrophobicContact CD1-CB 4.15Å; L202-R230 WeakPolarHBondContact CD1-O 3.46Å; L202-R230 HydrophobicContact CD2-CB 4.37Å; L202-R230 HydrophobicContact CG-CB 4.01Å; L202-R230 HydrophobicContact CG-CG 4.3Å; L202-R230 PolarHBondContact O-NH1 3.25Å; D204-R230 PolarHBondContact O-NH1 3.04Å; E226-R230 WeakPolarHBondContact O-CG 2.99Å; E226-R230 PolarHBondContact O-N 2.61Å; I227-R230 PolarHBondContact O-N 3.24Å; K228-R230 VanDerWaalsContact C-N 3.33Å; R230-A232 VanDerWaalsContact C-N 3.31Å; R230-A232 PolarHBondContact O-N 2.92Å; R230-L233 WeakPolarHBondContact O-CB 3.23Å; R230-L233 PolarHBondContact O-N 2.91Å; R230-F259 HydrophobicContact CB-CE1 4.32Å; R230-F259 HydrophobicContact CB-CZ 4.01Å
231	F	94.7	Very high	93	Very high	22 Å²	22	51.2 Å²	51.2	10%	0.096	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-35.1	174.1	-70.3	-24.8	0	0	0	113	I227 K228 L233 F234 A235 L239 L245 F259	I227-F231 HydrophobicContact CG2-CD2 3.87Å; I227-F231 HydrophobicContact CG2-CE1 4.38Å; I227-F231 HydrophobicContact CG2-CE2 3.4Å; I227-F231 VanDerWaalsContact CG2-CE2 3.4Å; I227-F231 HydrophobicContact CG2-CZ 3.7Å; I227-F231 WeakPolarHBondContact O-CG 3.18Å; I227-F231 PolarHBondContact O-N 3.22Å; K228-F231 PolarHBondContact O-N 2.79Å; F231-L233 PolarHBondContact O-N 2.03Å; F231-F234 PolarHBondContact O-N 3.44Å; F231-A235 WeakPolarHBondContact O-CB 3.42Å; F231-A235 PolarHBondContact O-N 2.9Å; F231-L239 HydrophobicContact CB-CD2 3.87Å; F231-L245 HydrophobicContact CB-CD2 4.06Å; F231-L245 HydrophobicContact CD1-CD1 3.86Å; F231-L245 HydrophobicContact CD1-CD2 3.99Å; F231-L245 HydrophobicContact CD2-CD2 4.47Å; F231-L245 HydrophobicContact CE1-CD1 4.45Å; F231-L245 HydrophobicContact CG-CD2 3.94Å; F231-F259 HydrophobicContact CD1-CE1 4.3Å; F231-F259 HydrophobicContact CD1-CE2 4.01Å; F231-F259 AromaticContact CD1-CZ 3.83Å; F231-F259 HydrophobicContact CD1-CZ 3.83Å; F231-F259 AromaticContact CE1-CD1 3.94Å; F231-F259 HydrophobicContact CE1-CD1 3.94Å; F231-F259 AromaticContact CE1-CD2 3.61Å; F231-F259 HydrophobicContact CE1-CD2 3.61Å; F231-F259 AromaticContact CE1-CE1 3.77Å; F231-F259 HydrophobicContact CE1-CE1 3.77Å; F231-F259 AromaticContact CE1-CE2 3.42Å; F231-F259 HydrophobicContact CE1-CE2 3.42Å; F231-F259 VanDerWaalsContact CE1-CE2 3.42Å; F231-F259 AromaticContact CE1-CG 3.86Å; F231-F259 HydrophobicContact CE1-CG 3.86Å; F231-F259 AromaticContact CE1-CZ 3.5Å; F231-F259 HydrophobicContact CE1-CZ 3.5Å; F231-F259 VanDerWaalsContact CE1-CZ 3.5Å; F231-F259 HydrophobicContact CZ-CD1 4.02Å; F231-F259 HydrophobicContact CZ-CD2 4.22Å; F231-F259 HydrophobicContact CZ-CE1 4.19Å; F231-F259 HydrophobicContact CZ-CE2 4.38Å; F231-F259 HydrophobicContact CZ-CG 4.03Å; F231-F259 HydrophobicContact CZ-CZ 4.36Å
232	A	94.6	Very high	93	Very high	22 Å²	22	50.7 Å²	50.7	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-61.6	-24.9	178.7	0	0	0	0	0	112.7	K228 D229 R230 F234 G236 L239	K228-A232 WeakPolarHBondContact O-CB 3.13Å; K228-A232 PolarHBondContact O-N 2.84Å; D229-A232 WeakPolarHBondContact O-CB 3.17Å; D229-A232 PolarHBondContact O-N 2.87Å; R230-A232 VanDerWaalsContact C-N 3.31Å; R230-A232 PolarHBondContact O-N 2.92Å; A232-F234 PolarHBondContact O-N 3.16Å; A232-G236 WeakPolarHBondContact CA-O 3.44Å; A232-G236 WeakPolarHBondContact CB-O 3.36Å; A232-G236 CarbonylContact O-C 3.54Å; A232-G236 WeakPolarHBondContact O-CA 3.09Å; A232-G236 PolarHBondContact O-N 2.85Å; A232-L239 HydrophobicContact CB-CD2 4.15Å
233	L	93.2	Very high	92.7	Very high	47 Å²	47	51.8 Å²	51.8	25%	0.246	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-29.2	173.2	-65.3	173.2	0	0	0	112.8	L197 Q199 L202 D229 R230 F231	L197-L233 HydrophobicContact CB-CD1 4.26Å; Q199-L233 HydrophobicContact CG-CB 4.25Å; Q199-L233 WeakPolarHBondContact CG-O 3.44Å; Q199-L233 PolarHBondContact NE2-O 3.22Å; L202-L233 HydrophobicContact CB-CD1 4.12Å; L202-L233 HydrophobicContact CD1-CB 4.31Å; L202-L233 HydrophobicContact CD1-CD1 3.9Å; L202-L233 HydrophobicContact CG-CD1 4.16Å; D229-L233 PolarHBondContact O-N 2.03Å; R230-L233 WeakPolarHBondContact O-CB 3.23Å; R230-L233 PolarHBondContact O-N 2.91Å; F231-L233 PolarHBondContact O-N 2.03Å
234	F	92.6	Very high	92.3	Very high	20 Å²	20	53.7 Å²	53.7	9%	0.088	28%	0.279	C	S	.	.	H	α-helix	trans	-104.6	-38.1	175.7	-63.5	-61.6	0	0	0	113.5	Q199 L202 F231 A232 S244 L245 Q248 L255	Q199-F234 HydrophobicContact CB-CD1 4.47Å; Q199-F234 HydrophobicContact CB-CE1 3.75Å; Q199-F234 HydrophobicContact CB-CZ 4.22Å; Q199-F234 HydrophobicContact CG-CD1 3.9Å; Q199-F234 HydrophobicContact CG-CE1 3.68Å; Q199-F234 HydrophobicContact CG-CZ 4.42Å; L202-F234 HydrophobicContact CD1-CD2 4.01Å; L202-F234 HydrophobicContact CD1-CE2 3.48Å; L202-F234 VanDerWaalsContact CD1-CE2 3.48Å; L202-F234 HydrophobicContact CD1-CZ 4.24Å; F231-F234 PolarHBondContact O-N 3.44Å; A232-F234 PolarHBondContact O-N 3.16Å; F234-S244 WeakPolarHBondContact O-CB 3.32Å; F234-S244 PolarHBondContact O-OG 3.24Å; F234-L245 HydrophobicContact CB-CB 4.25Å; F234-L245 HydrophobicContact CB-CD1 4.19Å; F234-L245 HydrophobicContact CD2-CD1 3.98Å; F234-Q248 HydrophobicContact CD1-CB 4.5Å; F234-Q248 HydrophobicContact CD1-CG 3.77Å; F234-Q248 HydrophobicContact CE1-CB 4.47Å; F234-Q248 HydrophobicContact CE1-CG 3.83Å; F234-Q248 HydrophobicContact CE2-CB 4.47Å; F234-Q248 HydrophobicContact CG-CG 4.19Å; F234-Q248 HydrophobicContact CZ-CB 4.46Å; F234-Q248 HydrophobicContact CZ-CG 4.29Å; F234-L255 HydrophobicContact CD2-CD2 4.26Å; F234-L255 HydrophobicContact CE2-CD1 3.99Å; F234-L255 HydrophobicContact CE2-CD2 3.62Å; F234-L255 HydrophobicContact CE2-CG 4.48Å; F234-L255 HydrophobicContact CZ-CD2 4.26Å
235	A	92.1	Very high	92	Very high	3 Å²	3	49.3 Å²	49.3	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-92.7	-5.4	-173	0	0	0	0	0	114.6	F231 L239 H240 N241 M242 L245	F231-A235 WeakPolarHBondContact O-CB 3.42Å; F231-A235 PolarHBondContact O-N 2.9Å; A235-L239 HydrophobicContact CB-CB 4.49Å; A235-L239 HydrophobicContact CB-CD2 3.82Å; A235-H240 PolarHBondContact O-N 2.92Å; A235-N241 WeakPolarHBondContact CA-O 3.11Å; A235-N241 WeakPolarHBondContact O-CB 3.28Å; A235-N241 PolarHBondContact O-N 3.19Å; A235-M242 HydrophobicContact CB-CE 3.15Å; A235-L245 HydrophobicContact CB-CB 4.23Å
236	G	91.3	Very high	91.7	Very high	26 Å²	26	50.3 Å²	50.3	27%	0.268	27%	0.267	S	S	.	.			trans	79.7	167.4	-171.8	0	0	0	0	0	112.9	A232 R238 L239	A232-G236 WeakPolarHBondContact CA-O 3.44Å; A232-G236 WeakPolarHBondContact CB-O 3.36Å; A232-G236 CarbonylContact O-C 3.54Å; A232-G236 WeakPolarHBondContact O-CA 3.09Å; A232-G236 PolarHBondContact O-N 2.85Å; G236-R238 PolarHBondContact O-N 2.92Å; G236-R238 VanDerWaalsContact O-N 3.12Å; G236-L239 PolarHBondContact O-N 2.81Å
237	P	89	Confident	91.3	Very high	128 Å²	128	50.8 Å²	50.8	83%	0.831	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-22.3	-170.9	24.6	-35.2	0	0	0	114.5
238	R	88.1	Confident	91	Very high	198 Å²	198	54.2 Å²	54.2	75%	0.747	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	6.3	175.9	-60.6	-173.5	-167.4	167.2	3.7	113.4	G236 H240	G236-R238 PolarHBondContact O-N 2.92Å; G236-R238 VanDerWaalsContact O-N 3.12Å; R238-H240 WeakPolarHBondContact CB-CD2 3.35Å; R238-H240 WeakPolarHBondContact CB-NE2 3.46Å; R238-H240 PolarHBondContact O-N 3.36Å; R238-H240 VanDerWaalsContact O-N 3.1Å
239	L	88.4	Confident	90.7	Very high	46 Å²	46	51.4 Å²	51.4	24%	0.241	28%	0.278	C	S	.	.	S	Bend	trans	52.7	30.7	-176.7	-56.4	176.8	0	0	0	113.8	K228 F231 A232 A235 G236 M242	K228-L239 HydrophobicContact CB-CD1 4.49Å; K228-L239 HydrophobicContact CG-CD1 4.22Å; F231-L239 HydrophobicContact CB-CD2 3.87Å; A232-L239 HydrophobicContact CB-CD2 4.15Å; A235-L239 HydrophobicContact CB-CB 4.49Å; A235-L239 HydrophobicContact CB-CD2 3.82Å; G236-L239 PolarHBondContact O-N 2.81Å; L239-M242 HydrophobicContact CB-CE 3.83Å; L239-M242 HydrophobicContact CD2-CE 4.27Å; L239-M242 WeakPolarHBondContact O-CE 3.42Å; L239-M242 WeakPolarHBondContact O-CG 3.48Å
240	H	87.2	Confident	90.3	Very high	150 Å²	150	50.2 Å²	50.2	69%	0.694	27%	0.271	S	S	*	.			trans	-81.7	-27.6	179.3	-69.9	-49.4	0	0	0	112.9	A235 R238 M242	A235-H240 PolarHBondContact O-N 2.92Å; R238-H240 WeakPolarHBondContact CB-CD2 3.35Å; R238-H240 WeakPolarHBondContact CB-NE2 3.46Å; R238-H240 PolarHBondContact O-N 3.36Å; R238-H240 VanDerWaalsContact O-N 3.1Å; H240-M242 PolarHBondContact O-N 2.87Å; H240-M242 VanDerWaalsContact O-N 3.09Å
241	N	88.4	Confident	89.8	Confident	85 Å²	85	54.9 Å²	54.9	46%	0.455	30%	0.3	S	S	.	.			trans	-88.5	56.1	-179.7	-168.2	4.6	0	0	0	111.6	A235 A243 S244	A235-N241 WeakPolarHBondContact CA-O 3.11Å; A235-N241 WeakPolarHBondContact O-CB 3.28Å; A235-N241 PolarHBondContact O-N 3.19Å; N241-A243 PolarHBondContact O-N 3.41Å; N241-S244 WeakPolarHBondContact O-CB 3.23Å; N241-S244 PolarHBondContact O-N 2.84Å; N241-S244 PolarHBondContact OD1-N 3.02Å
242	M	87.9	Confident	89.3	Confident	42 Å²	42	56.4 Å²	56.4	21%	0.207	31%	0.311	C	S	.	.	H	α-helix	trans	-61.1	-27.4	179	-67.8	-74.7	87.9	0	0	112.9	A235 L239 H240 S244 L245 Y246	A235-M242 HydrophobicContact CB-CE 3.15Å; L239-M242 HydrophobicContact CB-CE 3.83Å; L239-M242 HydrophobicContact CD2-CE 4.27Å; L239-M242 WeakPolarHBondContact O-CE 3.42Å; L239-M242 WeakPolarHBondContact O-CG 3.48Å; H240-M242 PolarHBondContact O-N 2.87Å; H240-M242 VanDerWaalsContact O-N 3.09Å; M242-S244 VanDerWaalsContact C-N 3.32Å; M242-S244 PolarHBondContact O-N 2.03Å; M242-L245 HydrophobicContact CE-CB 4.39Å; M242-L245 HydrophobicContact CE-CD2 3.69Å; M242-L245 PolarHBondContact O-N 3Å; M242-L245 HydrophobicContact SD-CD2 4.34Å; M242-Y246 HydrophobicContact CB-CD2 4.14Å; M242-Y246 HydrophobicContact CB-CE2 3.79Å; M242-Y246 WeakPolarHBondContact O-CB 3.34Å; M242-Y246 WeakPolarHBondContact O-CD2 3.47Å; M242-Y246 PolarHBondContact O-N 2.77Å
243	A	87.4	Confident	88.5	Confident	48 Å²	48	62.8 Å²	62.8	40%	0.397	34%	0.335	S	S	.	.	H	α-helix	trans	-56.9	-44	175.6	0	0	0	0	0	112.8	N241 G247 I348	N241-A243 PolarHBondContact O-N 3.41Å; A243-G247 PolarHBondContact O-N 3.29Å; A243-I348 VanDerWaalsContact CA-CD1 3.45Å; A243-I348 HydrophobicContact CB-CD1 3.3Å
244	S	89.3	Confident	88.3	Confident	41 Å²	41	65.9 Å²	65.9	29%	0.287	35%	0.351	S	S	.	.	H	α-helix	trans	-61.8	-48.6	175.8	177	0	0	0	0	111.5	F234 N241 M242 G247 Q248	F234-S244 WeakPolarHBondContact O-CB 3.32Å; F234-S244 PolarHBondContact O-OG 3.24Å; N241-S244 WeakPolarHBondContact O-CB 3.23Å; N241-S244 PolarHBondContact O-N 2.84Å; N241-S244 PolarHBondContact OD1-N 3.02Å; M242-S244 VanDerWaalsContact C-N 3.32Å; M242-S244 PolarHBondContact O-N 2.03Å; S244-G247 PolarHBondContact O-N 3.07Å; S244-Q248 WeakPolarHBondContact O-CG 3.3Å; S244-Q248 PolarHBondContact O-N 2.98Å; S244-Q248 VanDerWaalsContact O-N 3.13Å
245	L	90.8	Very high	88.2	Confident	7 Å²	7	65.2 Å²	65.2	4%	0.037	35%	0.349	C	S	.	.	H	α-helix	trans	-61	-47.7	178.8	176.7	62.6	0	0	0	112	F231 F234 A235 M242 G247 Q248 L249	F231-L245 HydrophobicContact CB-CD2 4.06Å; F231-L245 HydrophobicContact CD1-CD1 3.86Å; F231-L245 HydrophobicContact CD1-CD2 3.99Å; F231-L245 HydrophobicContact CD2-CD2 4.47Å; F231-L245 HydrophobicContact CE1-CD1 4.45Å; F231-L245 HydrophobicContact CG-CD2 3.94Å; F234-L245 HydrophobicContact CB-CB 4.25Å; F234-L245 HydrophobicContact CB-CD1 4.19Å; F234-L245 HydrophobicContact CD2-CD1 3.98Å; A235-L245 HydrophobicContact CB-CB 4.23Å; M242-L245 HydrophobicContact CE-CB 4.39Å; M242-L245 HydrophobicContact CE-CD2 3.69Å; M242-L245 PolarHBondContact O-N 3Å; M242-L245 HydrophobicContact SD-CD2 4.34Å; L245-G247 VanDerWaalsContact C-N 3.33Å; L245-G247 PolarHBondContact O-N 3.34Å; L245-Q248 PolarHBondContact O-N 2.9Å; L245-Q248 VanDerWaalsContact O-N 3.14Å; L245-L249 HydrophobicContact CD1-CD1 4.1Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CD2-CD1 4.5Å; L245-L249 HydrophobicContact CG-CD1 3.87Å; L245-L249 HydrophobicContact CG-CG 4.37Å; L245-L249 WeakPolarHBondContact O-CG 3.4Å; L245-L249 PolarHBondContact O-N 2.57Å
