G4LYN2_SCHMA Loading...

Zinc finger protein, putative

AlphaFold DB , UniProt , Accession G4LYN2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 585 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	28.4	Very low	30.6	Very low	231 Å²	231	129.8 Å²	129.8	100%	1.138	73%	0.73	S	S	*	*				0	124.5	0	-64.1	-170.4	179	0	0	106.9
2	T	26.3	Very low	31.3	Very low	68 Å²	68	126.7 Å²	126.7	42%	0.417	72%	0.716	S	S	.	*			trans	-119.1	96.3	171.2	-38	0	0	0	0	106.9	L4	T2-L4 PolarHBondContact O-N 2.79Å
3	T	24.5	Very low	32.1	Very low	135 Å²	135	118.7 Å²	118.7	83%	0.828	67%	0.67	S	S	*	*			trans	-75.3	95.1	172.5	41	0	0	0	0	108.2
4	L	28.4	Very low	33	Very low	126 Å²	126	120.4 Å²	120.4	66%	0.66	67%	0.667	S	S	*	*			trans	-86.7	138.6	161.4	-69.6	169.8	0	0	0	107.9	T2	T2-L4 PolarHBondContact O-N 2.79Å
5	A	29	Very low	34.2	Very low	85 Å²	85	119.7 Å²	119.7	70%	0.702	67%	0.668	S	S	*	*			trans	-44.8	148.9	-160.5	0	0	0	0	0	116.3	N7	A5-N7 PolarHBondContact O-N 3.19Å; A5-N7 VanDerWaalsContact O-N 3.09Å
6	P	31.5	Very low	35.3	Very low	127 Å²	127	115.6 Å²	115.6	83%	0.825	66%	0.661	S	S	*	*	S	Bend	trans	-73.1	1.7	-170.8	28.4	-34.6	0	0	0	116	S8	P6-S8 PolarHBondContact O-N 3.48Å
7	N	30.2	Very low	35.8	Very low	137 Å²	137	113.8 Å²	113.8	73%	0.733	65%	0.645	S	S	*	*			trans	-96.7	93.4	-177.3	-72.3	-8.9	0	0	0	110.6	A5 V9	A5-N7 PolarHBondContact O-N 3.19Å; A5-N7 VanDerWaalsContact O-N 3.09Å; N7-V9 PolarHBondContact O-N 3.3Å
8	S	35	Very low	36.6	Very low	110 Å²	110	111.7 Å²	111.7	77%	0.769	63%	0.632	S	S	*	*			trans	-67.4	70.3	170	66.3	0	0	0	0	111.1	P6 Y10	P6-S8 PolarHBondContact O-N 3.48Å; S8-Y10 PolarHBondContact O-N 3.44Å
9	V	31.1	Very low	37.5	Very low	119 Å²	119	108.9 Å²	108.9	72%	0.721	61%	0.613	S	S	*	*			trans	-82.5	113.8	165.1	-175.9	0	0	0	0	106.2	N7 Q11	N7-V9 PolarHBondContact O-N 3.3Å; V9-Q11 PolarHBondContact O-N 3.23Å; V9-Q11 VanDerWaalsContact O-N 3.1Å
10	Y	35.8	Very low	38.4	Very low	161 Å²	161	107.2 Å²	107.2	63%	0.631	61%	0.605	S	S	*	*			trans	-46.5	118	170.7	-64.8	-93.1	0	0	0	109.3	S8 Q49	S8-Y10 PolarHBondContact O-N 3.44Å; Y10-Q49 HydrophobicContact CD1-CG 4.36Å
11	Q	36.3	Very low	39.1	Very low	129 Å²	129	105.1 Å²	105.1	60%	0.603	59%	0.588	S	S	*	*			trans	-94	119.1	166.7	-86.1	-176.6	-14.8	0	0	108.9	V9 L13	V9-Q11 PolarHBondContact O-N 3.23Å; V9-Q11 VanDerWaalsContact O-N 3.1Å; Q11-L13 PolarHBondContact O-N 3.4Å
12	T	39.6	Very low	40	Very low	92 Å²	92	97.1 Å²	97.1	56%	0.564	55%	0.552	S	S	*	*			trans	-71.2	114.4	165.3	18	0	0	0	0	108.6	V47	T12-V47 HydrophobicContact CG2-CG1 3.99Å
13	L	40.9	Very low	40.9	Very low	23 Å²	23	95 Å²	95	12%	0.12	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-96.3	134.3	170.4	-66.5	169.1	0	0	0	109.4	Q11 Q19 L32 I34	Q11-L13 PolarHBondContact O-N 3.4Å; L13-Q19 HydrophobicContact CD2-CG 4.04Å; L13-L32 HydrophobicContact CD1-CD2 4.09Å; L13-I34 HydrophobicContact CB-CD1 3.6Å; L13-I34 HydrophobicContact CD1-CD1 3.87Å; L13-I34 HydrophobicContact CG-CD1 4.34Å
14	F	45.4	Very low	41.9	Very low	143 Å²	143	94 Å²	94	63%	0.627	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-91.7	151.4	176.5	-62.5	-85.7	0	0	0	110.5	G16 Q17	F14-G16 PolarHBondContact O-N 3.02Å; F14-Q17 PolarHBondContact O-N 3.35Å
15	T	50.3	Low	43	Very low	110 Å²	110	92 Å²	92	68%	0.675	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	134.3	174.8	47.6	0	0	0	0	110.8	A37	T15-A37 HydrophobicContact CG2-CB 4.04Å
16	G	51.6	Low	43.9	Very low	54 Å²	54	90.5 Å²	90.5	56%	0.557	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.8	2.6	-177.5	0	0	0	0	0	115.9	F14 I34	F14-G16 PolarHBondContact O-N 3.02Å; G16-I34 PolarHBondContact N-O 3.04Å
17	Q	44.7	Very low	44.9	Very low	85 Å²	85	90.5 Å²	90.5	40%	0.397	52%	0.515	S	S	.	.			trans	-91.6	137.6	172.1	-67.8	-177.3	-30.9	0	0	111.6	F14 I34	F14-Q17 PolarHBondContact O-N 3.35Å; Q17-I34 PolarHBondContact O-N 3.42Å
18	N	50.8	Low	46.1	Very low	76 Å²	76	88.2 Å²	88.2	41%	0.406	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	127.8	168	-176.3	-50.8	0	0	0	108.7	N31 L32	N18-N31 PolarHBondContact ND2-OD1 2.75Å; N18-N31 VanDerWaalsContact ND2-OD1 3.13Å; N18-N31 PolarHBondContact OD1-OD1 3.09Å; N18-L32 CarbonylContact C-O 3.44Å; N18-L32 WeakPolarHBondContact CA-O 3.04Å
19	Q	52.1	Low	46.6	Very low	59 Å²	59	87.8 Å²	87.8	28%	0.276	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.7	169.7	-75.9	-152.7	-5.5	0	0	112.1	L13 Y21 L32	L13-Q19 HydrophobicContact CD2-CG 4.04Å; Q19-Y21 HydrophobicContact CB-CE2 3.98Å; Q19-Y21 PolarHBondContact OE1-OH 3.02Å; Q19-L32 PolarHBondContact N-O 3.36Å; Q19-L32 PolarHBondContact O-N 3.3Å
20	V	56.1	Low	47.1	Very low	73 Å²	73	85.9 Å²	85.9	44%	0.442	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.8	174.5	-175.1	0	0	0	0	108.3	T22 V28	V20-T22 HydrophobicContact CG1-CG2 4.25Å; V20-V28 HydrophobicContact CG1-CB 4.15Å; V20-V28 HydrophobicContact CG1-CG1 3.59Å; V20-V28 HydrophobicContact CG1-CG2 3.56Å
21	Y	54.4	Low	47.6	Very low	64 Å²	64	82.6 Å²	82.6	25%	0.251	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	125.7	172.1	-59.6	-98.1	0	0	0	108.9	Q19 L29 M30	Q19-Y21 HydrophobicContact CB-CE2 3.98Å; Q19-Y21 PolarHBondContact OE1-OH 3.02Å; Y21-L29 WeakPolarHBondContact O-CA 3.48Å; Y21-L29 WeakPolarHBondContact O-CB 3.41Å; Y21-L29 PolarHBondContact O-N 3.38Å; Y21-M30 HydrophobicContact CD2-CE 3.68Å; Y21-M30 HydrophobicContact CD2-CG 3.56Å; Y21-M30 HydrophobicContact CD2-SD 3.92Å; Y21-M30 HydrophobicContact CE2-CE 3.72Å; Y21-M30 HydrophobicContact CE2-SD 4.45Å; Y21-M30 HydrophobicContact CG-CE 4.43Å; Y21-M30 HydrophobicContact CG-CG 3.82Å; Y21-M30 HydrophobicContact CG-SD 4.13Å; Y21-M30 PolarHBondContact N-O 3.36Å; Y21-M30 PolarHBondContact O-N 3.12Å
22	T	47.1	Very low	48.1	Very low	64 Å²	64	78.3 Å²	78.3	39%	0.393	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	157.5	178.2	56.2	0	0	0	0	111.7	V20 E27 V28	V20-T22 HydrophobicContact CG1-CG2 4.25Å; T22-E27 CarbonylContact C-O 3.49Å; T22-E27 WeakPolarHBondContact CA-O 3.35Å; T22-E27 WeakPolarHBondContact CB-O 3.46Å; T22-V28 HydrophobicContact CG2-CG2 4.12Å
23	N	44	Very low	48.5	Very low	24 Å²	24	78.5 Å²	78.5	13%	0.128	45%	0.45	C	S	.	.			trans	-79.3	179.4	166	64.9	11.5	0	0	0	111	S25 G26 E27 L29	N23-S25 PolarHBondContact ND2-OG 3.34Å; N23-S25 VanDerWaalsContact ND2-OG 3.12Å; N23-S25 PolarHBondContact O-N 2.86Å; N23-S25 PolarHBondContact OD1-N 3.34Å; N23-S25 VanDerWaalsContact OD1-N 3.12Å; N23-S25 PolarHBondContact OD1-OG 2.95Å; N23-G26 PolarHBondContact O-N 2.77Å; N23-G26 PolarHBondContact OD1-N 3.25Å; N23-G26 VanDerWaalsContact OD1-N 3.13Å; N23-E27 PolarHBondContact N-O 3.41Å; N23-E27 PolarHBondContact ND2-OE2 3.14Å; N23-E27 WeakPolarHBondContact OD1-CA 3.49Å; N23-E27 WeakPolarHBondContact OD1-CB 3.36Å; N23-E27 PolarHBondContact OD1-N 3.22Å; N23-E27 PolarHBondContact OD1-O 3.42Å; N23-L29 HydrophobicContact CB-CD1 3.81Å; N23-L29 HydrophobicContact CB-CD2 4.02Å; N23-L29 HydrophobicContact CB-CG 3.87Å