246	Y	90.4	Very high	88.1	Confident	21 Å²	21	66.9 Å²	66.9	8%	0.082	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-40.4	178.7	-71.1	-41.8	0	0	0	112.5	Y31 M242 Q248 L249 D250 Y345	Y31-Y246 HydrophobicContact CE2-CD2 4.26Å; Y31-Y246 HydrophobicContact CE2-CE2 4.01Å; M242-Y246 HydrophobicContact CB-CD2 4.14Å; M242-Y246 HydrophobicContact CB-CE2 3.79Å; M242-Y246 WeakPolarHBondContact O-CB 3.34Å; M242-Y246 WeakPolarHBondContact O-CD2 3.47Å; M242-Y246 PolarHBondContact O-N 2.77Å; Y246-Q248 VanDerWaalsContact C-N 3.3Å; Y246-Q248 PolarHBondContact O-N 3.25Å; Y246-L249 HydrophobicContact CD1-CD1 4.32Å; Y246-L249 PolarHBondContact O-N 2.93Å; Y246-D250 PolarHBondContact O-N 3.39Å; Y246-Y345 AromaticContact CD1-CD1 3.93Å; Y246-Y345 HydrophobicContact CD1-CD1 3.93Å; Y246-Y345 AromaticContact CD1-CD2 3.73Å; Y246-Y345 HydrophobicContact CD1-CD2 3.73Å; Y246-Y345 AromaticContact CD1-CE1 3.95Å; Y246-Y345 HydrophobicContact CD1-CE1 3.95Å; Y246-Y345 AromaticContact CD1-CE2 3.79Å; Y246-Y345 HydrophobicContact CD1-CE2 3.79Å; Y246-Y345 AromaticContact CD1-CG 3.8Å; Y246-Y345 HydrophobicContact CD1-CG 3.8Å; Y246-Y345 AromaticContact CD1-CZ 3.89Å; Y246-Y345 HydrophobicContact CE1-CD1 4.27Å; Y246-Y345 AromaticContact CE1-CE1 3.96Å; Y246-Y345 HydrophobicContact CE1-CE1 3.96Å; Y246-Y345 HydrophobicContact CE1-CE2 4.37Å; Y246-Y345 HydrophobicContact CG-CD1 4.27Å; Y246-Y345 HydrophobicContact CG-CD2 4.17Å; Y246-Y345 AromaticContact CG-CG 3.96Å; Y246-Y345 HydrophobicContact CG-CG 3.96Å
247	G	89.1	Confident	88.2	Confident	14 Å²	14	67.6 Å²	67.6	14%	0.144	35%	0.352	C	S	.	.	H	α-helix	trans	-60.1	-39.9	174.1	0	0	0	0	0	112.8	A243 S244 L245 T251	A243-G247 PolarHBondContact O-N 3.29Å; S244-G247 PolarHBondContact O-N 3.07Å; L245-G247 VanDerWaalsContact C-N 3.33Å; L245-G247 PolarHBondContact O-N 3.34Å; G247-T251 WeakPolarHBondContact O-CB 3.35Å; G247-T251 WeakPolarHBondContact O-CG2 3.4Å; G247-T251 PolarHBondContact O-N 2.87Å; G247-T251 PolarHBondContact O-OG1 3.25Å
248	Q	90.5	Very high	88.5	Confident	73 Å²	73	62.2 Å²	62.2	34%	0.341	32%	0.316	S	S	.	.	H	α-helix	trans	-71.3	-39	176.6	-66	-60.5	-38.3	0	0	112.6	F234 S244 L245 Y246 D250 T251 T252 L255	F234-Q248 HydrophobicContact CD1-CB 4.5Å; F234-Q248 HydrophobicContact CD1-CG 3.77Å; F234-Q248 HydrophobicContact CE1-CB 4.47Å; F234-Q248 HydrophobicContact CE1-CG 3.83Å; F234-Q248 HydrophobicContact CE2-CB 4.47Å; F234-Q248 HydrophobicContact CG-CG 4.19Å; F234-Q248 HydrophobicContact CZ-CB 4.46Å; F234-Q248 HydrophobicContact CZ-CG 4.29Å; S244-Q248 WeakPolarHBondContact O-CG 3.3Å; S244-Q248 PolarHBondContact O-N 2.98Å; S244-Q248 VanDerWaalsContact O-N 3.13Å; L245-Q248 PolarHBondContact O-N 2.9Å; L245-Q248 VanDerWaalsContact O-N 3.14Å; Y246-Q248 VanDerWaalsContact C-N 3.3Å; Y246-Q248 PolarHBondContact O-N 3.25Å; Q248-D250 VanDerWaalsContact C-N 3.33Å; Q248-D250 PolarHBondContact O-N 3.1Å; Q248-T251 PolarHBondContact O-N 2.88Å; Q248-T252 VanDerWaalsContact O-CB 3.27Å; Q248-T252 WeakPolarHBondContact O-CB 3.47Å; Q248-T252 PolarHBondContact O-N 2.8Å; Q248-T252 PolarHBondContact O-OG1 3.32Å; Q248-L255 HydrophobicContact CB-CD2 3.74Å
249	L	89.6	Confident	88.9	Confident	18 Å²	18	53 Å²	53	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-34.9	177.3	-73.9	170	0	0	0	112.9	L245 Y246 L255 R256 Y345	L245-L249 HydrophobicContact CD1-CD1 4.1Å; L245-L249 HydrophobicContact CD1-CG 4.15Å; L245-L249 HydrophobicContact CD2-CD1 4.5Å; L245-L249 HydrophobicContact CG-CD1 3.87Å; L245-L249 HydrophobicContact CG-CG 4.37Å; L245-L249 WeakPolarHBondContact O-CG 3.4Å; L245-L249 PolarHBondContact O-N 2.57Å; Y246-L249 HydrophobicContact CD1-CD1 4.32Å; Y246-L249 PolarHBondContact O-N 2.93Å; L249-L255 HydrophobicContact CD2-CD2 4.09Å; L249-L255 HydrophobicContact CD2-CG 3.98Å; L249-L255 HydrophobicContact CG-CD2 4.4Å; L249-R256 HydrophobicContact CD2-CB 4.29Å; L249-Y345 HydrophobicContact CB-CE2 4.35Å
250	D	86	Confident	89.3	Confident	43 Å²	43	50.9 Å²	50.9	23%	0.23	27%	0.27	C	S	.	.	H	α-helix	trans	-73.2	-41.6	175.9	-86.9	-9.6	0	0	0	112.7	Y246 Q248 S344 Y345 L346	Y246-D250 PolarHBondContact O-N 3.39Å; Q248-D250 VanDerWaalsContact C-N 3.33Å; Q248-D250 PolarHBondContact O-N 3.1Å; D250-S344 WeakPolarHBondContact OD2-CB 3.28Å; D250-S344 PolarHBondContact OD2-OG 2.81Å; D250-Y345 VanDerWaalsContact OD1-CD2 3.22Å; D250-Y345 WeakPolarHBondContact OD1-CD2 3.05Å; D250-Y345 PolarHBondContact OD1-N 3.21Å; D250-Y345 WeakPolarHBondContact OD2-CA 3.45Å; D250-Y345 WeakPolarHBondContact OD2-CB 3.43Å; D250-Y345 PolarHBondContact OD2-N 3.48Å; D250-L346 PolarHBondContact OD2-N 2.94Å; D250-L346 VanDerWaalsContact OD2-N 3.14Å
251	T	84.6	Confident	89.9	Confident	98 Å²	98	43.7 Å²	43.7	60%	0.601	24%	0.237	S	C	*	.	H	α-helix	trans	-87	-27.4	-171.4	54.2	0	0	0	0	113.3	G247 Q248	G247-T251 WeakPolarHBondContact O-CB 3.35Å; G247-T251 WeakPolarHBondContact O-CG2 3.4Å; G247-T251 PolarHBondContact O-N 2.87Å; G247-T251 PolarHBondContact O-OG1 3.25Å; Q248-T251 PolarHBondContact O-N 2.88Å
252	T	85.2	Confident	90.3	Very high	54 Å²	54	39.7 Å²	39.7	33%	0.331	22%	0.215	S	C	.	.			trans	-112.3	95.9	-174.6	-54.6	0	0	0	0	111.1	Q248 N254 L255 R256	Q248-T252 VanDerWaalsContact O-CB 3.27Å; Q248-T252 WeakPolarHBondContact O-CB 3.47Å; Q248-T252 PolarHBondContact O-N 2.8Å; Q248-T252 PolarHBondContact O-OG1 3.32Å; T252-N254 VanDerWaalsContact C-N 3.3Å; T252-N254 PolarHBondContact O-N 2.77Å; T252-L255 HydrophobicContact CG2-CB 3.93Å; T252-L255 WeakPolarHBondContact O-CB 3.33Å; T252-L255 PolarHBondContact O-N 3.39Å; T252-R256 PolarHBondContact O-N 3.23Å
253	K	77.5	Confident	90.9	Very high	156 Å²	156	38 Å²	38	68%	0.678	21%	0.207	S	C	*	.	H	α-helix	trans	-53.4	-44.3	-178.6	-172.9	-177.2	175.9	-171	0	113.4	L255 R256 D257	K253-L255 PolarHBondContact O-N 2.73Å; K253-R256 PolarHBondContact O-N 2.8Å; K253-D257 WeakPolarHBondContact CE-OD2 3.46Å; K253-D257 PolarHBondContact O-N 3.47Å
254	N	88.3	Confident	91.4	Very high	112 Å²	112	35.7 Å²	35.7	60%	0.599	19%	0.188	S	C	*	.	H	α-helix	trans	-63.4	-29.9	-177.6	-65.5	-9.6	0	0	0	112.6	L203 T252 F258	L203-N254 HydrophobicContact CD1-CB 3.72Å; T252-N254 VanDerWaalsContact C-N 3.3Å; T252-N254 PolarHBondContact O-N 2.77Å; N254-F258 WeakPolarHBondContact O-CB 3.41Å; N254-F258 PolarHBondContact O-N 2.98Å
255	L	91.1	Very high	91.8	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.031	18%	0.184	C	C	.	.	H	α-helix	trans	-68.8	-46.8	178.1	-177.8	66	0	0	0	111	L202 L203 F234 Q248 L249 T252 K253 F258 F259	L202-L255 HydrophobicContact CD1-CD1 4.17Å; L202-L255 HydrophobicContact CD2-CD1 3.36Å; L202-L255 HydrophobicContact CG-CD1 4.41Å; L203-L255 HydrophobicContact CD2-CD1 3.9Å; F234-L255 HydrophobicContact CD2-CD2 4.26Å; F234-L255 HydrophobicContact CE2-CD1 3.99Å; F234-L255 HydrophobicContact CE2-CD2 3.62Å; F234-L255 HydrophobicContact CE2-CG 4.48Å; F234-L255 HydrophobicContact CZ-CD2 4.26Å; Q248-L255 HydrophobicContact CB-CD2 3.74Å; L249-L255 HydrophobicContact CD2-CD2 4.09Å; L249-L255 HydrophobicContact CD2-CG 3.98Å; L249-L255 HydrophobicContact CG-CD2 4.4Å; T252-L255 HydrophobicContact CG2-CB 3.93Å; T252-L255 WeakPolarHBondContact O-CB 3.33Å; T252-L255 PolarHBondContact O-N 3.39Å; K253-L255 PolarHBondContact O-N 2.73Å; L255-F258 WeakPolarHBondContact O-CB 3.48Å; L255-F258 PolarHBondContact O-N 2.79Å; L255-F259 HydrophobicContact CD1-CE2 3.78Å; L255-F259 HydrophobicContact CG-CE2 4.33Å; L255-F259 VanDerWaalsContact O-CD2 3.23Å; L255-F259 WeakPolarHBondContact O-CD2 3.45Å
256	R	90.4	Very high	92.2	Very high	38 Å²	38	36 Å²	36	14%	0.143	18%	0.183	C	C	.	.	H	α-helix	trans	-66	-41.3	177.9	-174.9	174.5	170.9	-150	-10.5	112.1	E144 L249 T252 K253 F258 F259 T260 N302	E144-R256 IonicContact OE1-CZ 3.24Å; E144-R256 VanDerWaalsContact OE1-CZ 3.24Å; E144-R256 IonicContact OE1-NE 2.8Å; E144-R256 PolarHBondContact OE1-NE 2.92Å; E144-R256 IonicContact OE1-NH2 2.8Å; E144-R256 PolarHBondContact OE1-NH2 3.26Å; L249-R256 HydrophobicContact CD2-CB 4.29Å; T252-R256 PolarHBondContact O-N 3.23Å; K253-R256 PolarHBondContact O-N 2.8Å; R256-F258 PolarHBondContact O-N 2.83Å; R256-F259 PolarHBondContact O-N 2.92Å; R256-T260 PolarHBondContact O-N 2.84Å; R256-T260 PolarHBondContact O-OG1 2.81Å; R256-N302 PolarHBondContact NH2-OD1 2.73Å
257	D	92.8	Very high	92.6	Very high	42 Å²	42	39 Å²	39	23%	0.225	19%	0.194	C	C	.	.	H	α-helix	trans	-68.3	-22.3	177	-71.4	-19.4	0	0	0	112.1	K165 K253 T260 K300	K165-D257 PolarHBondContact NZ-O 2.9Å; K165-D257 VanDerWaalsContact NZ-O 3.11Å; K253-D257 WeakPolarHBondContact CE-OD2 3.46Å; K253-D257 PolarHBondContact O-N 3.47Å; D257-T260 PolarHBondContact O-N 3.02Å; D257-K300 IonicContact OD1-NZ 3.31Å; D257-K300 PolarHBondContact OD1-NZ 2.94Å
258	F	96.1	Very high	93.1	Very high	14 Å²	14	38.3 Å²	38.3	6%	0.061	19%	0.187	C	C	.	.	H	α-helix	trans	-63.6	-45.1	173.4	-174.2	-95.2	0	0	0	112.3	K165 Y176 L203 F225 N254 L255 R256 T260	K165-F258 VanDerWaalsContact NZ-CA 3.32Å; K165-F258 PolarHBondContact NZ-O 2.89Å; Y176-F258 HydrophobicContact CD2-CE2 4.13Å; Y176-F258 AromaticContact CD2-CZ 3.97Å; Y176-F258 HydrophobicContact CD2-CZ 3.97Å; Y176-F258 HydrophobicContact CE2-CD1 4.05Å; Y176-F258 HydrophobicContact CE2-CD2 4.21Å; Y176-F258 AromaticContact CE2-CE1 3.62Å; Y176-F258 HydrophobicContact CE2-CE1 3.62Å; Y176-F258 AromaticContact CE2-CE2 3.8Å; Y176-F258 HydrophobicContact CE2-CE2 3.8Å; Y176-F258 HydrophobicContact CE2-CG 4.33Å; Y176-F258 AromaticContact CE2-CZ 3.49Å; Y176-F258 HydrophobicContact CE2-CZ 3.49Å; Y176-F258 VanDerWaalsContact CE2-CZ 3.49Å; Y176-F258 PolarHBondContact OH-O 2.86Å; L203-F258 HydrophobicContact CB-CD2 4.32Å; L203-F258 HydrophobicContact CD2-CB 3.6Å; L203-F258 HydrophobicContact CD2-CD1 4.37Å; L203-F258 HydrophobicContact CD2-CD2 3.94Å; L203-F258 HydrophobicContact CD2-CG 3.73Å; F225-F258 AromaticContact CZ-CE1 3.92Å; F225-F258 HydrophobicContact CZ-CE1 3.92Å; F225-F258 AromaticContact CZ-CZ 3.98Å; F225-F258 HydrophobicContact CZ-CZ 3.98Å; N254-F258 WeakPolarHBondContact O-CB 3.41Å; N254-F258 PolarHBondContact O-N 2.98Å; L255-F258 WeakPolarHBondContact O-CB 3.48Å; L255-F258 PolarHBondContact O-N 2.79Å; R256-F258 PolarHBondContact O-N 2.83Å; F258-T260 VanDerWaalsContact C-N 3.29Å
259	F	96.5	Very high	93.4	Very high	5 Å²	5	36.3 Å²	36.3	2%	0.022	18%	0.178	C	C	.	.	S	Bend	trans	-86.7	0	177.2	-56.7	-74.7	0	0	0	113.7	E144 L145 L202 I227 R230 F231 L255 R256	E144-F259 WeakPolarHBondContact CA-O 3.34Å; L145-F259 PolarHBondContact N-O 2.81Å; L202-F259 HydrophobicContact CD2-CE2 4.22Å; L202-F259 HydrophobicContact CD2-CZ 4.01Å; I227-F259 HydrophobicContact CB-CE1 4.38Å; I227-F259 HydrophobicContact CG1-CD1 4.17Å; I227-F259 HydrophobicContact CG1-CE1 4.17Å; I227-F259 HydrophobicContact CG2-CD1 3.92Å; I227-F259 HydrophobicContact CG2-CE1 3.89Å; R230-F259 HydrophobicContact CB-CE1 4.32Å; R230-F259 HydrophobicContact CB-CZ 4.01Å; F231-F259 HydrophobicContact CD1-CE1 4.3Å; F231-F259 HydrophobicContact CD1-CE2 4.01Å; F231-F259 AromaticContact CD1-CZ 3.83Å; F231-F259 HydrophobicContact CD1-CZ 3.83Å; F231-F259 AromaticContact CE1-CD1 3.94Å; F231-F259 HydrophobicContact CE1-CD1 3.94Å; F231-F259 AromaticContact CE1-CD2 3.61Å; F231-F259 HydrophobicContact CE1-CD2 3.61Å; F231-F259 AromaticContact CE1-CE1 3.77Å; F231-F259 HydrophobicContact CE1-CE1 3.77Å; F231-F259 AromaticContact CE1-CE2 3.42Å; F231-F259 HydrophobicContact CE1-CE2 3.42Å; F231-F259 VanDerWaalsContact CE1-CE2 3.42Å; F231-F259 AromaticContact CE1-CG 3.86Å; F231-F259 HydrophobicContact CE1-CG 3.86Å; F231-F259 AromaticContact CE1-CZ 3.5Å; F231-F259 HydrophobicContact CE1-CZ 3.5Å; F231-F259 VanDerWaalsContact CE1-CZ 3.5Å; F231-F259 HydrophobicContact CZ-CD1 4.02Å; F231-F259 HydrophobicContact CZ-CD2 4.22Å; F231-F259 HydrophobicContact CZ-CE1 4.19Å; F231-F259 HydrophobicContact CZ-CE2 4.38Å; F231-F259 HydrophobicContact CZ-CG 4.03Å; F231-F259 HydrophobicContact CZ-CZ 4.36Å; L255-F259 HydrophobicContact CD1-CE2 3.78Å; L255-F259 HydrophobicContact CG-CE2 4.33Å; L255-F259 VanDerWaalsContact O-CD2 3.23Å; L255-F259 WeakPolarHBondContact O-CD2 3.45Å; R256-F259 PolarHBondContact O-N 2.92Å
260	T	97.3	Very high	93.7	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137.6	173.5	-58.6	0	0	0	0	109.9	T142 I143 L167 R256 D257 F258 K300	T142-T260 HydrophobicContact CG2-CG2 3.26Å; I143-T260 CarbonylContact O-C 3.51Å; I143-T260 VanDerWaalsContact O-CA 3.28Å; I143-T260 WeakPolarHBondContact O-CA 3.24Å; L167-T260 HydrophobicContact CD2-CG2 3.72Å; L167-T260 WeakPolarHBondContact CD2-O 2.99Å; R256-T260 PolarHBondContact O-N 2.84Å; R256-T260 PolarHBondContact O-OG1 2.81Å; D257-T260 PolarHBondContact O-N 3.02Å; F258-T260 VanDerWaalsContact C-N 3.29Å; T260-K300 HydrophobicContact CG2-CD 3.84Å; T260-K300 PolarHBondContact OG1-NZ 3.13Å