24	S	45	Very low	48.9	Very low	112 Å²	112	78.1 Å²	78.1	78%	0.783	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.6	177.5	51.5	0	0	0	0	114.2
25	S	51.9	Low	49.1	Very low	86 Å²	86	74.7 Å²	74.7	60%	0.601	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	5.7	173.9	45	0	0	0	0	113.4	N23 E27	N23-S25 PolarHBondContact ND2-OG 3.34Å; N23-S25 VanDerWaalsContact ND2-OG 3.12Å; N23-S25 PolarHBondContact O-N 2.86Å; N23-S25 PolarHBondContact OD1-N 3.34Å; N23-S25 VanDerWaalsContact OD1-N 3.12Å; N23-S25 PolarHBondContact OD1-OG 2.95Å; S25-E27 VanDerWaalsContact C-N 3.29Å; S25-E27 PolarHBondContact O-N 3.35Å
26	G	48.7	Very low	48.7	Very low	52 Å²	52	76.5 Å²	76.5	54%	0.536	45%	0.447	S	S	.	.	S	Bend	trans	80.4	2.7	179.1	0	0	0	0	0	114.8	N23	N23-G26 PolarHBondContact O-N 2.77Å; N23-G26 PolarHBondContact OD1-N 3.25Å; N23-G26 VanDerWaalsContact OD1-N 3.13Å
27	E	52.6	Low	48.3	Very low	127 Å²	127	76.5 Å²	76.5	59%	0.593	44%	0.442	S	S	*	.			trans	-75.2	134.2	175.5	-56.1	174.8	133.8	0	0	110.4	T22 N23 S25 L29	T22-E27 CarbonylContact C-O 3.49Å; T22-E27 WeakPolarHBondContact CA-O 3.35Å; T22-E27 WeakPolarHBondContact CB-O 3.46Å; N23-E27 PolarHBondContact N-O 3.41Å; N23-E27 PolarHBondContact ND2-OE2 3.14Å; N23-E27 WeakPolarHBondContact OD1-CA 3.49Å; N23-E27 WeakPolarHBondContact OD1-CB 3.36Å; N23-E27 PolarHBondContact OD1-N 3.22Å; N23-E27 PolarHBondContact OD1-O 3.42Å; S25-E27 VanDerWaalsContact C-N 3.29Å; S25-E27 PolarHBondContact O-N 3.35Å; E27-L29 PolarHBondContact O-N 2.79Å
28	V	55.1	Low	48.1	Very low	89 Å²	89	81.2 Å²	81.2	54%	0.539	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	113	178	179.2	0	0	0	0	110.2	V20 T22 N31	V20-V28 HydrophobicContact CG1-CB 4.15Å; V20-V28 HydrophobicContact CG1-CG1 3.59Å; V20-V28 HydrophobicContact CG1-CG2 3.56Å; T22-V28 HydrophobicContact CG2-CG2 4.12Å; V28-N31 HydrophobicContact CG1-CB 4.42Å
29	L	45.7	Very low	47.2	Very low	102 Å²	102	86.5 Å²	86.5	53%	0.534	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	-36.5	174.9	-69.3	174.5	0	0	0	112.2	Y21 N23 E27	Y21-L29 WeakPolarHBondContact O-CA 3.48Å; Y21-L29 WeakPolarHBondContact O-CB 3.41Å; Y21-L29 PolarHBondContact O-N 3.38Å; N23-L29 HydrophobicContact CB-CD1 3.81Å; N23-L29 HydrophobicContact CB-CD2 4.02Å; N23-L29 HydrophobicContact CB-CG 3.87Å; E27-L29 PolarHBondContact O-N 2.79Å
30	M	42	Very low	46.5	Very low	79 Å²	79	89.4 Å²	89.4	39%	0.389	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	138.7	179.8	50.9	-173.7	-76	0	0	109.8	Y21 L32	Y21-M30 HydrophobicContact CD2-CE 3.68Å; Y21-M30 HydrophobicContact CD2-CG 3.56Å; Y21-M30 HydrophobicContact CD2-SD 3.92Å; Y21-M30 HydrophobicContact CE2-CE 3.72Å; Y21-M30 HydrophobicContact CE2-SD 4.45Å; Y21-M30 HydrophobicContact CG-CE 4.43Å; Y21-M30 HydrophobicContact CG-CG 3.82Å; Y21-M30 HydrophobicContact CG-SD 4.13Å; Y21-M30 PolarHBondContact N-O 3.36Å; Y21-M30 PolarHBondContact O-N 3.12Å; M30-L32 HydrophobicContact CE-CD1 3.58Å
31	N	45.9	Very low	45.6	Very low	92 Å²	92	91.9 Å²	91.9	49%	0.492	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	114.4	171.5	-169.8	-8.9	0	0	0	107.2	N18 V28	N18-N31 PolarHBondContact ND2-OD1 2.75Å; N18-N31 VanDerWaalsContact ND2-OD1 3.13Å; N18-N31 PolarHBondContact OD1-OD1 3.09Å; V28-N31 HydrophobicContact CG1-CB 4.42Å
32	L	46.4	Very low	44.7	Very low	39 Å²	39	92.9 Å²	92.9	20%	0.204	55%	0.551	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.6	103.7	179.2	-132.1	82.5	0	0	0	108.5	L13 N18 Q19 M30 V50	L13-L32 HydrophobicContact CD1-CD2 4.09Å; N18-L32 CarbonylContact C-O 3.44Å; N18-L32 WeakPolarHBondContact CA-O 3.04Å; Q19-L32 PolarHBondContact N-O 3.36Å; Q19-L32 PolarHBondContact O-N 3.3Å; M30-L32 HydrophobicContact CE-CD1 3.58Å; L32-V50 HydrophobicContact CD2-CG2 3.74Å
33	D	48.7	Very low	44.2	Very low	95 Å²	95	92.9 Å²	92.9	51%	0.508	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.2	112.1	177.7	-169	-14.1	0	0	0	109.7	S35	D33-S35 WeakPolarHBondContact OD1-CB 3.48Å; D33-S35 PolarHBondContact OD1-N 2.91Å; D33-S35 PolarHBondContact OD1-OG 3.46Å
34	I	49.8	Very low	43.6	Very low	15 Å²	15	99.2 Å²	99.2	8%	0.077	59%	0.591	C	S	.	*			trans	-102	27	179.2	-41.3	178	0	0	0	110.6	L13 G16 Q17 N36 A37	L13-I34 HydrophobicContact CB-CD1 3.6Å; L13-I34 HydrophobicContact CD1-CD1 3.87Å; L13-I34 HydrophobicContact CG-CD1 4.34Å; G16-I34 PolarHBondContact N-O 3.04Å; Q17-I34 PolarHBondContact O-N 3.42Å; I34-N36 VanDerWaalsContact C-N 3.29Å; I34-N36 PolarHBondContact O-N 3.11Å; I34-A37 HydrophobicContact CG2-CB 4.44Å
35	S	48.4	Very low	43	Very low	71 Å²	71	99.2 Å²	99.2	50%	0.497	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72	-20.7	177.2	-54.9	0	0	0	0	113.6	D33	D33-S35 WeakPolarHBondContact OD1-CB 3.48Å; D33-S35 PolarHBondContact OD1-N 2.91Å; D33-S35 PolarHBondContact OD1-OG 3.46Å
36	N	41.4	Very low	42.2	Very low	148 Å²	148	105.2 Å²	105.2	79%	0.791	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	31.7	-172.4	-71.7	-22.1	0	0	0	114.5	I34 H38	I34-N36 VanDerWaalsContact C-N 3.29Å; I34-N36 PolarHBondContact O-N 3.11Å; N36-H38 VanDerWaalsContact C-N 3.26Å; N36-H38 PolarHBondContact O-N 3.33Å
37	A	44.8	Very low	41.3	Very low	54 Å²	54	105.8 Å²	105.8	45%	0.446	60%	0.595	S	S	.	*			trans	-72.9	86.5	166.8	0	0	0	0	0	108.9	T15 I34 E39	T15-A37 HydrophobicContact CG2-CB 4.04Å; I34-A37 HydrophobicContact CG2-CB 4.44Å; A37-E39 PolarHBondContact O-N 2.73Å; A37-E39 VanDerWaalsContact O-N 3.12Å
38	H	39	Very low	40.6	Very low	184 Å²	184	104.7 Å²	104.7	85%	0.852	59%	0.59	S	S	*	*			trans	-52.3	118.8	176.4	-114.4	-81.7	0	0	0	110.1	N36 N40	N36-H38 VanDerWaalsContact C-N 3.26Å; N36-H38 PolarHBondContact O-N 3.33Å; H38-N40 PolarHBondContact O-N 3.21Å; H38-N40 VanDerWaalsContact O-N 3.11Å
39	E	32.7	Very low	39.4	Very low	187 Å²	187	106.2 Å²	106.2	87%	0.874	59%	0.591	S	S	*	*			trans	-53.7	112.1	175.3	-63.5	177.6	162	0	0	109.6	A37 P41	A37-E39 PolarHBondContact O-N 2.73Å; A37-E39 VanDerWaalsContact O-N 3.12Å; E39-P41 WeakPolarHBondContact O-CD 3.34Å
40	N	38	Very low	38.8	Very low	121 Å²	121	104.2 Å²	104.2	65%	0.647	58%	0.583	S	S	*	*			trans	-99.1	106.2	165.8	-166	9.3	0	0	0	107.2	H38 G42 A43	H38-N40 PolarHBondContact O-N 3.21Å; H38-N40 VanDerWaalsContact O-N 3.11Å; N40-G42 PolarHBondContact O-N 3.29Å; N40-A43 PolarHBondContact O-N 3.09Å
41	P	35.9	Very low	38.4	Very low	125 Å²	125	102.8 Å²	102.8	81%	0.812	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	103.4	-178	25.8	-29.1	0	0	0	109	E39	E39-P41 WeakPolarHBondContact O-CD 3.34Å
42	G	34.9	Very low	37.8	Very low	84 Å²	84	103.7 Å²	103.7	87%	0.866	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	131.5	-5.1	177.2	0	0	0	0	0	115.5	N40	N40-G42 PolarHBondContact O-N 3.29Å
43	A	37.2	Very low	37.3	Very low	64 Å²	64	104.6 Å²	104.6	53%	0.529	60%	0.601	S	S	.	*	S	Bend	trans	-103.7	109.6	165.3	0	0	0	0	0	108.1	N40 S45	N40-A43 PolarHBondContact O-N 3.09Å; A43-S45 PolarHBondContact O-N 3.39Å
44	D	31.3	Very low	36.9	Very low	157 Å²	157	105.4 Å²	105.4	84%	0.84	61%	0.609	S	S	*	*			trans	-40.6	126.3	165	-77.7	-42	0	0	0	108.9	Y46	D44-Y46 PolarHBondContact O-N 3.42Å
45	S	33.3	Very low	36.3	Very low	113 Å²	113	108.7 Å²	108.7	79%	0.79	63%	0.626	S	S	*	*			trans	-36.6	89.7	-177.6	54.8	0	0	0	0	112.3	A43 V47	A43-S45 PolarHBondContact O-N 3.39Å; S45-V47 PolarHBondContact O-N 3.18Å; S45-V47 VanDerWaalsContact O-N 3.12Å
46	Y	34.8	Very low	36	Very low	211 Å²	211	106.3 Å²	106.3	83%	0.827	61%	0.609	S	S	*	*			trans	-84.8	101.1	-173.9	-167.4	-99.3	0	0	0	109.3	D44 Q48	D44-Y46 PolarHBondContact O-N 3.42Å; Y46-Q48 PolarHBondContact O-N 3.17Å
47	V	30.1	Very low	36	Very low	65 Å²	65	106.8 Å²	106.8	39%	0.394	61%	0.607	S	S	.	*			trans	-47.4	120.5	176	178.7	0	0	0	0	111.2	T12 S45 Q49	T12-V47 HydrophobicContact CG2-CG1 3.99Å; S45-V47 PolarHBondContact O-N 3.18Å; S45-V47 VanDerWaalsContact O-N 3.12Å; V47-Q49 VanDerWaalsContact C-N 3.33Å; V47-Q49 HydrophobicContact CG1-CG 4.43Å; V47-Q49 PolarHBondContact O-N 3.4Å
48	Q	37.2	Very low	35.8	Very low	103 Å²	103	110.5 Å²	110.5	48%	0.481	62%	0.615	S	S	.	*			trans	-65.9	93.9	160.9	-90	177.7	-72.4	0	0	108.4	Y46 V50	Y46-Q48 PolarHBondContact O-N 3.17Å; Q48-V50 HydrophobicContact CB-CG2 4.35Å; Q48-V50 PolarHBondContact O-N 2.7Å
49	Q	30.6	Very low	35.9	Very low	121 Å²	121	106 Å²	106	57%	0.565	60%	0.597	S	S	*	*			trans	-68.4	97.7	159.8	-76.4	-177.6	-41.2	0	0	107.7	Y10 V47 C51	Y10-Q49 HydrophobicContact CD1-CG 4.36Å; V47-Q49 VanDerWaalsContact C-N 3.33Å; V47-Q49 HydrophobicContact CG1-CG 4.43Å; V47-Q49 PolarHBondContact O-N 3.4Å; Q49-C51 PolarHBondContact O-N 3.38Å
50	V	33.1	Very low	36.3	Very low	60 Å²	60	102.5 Å²	102.5	36%	0.364	59%	0.591	S	S	.	*			trans	-82.6	102.1	170.4	-173.6	0	0	0	0	106.6	L32 Q48	L32-V50 HydrophobicContact CD2-CG2 3.74Å; Q48-V50 HydrophobicContact CB-CG2 4.35Å; Q48-V50 PolarHBondContact O-N 2.7Å
51	C	33.7	Very low	36.6	Very low	50 Å²	50	101 Å²	101	34%	0.338	58%	0.582	S	S	.	*			trans	-71.7	130.1	166.2	-78.5	0	0	0	0	108.5	Q49 V53	Q49-C51 PolarHBondContact O-N 3.38Å; C51-V53 VanDerWaalsContact C-N 3.34Å; C51-V53 PolarHBondContact O-N 3.4Å
52	S	32	Very low	36.8	Very low	110 Å²	110	99.2 Å²	99.2	77%	0.769	57%	0.568	S	S	*	*			trans	-58.1	98.1	164.8	-56.2	0	0	0	0	108.6	V54	S52-V54 VanDerWaalsContact C-N 3.28Å; S52-V54 PolarHBondContact O-N 3.37Å
53	V	36.6	Very low	37.2	Very low	59 Å²	59	99.7 Å²	99.7	36%	0.358	56%	0.559	S	S	.	*			trans	-73.8	90.1	173.1	-177.3	0	0	0	0	106.8	C51 I55 V131 E136	C51-V53 VanDerWaalsContact C-N 3.34Å; C51-V53 PolarHBondContact O-N 3.4Å; V53-I55 PolarHBondContact O-N 3.47Å; V53-V131 HydrophobicContact CG2-CG1 3.9Å; V53-E136 WeakPolarHBondContact CG2-OE1 3.42Å
54	V	39.3	Very low	37.3	Very low	112 Å²	112	104 Å²	104	68%	0.679	57%	0.568	S	S	*	*			trans	-59.2	110.3	158.8	-176.5	0	0	0	0	105.2	S52 S56	S52-V54 VanDerWaalsContact C-N 3.28Å; S52-V54 PolarHBondContact O-N 3.37Å; V54-S56 PolarHBondContact O-N 3.36Å
55	I	38.4	Very low	38	Very low	83 Å²	83	99.3 Å²	99.3	43%	0.426	55%	0.545	S	S	.	.			trans	-66.7	89.6	168.6	-54.8	164	0	0	0	104.3	V53 Q57	V53-I55 PolarHBondContact O-N 3.47Å; I55-Q57 PolarHBondContact O-N 3.4Å
56	S	41.5	Very low	38.3	Very low	21 Å²	21	99.6 Å²	99.6	15%	0.147	53%	0.533	C	S	.	.			trans	-57	127	-178.5	21.8	0	0	0	0	109.5	V54 N115	V54-S56 PolarHBondContact O-N 3.36Å; S56-N115 PolarHBondContact OG-ND2 2.93Å; S56-N115 PolarHBondContact OG-OD1 3.43Å
57	Q	42.2	Very low	38.5	Very low	159 Å²	159	94.2 Å²	94.2	74%	0.743	53%	0.527	S	S	*	.			trans	32.7	106.9	148.9	-64.3	175	-10.1	0	0	115	I55 N59	I55-Q57 PolarHBondContact O-N 3.4Å; Q57-N59 PolarHBondContact O-N 2.91Å
58	E	39.9	Very low	38.9	Very low	131 Å²	131	98.3 Å²	98.3	61%	0.612	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-50.8	116.4	147.6	-60.7	-175.2	-179.7	0	0	106.4	P60	E58-P60 VanDerWaalsContact O-CD 3.29Å; E58-P60 WeakPolarHBondContact O-CD 3.33Å
59	N	41.6	Very low	38.9	Very low	90 Å²	90	98.8 Å²	98.8	48%	0.481	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-51.3	120.6	168.1	-78	-23.7	0	0	0	106.8	Q57 I61 R111	Q57-N59 PolarHBondContact O-N 2.91Å; N59-I61 PolarHBondContact O-N 2.88Å; N59-R111 PolarHBondContact O-NH2 3.39Å
60	P	40.3	Very low	39.1	Very low	114 Å²	114	102.4 Å²	102.4	74%	0.74	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-54.7	129.9	-178.8	-22.4	30.4	0	0	0	108.8	E58 T62	E58-P60 VanDerWaalsContact O-CD 3.29Å; E58-P60 WeakPolarHBondContact O-CD 3.33Å; P60-T62 PolarHBondContact O-N 3.41Å; P60-T62 VanDerWaalsContact O-N 3.1Å
61	I	44.3	Very low	39.4	Very low	90 Å²	90	105.1 Å²	105.1	46%	0.462	58%	0.577	S	S	.	*			trans	-65	109.6	167.8	-54.1	175.6	0	0	0	104.4	N59 S63 V65 Q66	N59-I61 PolarHBondContact O-N 2.88Å; I61-S63 PolarHBondContact O-N 3.43Å; I61-V65 HydrophobicContact CG2-CB 4.24Å; I61-Q66 HydrophobicContact CG2-CG 4.36Å
62	T	39.8	Very low	39.6	Very low	86 Å²	86	106.6 Å²	106.6	53%	0.528	59%	0.588	S	S	.	*			trans	-61	133	163.1	45.1	0	0	0	0	106.8	P60 E64 V65	P60-T62 PolarHBondContact O-N 3.41Å; P60-T62 VanDerWaalsContact O-N 3.1Å; T62-E64 PolarHBondContact O-N 3.47Å; T62-V65 PolarHBondContact O-N 3.15Å
63	S	44.5	Very low	40	Very low	94 Å²	94	109.4 Å²	109.4	66%	0.657	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-52.8	-18	-177.8	42.3	0	0	0	0	113.7	I61 V65 Q66	I61-S63 PolarHBondContact O-N 3.43Å; S63-V65 PolarHBondContact O-N 3.34Å; S63-Q66 PolarHBondContact O-N 2.93Å
64	E	39.7	Very low	40.3	Very low	155 Å²	155	111.8 Å²	111.8	72%	0.724	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-65.2	-17.4	174.9	-66.2	170	170.8	0	0	114.1	T62 S67	T62-E64 PolarHBondContact O-N 3.47Å; E64-S67 PolarHBondContact O-OG 3.13Å