261	I	98.3	Very high	94.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	154.7	173.9	60.5	165.7	0	0	0	111.7	W139 I143 L145 K165 Y176 L264	W139-I261 HydrophobicContact CE3-CD1 4.25Å; W139-I261 HydrophobicContact CH2-CD1 3.98Å; W139-I261 HydrophobicContact CZ3-CD1 3.7Å; I143-I261 HydrophobicContact CB-CG1 4.32Å; I143-I261 PolarHBondContact N-O 2.87Å; I143-I261 PolarHBondContact O-N 2.77Å; L145-I261 HydrophobicContact CD1-CD1 4.14Å; L145-I261 HydrophobicContact CD1-CG1 4.36Å; L145-I261 HydrophobicContact CD1-CG2 4.08Å; L145-I261 HydrophobicContact CD2-CD1 3.77Å; L145-I261 HydrophobicContact CD2-CG1 4.32Å; L145-I261 HydrophobicContact CG-CD1 4.1Å; L145-I261 HydrophobicContact CG-CG1 4.2Å; K165-I261 HydrophobicContact CB-CG2 3.9Å; K165-I261 HydrophobicContact CD-CG2 3.96Å; Y176-I261 HydrophobicContact CE1-CG2 4.33Å; I261-L264 HydrophobicContact CD1-CD1 4.02Å; I261-L264 HydrophobicContact CD1-CD2 4.1Å; I261-L264 HydrophobicContact CD1-CG 3.75Å; I261-L264 HydrophobicContact CG2-CD2 4.15Å
262	T	98.2	Very high	94.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	-29.2	162.5	61.9	0	0	0	0	112.1	W139 T142 S166 Y169	W139-T262 PolarHBondContact N-O 2.81Å; T142-T262 HydrophobicContact CG2-CG2 4.41Å; S166-T262 PolarHBondContact O-N 2.84Å; S166-T262 PolarHBondContact O-OG1 2.56Å; S166-T262 PolarHBondContact OG-OG1 2.99Å; Y169-T262 WeakPolarHBondContact CA-OG1 3.4Å; Y169-T262 HydrophobicContact CD1-CG2 3.99Å; Y169-T262 HydrophobicContact CE1-CG2 3.88Å; Y169-T262 HydrophobicContact CG-CG2 4.37Å; Y169-T262 PolarHBondContact N-OG1 3.33Å
263	D	98.6	Very high	94.5	Very high	6 Å²	6	32 Å²	32	3%	0.032	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	151.2	-179	-43.6	-107.1	0	0	0	109.7	L137 S138 K165 S166 Y169 G170 W173	L137-D263 CarbonylContact O-C 3.56Å; L137-D263 WeakPolarHBondContact O-CA 3.39Å; L137-D263 WeakPolarHBondContact O-CB 3.49Å; S138-D263 WeakPolarHBondContact CA-OD1 3.33Å; S138-D263 WeakPolarHBondContact CB-OD1 3.43Å; S138-D263 PolarHBondContact OG-OD1 3.17Å; K165-D263 WeakPolarHBondContact CA-O 3.5Å; S166-D263 PolarHBondContact N-O 3.2Å; S166-D263 PolarHBondContact OG-OD2 3.27Å; Y169-D263 VanDerWaalsContact C-OD2 3.29Å; Y169-D263 WeakPolarHBondContact CA-OD2 3.45Å; G170-D263 PolarHBondContact N-OD2 2.99Å; W173-D263 HydrophobicContact CH2-CB 3.6Å; W173-D263 HydrophobicContact CZ2-CB 4.38Å; W173-D263 HydrophobicContact CZ3-CB 4.19Å
264	L	98.8	Very high	94.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	147.4	169.3	-71.2	179.1	0	0	0	109.2	T136 L137 W139 I149 L163 E164 K165 Y176 I261 V295	T136-L264 CarbonylContact C-O 3.41Å; T136-L264 WeakPolarHBondContact CA-O 3.09Å; L137-L264 HydrophobicContact CB-CB 4.31Å; L137-L264 HydrophobicContact CD1-CB 4.41Å; L137-L264 PolarHBondContact N-O 2.92Å; L137-L264 PolarHBondContact O-N 2.91Å; W139-L264 HydrophobicContact CH2-CB 4.2Å; W139-L264 HydrophobicContact CH2-CD1 3.85Å; W139-L264 HydrophobicContact CH2-CG 3.92Å; W139-L264 HydrophobicContact CZ3-CB 4.11Å; W139-L264 HydrophobicContact CZ3-CD1 4.34Å; W139-L264 HydrophobicContact CZ3-CG 3.91Å; I149-L264 HydrophobicContact CD1-CD1 3.63Å; I149-L264 HydrophobicContact CD1-CD2 4.36Å; I149-L264 HydrophobicContact CG1-CD1 4.38Å; L163-L264 HydrophobicContact CD1-CD2 4.47Å; E164-L264 CarbonylContact O-C 3.53Å; E164-L264 WeakPolarHBondContact O-CA 3.45Å; K165-L264 HydrophobicContact CB-CD2 3.9Å; Y176-L264 HydrophobicContact CD1-CD2 4.13Å; Y176-L264 HydrophobicContact CE1-CD2 4.36Å; I261-L264 HydrophobicContact CD1-CD1 4.02Å; I261-L264 HydrophobicContact CD1-CD2 4.1Å; I261-L264 HydrophobicContact CD1-CG 3.75Å; I261-L264 HydrophobicContact CG2-CD2 4.15Å; L264-V295 HydrophobicContact CD1-CG2 4.31Å
265	R	98.8	Very high	93.5	Very high	51 Å²	51	24.2 Å²	24.2	19%	0.192	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	118.9	172.2	-177.2	167.5	67.4	-174.5	3	110	N134 I135 E164 W173 R267	N134-R265 HydrophobicContact CB-CG 4.49Å; I135-R265 CarbonylContact O-C 3.58Å; I135-R265 WeakPolarHBondContact O-CA 3.17Å; E164-R265 HydrophobicContact CB-CB 4.32Å; E164-R265 PolarHBondContact N-O 2.95Å; E164-R265 PolarHBondContact O-N 2.86Å; E164-R265 IonicContact OE1-NH2 3.08Å; E164-R265 IonicContact OE2-CZ 2.8Å; E164-R265 IonicContact OE2-NE 2.65Å; E164-R265 PolarHBondContact OE2-NE 2.78Å; E164-R265 IonicContact OE2-NH2 2.79Å; E164-R265 PolarHBondContact OE2-NH2 3.16Å; W173-R265 VanDerWaalsContact CB-NH2 3.34Å; W173-R265 HydrophobicContact CD2-CB 4.38Å; W173-R265 HydrophobicContact CE3-CB 3.64Å; W173-R265 VanDerWaalsContact CG-CZ 3.47Å; W173-R265 HydrophobicContact CH2-CB 3.62Å; W173-R265 HydrophobicContact CZ2-CB 4.34Å; W173-R265 HydrophobicContact CZ3-CB 3.23Å; W173-R265 HydrophobicContact CZ3-CG 4.49Å; R265-R267 HydrophobicContact CG-CG 3.97Å
266	I	98.8	Very high	92.6	Very high	3 Å²	3	28.9 Å²	28.9	2%	0.015	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	112.7	173	-54.3	163.6	0	0	0	106.3	N134 I135 I151 M161 L163 L268 I293	N134-I266 WeakPolarHBondContact CA-O 3.33Å; I135-I266 HydrophobicContact CB-CB 4.26Å; I135-I266 PolarHBondContact N-O 3.17Å; I135-I266 PolarHBondContact O-N 2.88Å; I151-I266 HydrophobicContact CD1-CD1 3.66Å; I151-I266 HydrophobicContact CD1-CG1 3.98Å; I151-I266 HydrophobicContact CD1-CG2 4.4Å; I151-I266 HydrophobicContact CG1-CD1 4.19Å; M161-I266 HydrophobicContact CE-CG2 4Å; L163-I266 HydrophobicContact CD1-CG1 4.06Å; I266-L268 HydrophobicContact CG2-CD2 3.73Å; I266-L268 HydrophobicContact CG2-CG 4.15Å; I266-I293 HydrophobicContact CD1-CD1 3.87Å
267	R	98.8	Very high	92.2	Very high	84 Å²	84	35 Å²	35	32%	0.317	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	102.5	177.2	-62	-178	57.7	-164.5	-4.4	109	N134 M161 V162 E164 R265 L269	N134-R267 WeakPolarHBondContact OD1-CG 3.05Å; M161-R267 CarbonylContact C-O 2.95Å; M161-R267 WeakPolarHBondContact CA-O 3.43Å; M161-R267 WeakPolarHBondContact CB-O 3.3Å; V162-R267 HydrophobicContact CB-CB 4.24Å; V162-R267 PolarHBondContact N-O 3.22Å; V162-R267 PolarHBondContact O-N 3.47Å; E164-R267 WeakPolarHBondContact OE1-CD 3.34Å; E164-R267 IonicContact OE1-CZ 3.84Å; E164-R267 IonicContact OE1-NE 3.73Å; E164-R267 IonicContact OE1-NH1 2.7Å; E164-R267 PolarHBondContact OE1-NH1 3.08Å; E164-R267 WeakPolarHBondContact OE2-CD 3.49Å; R265-R267 HydrophobicContact CG-CG 3.97Å; R267-L269 HydrophobicContact CB-CD2 4.29Å
268	L	98.7	Very high	92	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	115	176	-53.8	175.3	0	0	0	108.1	W119 L132 V133 I135 F153 P158 M161 I266 Y288 I290	W119-L268 HydrophobicContact CZ3-CD1 4.43Å; L132-L268 WeakPolarHBondContact CA-O 3.41Å; V133-L268 HydrophobicContact CB-CB 4.16Å; V133-L268 HydrophobicContact CB-CD1 4.16Å; V133-L268 PolarHBondContact N-O 2.8Å; V133-L268 WeakPolarHBondContact O-CB 3.28Å; V133-L268 PolarHBondContact O-N 3.48Å; I135-L268 HydrophobicContact CD1-CD1 3.99Å; F153-L268 HydrophobicContact CE1-CD2 4.24Å; F153-L268 HydrophobicContact CZ-CD2 4.14Å; P158-L268 HydrophobicContact CB-CD2 4.47Å; P158-L268 HydrophobicContact CG-CD2 3.59Å; M161-L268 HydrophobicContact CB-CD2 4.2Å; I266-L268 HydrophobicContact CG2-CD2 3.73Å; I266-L268 HydrophobicContact CG2-CG 4.15Å; L268-Y288 HydrophobicContact CB-CD1 4.15Å; L268-Y288 HydrophobicContact CB-CD2 4.27Å; L268-Y288 HydrophobicContact CB-CE1 3.71Å; L268-Y288 HydrophobicContact CB-CE2 3.85Å; L268-Y288 HydrophobicContact CB-CG 4.39Å; L268-Y288 HydrophobicContact CD1-CD1 3.86Å; L268-Y288 HydrophobicContact CD1-CD2 4.01Å; L268-Y288 HydrophobicContact CD1-CE1 4.3Å; L268-Y288 HydrophobicContact CD1-CE2 4.44Å; L268-Y288 HydrophobicContact CD1-CG 3.67Å; L268-Y288 HydrophobicContact CD2-CD1 4.39Å; L268-Y288 HydrophobicContact CD2-CE1 4.4Å; L268-Y288 HydrophobicContact CG-CD1 4.37Å; L268-Y288 HydrophobicContact CG-CE1 4.36Å; L268-I290 HydrophobicContact CD1-CD1 4.47Å
269	L	98.2	Very high	91.6	Very high	31 Å²	31	35.3 Å²	35.3	16%	0.162	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-35.8	-171.6	-55.4	-178.9	0	0	0	112.6	L132 Q160 V162 F187 R267	L132-L269 HydrophobicContact CD2-CB 4.32Å; L132-L269 HydrophobicContact CD2-CD2 4.04Å; L132-L269 WeakPolarHBondContact CD2-O 3.32Å; Q160-L269 HydrophobicContact CB-CB 3.87Å; Q160-L269 WeakPolarHBondContact O-CB 3.49Å; Q160-L269 PolarHBondContact O-N 3.14Å; V162-L269 HydrophobicContact CG2-CD1 3.94Å; F187-L269 HydrophobicContact CE1-CD1 3.77Å; F187-L269 HydrophobicContact CZ-CD1 3.86Å; R267-L269 HydrophobicContact CB-CD2 4.29Å
270	R	95.8	Very high	91.3	Very high	90 Å²	90	41.6 Å²	41.6	34%	0.34	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	125.4	177.9	-169.6	171.9	173.7	137.7	1.8	111.2	W124 P158 E159 Q160 Y288	W124-R270 HydrophobicContact CH2-CG 4.3Å; P158-R270 WeakPolarHBondContact CA-O 3.38Å; P158-R270 WeakPolarHBondContact CB-O 3.23Å; E159-R270 HydrophobicContact CB-CB 4.21Å; E159-R270 HydrophobicContact CB-CG 4.11Å; E159-R270 PolarHBondContact N-O 3.5Å; E159-R270 WeakPolarHBondContact OE2-CD 3.5Å; E159-R270 IonicContact OE2-CZ 3.57Å; E159-R270 IonicContact OE2-NE 2.73Å; E159-R270 PolarHBondContact OE2-NE 3.25Å; E159-R270 IonicContact OE2-NH2 2.9Å; Q160-R270 HydrophobicContact CB-CB 3.89Å; Q160-R270 HydrophobicContact CG-CB 4.17Å; Q160-R270 PolarHBondContact N-O 3.28Å; Q160-R270 PolarHBondContact O-N 2.95Å; Q160-R270 VanDerWaalsContact O-N 3.17Å; R270-Y288 VanDerWaalsContact CA-OH 3.26Å; R270-Y288 WeakPolarHBondContact CA-OH 3.38Å; R270-Y288 PolarHBondContact N-OH 2.89Å
271	P	94.4	Very high	90.9	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.259	C	S	.	.			trans	-69.5	169.3	178.9	31.1	-35.7	0	0	0	110.8	W124 L131 E159 T273 Y288	W124-P271 HydrophobicContact CD2-CG 4.11Å; W124-P271 HydrophobicContact CE3-CG 3.45Å; W124-P271 VanDerWaalsContact CE3-CG 3.45Å; W124-P271 HydrophobicContact CZ3-CG 3.68Å; L131-P271 HydrophobicContact CD2-CG 4.36Å; E159-P271 WeakPolarHBondContact CG-O 3.49Å; P271-T273 PolarHBondContact O-N 3.47Å; P271-T273 VanDerWaalsContact O-N 3.17Å; P271-Y288 HydrophobicContact CB-CD1 4.26Å; P271-Y288 HydrophobicContact CB-CE1 3.81Å; P271-Y288 HydrophobicContact CB-CE2 4.38Å; P271-Y288 WeakPolarHBondContact CD-OH 3.36Å
272	A	90.7	Very high	90.4	Very high	18 Å²	18	48.3 Å²	48.3	15%	0.149	27%	0.267	C	S	.	.			trans	-61.9	115.8	172.9	0	0	0	0	0	110.1	R157 W217 Y286	R157-A272 WeakPolarHBondContact O-CB 3.28Å; W217-A272 HydrophobicContact CE3-CB 4.48Å; W217-A272 HydrophobicContact CH2-CB 3.9Å; W217-A272 HydrophobicContact CZ2-CB 4.22Å; W217-A272 HydrophobicContact CZ3-CB 4.07Å; A272-Y286 WeakPolarHBondContact O-CD1 3.09Å
273	T	87.1	Confident	90.1	Very high	14 Å²	14	49.8 Å²	49.8	9%	0.086	28%	0.275	C	S	.	.			trans	-104.3	-15.3	174.8	75.1	0	0	0	0	113.1	W124 E159 P271 V278 Y286	W124-T273 HydrophobicContact CZ3-CG2 3.74Å; E159-T273 VanDerWaalsContact OE1-CA 3.28Å; E159-T273 WeakPolarHBondContact OE1-CA 3.04Å; E159-T273 VanDerWaalsContact OE1-CB 3.24Å; E159-T273 WeakPolarHBondContact OE1-CB 3.34Å; E159-T273 PolarHBondContact OE1-N 3.23Å; E159-T273 PolarHBondContact OE1-OG1 2.92Å; E159-T273 PolarHBondContact OE2-OG1 3.41Å; P271-T273 PolarHBondContact O-N 3.47Å; P271-T273 VanDerWaalsContact O-N 3.17Å; T273-V278 HydrophobicContact CG2-CG2 3.8Å; T273-Y286 HydrophobicContact CG2-CD1 4.25Å; T273-Y286 HydrophobicContact CG2-CE1 4.33Å
274	G	77.8	Confident	89.7	Confident	35 Å²	35	50.5 Å²	50.5	36%	0.361	28%	0.281	S	S	.	.			trans	90.3	-157.1	179.2	0	0	0	0	0	111.5	E159	E159-G274 PolarHBondContact OE1-N 3.24Å
275	A	67.3	Low	89.3	Confident	70 Å²	70	54 Å²	54	58%	0.579	29%	0.294	S	S	*	.	S	Bend	trans	-89.5	-6	-179.2	0	0	0	0	0	113.9	Y215	Y215-A275 HydrophobicContact CE1-CB 4.3Å; Y215-A275 HydrophobicContact CE2-CB 4.07Å; Y215-A275 WeakPolarHBondContact OH-CB 2.98Å
276	T	70.9	Confident	89	Confident	104 Å²	104	52.2 Å²	52.2	64%	0.638	29%	0.287	S	S	*	.	S	Bend	trans	-108.1	163.7	-177.5	55.1	0	0	0	0	110.6
277	M	82.2	Confident	88.8	Confident	165 Å²	165	52.8 Å²	52.8	81%	0.813	29%	0.29	S	S	*	.			trans	-54.6	153.5	168.2	-62.2	-66	-75	0	0	110.7	D279	M277-D279 PolarHBondContact O-N 2.78Å