65	V	45.8	Very low	40.5	Very low	58 Å²	58	113.8 Å²	113.8	35%	0.352	61%	0.614	S	S	.	*	G	3₁₀ helix	trans	-90.2	-13.7	178.5	-167.9	0	0	0	0	112.6	I61 T62 S63	I61-V65 HydrophobicContact CG2-CB 4.24Å; T62-V65 PolarHBondContact O-N 3.15Å; S63-V65 PolarHBondContact O-N 3.34Å
66	Q	38	Very low	40.8	Very low	119 Å²	119	114.7 Å²	114.7	56%	0.556	63%	0.627	S	S	*	*	S	Bend	trans	-78.6	-20.5	179	-68.3	-176.5	-5.8	0	0	113.1	I61 S63 E68 L69	I61-Q66 HydrophobicContact CG2-CG 4.36Å; S63-Q66 PolarHBondContact O-N 2.93Å; Q66-E68 VanDerWaalsContact C-N 3.32Å; Q66-E68 PolarHBondContact O-N 3.05Å; Q66-L69 PolarHBondContact O-N 2.67Å
67	S	40.1	Very low	41.1	Very low	99 Å²	99	119 Å²	119	69%	0.692	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-14.4	-173.8	54.7	0	0	0	0	114.8	E64 L69	E64-S67 PolarHBondContact O-OG 3.13Å; S67-L69 VanDerWaalsContact C-N 3.35Å
68	E	37.9	Very low	41.2	Very low	151 Å²	151	113.8 Å²	113.8	71%	0.706	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	11.3	174	-64.4	-153.8	159.5	0	0	114	Q66 K70	Q66-E68 VanDerWaalsContact C-N 3.32Å; Q66-E68 PolarHBondContact O-N 3.05Å; E68-K70 PolarHBondContact O-N 3.04Å
69	L	37.5	Very low	41.5	Very low	113 Å²	113	113.9 Å²	113.9	59%	0.592	66%	0.658	S	S	*	*			trans	-72.9	59.8	165.4	-69.6	168.2	0	0	0	110.4	Q66 S67 V71	Q66-L69 PolarHBondContact O-N 2.67Å; S67-L69 VanDerWaalsContact C-N 3.35Å; L69-V71 VanDerWaalsContact C-N 3.27Å; L69-V71 PolarHBondContact O-N 2.74Å; L69-V71 VanDerWaalsContact O-N 3.08Å
70	K	34.5	Very low	41.9	Very low	197 Å²	197	116.6 Å²	116.6	86%	0.857	68%	0.678	S	S	*	*			trans	-74.9	96.4	155.1	-151	172.5	-171.7	179.6	0	105.3	E68 S72	E68-K70 PolarHBondContact O-N 3.04Å; K70-S72 PolarHBondContact O-N 3.38Å
71	V	39.5	Very low	42.8	Very low	117 Å²	117	113.5 Å²	113.5	71%	0.709	67%	0.666	S	S	*	*			trans	-39.2	115.8	170.7	174.6	0	0	0	0	107.2	L69 E73	L69-V71 VanDerWaalsContact C-N 3.27Å; L69-V71 PolarHBondContact O-N 2.74Å; L69-V71 VanDerWaalsContact O-N 3.08Å; V71-E73 PolarHBondContact O-N 3.04Å
72	S	39	Very low	44.3	Very low	80 Å²	80	117.5 Å²	117.5	56%	0.559	68%	0.676	S	S	*	*			trans	-65.2	100.8	162.5	24.1	0	0	0	0	104.4	K70 S74	K70-S72 PolarHBondContact O-N 3.38Å; S72-S74 PolarHBondContact O-N 2.95Å; S72-S74 VanDerWaalsContact O-N 3.12Å
73	E	39.8	Very low	46.4	Very low	170 Å²	170	117.2 Å²	117.2	79%	0.794	67%	0.667	S	S	*	*			trans	-41.6	123.8	163.5	-72.4	173.5	163.4	0	0	106.7	V71 I75	V71-E73 PolarHBondContact O-N 3.04Å; E73-I75 PolarHBondContact O-N 2.81Å
74	S	42.4	Very low	48.4	Very low	108 Å²	108	116.9 Å²	116.9	76%	0.755	66%	0.656	S	S	*	*			trans	-55.4	103.6	-173.6	-41.1	0	0	0	0	108	S72 S76	S72-S74 PolarHBondContact O-N 2.95Å; S72-S74 VanDerWaalsContact O-N 3.12Å; S74-S76 PolarHBondContact O-N 3.29Å
75	I	44.6	Very low	50.6	Low	155 Å²	155	109.5 Å²	109.5	80%	0.795	62%	0.621	S	S	*	*			trans	-72.7	77.2	168.3	-54.1	178.5	0	0	0	105.5	E73 S77	E73-I75 PolarHBondContact O-N 2.81Å; I75-S77 PolarHBondContact O-N 3.12Å
76	S	44.7	Very low	52.6	Low	102 Å²	102	112 Å²	112	71%	0.713	63%	0.632	S	S	*	*			trans	-71.8	83	170.6	-174.1	0	0	0	0	106.6	S74	S74-S76 PolarHBondContact O-N 3.29Å
77	S	46.8	Very low	54.9	Low	111 Å²	111	114.3 Å²	114.3	78%	0.776	64%	0.637	S	S	*	*			trans	-128.4	56.9	169.4	-63.3	0	0	0	0	108.6	I75	I75-S77 PolarHBondContact O-N 3.12Å
78	G	43.7	Very low	57.2	Low	50 Å²	50	111.5 Å²	111.5	52%	0.515	62%	0.617	S	S	.	*	S	Bend	trans	170.4	156.1	176.2	0	0	0	0	0	112.3	V80	G78-V80 PolarHBondContact O-N 3.02Å
79	P	47.7	Very low	59.5	Low	132 Å²	132	110.2 Å²	110.2	86%	0.857	61%	0.611	S	S	*	*	S	Bend	trans	-64.9	109.1	-169.7	26.5	-32.2	0	0	0	110.7
80	V	49.7	Very low	61.8	Low	147 Å²	147	109.4 Å²	109.4	89%	0.891	60%	0.603	S	S	*	*	S	Bend	trans	36	105.4	158.5	-168.1	0	0	0	0	116.2	G78	G78-V80 PolarHBondContact O-N 3.02Å
81	G	59.8	Low	64.4	Low	49 Å²	49	104.2 Å²	104.2	51%	0.505	58%	0.584	S	S	.	*			trans	102.6	32.7	145.9	0	0	0	0	0	117.9
82	R	75.8	Confident	66.6	Low	174 Å²	174	100.8 Å²	100.8	66%	0.657	56%	0.559	S	S	*	*			trans	-125	130.3	169	-62.8	-175.5	-176.7	-177.4	2.2	110.9	Y92	R82-Y92 CarbonylContact C-O 3.44Å; R82-Y92 WeakPolarHBondContact CA-O 3.39Å
83	F	83.6	Confident	68.9	Low	80 Å²	80	104.5 Å²	104.5	35%	0.351	57%	0.565	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.6	116.6	178.6	-63.5	-92.1	0	0	0	109.1	N91 Y92 E95 L98	F83-N91 CarbonylContact O-C 3.59Å; F83-Y92 PolarHBondContact N-O 3.34Å; F83-Y92 PolarHBondContact O-N 3.12Å; F83-E95 HydrophobicContact CD1-CB 4.04Å; F83-E95 HydrophobicContact CD1-CG 4.44Å; F83-E95 VanDerWaalsContact CD2-N 3.29Å; F83-E95 HydrophobicContact CE1-CB 3.69Å; F83-E95 HydrophobicContact CE1-CG 4.22Å; F83-E95 HydrophobicContact CE2-CB 4.24Å; F83-E95 VanDerWaalsContact CE2-N 3.28Å; F83-E95 HydrophobicContact CG-CB 4.46Å; F83-E95 HydrophobicContact CZ-CB 3.8Å; F83-L98 HydrophobicContact CB-CB 3.98Å; F83-L98 HydrophobicContact CB-CD2 3.76Å; F83-L98 HydrophobicContact CB-CG 4.45Å
84	E	86.2	Confident	71.1	Confident	88 Å²	88	98.2 Å²	98.2	41%	0.411	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	139.8	-179.2	-171.6	174.2	159.2	0	0	111.3	H89 N91	E84-H89 WeakPolarHBondContact OE1-CA 3.3Å; E84-H89 VanDerWaalsContact OE1-CB 3.23Å; E84-H89 WeakPolarHBondContact OE1-CB 3.4Å; E84-H89 IonicContact OE1-CE1 2.63Å; E84-H89 IonicContact OE1-CG 3.64Å; E84-H89 IonicContact OE1-ND1 3.32Å; E84-H89 PolarHBondContact OE1-ND1 3.4Å; E84-N91 VanDerWaalsContact CB-OD1 3.25Å; E84-N91 WeakPolarHBondContact CB-OD1 3.39Å; E84-N91 WeakPolarHBondContact CG-OD1 3Å
85	C	86.1	Confident	73.2	Confident	0 Å²	0	99.1 Å²	99.1	0%	0	53%	0.532	C	S	.	.	P	Polyproline II helix	trans	-81	119.8	169.9	177.4	0	0	0	0	111.3	Y87 C88 H89 K90 Y92 L98 H101 L102 H106	C85-Y87 PolarHBondContact O-N 3.42Å; C85-Y87 VanDerWaalsContact O-N 3.15Å; C85-C88 PolarHBondContact O-N 2.97Å; C85-C88 PolarHBondContact SG-SG 3.32Å; C85-H89 WeakPolarHBondContact O-CA 3.21Å; C85-H89 PolarHBondContact O-N 2.9Å; C85-K90 PolarHBondContact N-O 2.88Å; C85-Y92 HydrophobicContact CB-CE2 4.33Å; C85-L98 HydrophobicContact CB-CD1 3.63Å; C85-H101 WeakPolarHBondContact CB-NE2 3.31Å; C85-H101 PolarHBondContact SG-NE2 2.87Å; C85-L102 VanDerWaalsContact SG-CD2 3.6Å; C85-H106 PolarHBondContact SG-NE2 3.06Å; C85-H106 VanDerWaalsContact SG-NE2 3.42Å
86	N	87.7	Confident	75.1	Confident	109 Å²	109	96.1 Å²	96.1	58%	0.583	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-19.6	-179.3	-64	-17.1	0	0	0	114.9