278	V	88.5	Confident	88.8	Confident	14 Å²	14	48.8 Å²	48.8	9%	0.085	28%	0.275	C	S	.	.			trans	-56.3	125.7	174.6	176.6	0	0	0	0	109.3	W124 Y127 T273 E280 L283 Y286	W124-V278 HydrophobicContact CZ3-CG2 4.12Å; Y127-V278 HydrophobicContact CD2-CG1 3.92Å; Y127-V278 HydrophobicContact CE1-CG1 4.45Å; Y127-V278 HydrophobicContact CE2-CB 3.96Å; Y127-V278 HydrophobicContact CE2-CG1 3.77Å; Y127-V278 HydrophobicContact CE2-CG2 3.91Å; Y127-V278 HydrophobicContact CG-CG1 4.34Å; T273-V278 HydrophobicContact CG2-CG2 3.8Å; V278-E280 PolarHBondContact O-N 2.85Å; V278-L283 HydrophobicContact CG1-CD2 3.93Å; V278-Y286 HydrophobicContact CG1-CD2 4.1Å; V278-Y286 HydrophobicContact CG1-CE2 3.63Å
279	D	88.3	Confident	88.6	Confident	50 Å²	50	48.8 Å²	48.8	27%	0.267	28%	0.275	S	S	.	.			trans	-79.9	94.8	174.2	-178.2	1.5	0	0	0	109.2	M277 S281 N282 R285 Y286	M277-D279 PolarHBondContact O-N 2.78Å; D279-S281 PolarHBondContact O-N 3.29Å; D279-S281 VanDerWaalsContact O-N 3.16Å; D279-S281 WeakPolarHBondContact OD1-CB 3.48Å; D279-S281 PolarHBondContact OD1-N 3.18Å; D279-S281 VanDerWaalsContact OD1-N 3.09Å; D279-S281 PolarHBondContact OD1-OG 2.92Å; D279-N282 CarbonylContact O-C 3.54Å; D279-N282 PolarHBondContact O-N 2.92Å; D279-R285 IonicContact OD2-CZ 3.91Å; D279-R285 IonicContact OD2-NH1 2.92Å; D279-R285 PolarHBondContact OD2-NH1 2.78Å; D279-Y286 PolarHBondContact N-OH 3.09Å
280	E	90.2	Very high	88.6	Confident	137 Å²	137	47.3 Å²	47.3	64%	0.64	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.4	179.8	-64.2	-174.3	-164.2	0	0	113.1	Y127 V278 N282	Y127-E280 HydrophobicContact CD1-CG 3.99Å; Y127-E280 HydrophobicContact CE1-CG 3.75Å; V278-E280 PolarHBondContact O-N 2.85Å; E280-N282 VanDerWaalsContact C-N 3.31Å
281	S	87.9	Confident	88.5	Confident	109 Å²	109	43.6 Å²	43.6	76%	0.762	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.1	177	77.2	0	0	0	0	112.9	D279	D279-S281 PolarHBondContact O-N 3.29Å; D279-S281 VanDerWaalsContact O-N 3.16Å; D279-S281 WeakPolarHBondContact OD1-CB 3.48Å; D279-S281 PolarHBondContact OD1-N 3.18Å; D279-S281 VanDerWaalsContact OD1-N 3.09Å; D279-S281 PolarHBondContact OD1-OG 2.92Å
282	N	87.5	Confident	88.6	Confident	32 Å²	32	44.4 Å²	44.4	17%	0.171	26%	0.259	C	S	.	.			trans	-138.4	66.3	-176.4	-163.1	-9	0	0	0	112.8	C81 C89 D279 E280 S284 R285	C81-N282 PolarHBondContact SG-OD1 3.31Å; C89-N282 PolarHBondContact SG-ND2 3.2Å; D279-N282 CarbonylContact O-C 3.54Å; D279-N282 PolarHBondContact O-N 2.92Å; E280-N282 VanDerWaalsContact C-N 3.31Å; N282-S284 PolarHBondContact O-N 3.32Å; N282-R285 VanDerWaalsContact ND2-CZ 3.28Å; N282-R285 PolarHBondContact ND2-NE 2.74Å; N282-R285 VanDerWaalsContact ND2-NE 3.17Å; N282-R285 PolarHBondContact ND2-NH2 2.81Å; N282-R285 PolarHBondContact O-N 3.25Å
283	L	92.1	Very high	88.9	Confident	31 Å²	31	43.6 Å²	43.6	16%	0.162	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-69	-13	178	-63.6	172.9	0	0	0	114	Y127 V278 R285 Y286	Y127-L283 HydrophobicContact CD1-CD2 4.48Å; Y127-L283 HydrophobicContact CG-CD2 4.01Å; V278-L283 HydrophobicContact CG1-CD2 3.93Å; L283-R285 PolarHBondContact O-N 2.91Å; L283-Y286 HydrophobicContact CD2-CD2 4.13Å; L283-Y286 HydrophobicContact CD2-CE2 4.37Å; L283-Y286 PolarHBondContact O-N 2.87Å
284	S	91.3	Very high	89.4	Confident	21 Å²	21	46.3 Å²	46.3	15%	0.147	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-66.8	-9	174.7	-72.2	0	0	0	0	113.8	T79 Y80 C81 N282	T79-S284 WeakPolarHBondContact O-CB 3.12Å; T79-S284 PolarHBondContact O-OG 3.24Å; T79-S284 VanDerWaalsContact O-OG 3.08Å; Y80-S284 WeakPolarHBondContact CA-O 3.47Å; C81-S284 PolarHBondContact N-O 3.02Å; C81-S284 VanDerWaalsContact N-O 3.09Å; N282-S284 PolarHBondContact O-N 3.32Å
285	R	89.3	Confident	90.3	Very high	74 Å²	74	44.6 Å²	44.6	28%	0.279	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-80.7	-19.9	173.7	-67.1	178.2	173.3	150.8	5.3	113.8	C81 P86 D279 N282 L283	C81-R285 HydrophobicContact CB-CB 4.46Å; C81-R285 HydrophobicContact CB-CG 3.74Å; C81-R285 WeakPolarHBondContact SG-CG 3.26Å; P86-R285 PolarHBondContact O-NE 3.32Å; P86-R285 PolarHBondContact O-NH2 3.17Å; D279-R285 IonicContact OD2-CZ 3.91Å; D279-R285 IonicContact OD2-NH1 2.92Å; D279-R285 PolarHBondContact OD2-NH1 2.78Å; N282-R285 VanDerWaalsContact ND2-CZ 3.28Å; N282-R285 PolarHBondContact ND2-NE 2.74Å; N282-R285 VanDerWaalsContact ND2-NE 3.17Å; N282-R285 PolarHBondContact ND2-NH2 2.81Å; N282-R285 PolarHBondContact O-N 3.25Å; L283-R285 PolarHBondContact O-N 2.91Å
286	Y	92.9	Very high	91.8	Very high	14 Å²	14	44.4 Å²	44.4	6%	0.055	23%	0.232	C	C	.	.			trans	-109.7	109.2	-169.8	-50	-63.7	0	0	0	110.3	T123 W124 A272 T273 V278 D279 L283	T123-Y286 CarbonylContact C-O 3.26Å; T123-Y286 WeakPolarHBondContact CA-O 3.19Å; W124-Y286 WeakPolarHBondContact CB-O 3.32Å; W124-Y286 HydrophobicContact CE3-CG 4.23Å; W124-Y286 PolarHBondContact N-O 2.98Å; A272-Y286 WeakPolarHBondContact O-CD1 3.09Å; T273-Y286 HydrophobicContact CG2-CD1 4.25Å; T273-Y286 HydrophobicContact CG2-CE1 4.33Å; V278-Y286 HydrophobicContact CG1-CD2 4.1Å; V278-Y286 HydrophobicContact CG1-CE2 3.63Å; D279-Y286 PolarHBondContact N-OH 3.09Å; L283-Y286 HydrophobicContact CD2-CD2 4.13Å; L283-Y286 HydrophobicContact CD2-CE2 4.37Å; L283-Y286 PolarHBondContact O-N 2.87Å
287	F	95.7	Very high	93	Very high	16 Å²	16	39.4 Å²	39.4	7%	0.07	20%	0.202	C	C	.	.			trans	-159.1	171.8	177.3	56.5	-87.2	0	0	0	108.5	Y80 C81 Q120 A289	Y80-F287 AromaticContact CD2-CE1 3.94Å; Y80-F287 HydrophobicContact CD2-CE1 3.94Å; Y80-F287 HydrophobicContact CD2-CE2 4.37Å; Y80-F287 AromaticContact CD2-CZ 3.64Å; Y80-F287 HydrophobicContact CD2-CZ 3.64Å; Y80-F287 HydrophobicContact CE2-CZ 4.32Å; Y80-F287 HydrophobicContact CG-CE1 4.42Å; Y80-F287 HydrophobicContact CG-CZ 4.44Å; C81-F287 WeakPolarHBondContact O-CE1 3.22Å; Q120-F287 HydrophobicContact CG-CD2 3.78Å; Q120-F287 HydrophobicContact CG-CE2 4.19Å; F287-A289 HydrophobicContact CD2-CB 4.16Å; F287-A289 HydrophobicContact CE2-CB 3.94Å
288	Y	97.4	Very high	93.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.			trans	-104.7	137.1	168.2	-55.1	-77.7	0	0	0	109.3	Q120 S121 L131 V133 P158 L268 R270 P271	Q120-Y288 CarbonylContact C-O 3.59Å; Q120-Y288 WeakPolarHBondContact CA-O 3.3Å; S121-Y288 PolarHBondContact N-O 3.2Å; S121-Y288 PolarHBondContact OG-N 3.37Å; S121-Y288 PolarHBondContact OG-O 2.8Å; L131-Y288 HydrophobicContact CB-CE2 4.43Å; L131-Y288 HydrophobicContact CD2-CD2 4Å; L131-Y288 HydrophobicContact CD2-CE2 3.8Å; L131-Y288 HydrophobicContact CG-CD2 4.35Å; L131-Y288 HydrophobicContact CG-CE2 3.84Å; L131-Y288 WeakPolarHBondContact O-CE2 3.42Å; L131-Y288 PolarHBondContact O-OH 3.41Å; V133-Y288 HydrophobicContact CB-CD2 4.49Å; V133-Y288 HydrophobicContact CG2-CD2 3.72Å; V133-Y288 HydrophobicContact CG2-CE2 3.76Å; P158-Y288 HydrophobicContact CB-CE1 4.07Å; P158-Y288 HydrophobicContact CG-CD1 4.15Å; P158-Y288 HydrophobicContact CG-CE1 3.99Å; L268-Y288 HydrophobicContact CB-CD1 4.15Å; L268-Y288 HydrophobicContact CB-CD2 4.27Å; L268-Y288 HydrophobicContact CB-CE1 3.71Å; L268-Y288 HydrophobicContact CB-CE2 3.85Å; L268-Y288 HydrophobicContact CB-CG 4.39Å; L268-Y288 HydrophobicContact CD1-CD1 3.86Å; L268-Y288 HydrophobicContact CD1-CD2 4.01Å; L268-Y288 HydrophobicContact CD1-CE1 4.3Å; L268-Y288 HydrophobicContact CD1-CE2 4.44Å; L268-Y288 HydrophobicContact CD1-CG 3.67Å; L268-Y288 HydrophobicContact CD2-CD1 4.39Å; L268-Y288 HydrophobicContact CD2-CE1 4.4Å; L268-Y288 HydrophobicContact CG-CD1 4.37Å; L268-Y288 HydrophobicContact CG-CE1 4.36Å; R270-Y288 VanDerWaalsContact CA-OH 3.26Å; R270-Y288 WeakPolarHBondContact CA-OH 3.38Å; R270-Y288 PolarHBondContact N-OH 2.89Å; P271-Y288 HydrophobicContact CB-CD1 4.26Å; P271-Y288 HydrophobicContact CB-CE1 3.81Å; P271-Y288 HydrophobicContact CB-CE2 4.38Å; P271-Y288 WeakPolarHBondContact CD-OH 3.36Å
289	A	96.1	Very high	94	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	132.1	166.4	0	0	0	0	0	109.7	F118 W119 Q120 F153 E154 S155 F287	F118-A289 HydrophobicContact CD2-CB 3.78Å; F118-A289 HydrophobicContact CE2-CB 4.31Å; F118-A289 HydrophobicContact CG-CB 4.49Å; W119-A289 CarbonylContact O-C 3.37Å; W119-A289 WeakPolarHBondContact O-CA 3.38Å; W119-A289 WeakPolarHBondContact O-CB 3.4Å; Q120-A289 HydrophobicContact CB-CB 4.3Å; Q120-A289 HydrophobicContact CG-CB 4.46Å; F153-A289 CarbonylContact C-O 3.58Å; F153-A289 VanDerWaalsContact CA-O 3.28Å; F153-A289 WeakPolarHBondContact CA-O 3.26Å; F153-A289 WeakPolarHBondContact CD1-O 3.47Å; E154-A289 HydrophobicContact CB-CB 3.96Å; E154-A289 PolarHBondContact N-O 3.44Å; S155-A289 PolarHBondContact N-O 2.66Å; S155-A289 PolarHBondContact OG-N 2.95Å; S155-A289 PolarHBondContact OG-O 3.08Å; F287-A289 HydrophobicContact CD2-CB 4.16Å; F287-A289 HydrophobicContact CE2-CB 3.94Å
290	I	97	Very high	94.5	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	119.8	-177	-61.3	174.9	0	0	0	107.6	M107 F118 W119 I135 I151 T152 F153 L268 I293	M107-I290 HydrophobicContact CB-CG2 4.4Å; M107-I290 HydrophobicContact CG-CB 3.97Å; M107-I290 HydrophobicContact CG-CG2 3.87Å; M107-I290 HydrophobicContact SD-CB 3.91Å; M107-I290 HydrophobicContact SD-CD1 4.05Å; M107-I290 HydrophobicContact SD-CG2 3.97Å; F118-I290 CarbonylContact C-O 3.53Å; F118-I290 VanDerWaalsContact CA-O 3.28Å; F118-I290 WeakPolarHBondContact CA-O 3.46Å; F118-I290 WeakPolarHBondContact CB-O 3.43Å; W119-I290 HydrophobicContact CE3-CB 4.16Å; W119-I290 HydrophobicContact CE3-CD1 4.14Å; W119-I290 HydrophobicContact CE3-CG1 4.1Å; W119-I290 HydrophobicContact CZ3-CD1 4.03Å; W119-I290 HydrophobicContact CZ3-CG1 4.2Å; W119-I290 PolarHBondContact N-O 3.36Å; W119-I290 PolarHBondContact O-N 3.11Å; I135-I290 HydrophobicContact CD1-CD1 3.41Å; I135-I290 VanDerWaalsContact CD1-CD1 3.41Å; I151-I290 HydrophobicContact CG2-CD1 4.3Å; I151-I290 HydrophobicContact CG2-CG2 4.06Å; T152-I290 WeakPolarHBondContact O-CA 3.49Å; T152-I290 WeakPolarHBondContact O-CG2 3.07Å; F153-I290 HydrophobicContact CD1-CG1 3.86Å; F153-I290 HydrophobicContact CE1-CD1 4.07Å; F153-I290 HydrophobicContact CE1-CG1 3.7Å; F153-I290 HydrophobicContact CZ-CD1 4.37Å; F153-I290 HydrophobicContact CZ-CG1 4.3Å; L268-I290 HydrophobicContact CD1-CD1 4.47Å; I290-I293 HydrophobicContact CG2-CD1 4.11Å; I290-I293 HydrophobicContact CG2-CG1 3.7Å
291	S	94.7	Very high	94.8	Very high	11 Å²	11	25.5 Å²	25.5	8%	0.077	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	-32.2	179.4	50.2	0	0	0	0	112.8	L106 T117 T152	L106-S291 VanDerWaalsContact O-O 3.11Å; T117-S291 WeakPolarHBondContact O-CA 3.49Å; T117-S291 WeakPolarHBondContact O-CB 3.19Å; T152-S291 WeakPolarHBondContact CG2-OG 3.25Å; T152-S291 PolarHBondContact O-N 3.16Å; T152-S291 PolarHBondContact O-OG 3.07Å
292	D	95.8	Very high	95.3	Very high	17 Å²	17	21 Å²	21	9%	0.091	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	143.9	-177.4	-170.4	34.2	0	0	0	112.1	M107 T152 K294	M107-D292 CarbonylContact O-C 3.58Å; M107-D292 WeakPolarHBondContact O-CA 3.2Å; T152-D292 PolarHBondContact N-O 3.34Å; T152-D292 PolarHBondContact O-N 2.88Å; D292-K294 WeakPolarHBondContact OD2-CE 3.34Å; D292-K294 VanDerWaalsContact OD2-CG 3.25Å; D292-K294 WeakPolarHBondContact OD2-CG 3.45Å; D292-K294 IonicContact OD2-NZ 2.72Å
293	I	97.6	Very high	95.7	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	114.6	171.9	-60.4	175.8	0	0	0	107.8	T59 M107 F108 L137 V150 I151 I266 I290 V295	T59-I293 WeakPolarHBondContact CG2-O 3.28Å; M107-I293 HydrophobicContact CB-CD1 4.09Å; M107-I293 HydrophobicContact CB-CG1 4.26Å; M107-I293 HydrophobicContact CG-CD1 4.43Å; M107-I293 PolarHBondContact O-N 3.23Å; M107-I293 HydrophobicContact SD-CD1 3.77Å; F108-I293 HydrophobicContact CD1-CB 4.24Å; F108-I293 HydrophobicContact CE1-CB 3.88Å; F108-I293 HydrophobicContact CE1-CD1 3.96Å; F108-I293 HydrophobicContact CE1-CG1 4.37Å; F108-I293 HydrophobicContact CE1-CG2 4.33Å; F108-I293 HydrophobicContact CZ-CD1 4.2Å; L137-I293 HydrophobicContact CD1-CG2 4.02Å; V150-I293 CarbonylContact O-C 3.55Å; V150-I293 WeakPolarHBondContact O-CA 3.24Å; I151-I293 HydrophobicContact CG2-CG1 4.3Å; I266-I293 HydrophobicContact CD1-CD1 3.87Å; I290-I293 HydrophobicContact CG2-CD1 4.11Å; I290-I293 HydrophobicContact CG2-CG1 3.7Å; I293-V295 HydrophobicContact CG2-CG2 4.16Å
294	K	96.9	Very high	96	Very high	71 Å²	71	18.3 Å²	18.3	31%	0.309	8%	0.084	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	126.6	176.6	-58.4	-172.4	-173.8	178.5	0	111.2	E111 I149 V150 D292	E111-K294 IonicContact OE1-NZ 3.47Å; E111-K294 PolarHBondContact OE1-NZ 2.53Å; E111-K294 WeakPolarHBondContact OE2-CE 3.42Å; E111-K294 IonicContact OE2-NZ 3.66Å; E111-K294 PolarHBondContact OE2-NZ 3.35Å; I149-K294 WeakPolarHBondContact CA-O 3.49Å; V150-K294 HydrophobicContact CB-CB 4.33Å; V150-K294 PolarHBondContact N-O 3.3Å; V150-K294 VanDerWaalsContact N-O 3.16Å; V150-K294 PolarHBondContact O-N 2.89Å; D292-K294 WeakPolarHBondContact OD2-CE 3.34Å; D292-K294 VanDerWaalsContact OD2-CG 3.25Å; D292-K294 WeakPolarHBondContact OD2-CG 3.45Å; D292-K294 IonicContact OD2-NZ 2.72Å
295	V	97.9	Very high	96.3	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	8%	0.077	C	C	.	.			trans	-132.8	104.1	173.2	-175.7	0	0	0	0	108.7	M58 T59 W139 L145 I149 L264 I293	M58-V295 HydrophobicContact CB-CG1 4.36Å; M58-V295 WeakPolarHBondContact CB-O 3.03Å; M58-V295 PolarHBondContact N-O 2.82Å; T59-V295 HydrophobicContact CG2-CB 4.21Å; T59-V295 HydrophobicContact CG2-CG2 4.46Å; W139-V295 HydrophobicContact CH2-CG1 4.23Å; W139-V295 HydrophobicContact CH2-CG2 4.4Å; W139-V295 HydrophobicContact CZ2-CB 4.17Å; W139-V295 HydrophobicContact CZ2-CG1 3.88Å; W139-V295 HydrophobicContact CZ2-CG2 4.21Å; L145-V295 HydrophobicContact CD2-CG1 3.59Å; I149-V295 HydrophobicContact CG2-CG2 4.24Å; L264-V295 HydrophobicContact CD1-CG2 4.31Å; I293-V295 HydrophobicContact CG2-CG2 4.16Å
296	Q	97.1	Very high	96.7	Very high	65 Å²	65	17 Å²	17	30%	0.304	8%	0.081	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.3	176.6	-72.4	-73.9	-25.5	0	0	110.4	A56 T146 D147	A56-Q296 PolarHBondContact O-OE1 3.04Å; A56-Q296 VanDerWaalsContact O-OE1 3.14Å; T146-Q296 PolarHBondContact N-O 2.89Å; T146-Q296 PolarHBondContact OG1-O 2.83Å; D147-Q296 HydrophobicContact CB-CB 3.66Å; D147-Q296 HydrophobicContact CB-CG 4.25Å
297	G	96.4	Very high	96.8	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	-174.1	-178.6	0	0	0	0	0	112.7	A55 A56 E144 T146	A55-G297 CarbonylContact C-O 3.45Å; A55-G297 WeakPolarHBondContact CA-O 3.44Å; A56-G297 PolarHBondContact N-O 2.83Å; A56-G297 PolarHBondContact O-N 2.88Å; A56-G297 VanDerWaalsContact O-N 3.08Å; A56-G297 VanDerWaalsContact O-O 3.11Å; E144-G297 CarbonylContact O-C 3.33Å; E144-G297 VanDerWaalsContact O-CA 3.23Å; E144-G297 WeakPolarHBondContact O-CA 3.32Å; T146-G297 WeakPolarHBondContact OG1-CA 3.28Å; T146-G297 PolarHBondContact OG1-N 2.8Å
298	R	95.9	Very high	96.8	Very high	41 Å²	41	19.1 Å²	19.1	16%	0.155	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	156.9	175.5	58.8	-175.9	155.6	-154.4	-4.9	110.6	P53 I143 E144 T146 K300	P53-R298 WeakPolarHBondContact O-CD 3.39Å; I143-R298 CarbonylContact C-O 3.6Å; I143-R298 WeakPolarHBondContact CA-O 3.08Å; I143-R298 WeakPolarHBondContact CG2-O 3.2Å; E144-R298 HydrophobicContact CB-CG 4.26Å; E144-R298 PolarHBondContact N-O 2.84Å; E144-R298 PolarHBondContact O-N 2.87Å; T146-R298 HydrophobicContact CG2-CG 4.16Å; R298-K300 PolarHBondContact O-N 2.92Å
299	C	96.5	Very high	96.6	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.034	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	131.7	171.4	-74.6	0	0	0	0	112	P53 C301 C308 L315	P53-C299 HydrophobicContact CG-CB 4.16Å; C299-C301 PolarHBondContact O-N 3.35Å; C299-C308 HydrophobicContact CB-CB 3.94Å; C299-C308 WeakPolarHBondContact CB-SG 3.25Å; C299-C308 WeakPolarHBondContact SG-CB 3.04Å; C299-C308 CovalentContact SG-SG 2.03Å; C299-C308 PolarHBondContact SG-SG 3.4Å; C299-L315 WeakPolarHBondContact SG-CD2 3.24Å; C299-L315 VanDerWaalsContact SG-CG 3.56Å
300	K	97.4	Very high	96.5	Very high	24 Å²	24	26.7 Å²	26.7	10%	0.104	14%	0.137	C	C	.	.			trans	-67.7	106.3	164.8	-173.6	169.8	-167.5	165.9	0	109.3	K141 T142 E144 D257 T260 R298 C317 D327	K141-K300 PolarHBondContact NZ-O 3.02Å; T142-K300 HydrophobicContact CG2-CB 3.91Å; T142-K300 HydrophobicContact CG2-CD 3.5Å; T142-K300 VanDerWaalsContact CG2-CD 3.5Å; T142-K300 HydrophobicContact CG2-CG 4.3Å; T142-K300 WeakPolarHBondContact O-CB 3.17Å; T142-K300 PolarHBondContact O-N 3.11Å; E144-K300 HydrophobicContact CG-CB 4.06Å; E144-K300 HydrophobicContact CG-CG 4.29Å; E144-K300 WeakPolarHBondContact OE1-CG 3.25Å; D257-K300 IonicContact OD1-NZ 3.31Å; D257-K300 PolarHBondContact OD1-NZ 2.94Å; T260-K300 HydrophobicContact CG2-CD 3.84Å; T260-K300 PolarHBondContact OG1-NZ 3.13Å; R298-K300 PolarHBondContact O-N 2.92Å; K300-C317 PolarHBondContact O-SG 2.73Å; K300-C317 VanDerWaalsContact O-SG 3.35Å; K300-D327 WeakPolarHBondContact O-CA 3.17Å; K300-D327 WeakPolarHBondContact O-CB 3.49Å
301	C	97.8	Very high	96.2	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.02	16%	0.162	C	C	.	.			trans	-117.2	14.2	176	-55.8	0	0	0	0	112.8	P53 C299 L303 H304 A305 C317 D327 C328	P53-C301 HydrophobicContact CG-CB 4.48Å; P53-C301 VanDerWaalsContact CG-SG 3.6Å; C299-C301 PolarHBondContact O-N 3.35Å; C301-L303 PolarHBondContact O-N 3.28Å; C301-L303 VanDerWaalsContact O-N 3.12Å; C301-H304 PolarHBondContact O-N 3.48Å; C301-A305 HydrophobicContact CB-CB 3.73Å; C301-C317 WeakPolarHBondContact CA-SG 3.46Å; C301-C317 HydrophobicContact CB-CB 3.83Å; C301-C317 WeakPolarHBondContact CB-SG 3.38Å; C301-C317 WeakPolarHBondContact SG-CB 3.48Å; C301-C317 CovalentContact SG-SG 2.03Å; C301-C317 PolarHBondContact SG-SG 3.39Å; C301-D327 CarbonylContact C-O 3.48Å; C301-C328 WeakPolarHBondContact O-CB 3.48Å
302	N	97.1	Very high	95.9	Very high	15 Å²	15	39.3 Å²	39.3	8%	0.08	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.5	36	178.8	-66.6	-55.5	0	0	0	114.2	R256 H304 D327 W340 A342 G343	R256-N302 PolarHBondContact NH2-OD1 2.73Å; N302-H304 VanDerWaalsContact C-N 3.27Å; N302-H304 PolarHBondContact O-CD2 2.83Å; N302-H304 PolarHBondContact O-N 3.06Å; N302-H304 PolarHBondContact O-NE2 3.49Å; N302-D327 PolarHBondContact ND2-O 3Å; N302-W340 HydrophobicContact CB-CH2 4.34Å; N302-W340 HydrophobicContact CB-CZ2 3.83Å; N302-A342 HydrophobicContact CB-CB 4Å; N302-G343 PolarHBondContact O-N 3.22Å
303	L	96.9	Very high	95.4	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.037	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	28.8	-177	-66.6	167.5	0	0	0	114.9	A50 C51 Q52 C301 G343 Y345	A50-L303 HydrophobicContact CB-CB 4.18Å; A50-L303 HydrophobicContact CB-CD1 4.44Å; A50-L303 HydrophobicContact CB-CD2 4.34Å; C51-L303 PolarHBondContact N-O 3.13Å; C51-L303 CarbonylContact O-C 3.56Å; C51-L303 WeakPolarHBondContact O-CA 3.48Å; Q52-L303 HydrophobicContact CB-CD2 3.97Å; C301-L303 PolarHBondContact O-N 3.28Å; C301-L303 VanDerWaalsContact O-N 3.12Å; L303-G343 WeakPolarHBondContact CD1-O 3.48Å; L303-Y345 HydrophobicContact CD1-CD1 3.98Å; L303-Y345 HydrophobicContact CD1-CD2 4.17Å; L303-Y345 HydrophobicContact CD1-CE1 3.99Å; L303-Y345 HydrophobicContact CD1-CE2 4.14Å; L303-Y345 HydrophobicContact CD1-CG 4.11Å; L303-Y345 HydrophobicContact CD2-CD1 3.94Å; L303-Y345 HydrophobicContact CD2-CE1 3.4Å; L303-Y345 HydrophobicContact CG-CE1 4.28Å
304	H	98.1	Very high	95.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-125.1	16.5	178.7	-52.5	-74.7	0	0	0	115.3	C51 C301 N302 E320 H321 T323 C328 W340 S341 A342 G343 A353	C51-H304 PolarHBondContact O-N 2.84Å; C301-H304 PolarHBondContact O-N 3.48Å; N302-H304 VanDerWaalsContact C-N 3.27Å; N302-H304 PolarHBondContact O-CD2 2.83Å; N302-H304 PolarHBondContact O-N 3.06Å; N302-H304 PolarHBondContact O-NE2 3.49Å; H304-E320 WeakPolarHBondContact O-CA 3.44Å; H304-E320 WeakPolarHBondContact O-CB 3.32Å; H304-E320 PolarHBondContact O-N 2.85Å; H304-H321 WeakPolarHBondContact CA-ND1 3.05Å; H304-H321 HydrophobicContact CB-CB 4.17Å; H304-H321 AromaticContact CG-ND1 3.73Å; H304-H321 WeakPolarHBondContact ND1-CB 3.13Å; H304-H321 AromaticContact ND1-CG 3.63Å; H304-H321 AromaticContact ND1-ND1 3.12Å; H304-H321 PolarHBondContact ND1-ND1 3.4Å; H304-H321 VanDerWaalsContact ND1-ND1 3.12Å; H304-T323 HydrophobicContact CB-CG2 4.19Å; H304-C328 HydrophobicContact CB-CB 3.92Å; H304-W340 AromaticContact NE2-NE1 3.73Å; H304-S341 PolarHBondContact CE1-O 2.69Å; H304-S341 PolarHBondContact NE2-O 2.77Å; H304-A342 WeakPolarHBondContact NE2-CA 3.34Å; H304-G343 PolarHBondContact CE1-N 2.84Å; H304-G343 PolarHBondContact NE2-N 2.93Å; H304-A353 PolarHBondContact CE1-O 2.03Å; H304-A353 PolarHBondContact ND1-O 3.46Å; H304-A353 VanDerWaalsContact ND1-O 3.16Å
305	A	97.9	Very high	94.9	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.234	C	C	.	.			trans	-153.1	142.6	170	0	0	0	0	0	109.4	C51 Q52 P53 C301 C317 E318	C51-A305 CarbonylContact C-O 3.59Å; C51-A305 PolarHBondContact O-N 2.82Å; C51-A305 VanDerWaalsContact O-O 3.12Å; C51-A305 PolarHBondContact SG-N 3.28Å; C51-A305 VanDerWaalsContact SG-N 3.4Å; Q52-A305 CarbonylContact C-O 3.56Å; Q52-A305 VanDerWaalsContact C-O 3.26Å; Q52-A305 WeakPolarHBondContact CA-O 3.1Å; Q52-A305 PolarHBondContact N-O 3.2Å; P53-A305 WeakPolarHBondContact CD-O 3.36Å; C301-A305 HydrophobicContact CB-CB 3.73Å; A305-C317 HydrophobicContact CB-CB 4Å; A305-E318 VanDerWaalsContact CB-O 3.28Å; A305-E318 WeakPolarHBondContact CB-O 3.03Å
306	N	96.6	Very high	94.8	Very high	67 Å²	67	49.3 Å²	49.3	36%	0.358	25%	0.245	S	C	.	.	S	Bend	trans	-100.8	-1.2	174.7	64.3	-14.8	0	0	0	113.2	D32 C51 P53	D32-N306 WeakPolarHBondContact O-CB 3.46Å; D32-N306 PolarHBondContact O-ND2 3.19Å; C51-N306 HydrophobicContact CB-CB 4.24Å; P53-N306 WeakPolarHBondContact CA-O 3.37Å
307	S	95.5	Very high	94.8	Very high	36 Å²	36	46.9 Å²	46.9	25%	0.252	24%	0.235	S	C	.	.			trans	-141.4	157.2	179.7	58.3	0	0	0	0	111.6	E318	S307-E318 WeakPolarHBondContact CB-OE2 3.37Å; S307-E318 PolarHBondContact O-N 2.91Å; S307-E318 VanDerWaalsContact O-N 3.16Å; S307-E318 WeakPolarHBondContact OG-CB 3.02Å; S307-E318 PolarHBondContact OG-OE2 3.47Å
308	C	95.4	Very high	94.9	Very high	38 Å²	38	51.8 Å²	51.8	26%	0.257	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	133	177.4	-126	0	0	0	0	108.5	C299 L315 S316	C299-C308 HydrophobicContact CB-CB 3.94Å; C299-C308 WeakPolarHBondContact CB-SG 3.25Å; C299-C308 WeakPolarHBondContact SG-CB 3.04Å; C299-C308 CovalentContact SG-SG 2.03Å; C299-C308 PolarHBondContact SG-SG 3.4Å; C308-L315 HydrophobicContact CB-CD1 4.13Å; C308-L315 HydrophobicContact CB-CG 4.46Å; C308-S316 CarbonylContact C-O 3.53Å; C308-S316 WeakPolarHBondContact CA-O 3.43Å; C308-S316 VanDerWaalsContact SG-C 3.53Å; C308-S316 PolarHBondContact SG-O 2.93Å
309	V	94.8	Very high	95	Very high	64 Å²	64	51.1 Å²	51.1	39%	0.388	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	134.6	-179.6	175.4	0	0	0	0	109.2	D311 L315 S316 E318	V309-D311 HydrophobicContact CG1-CB 4.43Å; V309-L315 CarbonylContact O-C 3.54Å; V309-L315 WeakPolarHBondContact O-CA 3.49Å; V309-S316 PolarHBondContact N-O 2.79Å; V309-S316 PolarHBondContact O-N 2.94Å; V309-E318 HydrophobicContact CB-CG 4.41Å; V309-E318 HydrophobicContact CG2-CG 3.52Å; V309-E318 WeakPolarHBondContact CG2-OE1 2.81Å
310	F	93.7	Very high	95.1	Very high	95 Å²	95	53.6 Å²	53.6	42%	0.417	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	103	171.3	-170.3	-108.7	0	0	0	108.9	F61 E313 L315	F61-F310 HydrophobicContact CB-CD2 4.33Å; F61-F310 HydrophobicContact CB-CE2 4.11Å; F61-F310 HydrophobicContact CD1-CB 4.13Å; F61-F310 HydrophobicContact CD1-CD1 4.3Å; F61-F310 AromaticContact CD1-CD2 3.58Å; F61-F310 HydrophobicContact CD1-CD2 3.58Å; F61-F310 AromaticContact CD1-CE2 3.96Å; F61-F310 HydrophobicContact CD1-CE2 3.96Å; F61-F310 AromaticContact CD1-CG 3.76Å; F61-F310 HydrophobicContact CD1-CG 3.76Å; F61-F310 HydrophobicContact CD1-CZ 4.44Å; F61-F310 HydrophobicContact CE1-CB 4.06Å; F61-F310 HydrophobicContact CE1-CD2 4.36Å; F61-F310 HydrophobicContact CE1-CG 4.13Å; F61-F310 HydrophobicContact CG-CD2 4.31Å; F310-E313 HydrophobicContact CZ-CB 4.49Å; F310-L315 HydrophobicContact CB-CD1 4Å; F310-L315 HydrophobicContact CD2-CB 4.06Å; F310-L315 HydrophobicContact CD2-CD1 4.23Å
311	D	90.8	Very high	95.1	Very high	95 Å²	95	52.5 Å²	52.5	51%	0.508	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.3	176.9	-179.5	41.2	0	0	0	109.6	V309 E313 K314	V309-D311 HydrophobicContact CG1-CB 4.43Å; D311-E313 VanDerWaalsContact C-N 3.35Å; D311-E313 PolarHBondContact O-N 2.89Å; D311-K314 PolarHBondContact N-O 2.89Å; D311-K314 WeakPolarHBondContact O-CA 3.36Å; D311-K314 WeakPolarHBondContact O-CB 3.28Å; D311-K314 PolarHBondContact O-N 3.27Å; D311-K314 VanDerWaalsContact O-O 3.12Å
312	K	87.9	Confident	95.1	Very high	181 Å²	181	53.8 Å²	53.8	79%	0.787	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	53.2	177.5	-62.9	166.6	-171.1	170.8	0	113.4	K314	K312-K314 PolarHBondContact O-N 2.89Å