87	Y	85.2	Confident	77.1	Confident	168 Å²	168	94.7 Å²	94.7	66%	0.659	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-24.2	-179	-63.2	-76.7	0	0	0	114	C85 L102 H106	C85-Y87 PolarHBondContact O-N 3.42Å; C85-Y87 VanDerWaalsContact O-N 3.15Å; Y87-L102 HydrophobicContact CD2-CD2 3.87Å; Y87-L102 HydrophobicContact CE2-CD2 4.12Å; Y87-H106 WeakPolarHBondContact CB-CE1 3.18Å; Y87-H106 WeakPolarHBondContact CB-ND1 3.44Å; Y87-H106 HydrophobicContact CD2-CB 4.36Å; Y87-H106 AromaticContact CD2-CD2 3.98Å; Y87-H106 AromaticContact CD2-CG 3.85Å; Y87-H106 AromaticContact CG-ND1 3.82Å
88	C	88.4	Confident	79.1	Confident	41 Å²	41	90.2 Å²	90.2	28%	0.277	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141.7	6.5	-174	69	0	0	0	0	114.2	C85 K90 H101	C85-C88 PolarHBondContact O-N 2.97Å; C85-C88 PolarHBondContact SG-SG 3.32Å; C88-K90 PolarHBondContact O-N 3.45Å; C88-K90 WeakPolarHBondContact SG-CE 3.33Å; C88-K90 PolarHBondContact SG-NZ 2.88Å; C88-H101 PolarHBondContact SG-NE2 3.44Å
89	H	87.4	Confident	81.1	Confident	123 Å²	123	90.6 Å²	90.6	57%	0.569	47%	0.465	S	S	*	.			trans	54.6	26.6	175	-56.4	-67.2	0	0	0	113.9	E84 C85	E84-H89 WeakPolarHBondContact OE1-CA 3.3Å; E84-H89 VanDerWaalsContact OE1-CB 3.23Å; E84-H89 WeakPolarHBondContact OE1-CB 3.4Å; E84-H89 IonicContact OE1-CE1 2.63Å; E84-H89 IonicContact OE1-CG 3.64Å; E84-H89 IonicContact OE1-ND1 3.32Å; E84-H89 PolarHBondContact OE1-ND1 3.4Å; C85-H89 WeakPolarHBondContact O-CA 3.21Å; C85-H89 PolarHBondContact O-N 2.9Å
90	K	85.9	Confident	83	Confident	97 Å²	97	86.4 Å²	86.4	42%	0.422	44%	0.435	S	S	.	.			trans	-82.6	132.5	174.3	-78.2	-167.7	-70.5	-71.2	0	110	C85 C88 Y92 H101	C85-K90 PolarHBondContact N-O 2.88Å; C88-K90 PolarHBondContact O-N 3.45Å; C88-K90 WeakPolarHBondContact SG-CE 3.33Å; C88-K90 PolarHBondContact SG-NZ 2.88Å; K90-Y92 HydrophobicContact CB-CE2 3.7Å; K90-Y92 WeakPolarHBondContact CE-OH 3.43Å; K90-Y92 WeakPolarHBondContact O-CD2 3.49Å; K90-Y92 VanDerWaalsContact O-CE2 3.32Å; K90-Y92 WeakPolarHBondContact O-CE2 3.49Å; K90-H101 WeakPolarHBondContact CE-CE1 3.28Å
91	N	88.5	Confident	84.8	Confident	87 Å²	87	80.2 Å²	80.2	47%	0.465	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	136.4	-179.7	-68.7	-40.1	0	0	0	112.1	F83 E84	F83-N91 CarbonylContact O-C 3.59Å; E84-N91 VanDerWaalsContact CB-OD1 3.25Å; E84-N91 WeakPolarHBondContact CB-OD1 3.39Å; E84-N91 WeakPolarHBondContact CG-OD1 3Å
92	Y	85.8	Confident	86.1	Confident	46 Å²	46	79.3 Å²	79.3	18%	0.18	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146	179.9	-64.9	-86.3	0	0	0	110.2	R82 F83 C85 K90 S94 N97 L98 H101	R82-Y92 CarbonylContact C-O 3.44Å; R82-Y92 WeakPolarHBondContact CA-O 3.39Å; F83-Y92 PolarHBondContact N-O 3.34Å; F83-Y92 PolarHBondContact O-N 3.12Å; C85-Y92 HydrophobicContact CB-CE2 4.33Å; K90-Y92 HydrophobicContact CB-CE2 3.7Å; K90-Y92 WeakPolarHBondContact CE-OH 3.43Å; K90-Y92 WeakPolarHBondContact O-CD2 3.49Å; K90-Y92 VanDerWaalsContact O-CE2 3.32Å; K90-Y92 WeakPolarHBondContact O-CE2 3.49Å; Y92-S94 VanDerWaalsContact C-N 3.28Å; Y92-S94 PolarHBondContact O-N 3.07Å; Y92-N97 HydrophobicContact CD1-CB 4.05Å; Y92-L98 HydrophobicContact CD2-CB 4.12Å; Y92-L98 HydrophobicContact CD2-CD1 3.68Å; Y92-L98 HydrophobicContact CE2-CD1 4.06Å; Y92-L98 HydrophobicContact CG-CB 4.23Å; Y92-H101 HydrophobicContact CD1-CB 4.46Å; Y92-H101 HydrophobicContact CE1-CB 3.71Å; Y92-H101 HydrophobicContact CE2-CB 3.79Å; Y92-H101 AromaticContact CE2-CD2 3.3Å; Y92-H101 WeakPolarHBondContact CE2-CD2 3.44Å; Y92-H101 AromaticContact CE2-CG 3.52Å; Y92-H101 AromaticContact CZ-CD2 3.54Å; Y92-H101 AromaticContact CZ-CG 3.24Å; Y92-H101 AromaticContact CZ-ND1 3.82Å; Y92-H101 WeakPolarHBondContact OH-CB 3.4Å; Y92-H101 PolarHBondContact OH-CD2 3.44Å; Y92-H101 PolarHBondContact OH-CE1 3.34Å; Y92-H101 PolarHBondContact OH-ND1 2.77Å
93	F	86.6	Confident	86.6	Confident	157 Å²	157	72.3 Å²	72.3	69%	0.689	36%	0.355	S	S	*	.	S	Bend	trans	-81.4	-7	-178.7	-59.7	-76.2	0	0	0	113.7
94	S	86.4	Confident	86.8	Confident	38 Å²	38	70.2 Å²	70.2	27%	0.266	35%	0.349	S	S	.	.	S	Bend	trans	-150.4	149.4	179.5	62.6	0	0	0	0	110.9	Y92 S96 N97 L98	Y92-S94 VanDerWaalsContact C-N 3.28Å; Y92-S94 PolarHBondContact O-N 3.07Å; S94-S96 VanDerWaalsContact C-N 3.33Å; S94-S96 PolarHBondContact O-N 2.69Å; S94-N97 PolarHBondContact O-N 3.11Å; S94-N97 VanDerWaalsContact O-N 3.13Å; S94-N97 VanDerWaalsContact OG-CB 3.27Å; S94-N97 WeakPolarHBondContact OG-CB 3.37Å; S94-N97 PolarHBondContact OG-N 2.98Å; S94-N97 PolarHBondContact OG-OD1 3.15Å; S94-N97 VanDerWaalsContact OG-OD1 3.05Å; S94-L98 PolarHBondContact O-N 3.27Å
95	E	85.6	Confident	86.7	Confident	128 Å²	128	68.8 Å²	68.8	60%	0.598	35%	0.352	S	S	*	.	H	α-helix	trans	-58.5	-44.5	176.1	-172.5	176	-170.2	0	0	111.3	F83 N97 L98 Q99	F83-E95 HydrophobicContact CD1-CB 4.04Å; F83-E95 HydrophobicContact CD1-CG 4.44Å; F83-E95 VanDerWaalsContact CD2-N 3.29Å; F83-E95 HydrophobicContact CE1-CB 3.69Å; F83-E95 HydrophobicContact CE1-CG 4.22Å; F83-E95 HydrophobicContact CE2-CB 4.24Å; F83-E95 VanDerWaalsContact CE2-N 3.28Å; F83-E95 HydrophobicContact CG-CB 4.46Å; F83-E95 HydrophobicContact CZ-CB 3.8Å; E95-N97 PolarHBondContact O-N 3.05Å; E95-L98 CarbonylContact O-C 3.31Å; E95-L98 WeakPolarHBondContact O-CA 3.46Å; E95-L98 WeakPolarHBondContact O-CB 3.21Å; E95-L98 PolarHBondContact O-N 3.02Å; E95-Q99 WeakPolarHBondContact O-CB 3.45Å; E95-Q99 PolarHBondContact O-N 3.27Å
96	S	85.1	Confident	86.7	Confident	91 Å²	91	72.3 Å²	72.3	64%	0.636	37%	0.369	S	S	*	.	H	α-helix	trans	-60.3	-32.3	177.3	-43.1	0	0	0	0	112.8	S94 L100	S94-S96 VanDerWaalsContact C-N 3.33Å; S94-S96 PolarHBondContact O-N 2.69Å; S96-L100 WeakPolarHBondContact O-CB 3.47Å; S96-L100 PolarHBondContact O-N 3.33Å
97	N	87.7	Confident	86.6	Confident	72 Å²	72	71.7 Å²	71.7	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-76	-36.4	175.8	-77	30.6	0	0	0	111.9	Y92 S94 E95 H101	Y92-N97 HydrophobicContact CD1-CB 4.05Å; S94-N97 PolarHBondContact O-N 3.11Å; S94-N97 VanDerWaalsContact O-N 3.13Å; S94-N97 VanDerWaalsContact OG-CB 3.27Å; S94-N97 WeakPolarHBondContact OG-CB 3.37Å; S94-N97 PolarHBondContact OG-N 2.98Å; S94-N97 PolarHBondContact OG-OD1 3.15Å; S94-N97 VanDerWaalsContact OG-OD1 3.05Å; E95-N97 PolarHBondContact O-N 3.05Å; N97-H101 WeakPolarHBondContact O-CB 3.06Å; N97-H101 PolarHBondContact O-N 3.2Å
98	L	87.3	Confident	86.5	Confident	17 Å²	17	66 Å²	66	9%	0.089	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-47.5	171	173.6	61.6	0	0	0	110.2	F83 C85 Y92 S94 E95 L100 H101 L102	F83-L98 HydrophobicContact CB-CB 3.98Å; F83-L98 HydrophobicContact CB-CD2 3.76Å; F83-L98 HydrophobicContact CB-CG 4.45Å; C85-L98 HydrophobicContact CB-CD1 3.63Å; Y92-L98 HydrophobicContact CD2-CB 4.12Å; Y92-L98 HydrophobicContact CD2-CD1 3.68Å; Y92-L98 HydrophobicContact CE2-CD1 4.06Å; Y92-L98 HydrophobicContact CG-CB 4.23Å; S94-L98 PolarHBondContact O-N 3.27Å; E95-L98 CarbonylContact O-C 3.31Å; E95-L98 WeakPolarHBondContact O-CA 3.46Å; E95-L98 WeakPolarHBondContact O-CB 3.21Å; E95-L98 PolarHBondContact O-N 3.02Å; L98-L100 PolarHBondContact O-N 3.47Å; L98-H101 CarbonylContact O-C 3.56Å; L98-H101 WeakPolarHBondContact O-CA 3.38Å; L98-H101 VanDerWaalsContact O-CB 3.27Å; L98-H101 WeakPolarHBondContact O-CB 3.49Å; L98-H101 PolarHBondContact O-N 3.15Å; L98-L102 HydrophobicContact CD1-CD1 4.46Å; L98-L102 HydrophobicContact CD1-CD2 4.5Å; L98-L102 HydrophobicContact CD1-CG 4.19Å; L98-L102 HydrophobicContact CG-CD1 4.22Å; L98-L102 HydrophobicContact CG-CG 4.38Å; L98-L102 WeakPolarHBondContact O-CG 3.5Å; L98-L102 PolarHBondContact O-N 3.18Å
99	Q	87.1	Confident	86.2	Confident	58 Å²	58	67.3 Å²	67.3	27%	0.271	35%	0.354	S	S	.	.	H	α-helix	trans	-58.9	-47.6	179.5	-173	57	42.8	0	0	111.6	E95 H101 L102 D103	E95-Q99 WeakPolarHBondContact O-CB 3.45Å; E95-Q99 PolarHBondContact O-N 3.27Å; Q99-H101 PolarHBondContact O-N 2.89Å; Q99-L102 WeakPolarHBondContact O-CB 3.45Å; Q99-L102 PolarHBondContact O-N 2.95Å; Q99-L102 VanDerWaalsContact O-N 3.16Å; Q99-D103 PolarHBondContact NE2-OD1 3.44Å; Q99-D103 VanDerWaalsContact NE2-OD1 3.13Å; Q99-D103 VanDerWaalsContact O-CG 3.29Å; Q99-D103 PolarHBondContact O-N 3.01Å
100	L	87.1	Confident	86	Confident	45 Å²	45	67.1 Å²	67.1	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-37.1	174.2	-179.1	70.5	0	0	0	112.1	S96 L98 V104 A122 K123	S96-L100 WeakPolarHBondContact O-CB 3.47Å; S96-L100 PolarHBondContact O-N 3.33Å; L98-L100 PolarHBondContact O-N 3.47Å; L100-V104 HydrophobicContact CD1-CG2 3.97Å; L100-V104 HydrophobicContact CG-CG2 4.22Å; L100-V104 WeakPolarHBondContact O-CB 3.23Å; L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 2.84Å; L100-A122 HydrophobicContact CD1-CB 4.3Å; L100-K123 HydrophobicContact CD2-CD 3.9Å; L100-K123 HydrophobicContact CD2-CG 3.75Å
101	H	86.5	Confident	85.7	Confident	17 Å²	17	65.3 Å²	65.3	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-63.9	-46	175	161.9	60	0	0	0	111.7	C85 C88 K90 Y92 N97 L98 Q99 D103 V104 A105 H106	C85-H101 WeakPolarHBondContact CB-NE2 3.31Å; C85-H101 PolarHBondContact SG-NE2 2.87Å; C88-H101 PolarHBondContact SG-NE2 3.44Å; K90-H101 WeakPolarHBondContact CE-CE1 3.28Å; Y92-H101 HydrophobicContact CD1-CB 4.46Å; Y92-H101 HydrophobicContact CE1-CB 3.71Å; Y92-H101 HydrophobicContact CE2-CB 3.79Å; Y92-H101 AromaticContact CE2-CD2 3.3Å; Y92-H101 WeakPolarHBondContact CE2-CD2 3.44Å; Y92-H101 AromaticContact CE2-CG 3.52Å; Y92-H101 AromaticContact CZ-CD2 3.54Å; Y92-H101 AromaticContact CZ-CG 3.24Å; Y92-H101 AromaticContact CZ-ND1 3.82Å; Y92-H101 WeakPolarHBondContact OH-CB 3.4Å; Y92-H101 PolarHBondContact OH-CD2 3.44Å; Y92-H101 PolarHBondContact OH-CE1 3.34Å; Y92-H101 PolarHBondContact OH-ND1 2.77Å; N97-H101 WeakPolarHBondContact O-CB 3.06Å; N97-H101 PolarHBondContact O-N 3.2Å; L98-H101 CarbonylContact O-C 3.56Å; L98-H101 WeakPolarHBondContact O-CA 3.38Å; L98-H101 VanDerWaalsContact O-CB 3.27Å; L98-H101 WeakPolarHBondContact O-CB 3.49Å; L98-H101 PolarHBondContact O-N 3.15Å; Q99-H101 PolarHBondContact O-N 2.89Å; H101-D103 VanDerWaalsContact C-N 3.32Å; H101-D103 PolarHBondContact O-N 3.03Å; H101-V104 PolarHBondContact O-N 3.31Å; H101-A105 WeakPolarHBondContact CE1-CB 3.12Å; H101-A105 WeakPolarHBondContact ND1-CB 3.43Å; H101-A105 WeakPolarHBondContact O-CB 3.32Å; H101-A105 PolarHBondContact O-N 3.38Å; H101-H106 AromaticContact CE1-CD2 3.97Å; H101-H106 AromaticContact CE1-NE2 3.61Å; H101-H106 AromaticContact NE2-CD2 3.71Å; H101-H106 AromaticContact NE2-NE2 3.35Å; H101-H106 PolarHBondContact NE2-NE2 3Å
102	L	87.3	Confident	85.4	Confident	30 Å²	30	63 Å²	63	16%	0.157	33%	0.325	C	S	.	.	I	π-helix	trans	-56.6	-48.7	175.4	-66.7	173.7	0	0	0	110.4	C85 Y87 L98 Q99 V104 H106 R107	C85-L102 VanDerWaalsContact SG-CD2 3.6Å; Y87-L102 HydrophobicContact CD2-CD2 3.87Å; Y87-L102 HydrophobicContact CE2-CD2 4.12Å; L98-L102 HydrophobicContact CD1-CD1 4.46Å; L98-L102 HydrophobicContact CD1-CD2 4.5Å; L98-L102 HydrophobicContact CD1-CG 4.19Å; L98-L102 HydrophobicContact CG-CD1 4.22Å; L98-L102 HydrophobicContact CG-CG 4.38Å; L98-L102 WeakPolarHBondContact O-CG 3.5Å; L98-L102 PolarHBondContact O-N 3.18Å; Q99-L102 WeakPolarHBondContact O-CB 3.45Å; Q99-L102 PolarHBondContact O-N 2.95Å; Q99-L102 VanDerWaalsContact O-N 3.16Å; L102-V104 PolarHBondContact O-N 2.98Å; L102-H106 WeakPolarHBondContact O-CA 3.44Å; L102-H106 WeakPolarHBondContact O-CB 3.29Å; L102-H106 PolarHBondContact O-N 3.39Å; L102-R107 PolarHBondContact O-N 2.88Å
103	D	87.6	Confident	85.4	Confident	26 Å²	26	65 Å²	65	14%	0.139	34%	0.336	C	S	.	.	I	π-helix	trans	-59.1	-45.6	178.9	-69	-17.6	0	0	0	111.9	Q99 H101 R107 G108 L109	Q99-D103 PolarHBondContact NE2-OD1 3.44Å; Q99-D103 VanDerWaalsContact NE2-OD1 3.13Å; Q99-D103 VanDerWaalsContact O-CG 3.29Å; Q99-D103 PolarHBondContact O-N 3.01Å; H101-D103 VanDerWaalsContact C-N 3.32Å; H101-D103 PolarHBondContact O-N 3.03Å; D103-R107 CarbonylContact O-C 3.58Å; D103-R107 IonicContact OD1-CZ 2.71Å; D103-R107 IonicContact OD1-NH1 3.71Å; D103-R107 PolarHBondContact OD1-NH1 3.32Å; D103-G108 CarbonylContact O-C 3.11Å; D103-G108 PolarHBondContact O-N 3.3Å; D103-L109 HydrophobicContact CB-CB 4.23Å; D103-L109 PolarHBondContact O-N 3.12Å
104	V	86.6	Confident	85	Confident	37 Å²	37	57.6 Å²	57.6	22%	0.224	30%	0.304	C	S	.	.	I	π-helix	trans	-83.5	-39.7	-173	177.2	0	0	0	0	113.1	L100 H101 L102 A122	L100-V104 HydrophobicContact CD1-CG2 3.97Å; L100-V104 HydrophobicContact CG-CG2 4.22Å; L100-V104 WeakPolarHBondContact O-CB 3.23Å; L100-V104 WeakPolarHBondContact O-CG2 3.38Å; L100-V104 PolarHBondContact O-N 2.84Å; H101-V104 PolarHBondContact O-N 3.31Å; L102-V104 PolarHBondContact O-N 2.98Å; V104-A122 HydrophobicContact CB-CB 4.49Å; V104-A122 HydrophobicContact CG1-CB 4.32Å; V104-A122 HydrophobicContact CG2-CB 3.33Å
105	A	84.8	Confident	84.8	Confident	57 Å²	57	61 Å²	61	47%	0.471	32%	0.319	S	S	.	.	I	π-helix	trans	-93.4	-33.6	-170.6	0	0	0	0	0	113	H101	H101-A105 WeakPolarHBondContact CE1-CB 3.12Å; H101-A105 WeakPolarHBondContact ND1-CB 3.43Å; H101-A105 WeakPolarHBondContact O-CB 3.32Å; H101-A105 PolarHBondContact O-N 3.38Å