313	E	86.1	Confident	95.1	Very high	166 Å²	166	53 Å²	53	78%	0.776	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	23.3	-179.2	-55	-178.5	165.5	0	0	114.3	F310 D311	F310-E313 HydrophobicContact CZ-CB 4.49Å; D311-E313 VanDerWaalsContact C-N 3.35Å; D311-E313 PolarHBondContact O-N 2.89Å
314	K	89.6	Confident	95.2	Very high	94 Å²	94	55.2 Å²	55.2	41%	0.409	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	118.8	-179.7	-172.1	179	179.3	176.2	0	110.8	D311 K312	D311-K314 PolarHBondContact N-O 2.89Å; D311-K314 WeakPolarHBondContact O-CA 3.36Å; D311-K314 WeakPolarHBondContact O-CB 3.28Å; D311-K314 PolarHBondContact O-N 3.27Å; D311-K314 VanDerWaalsContact O-O 3.12Å; K312-K314 PolarHBondContact O-N 2.89Å
315	L	93.8	Very high	95.1	Very high	6 Å²	6	56 Å²	56	3%	0.031	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	133.4	170.5	-164.9	63.4	0	0	0	109.6	M58 F61 K141 C299 C308 V309 F310	M58-L315 HydrophobicContact CE-CD2 3.63Å; F61-L315 HydrophobicContact CB-CD2 4.43Å; F61-L315 HydrophobicContact CD1-CD1 4.43Å; F61-L315 HydrophobicContact CD2-CD2 4.18Å; F61-L315 HydrophobicContact CG-CD2 4.28Å; K141-L315 HydrophobicContact CB-CB 4.05Å; K141-L315 WeakPolarHBondContact CD-O 3.28Å; K141-L315 HydrophobicContact CG-CB 4.06Å; K141-L315 HydrophobicContact CG-CD2 4.3Å; K141-L315 HydrophobicContact CG-CG 4.28Å; C299-L315 WeakPolarHBondContact SG-CD2 3.24Å; C299-L315 VanDerWaalsContact SG-CG 3.56Å; C308-L315 HydrophobicContact CB-CD1 4.13Å; C308-L315 HydrophobicContact CB-CG 4.46Å; V309-L315 CarbonylContact O-C 3.54Å; V309-L315 WeakPolarHBondContact O-CA 3.49Å; F310-L315 HydrophobicContact CB-CD1 4Å; F310-L315 HydrophobicContact CD2-CB 4.06Å; F310-L315 HydrophobicContact CD2-CD1 4.23Å
316	S	95.6	Very high	94.9	Very high	34 Å²	34	58.2 Å²	58.2	24%	0.238	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	144.8	-179.1	-71.7	0	0	0	0	112.2	C308 V309	C308-S316 CarbonylContact C-O 3.53Å; C308-S316 WeakPolarHBondContact CA-O 3.43Å; C308-S316 VanDerWaalsContact SG-C 3.53Å; C308-S316 PolarHBondContact SG-O 2.93Å; V309-S316 PolarHBondContact N-O 2.79Å; V309-S316 PolarHBondContact O-N 2.94Å
317	C	97.9	Very high	95	Very high	14 Å²	14	56.1 Å²	56.1	10%	0.095	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	140.1	179.1	-60.1	0	0	0	0	112	K300 C301 A305 C319 P326 C328	K300-C317 PolarHBondContact O-SG 2.73Å; K300-C317 VanDerWaalsContact O-SG 3.35Å; C301-C317 WeakPolarHBondContact CA-SG 3.46Å; C301-C317 HydrophobicContact CB-CB 3.83Å; C301-C317 WeakPolarHBondContact CB-SG 3.38Å; C301-C317 WeakPolarHBondContact SG-CB 3.48Å; C301-C317 CovalentContact SG-SG 2.03Å; C301-C317 PolarHBondContact SG-SG 3.39Å; A305-C317 HydrophobicContact CB-CB 4Å; C317-C319 PolarHBondContact O-N 3.32Å; C317-C319 VanDerWaalsContact O-N 3.13Å; C317-P326 WeakPolarHBondContact CB-O 3.41Å; C317-P326 PolarHBondContact N-O 3.07Å; C317-P326 PolarHBondContact SG-O 3.25Å; C317-C328 WeakPolarHBondContact CB-SG 3.43Å
318	E	97.5	Very high	95.1	Very high	103 Å²	103	54.4 Å²	54.4	48%	0.481	28%	0.281	S	S	.	.			trans	-83.6	82.5	168.4	-64.9	-170.1	109.1	0	0	110.1	A305 S307 V309 E320	A305-E318 VanDerWaalsContact CB-O 3.28Å; A305-E318 WeakPolarHBondContact CB-O 3.03Å; S307-E318 WeakPolarHBondContact CB-OE2 3.37Å; S307-E318 PolarHBondContact O-N 2.91Å; S307-E318 VanDerWaalsContact O-N 3.16Å; S307-E318 WeakPolarHBondContact OG-CB 3.02Å; S307-E318 PolarHBondContact OG-OE2 3.47Å; V309-E318 HydrophobicContact CB-CG 4.41Å; V309-E318 HydrophobicContact CG2-CG 3.52Å; V309-E318 WeakPolarHBondContact CG2-OE1 2.81Å; E318-E320 PolarHBondContact O-N 3.17Å
319	C	97.9	Very high	95.2	Very high	26 Å²	26	54.3 Å²	54.3	18%	0.176	29%	0.287	C	S	.	.			trans	-65	124.3	-167.9	-63.3	0	0	0	0	115	C317 T323 G325 C328	C317-C319 PolarHBondContact O-N 3.32Å; C317-C319 VanDerWaalsContact O-N 3.13Å; C319-T323 WeakPolarHBondContact CB-O 3.46Å; C319-T323 WeakPolarHBondContact CB-OG1 3.18Å; C319-G325 PolarHBondContact SG-O 2.72Å; C319-C328 WeakPolarHBondContact CA-SG 3.46Å; C319-C328 HydrophobicContact CB-CB 3.97Å; C319-C328 WeakPolarHBondContact CB-SG 3.42Å; C319-C328 WeakPolarHBondContact SG-CA 3.32Å; C319-C328 WeakPolarHBondContact SG-CB 3.36Å; C319-C328 CovalentContact SG-SG 2.05Å; C319-C328 PolarHBondContact SG-SG 3.4Å
320	E	97.9	Very high	95.3	Very high	58 Å²	58	58.1 Å²	58.1	27%	0.271	29%	0.294	S	S	.	.			trans	-98.5	-165	170	-74.8	-73.5	-175.4	0	0	110.7	C34 K35 H304 E318 N322 T323	C34-E320 HydrophobicContact CB-CB 4.01Å; C34-E320 HydrophobicContact CB-CG 4Å; K35-E320 IonicContact NZ-OE1 2.68Å; K35-E320 PolarHBondContact NZ-OE1 3.26Å; K35-E320 IonicContact NZ-OE2 2.78Å; K35-E320 PolarHBondContact NZ-OE2 3.36Å; H304-E320 WeakPolarHBondContact O-CA 3.44Å; H304-E320 WeakPolarHBondContact O-CB 3.32Å; H304-E320 PolarHBondContact O-N 2.85Å; E318-E320 PolarHBondContact O-N 3.17Å; E320-N322 PolarHBondContact O-N 3.05Å; E320-T323 WeakPolarHBondContact O-CB 3.21Å; E320-T323 PolarHBondContact O-N 2.92Å; E320-T323 PolarHBondContact O-OG1 2.8Å
321	H	97.7	Very high	95.5	Very high	1 Å²	1	54.3 Å²	54.3	1%	0.005	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	25.8	173	-57.6	155.2	0	0	0	114.6	C34 Y48 M49 H304 T323 I355 C356	C34-H321 PolarHBondContact O-NE2 2.84Å; Y48-H321 AromaticContact CD1-CD2 3.67Å; M49-H321 PolarHBondContact O-CE1 2.61Å; M49-H321 PolarHBondContact O-NE2 3.21Å; H304-H321 WeakPolarHBondContact CA-ND1 3.05Å; H304-H321 HydrophobicContact CB-CB 4.17Å; H304-H321 AromaticContact CG-ND1 3.73Å; H304-H321 WeakPolarHBondContact ND1-CB 3.13Å; H304-H321 AromaticContact ND1-CG 3.63Å; H304-H321 AromaticContact ND1-ND1 3.12Å; H304-H321 PolarHBondContact ND1-ND1 3.4Å; H304-H321 VanDerWaalsContact ND1-ND1 3.12Å; H321-T323 HydrophobicContact CB-CG2 4.28Å; H321-T323 PolarHBondContact O-N 3Å; H321-I355 HydrophobicContact CB-CB 4.24Å; H321-I355 HydrophobicContact CB-CG2 3.84Å; H321-C356 PolarHBondContact O-N 3.12Å
322	N	97.7	Very high	95.9	Very high	29 Å²	29	53.8 Å²	53.8	16%	0.155	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	57	27.9	-174	-57.8	-46.5	0	0	0	114.3	E320 K332 Y335 C356	E320-N322 PolarHBondContact O-N 3.05Å; N322-K332 WeakPolarHBondContact O-CB 3.14Å; N322-K332 WeakPolarHBondContact O-CG 3.36Å; N322-K332 PolarHBondContact O-N 3.09Å; N322-Y335 HydrophobicContact CB-CD1 3.61Å; N322-Y335 HydrophobicContact CB-CD2 3.96Å; N322-Y335 HydrophobicContact CB-CE1 4.06Å; N322-Y335 HydrophobicContact CB-CE2 4.38Å; N322-Y335 HydrophobicContact CB-CG 3.55Å; N322-Y335 VanDerWaalsContact CG-CD1 3.45Å; N322-Y335 VanDerWaalsContact ND2-CD1 3.32Å; N322-Y335 WeakPolarHBondContact ND2-CD1 3.24Å; N322-Y335 WeakPolarHBondContact ND2-CE1 3.43Å; N322-C356 HydrophobicContact CB-CB 3.93Å; N322-C356 PolarHBondContact ND2-O 3.11Å
323	T	98.4	Very high	96.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	167.6	176.3	64.9	0	0	0	0	111.9	H304 C319 E320 H321 C328 R330 K332	H304-T323 HydrophobicContact CB-CG2 4.19Å; C319-T323 WeakPolarHBondContact CB-O 3.46Å; C319-T323 WeakPolarHBondContact CB-OG1 3.18Å; E320-T323 WeakPolarHBondContact O-CB 3.21Å; E320-T323 PolarHBondContact O-N 2.92Å; E320-T323 PolarHBondContact O-OG1 2.8Å; H321-T323 HydrophobicContact CB-CG2 4.28Å; H321-T323 PolarHBondContact O-N 3Å; T323-C328 WeakPolarHBondContact OG1-CB 3.39Å; T323-R330 CarbonylContact C-O 3.58Å; T323-R330 VanDerWaalsContact CA-O 3.26Å; T323-R330 WeakPolarHBondContact CA-O 3.46Å; T323-K332 WeakPolarHBondContact O-CE 3.36Å
324	T	97.8	Very high	96.7	Very high	53 Å²	53	51.6 Å²	51.6	33%	0.325	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	173.9	177.8	-172	0	0	0	0	110.8	C328 R330 K332	T324-C328 CarbonylContact O-C 3.5Å; T324-R330 HydrophobicContact CG2-CG 3.86Å; T324-R330 PolarHBondContact N-O 3.13Å; T324-R330 WeakPolarHBondContact O-CG 3.37Å; T324-R330 PolarHBondContact O-N 2.03Å; T324-K332 HydrophobicContact CG2-CG 4.2Å
325	G	96.1	Very high	97	Very high	15 Å²	15	50.7 Å²	50.7	16%	0.155	26%	0.259	C	S	.	.	S	Bend	trans	96	169.2	-172.1	0	0	0	0	0	112.2	C319 D327 C328	C319-G325 PolarHBondContact SG-O 2.72Å; G325-D327 VanDerWaalsContact C-N 3.25Å; G325-D327 PolarHBondContact O-N 3.2Å; G325-C328 PolarHBondContact O-N 3.45Å
326	P	95.3	Very high	97.1	Very high	48 Å²	48	56.1 Å²	56.1	31%	0.312	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-32.6	-173.1	24.6	-34	0	0	0	113.3	K141 C317	K141-P326 VanDerWaalsContact CE-O 3.24Å; K141-P326 WeakPolarHBondContact CE-O 3.04Å; C317-P326 WeakPolarHBondContact CB-O 3.41Å; C317-P326 PolarHBondContact N-O 3.07Å; C317-P326 PolarHBondContact SG-O 3.25Å
327	D	97.4	Very high	97.1	Very high	23 Å²	23	56.2 Å²	56.2	12%	0.123	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.1	14.1	-178.4	-58.8	-15.5	0	0	0	112.2	K141 T142 K300 C301 N302 G325 G329	K141-D327 VanDerWaalsContact CE-OD1 3.32Å; K141-D327 WeakPolarHBondContact CE-OD1 3.4Å; K141-D327 IonicContact NZ-OD1 3.86Å; K141-D327 PolarHBondContact NZ-OD1 3.18Å; T142-D327 WeakPolarHBondContact CB-OD2 3.25Å; T142-D327 PolarHBondContact OG1-OD2 2.92Å; K300-D327 WeakPolarHBondContact O-CA 3.17Å; K300-D327 WeakPolarHBondContact O-CB 3.49Å; C301-D327 CarbonylContact C-O 3.48Å; N302-D327 PolarHBondContact ND2-O 3Å; G325-D327 VanDerWaalsContact C-N 3.25Å; G325-D327 PolarHBondContact O-N 3.2Å; D327-G329 PolarHBondContact O-N 3.01Å; D327-G329 VanDerWaalsContact O-N 3.16Å
328	C	98.1	Very high	96.9	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.305	C	S	.	.	S	Bend	trans	57.9	27.6	-173.9	-49.3	0	0	0	0	114.3	C301 H304 C317 C319 T323 T324 G325 R330 W340	C301-C328 WeakPolarHBondContact O-CB 3.48Å; H304-C328 HydrophobicContact CB-CB 3.92Å; C317-C328 WeakPolarHBondContact CB-SG 3.43Å; C319-C328 WeakPolarHBondContact CA-SG 3.46Å; C319-C328 HydrophobicContact CB-CB 3.97Å; C319-C328 WeakPolarHBondContact CB-SG 3.42Å; C319-C328 WeakPolarHBondContact SG-CA 3.32Å; C319-C328 WeakPolarHBondContact SG-CB 3.36Å; C319-C328 CovalentContact SG-SG 2.05Å; C319-C328 PolarHBondContact SG-SG 3.4Å; T323-C328 WeakPolarHBondContact OG1-CB 3.39Å; T324-C328 CarbonylContact O-C 3.5Å; G325-C328 PolarHBondContact O-N 3.45Å; C328-R330 VanDerWaalsContact C-N 3.28Å; C328-R330 PolarHBondContact O-N 3.33Å; C328-W340 PolarHBondContact O-NE1 3.09Å
329	G	97.3	Very high	96.8	Very high	36 Å²	36	60.1 Å²	60.1	37%	0.371	32%	0.317	S	S	.	.			trans	-82.3	15.6	-173.5	0	0	0	0	0	116.2	D327	D327-G329 PolarHBondContact O-N 3.01Å; D327-G329 VanDerWaalsContact O-N 3.16Å
330	R	97.3	Very high	96.8	Very high	144 Å²	144	63.3 Å²	63.3	54%	0.543	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	155.4	177.6	58.4	176.4	-176.3	-118	-0.2	111.9	T323 T324 C328	T323-R330 CarbonylContact C-O 3.58Å; T323-R330 VanDerWaalsContact CA-O 3.26Å; T323-R330 WeakPolarHBondContact CA-O 3.46Å; T324-R330 HydrophobicContact CG2-CG 3.86Å; T324-R330 PolarHBondContact N-O 3.13Å; T324-R330 WeakPolarHBondContact O-CG 3.37Å; T324-R330 PolarHBondContact O-N 2.03Å; C328-R330 VanDerWaalsContact C-N 3.28Å; C328-R330 PolarHBondContact O-N 3.33Å
331	C	98.3	Very high	96.8	Very high	14 Å²	14	62.7 Å²	62.7	10%	0.095	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	149	173.5	-62.6	0	0	0	0	112.9	Y335 Q336 C356	C331-Y335 VanDerWaalsContact CB-O 3.28Å; C331-Y335 WeakPolarHBondContact CB-O 3.36Å; C331-Q336 HydrophobicContact CB-CG 4.2Å; C331-C356 WeakPolarHBondContact CA-SG 3.39Å; C331-C356 HydrophobicContact CB-CB 3.63Å; C331-C356 WeakPolarHBondContact CB-SG 3.36Å; C331-C356 WeakPolarHBondContact SG-CB 3.39Å; C331-C356 CovalentContact SG-SG 2.04Å; C331-C356 PolarHBondContact SG-SG 3.25Å
332	K	97.9	Very high	96.7	Very high	85 Å²	85	63.7 Å²	63.7	37%	0.37	34%	0.336	S	S	.	.			trans	-61.8	152.4	166.9	-70.3	175.2	-172.1	178.1	0	110.1	N322 T323 T324 S334 Y335 Q336	N322-K332 WeakPolarHBondContact O-CB 3.14Å; N322-K332 WeakPolarHBondContact O-CG 3.36Å; N322-K332 PolarHBondContact O-N 3.09Å; T323-K332 WeakPolarHBondContact O-CE 3.36Å; T324-K332 HydrophobicContact CG2-CG 4.2Å; K332-S334 VanDerWaalsContact C-N 3.25Å; K332-S334 PolarHBondContact O-N 3.2Å; K332-S334 VanDerWaalsContact O-N 3.1Å; K332-Y335 HydrophobicContact CB-CD2 4.05Å; K332-Y335 PolarHBondContact O-N 2.58Å; K332-Q336 WeakPolarHBondContact O-CG 3.45Å
333	R	95.3	Very high	96.6	Very high	220 Å²	220	62.6 Å²	62.6	83%	0.83	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-35.1	-173.3	-68.4	-177.4	-178.5	171.8	0.5	114.6	Q336 N359	R333-Q336 PolarHBondContact O-OE1 3.09Å; R333-N359 PolarHBondContact O-ND2 3.41Å