106	H	86.7	Confident	84.4	Confident	75 Å²	75	60.6 Å²	60.6	35%	0.347	32%	0.315	S	S	.	.	I	π-helix	trans	-106.8	-39	-175.9	-64.3	-67.1	0	0	0	111.9	C85 Y87 H101 L102	C85-H106 PolarHBondContact SG-NE2 3.06Å; C85-H106 VanDerWaalsContact SG-NE2 3.42Å; Y87-H106 WeakPolarHBondContact CB-CE1 3.18Å; Y87-H106 WeakPolarHBondContact CB-ND1 3.44Å; Y87-H106 HydrophobicContact CD2-CB 4.36Å; Y87-H106 AromaticContact CD2-CD2 3.98Å; Y87-H106 AromaticContact CD2-CG 3.85Å; Y87-H106 AromaticContact CG-ND1 3.82Å; H101-H106 AromaticContact CE1-CD2 3.97Å; H101-H106 AromaticContact CE1-NE2 3.61Å; H101-H106 AromaticContact NE2-CD2 3.71Å; H101-H106 AromaticContact NE2-NE2 3.35Å; H101-H106 PolarHBondContact NE2-NE2 3Å; L102-H106 WeakPolarHBondContact O-CA 3.44Å; L102-H106 WeakPolarHBondContact O-CB 3.29Å; L102-H106 PolarHBondContact O-N 3.39Å
107	R	85.8	Confident	84	Confident	96 Å²	96	59 Å²	59	36%	0.362	30%	0.303	S	S	.	.	S	Bend	trans	-96.2	-10.8	-179.5	-50.6	175.1	170.7	177	-12.9	113.9	L102 D103 L109	L102-R107 PolarHBondContact O-N 2.88Å; D103-R107 CarbonylContact O-C 3.58Å; D103-R107 IonicContact OD1-CZ 2.71Å; D103-R107 IonicContact OD1-NH1 3.71Å; D103-R107 PolarHBondContact OD1-NH1 3.32Å; R107-L109 HydrophobicContact CB-CD1 3.22Å; R107-L109 HydrophobicContact CG-CD1 4.25Å; R107-L109 PolarHBondContact O-N 3.21Å; R107-L109 VanDerWaalsContact O-N 3.15Å
108	G	82.9	Confident	83.7	Confident	47 Å²	47	57.3 Å²	57.3	49%	0.485	30%	0.303	S	S	.	.			trans	66.4	9.3	-178.5	0	0	0	0	0	115.5	D103 R110	D103-G108 CarbonylContact O-C 3.11Å; D103-G108 PolarHBondContact O-N 3.3Å; G108-R110 PolarHBondContact O-N 3.27Å
109	L	82.7	Confident	83.4	Confident	70 Å²	70	62.1 Å²	62.1	37%	0.366	32%	0.323	S	S	.	.			trans	-70.1	117.3	179.4	-78.8	100.7	0	0	0	111.1	D103 R107	D103-L109 HydrophobicContact CB-CB 4.23Å; D103-L109 PolarHBondContact O-N 3.12Å; R107-L109 HydrophobicContact CB-CD1 3.22Å; R107-L109 HydrophobicContact CG-CD1 4.25Å; R107-L109 PolarHBondContact O-N 3.21Å; R107-L109 VanDerWaalsContact O-N 3.15Å
110	R	82.2	Confident	83.2	Confident	118 Å²	118	62 Å²	62	45%	0.445	33%	0.327	S	S	.	.			trans	-123	89.9	172	-67.1	-172.7	-177.7	104.9	5.6	108.9	G108 F112 Y121	G108-R110 PolarHBondContact O-N 3.27Å; R110-F112 PolarHBondContact O-N 3.47Å; R110-F112 VanDerWaalsContact O-N 3.12Å; R110-Y121 CarbonylContact C-O 3.57Å; R110-Y121 VanDerWaalsContact C-O 3.3Å
111	R	79.6	Confident	82.9	Confident	60 Å²	60	62.1 Å²	62.1	23%	0.226	32%	0.324	C	S	.	.			trans	-66	-14.3	-166.5	-49.7	-174.5	83.7	-146.7	-8.1	114.8	N59 Y121	N59-R111 PolarHBondContact O-NH2 3.39Å; R111-Y121 PolarHBondContact N-O 2.81Å
112	F	82.8	Confident	82.8	Confident	38 Å²	38	62.2 Å²	62.2	17%	0.167	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	105.8	-172.8	-59.7	-83.4	0	0	0	111.5	R110 T120 Y121 A122 G124 L127	R110-F112 PolarHBondContact O-N 3.47Å; R110-F112 VanDerWaalsContact O-N 3.12Å; F112-T120 CarbonylContact O-C 3.37Å; F112-T120 WeakPolarHBondContact O-CA 3.41Å; F112-Y121 WeakPolarHBondContact CB-O 3.46Å; F112-Y121 PolarHBondContact N-O 3.26Å; F112-Y121 PolarHBondContact O-N 2.97Å; F112-A122 WeakPolarHBondContact CD2-O 3.41Å; F112-A122 WeakPolarHBondContact CE2-O 3.47Å; F112-G124 VanDerWaalsContact CD2-N 3.3Å; F112-G124 VanDerWaalsContact CE2-N 3.27Å; F112-L127 HydrophobicContact CB-CB 4.06Å; F112-L127 HydrophobicContact CB-CD2 3.89Å
113	Q	84.3	Confident	82.7	Confident	88 Å²	88	64.1 Å²	64.1	41%	0.411	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	140.7	-179.9	-168.3	171.5	32.7	0	0	112.6	G118 T120 L127	Q113-G118 WeakPolarHBondContact CG-O 3.44Å; Q113-G118 PolarHBondContact NE2-O 3.36Å; Q113-T120 HydrophobicContact CB-CG2 3.98Å; Q113-T120 HydrophobicContact CG-CG2 3.82Å; Q113-L127 WeakPolarHBondContact O-CD2 3.48Å
114	C	78.9	Confident	82.5	Confident	2 Å²	2	63.7 Å²	63.7	1%	0.014	34%	0.337	C	S	.	.			trans	-83.3	114.9	171.7	-178.2	0	0	0	0	111	F116 C117 G118 K119 Y121 L127 H130 H135	C114-F116 PolarHBondContact O-N 2.9Å; C114-C117 PolarHBondContact O-N 3.04Å; C114-C117 VanDerWaalsContact SG-SG 3.61Å; C114-G118 VanDerWaalsContact O-CA 3.31Å; C114-G118 WeakPolarHBondContact O-CA 3.41Å; C114-G118 PolarHBondContact O-N 2.86Å; C114-K119 WeakPolarHBondContact CB-O 3.46Å; C114-K119 PolarHBondContact N-O 3.12Å; C114-Y121 HydrophobicContact CB-CE2 4.46Å; C114-L127 HydrophobicContact CB-CD1 3.51Å; C114-H130 VanDerWaalsContact SG-CD2 3.53Å; C114-H130 PolarHBondContact SG-NE2 3.21Å; C114-H135 VanDerWaalsContact SG-CD2 3.52Å; C114-H135 PolarHBondContact SG-NE2 2.83Å
115	N	82.9	Confident	82.4	Confident	110 Å²	110	67.9 Å²	67.9	59%	0.588	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.7	179.6	-59.6	-12.9	0	0	0	113.4	S56	S56-N115 PolarHBondContact OG-ND2 2.93Å; S56-N115 PolarHBondContact OG-OD1 3.43Å
116	F	76.6	Confident	82.5	Confident	119 Å²	119	68.6 Å²	68.6	52%	0.522	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-25.3	-179.2	-59.9	-74.2	0	0	0	115.3	C114 V131 H135	C114-F116 PolarHBondContact O-N 2.9Å; F116-V131 HydrophobicContact CD2-CG1 4.41Å; F116-V131 HydrophobicContact CE2-CG1 4.04Å; F116-H135 WeakPolarHBondContact CB-CE1 3.46Å; F116-H135 WeakPolarHBondContact CB-ND1 3.5Å; F116-H135 WeakPolarHBondContact CB-NE2 3.38Å; F116-H135 HydrophobicContact CD2-CB 4.11Å; F116-H135 AromaticContact CD2-CD2 3.8Å; F116-H135 AromaticContact CD2-CG 3.81Å; F116-H135 HydrophobicContact CG-CB 4.38Å; F116-H135 AromaticContact CG-CG 3.87Å; F116-H135 AromaticContact CG-ND1 3.99Å
117	C	77.8	Confident	82.4	Confident	56 Å²	56	65.4 Å²	65.4	38%	0.378	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.5	4.3	-175.9	66	0	0	0	0	115.1	C114 K119 H130 H135	C114-C117 PolarHBondContact O-N 3.04Å; C114-C117 VanDerWaalsContact SG-SG 3.61Å; C117-K119 PolarHBondContact O-N 2.93Å; C117-K119 VanDerWaalsContact O-N 3.09Å; C117-H130 PolarHBondContact SG-NE2 3.26Å; C117-H135 PolarHBondContact SG-NE2 2.86Å
118	G	80.5	Confident	82.4	Confident	38 Å²	38	66.4 Å²	66.4	39%	0.392	34%	0.34	S	S	.	.			trans	70.6	-4.1	-179.9	0	0	0	0	0	115.7	Q113 C114 T120	Q113-G118 WeakPolarHBondContact CG-O 3.44Å; Q113-G118 PolarHBondContact NE2-O 3.36Å; C114-G118 VanDerWaalsContact O-CA 3.31Å; C114-G118 WeakPolarHBondContact O-CA 3.41Å; C114-G118 PolarHBondContact O-N 2.86Å; G118-T120 PolarHBondContact O-N 3.11Å
119	K	80.5	Confident	82.4	Confident	117 Å²	117	66 Å²	66	51%	0.509	33%	0.332	S	S	.	.			trans	-64.9	133.9	-179.5	-70.8	-177.1	-177.7	-178.5	0	111.6	C114 C117 Y121	C114-K119 WeakPolarHBondContact CB-O 3.46Å; C114-K119 PolarHBondContact N-O 3.12Å; C117-K119 PolarHBondContact O-N 2.93Å; C117-K119 VanDerWaalsContact O-N 3.09Å; K119-Y121 HydrophobicContact CB-CE2 3.97Å