334	S	96	Very high	96.4	Very high	80 Å²	80	63.7 Å²	63.7	56%	0.559	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	0.1	-179.9	-49.6	0	0	0	0	114.2	K332 P358 N359	K332-S334 VanDerWaalsContact C-N 3.25Å; K332-S334 PolarHBondContact O-N 3.2Å; K332-S334 VanDerWaalsContact O-N 3.1Å; S334-P358 CarbonylContact O-C 3.58Å; S334-P358 WeakPolarHBondContact O-CA 3.36Å; S334-N359 PolarHBondContact O-N 3.21Å; S334-N359 PolarHBondContact O-OD1 3.01Å
335	Y	96.4	Very high	96.2	Very high	76 Å²	76	61.5 Å²	61.5	30%	0.298	33%	0.325	S	S	.	.			trans	-123.1	38.3	-172.8	-69	-92.8	0	0	0	112.4	N322 C331 K332 C356 V357 P358	N322-Y335 HydrophobicContact CB-CD1 3.61Å; N322-Y335 HydrophobicContact CB-CD2 3.96Å; N322-Y335 HydrophobicContact CB-CE1 4.06Å; N322-Y335 HydrophobicContact CB-CE2 4.38Å; N322-Y335 HydrophobicContact CB-CG 3.55Å; N322-Y335 VanDerWaalsContact CG-CD1 3.45Å; N322-Y335 VanDerWaalsContact ND2-CD1 3.32Å; N322-Y335 WeakPolarHBondContact ND2-CD1 3.24Å; N322-Y335 WeakPolarHBondContact ND2-CE1 3.43Å; C331-Y335 VanDerWaalsContact CB-O 3.28Å; C331-Y335 WeakPolarHBondContact CB-O 3.36Å; K332-Y335 HydrophobicContact CB-CD2 4.05Å; K332-Y335 PolarHBondContact O-N 2.58Å; Y335-C356 WeakPolarHBondContact O-CB 3.4Å; Y335-V357 CarbonylContact C-O 2.85Å; Y335-V357 WeakPolarHBondContact CA-O 3.42Å; Y335-V357 VanDerWaalsContact O-O 3.05Å; Y335-P358 HydrophobicContact CD1-CB 4.5Å; Y335-P358 HydrophobicContact CD1-CG 3.94Å; Y335-P358 HydrophobicContact CE1-CG 3.8Å
336	Q	95.8	Very high	96	Very high	120 Å²	120	64 Å²	64	56%	0.561	33%	0.334	S	S	*	.			trans	-103.4	24.8	-179.2	-53.9	178.9	-55	0	0	112	C331 K332 R333 R338 V357 N359	C331-Q336 HydrophobicContact CB-CG 4.2Å; K332-Q336 WeakPolarHBondContact O-CG 3.45Å; R333-Q336 PolarHBondContact O-OE1 3.09Å; Q336-R338 PolarHBondContact O-N 3.04Å; Q336-V357 PolarHBondContact N-O 3.39Å; Q336-N359 VanDerWaalsContact CA-OD1 3.24Å; Q336-N359 WeakPolarHBondContact CA-OD1 3.49Å; Q336-N359 WeakPolarHBondContact CB-OD1 3.31Å; Q336-N359 PolarHBondContact N-OD1 2.71Å
337	G	94.8	Very high	95.8	Very high	35 Å²	35	65.8 Å²	65.8	36%	0.361	35%	0.346	S	S	.	.	S	Bend	trans	-65.3	-15.6	176.6	0	0	0	0	0	113.7	V357 P358 N359	G337-V357 PolarHBondContact N-O 3.16Å; G337-P358 WeakPolarHBondContact CA-O 3.45Å; G337-N359 PolarHBondContact N-OD1 3.3Å
338	R	94.1	Very high	95.3	Very high	111 Å²	111	68.5 Å²	68.5	42%	0.419	36%	0.36	S	S	.	.	S	Bend	trans	-140.2	161.8	167.4	74	-175.4	179.4	171.8	-1.2	111	Q336 I355 V357	Q336-R338 PolarHBondContact O-N 3.04Å; R338-I355 PolarHBondContact NE-O 3.37Å; R338-I355 PolarHBondContact NH2-O 3.02Å; R338-V357 HydrophobicContact CB-CG2 4.05Å; R338-V357 HydrophobicContact CG-CG1 4.49Å; R338-V357 HydrophobicContact CG-CG2 3.83Å
339	A	96	Very high	94.8	Very high	88 Å²	88	73.3 Å²	73.3	73%	0.727	39%	0.391	S	S	*	.			trans	-60.8	146.1	173.4	0	0	0	0	0	111
340	W	97.8	Very high	94.5	Very high	94 Å²	94	76.5 Å²	76.5	36%	0.356	40%	0.395	S	S	.	.			trans	-65.8	142.3	176.3	174.7	86.9	0	0	0	111	N302 H304 C328 A342	N302-W340 HydrophobicContact CB-CH2 4.34Å; N302-W340 HydrophobicContact CB-CZ2 3.83Å; H304-W340 AromaticContact NE2-NE1 3.73Å; C328-W340 PolarHBondContact O-NE1 3.09Å; W340-A342 HydrophobicContact CH2-CB 3.91Å; W340-A342 HydrophobicContact CZ2-CB 4.06Å
341	S	96.6	Very high	94.3	Very high	44 Å²	44	70.1 Å²	70.1	31%	0.308	37%	0.374	S	S	.	.			trans	-146.1	136.5	173.2	51	0	0	0	0	108.4	H304 N354	H304-S341 PolarHBondContact CE1-O 2.69Å; H304-S341 PolarHBondContact NE2-O 2.77Å; S341-N354 WeakPolarHBondContact OG-CB 3.23Å
342	A	96.1	Very high	94.1	Very high	23 Å²	23	71.9 Å²	71.9	19%	0.19	38%	0.384	C	S	.	.			trans	-57.8	156	173	0	0	0	0	0	111.1	N302 H304 W340 N354	N302-A342 HydrophobicContact CB-CB 4Å; H304-A342 WeakPolarHBondContact NE2-CA 3.34Å; W340-A342 HydrophobicContact CH2-CB 3.91Å; W340-A342 HydrophobicContact CZ2-CB 4.06Å; A342-N354 WeakPolarHBondContact O-CB 3.24Å; A342-N354 PolarHBondContact O-ND2 3.1Å
343	G	95.9	Very high	94	Very high	5 Å²	5	68 Å²	68	5%	0.052	37%	0.368	C	S	.	.			trans	-61.7	166.9	163.6	0	0	0	0	0	111.3	N302 L303 H304 T352	N302-G343 PolarHBondContact O-N 3.22Å; L303-G343 WeakPolarHBondContact CD1-O 3.48Å; H304-G343 PolarHBondContact CE1-N 2.84Å; H304-G343 PolarHBondContact NE2-N 2.93Å; G343-T352 CarbonylContact C-O 3.56Å; G343-T352 WeakPolarHBondContact CA-O 3.46Å
344	S	94.9	Very high	94.1	Very high	24 Å²	24	60 Å²	60	17%	0.168	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-132.3	143.6	175.6	153.8	0	0	0	0	109.4	A50 D250 L346 G351 T352	A50-S344 WeakPolarHBondContact CB-O 3.37Å; D250-S344 WeakPolarHBondContact OD2-CB 3.28Å; D250-S344 PolarHBondContact OD2-OG 2.81Å; S344-L346 PolarHBondContact O-N 2.78Å; S344-L346 PolarHBondContact OG-N 3.02Å; S344-L346 PolarHBondContact OG-O 2.95Å; S344-G351 CarbonylContact O-C 3.57Å; S344-G351 WeakPolarHBondContact O-CA 3.12Å; S344-T352 WeakPolarHBondContact CB-OG1 3.24Å; S344-T352 PolarHBondContact N-O 3.43Å; S344-T352 PolarHBondContact O-N 3.31Å
345	Y	92.8	Very high	94.1	Very high	6 Å²	6	58.1 Å²	58.1	2%	0.024	33%	0.325	C	S	.	.			trans	-63.2	-19.9	172	-63.7	-61.8	0	0	0	112.8	Y31 Q52 Y246 L249 D250 L303 P347 G351	Y31-Y345 HydrophobicContact CD1-CD1 4.42Å; Y31-Y345 AromaticContact CD2-CD1 3.62Å; Y31-Y345 HydrophobicContact CD2-CD1 3.62Å; Y31-Y345 AromaticContact CD2-CE1 3.8Å; Y31-Y345 HydrophobicContact CD2-CE1 3.8Å; Y31-Y345 HydrophobicContact CE1-CD1 4.13Å; Y31-Y345 AromaticContact CE2-CD1 3.3Å; Y31-Y345 HydrophobicContact CE2-CD1 3.3Å; Y31-Y345 AromaticContact CE2-CE1 3.89Å; Y31-Y345 HydrophobicContact CE2-CE1 3.89Å; Y31-Y345 HydrophobicContact CE2-CG 4.27Å; Y31-Y345 HydrophobicContact CG-CD1 4.19Å; Y31-Y345 HydrophobicContact CG-CE1 4.43Å; Y31-Y345 AromaticContact CZ-CD1 3.59Å; Y31-Y345 PolarHBondContact OH-O 3.2Å; Q52-Y345 VanDerWaalsContact OE1-CE1 3.3Å; Q52-Y345 PolarHBondContact OE1-OH 3.08Å; Y246-Y345 AromaticContact CD1-CD1 3.93Å; Y246-Y345 HydrophobicContact CD1-CD1 3.93Å; Y246-Y345 AromaticContact CD1-CD2 3.73Å; Y246-Y345 HydrophobicContact CD1-CD2 3.73Å; Y246-Y345 AromaticContact CD1-CE1 3.95Å; Y246-Y345 HydrophobicContact CD1-CE1 3.95Å; Y246-Y345 AromaticContact CD1-CE2 3.79Å; Y246-Y345 HydrophobicContact CD1-CE2 3.79Å; Y246-Y345 AromaticContact CD1-CG 3.8Å; Y246-Y345 HydrophobicContact CD1-CG 3.8Å; Y246-Y345 AromaticContact CD1-CZ 3.89Å; Y246-Y345 HydrophobicContact CE1-CD1 4.27Å; Y246-Y345 AromaticContact CE1-CE1 3.96Å; Y246-Y345 HydrophobicContact CE1-CE1 3.96Å; Y246-Y345 HydrophobicContact CE1-CE2 4.37Å; Y246-Y345 HydrophobicContact CG-CD1 4.27Å; Y246-Y345 HydrophobicContact CG-CD2 4.17Å; Y246-Y345 AromaticContact CG-CG 3.96Å; Y246-Y345 HydrophobicContact CG-CG 3.96Å; L249-Y345 HydrophobicContact CB-CE2 4.35Å; D250-Y345 VanDerWaalsContact OD1-CD2 3.22Å; D250-Y345 WeakPolarHBondContact OD1-CD2 3.05Å; D250-Y345 PolarHBondContact OD1-N 3.21Å; D250-Y345 WeakPolarHBondContact OD2-CA 3.45Å; D250-Y345 WeakPolarHBondContact OD2-CB 3.43Å; D250-Y345 PolarHBondContact OD2-N 3.48Å; L303-Y345 HydrophobicContact CD1-CD1 3.98Å; L303-Y345 HydrophobicContact CD1-CD2 4.17Å; L303-Y345 HydrophobicContact CD1-CE1 3.99Å; L303-Y345 HydrophobicContact CD1-CE2 4.14Å; L303-Y345 HydrophobicContact CD1-CG 4.11Å; L303-Y345 HydrophobicContact CD2-CD1 3.94Å; L303-Y345 HydrophobicContact CD2-CE1 3.4Å; L303-Y345 HydrophobicContact CG-CE1 4.28Å; Y345-P347 CarbonylContact O-C 3.53Å; Y345-G351 VanDerWaalsContact O-CA 3.3Å; Y345-G351 WeakPolarHBondContact O-CA 3.41Å
346	L	91.9	Very high	94.2	Very high	67 Å²	67	54.6 Å²	54.6	35%	0.351	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-93.4	142.2	179.6	-58.7	180	0	0	0	112.5	D250 S344 I348 G351 T352	D250-L346 PolarHBondContact OD2-N 2.94Å; D250-L346 VanDerWaalsContact OD2-N 3.14Å; S344-L346 PolarHBondContact O-N 2.78Å; S344-L346 PolarHBondContact OG-N 3.02Å; S344-L346 PolarHBondContact OG-O 2.95Å; L346-I348 HydrophobicContact CD2-CD1 4.34Å; L346-I348 HydrophobicContact CD2-CG1 4.1Å; L346-G351 CarbonylContact O-C 3.59Å; L346-T352 WeakPolarHBondContact O-CG2 3.2Å; L346-T352 PolarHBondContact O-N 3.17Å; L346-T352 VanDerWaalsContact O-N 3.16Å; L346-T352 PolarHBondContact O-OG1 3.48Å
347	P	92.1	Very high	94.1	Very high	87 Å²	87	51 Å²	51	57%	0.565	30%	0.298	S	S	*	.	S	Bend	cis	-81.6	145.2	-4.9	33.9	-32.9	0	0	0	112.5	Y345 K350 G351	Y345-P347 CarbonylContact O-C 3.53Å; P347-K350 PolarHBondContact O-N 2.84Å; P347-G351 WeakPolarHBondContact O-CA 3.45Å; P347-G351 PolarHBondContact O-N 3.35Å
348	I	86.2	Confident	94.2	Very high	79 Å²	79	53.1 Å²	53.1	41%	0.405	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	138	176	-60.5	171.3	0	0	0	109	A243 L346	A243-I348 VanDerWaalsContact CA-CD1 3.45Å; A243-I348 HydrophobicContact CB-CD1 3.3Å; L346-I348 HydrophobicContact CD2-CD1 4.34Å; L346-I348 HydrophobicContact CD2-CG1 4.1Å
349	P	87.7	Confident	94	Very high	101 Å²	101	50.9 Å²	50.9	66%	0.656	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	cis	-98.5	-12.3	12.6	36.6	-35.4	0	0	0	116	Y31	Y31-P349 WeakPolarHBondContact CE1-O 3.44Å
350	K	89.8	Confident	93.4	Very high	104 Å²	104	54 Å²	54	45%	0.452	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-25.4	-172.6	-71.8	-174.8	171.2	-171.9	0	113.6	D47 M49 A50 P347	D47-K350 IonicContact OD2-NZ 2.81Å; D47-K350 PolarHBondContact OD2-NZ 3.03Å; M49-K350 HydrophobicContact CB-CB 4.05Å; M49-K350 WeakPolarHBondContact CB-O 3.01Å; M49-K350 HydrophobicContact CE-CD 4.16Å; M49-K350 HydrophobicContact SD-CD 4.32Å; M49-K350 HydrophobicContact SD-CG 4.29Å; A50-K350 PolarHBondContact N-O 3.47Å; A50-K350 VanDerWaalsContact N-O 3.11Å; P347-K350 PolarHBondContact O-N 2.84Å
351	G	93.3	Very high	91.8	Very high	10 Å²	10	57.3 Å²	57.3	10%	0.103	33%	0.329	C	S	.	.			trans	66	-170.5	-169.7	0	0	0	0	0	112.7	S344 Y345 L346 P347	S344-G351 CarbonylContact O-C 3.57Å; S344-G351 WeakPolarHBondContact O-CA 3.12Å; Y345-G351 VanDerWaalsContact O-CA 3.3Å; Y345-G351 WeakPolarHBondContact O-CA 3.41Å; L346-G351 CarbonylContact O-C 3.59Å; P347-G351 WeakPolarHBondContact O-CA 3.45Å; P347-G351 PolarHBondContact O-N 3.35Å
352	T	95.3	Very high	89.8	Confident	50 Å²	50	57.3 Å²	57.3	31%	0.307	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-118	124.6	176	44.7	0	0	0	0	110.5	G343 S344 L346 N354	G343-T352 CarbonylContact C-O 3.56Å; G343-T352 WeakPolarHBondContact CA-O 3.46Å; S344-T352 WeakPolarHBondContact CB-OG1 3.24Å; S344-T352 PolarHBondContact N-O 3.43Å; S344-T352 PolarHBondContact O-N 3.31Å; L346-T352 WeakPolarHBondContact O-CG2 3.2Å; L346-T352 PolarHBondContact O-N 3.17Å; L346-T352 VanDerWaalsContact O-N 3.16Å; L346-T352 PolarHBondContact O-OG1 3.48Å; T352-N354 VanDerWaalsContact C-N 3.33Å; T352-N354 PolarHBondContact O-N 2.91Å
353	A	95.6	Very high	87.5	Confident	5 Å²	5	61.7 Å²	61.7	4%	0.041	36%	0.362	C	S	.	.			trans	-72.3	-24.5	-178.6	0	0	0	0	0	114.2	H304 I355	H304-A353 PolarHBondContact CE1-O 2.03Å; H304-A353 PolarHBondContact ND1-O 3.46Å; H304-A353 VanDerWaalsContact ND1-O 3.16Å; A353-I355 VanDerWaalsContact C-N 3.27Å; A353-I355 HydrophobicContact CB-CG2 3.68Å; A353-I355 PolarHBondContact O-N 2.98Å
354	N	96.4	Very high	85.1	Confident	52 Å²	52	67.5 Å²	67.5	28%	0.278	40%	0.397	S	S	.	.			trans	46.7	47.2	-177.1	-65.9	-28.1	0	0	0	114	S341 A342 T352	S341-N354 WeakPolarHBondContact OG-CB 3.23Å; A342-N354 WeakPolarHBondContact O-CB 3.24Å; A342-N354 PolarHBondContact O-ND2 3.1Å; T352-N354 VanDerWaalsContact C-N 3.33Å; T352-N354 PolarHBondContact O-N 2.91Å
355	I	96.9	Very high	82.7	Confident	39 Å²	39	73.2 Å²	73.2	20%	0.2	42%	0.423	C	S	.	.			trans	-58.4	151.5	-172.3	71.3	174.7	0	0	0	114.2	Y48 H321 R338 A353	Y48-I355 HydrophobicContact CD1-CG2 4.24Å; Y48-I355 HydrophobicContact CD2-CD1 3.83Å; Y48-I355 HydrophobicContact CD2-CG2 4.2Å; Y48-I355 HydrophobicContact CE2-CD1 4.03Å; Y48-I355 HydrophobicContact CG-CD1 4.47Å; Y48-I355 HydrophobicContact CG-CG2 3.79Å; H321-I355 HydrophobicContact CB-CB 4.24Å; H321-I355 HydrophobicContact CB-CG2 3.84Å; R338-I355 PolarHBondContact NE-O 3.37Å; R338-I355 PolarHBondContact NH2-O 3.02Å; A353-I355 VanDerWaalsContact C-N 3.27Å; A353-I355 HydrophobicContact CB-CG2 3.68Å; A353-I355 PolarHBondContact O-N 2.98Å
356	C	97.4	Very high	80.1	Confident	2 Å²	2	82.8 Å²	82.8	1%	0.014	46%	0.46	C	S	.	.			trans	-74.1	133.5	168.9	-69.5	0	0	0	0	110.4	H321 N322 C331 Y335	H321-C356 PolarHBondContact O-N 3.12Å; N322-C356 HydrophobicContact CB-CB 3.93Å; N322-C356 PolarHBondContact ND2-O 3.11Å; C331-C356 WeakPolarHBondContact CA-SG 3.39Å; C331-C356 HydrophobicContact CB-CB 3.63Å; C331-C356 WeakPolarHBondContact CB-SG 3.36Å; C331-C356 WeakPolarHBondContact SG-CB 3.39Å; C331-C356 CovalentContact SG-SG 2.04Å; C331-C356 PolarHBondContact SG-SG 3.25Å; Y335-C356 WeakPolarHBondContact O-CB 3.4Å
357	V	95.4	Very high	77.5	Confident	45 Å²	45	84.8 Å²	84.8	27%	0.273	48%	0.476	S	S	.	.			trans	-104.6	145.8	-174.4	-56	0	0	0	0	111.4	Y335 Q336 G337 R338	Y335-V357 CarbonylContact C-O 2.85Å; Y335-V357 WeakPolarHBondContact CA-O 3.42Å; Y335-V357 VanDerWaalsContact O-O 3.05Å; Q336-V357 PolarHBondContact N-O 3.39Å; G337-V357 PolarHBondContact N-O 3.16Å; R338-V357 HydrophobicContact CB-CG2 4.05Å; R338-V357 HydrophobicContact CG-CG1 4.49Å; R338-V357 HydrophobicContact CG-CG2 3.83Å
358	P	95	Very high	74.6	Confident	80 Å²	80	87.8 Å²	87.8	52%	0.519	49%	0.488	S	S	.	.			trans	-50.7	147.9	179.6	-27	34.6	0	0	0	113.3	S334 Y335 G337 N360	S334-P358 CarbonylContact O-C 3.58Å; S334-P358 WeakPolarHBondContact O-CA 3.36Å; Y335-P358 HydrophobicContact CD1-CB 4.5Å; Y335-P358 HydrophobicContact CD1-CG 3.94Å; Y335-P358 HydrophobicContact CE1-CG 3.8Å; G337-P358 WeakPolarHBondContact CA-O 3.45Å; P358-N360 PolarHBondContact O-N 2.88Å
359	N	91.6	Very high	72.5	Confident	64 Å²	64	90.5 Å²	90.5	34%	0.342	51%	0.508	S	S	.	.			trans	-59.3	137.3	171.8	-64.3	-11	0	0	0	109.4	R333 S334 Q336 G337 I361	R333-N359 PolarHBondContact O-ND2 3.41Å; S334-N359 PolarHBondContact O-N 3.21Å; S334-N359 PolarHBondContact O-OD1 3.01Å; Q336-N359 VanDerWaalsContact CA-OD1 3.24Å; Q336-N359 WeakPolarHBondContact CA-OD1 3.49Å; Q336-N359 WeakPolarHBondContact CB-OD1 3.31Å; Q336-N359 PolarHBondContact N-OD1 2.71Å; G337-N359 PolarHBondContact N-OD1 3.3Å; N359-I361 PolarHBondContact O-N 2.94Å
360	N	82.1	Confident	70.1	Confident	152 Å²	152	90.1 Å²	90.1	81%	0.813	51%	0.507	S	S	*	.			trans	-64.6	98.4	170.6	-76.9	-23.7	0	0	0	109	P358 G362	P358-N360 PolarHBondContact O-N 2.88Å; N360-G362 PolarHBondContact O-N 2.71Å
361	I	64.4	Low	67.9	Low	164 Å²	164	90.8 Å²	90.8	84%	0.841	53%	0.525	S	S	*	.			trans	-81	67	162.6	-49.8	175.4	0	0	0	106.5	N359	N359-I361 PolarHBondContact O-N 2.94Å
362	G	55.8	Low	65.2	Low	44 Å²	44	98.9 Å²	98.9	45%	0.454	57%	0.565	S	S	.	*			trans	-67.2	146.9	159.6	0	0	0	0	0	108.3	N360 V364	N360-G362 PolarHBondContact O-N 2.71Å; G362-V364 PolarHBondContact O-N 2.97Å
363	P	46.8	Very low	62.2	Low	116 Å²	116	99.8 Å²	99.8	75%	0.753	59%	0.585	S	S	*	*			trans	-57	120.7	176.5	23.7	-30.7	0	0	0	108.1	I365	P363-I365 PolarHBondContact O-N 3.14Å
364	V	45.6	Very low	59.2	Low	127 Å²	127	106.7 Å²	106.7	77%	0.77	63%	0.626	S	S	*	*			trans	-67.6	86.3	167.6	-177.7	0	0	0	0	106	G362 R366	G362-V364 PolarHBondContact O-N 2.97Å; V364-R366 HydrophobicContact CG1-CG 3.91Å; V364-R366 PolarHBondContact O-N 3.34Å
365	I	44	Very low	56.1	Low	143 Å²	143	109.1 Å²	109.1	73%	0.733	65%	0.653	S	S	*	*			trans	-68.4	89.8	162.2	-57.5	175.3	0	0	0	104.5	P363 P367	P363-I365 PolarHBondContact O-N 3.14Å; I365-P367 VanDerWaalsContact O-CD 3.27Å; I365-P367 WeakPolarHBondContact O-CD 3.31Å
366	R	38.2	Very low	52.9	Low	208 Å²	208	114.1 Å²	114.1	79%	0.785	68%	0.68	S	S	*	*			trans	-60	119.3	160.8	-68.1	-172.8	-177.1	-141.2	0.8	105.3	V364 N368	V364-R366 HydrophobicContact CG1-CG 3.91Å; V364-R366 PolarHBondContact O-N 3.34Å; R366-N368 PolarHBondContact O-N 3.39Å
367	P	37.1	Very low	49.8	Very low	108 Å²	108	123.1 Å²	123.1	70%	0.701	71%	0.714	S	S	*	*			trans	-61.2	113.8	166.9	24.7	-29.6	0	0	0	106.6	I365 V369	I365-P367 VanDerWaalsContact O-CD 3.27Å; I365-P367 WeakPolarHBondContact O-CD 3.31Å; P367-V369 VanDerWaalsContact C-N 3.28Å; P367-V369 PolarHBondContact O-N 3.39Å
368	N	31.2	Very low	46.6	Very low	150 Å²	150	129 Å²	129	80%	0.802	74%	0.736	S	S	*	*			trans	-66	93.1	170.2	-120	-1.1	0	0	0	106.5	R366 S370	R366-N368 PolarHBondContact O-N 3.39Å; N368-S370 PolarHBondContact O-N 3.18Å
369	V	43.7	Very low	43.5	Very low	137 Å²	137	134 Å²	134	83%	0.83	75%	0.752	S	S	*	*			trans	-77.8	76.8	169	-175.9	0	0	0	0	107.4	P367	P367-V369 VanDerWaalsContact C-N 3.28Å; P367-V369 PolarHBondContact O-N 3.39Å
370	S	37.4	Very low	40.6	Very low	92 Å²	92	137.6 Å²	137.6	64%	0.643	78%	0.776	S	S	*	*			trans	-151.6	67.9	174.4	-57.8	0	0	0	0	110.2	N368	N368-S370 PolarHBondContact O-N 3.18Å
371	S	43.2	Very low	38.1	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	77%	0.773	S	S	*	*			trans	159.5	83.4	147.1	49.3	0	0	0	0	110.7
372	L	36	Very low	36.5	Very low	180 Å²	180	132.8 Å²	132.8	94%	0.942	77%	0.772	S	S	*	*			trans	-130.5	117.4	151.3	-98.5	156	0	0	0	107.1
373	G	31.4	Very low	35.3	Very low	70 Å²	70	139.7 Å²	139.7	72%	0.722	79%	0.792	S	S	*	*			trans	-61.8	155.4	-166.6	0	0	0	0	0	113.7	A375	G373-A375 PolarHBondContact O-N 3.48Å
374	V	33.8	Very low	34.4	Very low	150 Å²	150	141.3 Å²	141.3	91%	0.909	80%	0.8	S	S	*	*			trans	-48.8	115.3	164.3	176.1	0	0	0	0	109.8
375	A	31.1	Very low	33.6	Very low	102 Å²	102	139 Å²	139	84%	0.843	79%	0.794	S	S	*	*			trans	-133.1	123	154.9	0	0	0	0	0	108	G373	G373-A375 PolarHBondContact O-N 3.48Å
376	N	30.4	Very low	32.9	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	80%	0.799	S	S	*	*			trans	-101.5	153.2	-170.2	-160.7	-3.2	0	0	0	110.4
377	R	32.3	Very low	32.3	Very low	191 Å²	191	135.6 Å²	135.6	72%	0.721	80%	0.801	S	S	*	*			trans	87.6	116.4	158.4	-78.7	-172.5	164.9	171.9	-1.5	121.9
378	K	28	Very low	32	Very low	168 Å²	168	136.5 Å²	136.5	73%	0.73	81%	0.805	S	S	*	*				76.5	112.4	125.5	-69.9	-178.1	176.5	-168.7	0	118.9
379	E	28.8	Very low	32	Very low	185 Å²	185	134 Å²	134	86%	0.864	81%	0.806	S	S	*	*				179.2	107.3	115.8	-97	170.2	175.3	0	0	108.6
380	V	30.7	Very low	31.4	Very low	140 Å²	140	133.2 Å²	133.2	85%	0.848	80%	0.803	S	S	*	*				56.6	110.3	107	-175.5	0	0	0	0	114.2
381	A	29.8	Very low	31	Very low	89 Å²	89	134.7 Å²	134.7	74%	0.736	81%	0.813	S	S	*	*			trans	-71.6	165.2	169.8	0	0	0	0	0	112.4
382	P	30.7	Very low	30.3	Very low	127 Å²	127	135.6 Å²	135.6	83%	0.825	81%	0.813	S	S	*	*				-128.4	144.9	126.9	31.3	-19	0	0	0	113.5
383	Q	30.7	Very low	30	Very low	189 Å²	189	136.1 Å²	136.1	88%	0.883	81%	0.811	S	S	*	*			trans	-66.2	145.7	167.1	-70.8	174.8	-30.3	0	0	111.2
384	V	28.7	Very low	29.9	Very low	150 Å²	150	137.5 Å²	137.5	91%	0.909	82%	0.815	S	S	*	*			trans	-135.8	132.3	146.7	-179.1	0	0	0	0	108.5
385	A	28.8	Very low	29.7	Very low	79 Å²	79	134.9 Å²	134.9	65%	0.653	81%	0.81	S	S	*	*			trans	-103.6	161	-174.4	0	0	0	0	0	112.6
386	L	29	Very low	29.5	Very low	158 Å²	158	137.8 Å²	137.8	83%	0.827	81%	0.811	S	S	*	*			trans	66.2	125	154.3	-95.1	77.1	0	0	0	120.1
387	S	26.5	Very low	29.4	Very low	120 Å²	120	136.5 Å²	136.5	84%	0.839	81%	0.813	S	S	*	*				-161.2	144.9	100.8	63.1	0	0	0	0	113.2
388	T	29.8	Very low	29.4	Very low	127 Å²	127	136.9 Å²	136.9	78%	0.779	82%	0.82	S	S	*	*			trans	-82.8	145.1	-175.8	41.6	0	0	0	0	112.6
389	A	30.3	Very low	29.5	Very low	99 Å²	99	141 Å²	141	82%	0.818	83%	0.831	S	S	*	*			trans	-107.9	138.2	165.2	0	0	0	0	0	110.6
390	P	31.2	Very low	29.5	Very low	120 Å²	120	135.7 Å²	135.7	78%	0.779	83%	0.826	S	S	*	*			trans	-90.7	145.1	-169.6	34.4	-32.5	0	0	0	113.6
391	S	29	Very low	29.5	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	83%	0.831	S	S	*	*			trans	-79.4	139.5	164.6	24.6	0	0	0	0	111
392	V	29	Very low	29.4	Very low	137 Å²	137	141.9 Å²	141.9	83%	0.83	83%	0.831	S	S	*	*			trans	-120.8	116.3	172	-178.6	0	0	0	0	109.3
393	H	29.4	Very low	29.4	Very low	192 Å²	192	141.6 Å²	141.6	89%	0.889	83%	0.832	S	S	*	*			trans	-116.6	136.7	158.7	-91.9	-42.5	0	0	0	108.1
394	A	29.3	Very low	29.3	Very low	99 Å²	99	136.7 Å²	136.7	82%	0.818	83%	0.832	S	S	*	*			trans	173.3	150.3	152.7	0	0	0	0	0	107.7
395	A	29.2	Very low	29.4	Very low	95 Å²	95	135 Å²	135	79%	0.785	83%	0.826	S	S	*	*			cis	-170	161.2	-12.6	0	0	0	0	0	107.2
396	N	28.6	Very low	29.5	Very low	162 Å²	162	142.8 Å²	142.8	87%	0.866	84%	0.839	S	S	*	*			trans	-60.9	147.5	172.4	-138.5	-9.6	0	0	0	112.3
397	S	28.3	Very low	29.7	Very low	118 Å²	118	139.5 Å²	139.5	83%	0.825	84%	0.835	S	S	*	*			trans	-137.3	120.4	161.7	-174.4	0	0	0	0	111.4
398	K	31.6	Very low	29.9	Very low	198 Å²	198	139.4 Å²	139.4	86%	0.861	83%	0.834	S	S	*	*			trans	-113.9	132.7	166.5	-100.8	-173.5	177.3	179.3	0	108.3
399	R	30	Very low	30	Very low	256 Å²	256	138.7 Å²	138.7	97%	0.966	83%	0.834	S	S	*	*			trans	178	138.5	152.3	-101.6	174.9	-178.7	-168.7	0.7	105.2
400	G	29	Very low	30.9	Very low	73 Å²	73	139.7 Å²	139.7	75%	0.753	83%	0.833	S	S	*	*			cis	151.3	122.3	6.3	0	0	0	0	0	108.3
401	R	29.9	Very low	31	Very low	254 Å²	254	140.7 Å²	140.7	96%	0.958	83%	0.831	S	S	*	*			trans	52.1	124.2	150.4	-103.2	177.7	176.1	-177.8	-1.4	122.7
402	S	28.3	Very low	31.1	Very low	104 Å²	104	142.7 Å²	142.7	73%	0.727	83%	0.833	S	S	*	*				171	107.5	121.7	56.9	0	0	0	0	109.9
403	S	31	Very low	31.2	Very low	122 Å²	122	142.1 Å²	142.1	85%	0.853	83%	0.83	S	S	*	*				48.2	116.9	96.2	66.6	0	0	0	0	116.4
404	G	28.5	Very low	31.4	Very low	85 Å²	85	137.6 Å²	137.6	88%	0.876	83%	0.825	S	S	*	*			trans	174.6	97.5	167.8	0	0	0	0	0	114.1
405	S	30.6	Very low	31.6	Very low	114 Å²	114	137 Å²	137	80%	0.797	82%	0.82	S	S	*	*			trans	-84.7	143.8	176	46.3	0	0	0	0	114.2
406	R	31.2	Very low	31.6	Very low	243 Å²	243	141.8 Å²	141.8	92%	0.917	82%	0.824	S	S	*	*			trans	159	114.7	142.4	-95.6	174.9	174.7	-176.9	-2.3	108.7
407	A	32.1	Very low	31.8	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	82%	0.823	S	S	*	*				69.5	108.4	75.2	0	0	0	0	0	113.8
408	S	30.8	Very low	32	Very low	118 Å²	118	143.4 Å²	143.4	83%	0.825	82%	0.821	S	S	*	*			trans	167.2	111.1	131.7	53	0	0	0	0	111.9
409	S	32.4	Very low	32.4	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	82%	0.819	S	S	*	*			trans	-68.5	164.1	143	-40.1	0	0	0	0	108.7
410	P	48.8	Very low	32.7	Very low	121 Å²	121	133.4 Å²	133.4	79%	0.786	81%	0.808	S	S	*	*				-144.9	175.7	76.9	33.7	-12.6	0	0	0	115.5
411	D	33.6	Very low	33.5	Very low	141 Å²	141	135.6 Å²	135.6	75%	0.754	81%	0.809	S	S	*	*			trans	-45.1	154.8	175.4	-57.6	-66.4	0	0	0	116.2
412	D	30.6	Very low	33.9	Very low	164 Å²	164	135.1 Å²	135.1	88%	0.877	81%	0.807	S	S	*	*				-157.9	139.2	118.3	-107.3	-25.5	0	0	0	113.8
413	T	32.9	Very low	34.3	Very low	125 Å²	125	138.4 Å²	138.4	77%	0.767	81%	0.81	S	S	*	*			trans	-78.6	146.4	-177.2	41.9	0	0	0	0	114.6
414	A	32.7	Very low	34.6	Very low	96 Å²	96	138 Å²	138	79%	0.793	80%	0.803	S	S	*	*			trans	177	113.3	136.6	0	0	0	0	0	109
415	A	32.7	Very low	35	Very low	87 Å²	87	140.4 Å²	140.4	72%	0.719	81%	0.805	S	S	*	*				77.6	110.3	64.2	0	0	0	0	0	114.6
416	F	30.1	Very low	35.3	Very low	195 Å²	195	144 Å²	144	86%	0.855	81%	0.806	S	S	*	*			trans	66.5	119.3	150.5	-77.3	-93.9	0	0	0	120.9
417	L	32.2	Very low	36.2	Very low	164 Å²	164	142.1 Å²	142.1	86%	0.859	83%	0.828	S	S	*	*				177.2	121	103.8	-90.8	161.1	0	0	0	111.7
418	L	33.1	Very low	36.4	Very low	150 Å²	150	144.8 Å²	144.8	79%	0.785	83%	0.833	S	S	*	*			trans	-66.8	156.9	156.3	-76.9	155.8	0	0	0	109.6
419	P	39.3	Very low	36.7	Very low	125 Å²	125	146.2 Å²	146.2	81%	0.812	83%	0.833	S	S	*	*				-139.2	154.1	109	33.2	-18.2	0	0	0	114.5
420	T	37.3	Very low	36.9	Very low	120 Å²	120	148.1 Å²	148.1	74%	0.736	84%	0.836	S	S	*	*			trans	-80.3	-167.3	176.7	55.3	0	0	0	0	112
421	P	45.5	Very low	36.2	Very low	118 Å²	118	149.7 Å²	149.7	77%	0.766	84%	0.839	S	S	*	*				-106	168.7	-116.7	22.2	2.5	0	0	0	113
422	R	38.1	Very low	36.4	Very low	244 Å²	244	150.3 Å²	150.3	92%	0.921	84%	0.844	S	S	*	*			trans	-126.6	116.6	165.3	-85.8	-171	176.3	-173.1	-0	112.4
423	H	35.8	Very low	36.8	Very low	173 Å²	173	149.3 Å²	149.3	80%	0.801	84%	0.842	S	S	*	*			trans	18.2	119.5	144.2	-70.1	-60.5	0	0	0	120.9
424	V	38.6	Very low	37	Very low	115 Å²	115	151.1 Å²	151.1	70%	0.697	85%	0.847	S	S	*	*				27.2	117.8	111.2	-170.9	0	0	0	0	116.8
425	C	36.6	Very low	37.4	Very low	135 Å²	135	155.3 Å²	155.3	91%	0.912	85%	0.852	S	S	*	*			trans	-144.1	122.1	143.2	-105.2	0	0	0	0	109.7
426	F	36.1	Very low	37.8	Very low	189 Å²	189	161 Å²	161	83%	0.829	86%	0.863	S	S	*	*			trans	-68.6	140.5	161.2	-95.1	-100.3	0	0	0	109.8
427	C	50.3	Low	38.5	Very low	204 Å²	204	157.9 Å²	157.9	100%	1.378	86%	0.863	S	S	*	*			trans	-160.6	0	136.6	-107.1	0	0	0	0	109.1

Retrieved 427 of 427 residues in 122.6 ms (Link to these results)

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