120	T	83.9	Confident	82.4	Confident	56 Å²	56	63 Å²	63	34%	0.344	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.2	-179.6	57.7	0	0	0	0	112.3	F112 Q113 G118	F112-T120 CarbonylContact O-C 3.37Å; F112-T120 WeakPolarHBondContact O-CA 3.41Å; Q113-T120 HydrophobicContact CB-CG2 3.98Å; Q113-T120 HydrophobicContact CG-CG2 3.82Å; G118-T120 PolarHBondContact O-N 3.11Å
121	Y	81	Confident	82.4	Confident	47 Å²	47	57.7 Å²	57.7	18%	0.184	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	148.1	-175.5	-64.2	-81.8	0	0	0	110.9	R110 R111 F112 C114 K119 L126 L127 H130	R110-Y121 CarbonylContact C-O 3.57Å; R110-Y121 VanDerWaalsContact C-O 3.3Å; R111-Y121 PolarHBondContact N-O 2.81Å; F112-Y121 WeakPolarHBondContact CB-O 3.46Å; F112-Y121 PolarHBondContact N-O 3.26Å; F112-Y121 PolarHBondContact O-N 2.97Å; C114-Y121 HydrophobicContact CB-CE2 4.46Å; K119-Y121 HydrophobicContact CB-CE2 3.97Å; Y121-L126 HydrophobicContact CD1-CB 3.99Å; Y121-L126 HydrophobicContact CG-CB 4.36Å; Y121-L127 HydrophobicContact CD2-CB 3.8Å; Y121-L127 HydrophobicContact CD2-CD1 3.67Å; Y121-L127 HydrophobicContact CD2-CG 4.34Å; Y121-L127 HydrophobicContact CE2-CD1 3.89Å; Y121-L127 HydrophobicContact CG-CB 4.17Å; Y121-H130 HydrophobicContact CE1-CB 4.11Å; Y121-H130 HydrophobicContact CE2-CB 3.76Å; Y121-H130 AromaticContact CE2-CD2 3.79Å; Y121-H130 AromaticContact CE2-CG 3.65Å; Y121-H130 VanDerWaalsContact CZ-CB 3.46Å; Y121-H130 AromaticContact CZ-CG 3.46Å; Y121-H130 VanDerWaalsContact CZ-CG 3.46Å; Y121-H130 AromaticContact CZ-ND1 3.79Å; Y121-H130 WeakPolarHBondContact OH-CB 3.5Å; Y121-H130 PolarHBondContact OH-ND1 3.29Å
122	A	84.4	Confident	82.6	Confident	20 Å²	20	58 Å²	58	17%	0.165	30%	0.3	C	S	.	.	S	Bend	trans	-71.1	-34.2	177.9	0	0	0	0	0	113.3	L100 V104 F112	L100-A122 HydrophobicContact CD1-CB 4.3Å; V104-A122 HydrophobicContact CB-CB 4.49Å; V104-A122 HydrophobicContact CG1-CB 4.32Å; V104-A122 HydrophobicContact CG2-CB 3.33Å; F112-A122 WeakPolarHBondContact CD2-O 3.41Å; F112-A122 WeakPolarHBondContact CE2-O 3.47Å
123	K	83.7	Confident	82.5	Confident	70 Å²	70	57.3 Å²	57.3	30%	0.304	30%	0.3	S	S	.	.	S	Bend	trans	-129.5	142.5	-175	-61.4	-169.8	176.9	-173.5	0	110.5	L100 F125 L126 L127	L100-K123 HydrophobicContact CD2-CD 3.9Å; L100-K123 HydrophobicContact CD2-CG 3.75Å; K123-F125 VanDerWaalsContact C-N 3.33Å; K123-F125 HydrophobicContact CB-CD1 3.91Å; K123-F125 HydrophobicContact CB-CE1 3.85Å; K123-F125 HydrophobicContact CD-CD1 4.09Å; K123-F125 HydrophobicContact CD-CE1 3.26Å; K123-F125 HydrophobicContact CD-CZ 3.86Å; K123-F125 HydrophobicContact CG-CE1 4.19Å; K123-F125 PolarHBondContact O-N 3.44Å; K123-L126 HydrophobicContact CB-CD1 4.13Å; K123-L126 HydrophobicContact CB-CG 4.24Å; K123-L126 WeakPolarHBondContact O-CB 3.46Å; K123-L126 PolarHBondContact O-N 2.96Å; K123-L127 PolarHBondContact O-N 3.38Å
124	G	84.1	Confident	82.3	Confident	16 Å²	16	56.5 Å²	56.5	17%	0.165	30%	0.3	C	S	.	.	H	α-helix	trans	-58.8	-38.3	-179.4	0	0	0	0	0	114	F112 L126 L127 K128	F112-G124 VanDerWaalsContact CD2-N 3.3Å; F112-G124 VanDerWaalsContact CE2-N 3.27Å; G124-L126 VanDerWaalsContact C-N 3.26Å; G124-L126 PolarHBondContact O-N 3.42Å; G124-L127 WeakPolarHBondContact O-CB 3.49Å; G124-L127 PolarHBondContact O-N 3.39Å; G124-K128 PolarHBondContact O-N 3.32Å
125	F	84.2	Confident	82.4	Confident	126 Å²	126	59.1 Å²	59.1	55%	0.553	31%	0.312	S	S	*	.	H	α-helix	trans	-66.3	-27.3	177.7	77.7	-102.4	0	0	0	113.2	K123 A129	K123-F125 VanDerWaalsContact C-N 3.33Å; K123-F125 HydrophobicContact CB-CD1 3.91Å; K123-F125 HydrophobicContact CB-CE1 3.85Å; K123-F125 HydrophobicContact CD-CD1 4.09Å; K123-F125 HydrophobicContact CD-CE1 3.26Å; K123-F125 HydrophobicContact CD-CZ 3.86Å; K123-F125 HydrophobicContact CG-CE1 4.19Å; K123-F125 PolarHBondContact O-N 3.44Å; F125-A129 WeakPolarHBondContact O-CB 3.07Å; F125-A129 PolarHBondContact O-N 3.44Å
126	L	86.1	Confident	82.4	Confident	72 Å²	72	57.1 Å²	57.1	38%	0.377	30%	0.299	S	S	.	.	H	α-helix	trans	-71.2	-39.6	175.3	-66.5	173.2	0	0	0	110.6	Y121 K123 G124 A129 H130	Y121-L126 HydrophobicContact CD1-CB 3.99Å; Y121-L126 HydrophobicContact CG-CB 4.36Å; K123-L126 HydrophobicContact CB-CD1 4.13Å; K123-L126 HydrophobicContact CB-CG 4.24Å; K123-L126 WeakPolarHBondContact O-CB 3.46Å; K123-L126 PolarHBondContact O-N 2.96Å; G124-L126 VanDerWaalsContact C-N 3.26Å; G124-L126 PolarHBondContact O-N 3.42Å; L126-A129 PolarHBondContact O-N 3.04Å; L126-H130 WeakPolarHBondContact O-CB 3.49Å; L126-H130 PolarHBondContact O-N 2.97Å
127	L	85.4	Confident	82.6	Confident	8 Å²	8	56 Å²	56	4%	0.042	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-49.5	171.4	171.9	61.7	0	0	0	110.7	F112 Q113 C114 Y121 K123 G124 A129 H130 V131	F112-L127 HydrophobicContact CB-CB 4.06Å; F112-L127 HydrophobicContact CB-CD2 3.89Å; Q113-L127 WeakPolarHBondContact O-CD2 3.48Å; C114-L127 HydrophobicContact CB-CD1 3.51Å; Y121-L127 HydrophobicContact CD2-CB 3.8Å; Y121-L127 HydrophobicContact CD2-CD1 3.67Å; Y121-L127 HydrophobicContact CD2-CG 4.34Å; Y121-L127 HydrophobicContact CE2-CD1 3.89Å; Y121-L127 HydrophobicContact CG-CB 4.17Å; K123-L127 PolarHBondContact O-N 3.38Å; G124-L127 WeakPolarHBondContact O-CB 3.49Å; G124-L127 PolarHBondContact O-N 3.39Å; L127-A129 VanDerWaalsContact C-N 3.31Å; L127-A129 PolarHBondContact O-N 3.21Å; L127-H130 WeakPolarHBondContact O-CA 3.47Å; L127-H130 WeakPolarHBondContact O-CB 3.46Å; L127-H130 PolarHBondContact O-N 3.02Å; L127-V131 HydrophobicContact CD1-CG2 4.01Å; L127-V131 HydrophobicContact CG-CG2 4.47Å; L127-V131 WeakPolarHBondContact O-CG2 3.33Å; L127-V131 PolarHBondContact O-N 3.34Å
128	K	85.5	Confident	82.8	Confident	117 Å²	117	55.9 Å²	55.9	51%	0.509	29%	0.294	S	S	.	.	H	α-helix	trans	-55	-47.3	176.1	-70.4	-176.9	-176.7	-174.6	0	111.7	G124 H130 V131 K132	G124-K128 PolarHBondContact O-N 3.32Å; K128-H130 VanDerWaalsContact C-N 3.3Å; K128-H130 PolarHBondContact O-N 3.14Å; K128-V131 PolarHBondContact O-N 2.94Å; K128-K132 WeakPolarHBondContact O-CB 3.41Å; K128-K132 PolarHBondContact O-N 3.15Å
129	A	82.4	Confident	82.9	Confident	37 Å²	37	60.1 Å²	60.1	31%	0.306	30%	0.298	S	S	.	.	H	α-helix	trans	-63.8	-34.3	177.2	0	0	0	0	0	112.7	F125 L126 L127 S133	F125-A129 WeakPolarHBondContact O-CB 3.07Å; F125-A129 PolarHBondContact O-N 3.44Å; L126-A129 PolarHBondContact O-N 3.04Å; L127-A129 VanDerWaalsContact C-N 3.31Å; L127-A129 PolarHBondContact O-N 3.21Å; A129-S133 VanDerWaalsContact O-CB 3.27Å; A129-S133 WeakPolarHBondContact O-CB 3.5Å; A129-S133 PolarHBondContact O-N 2.88Å; A129-S133 VanDerWaalsContact O-N 3.08Å; A129-S133 PolarHBondContact O-OG 3.39Å
130	H	83.2	Confident	83	Confident	9 Å²	9	58.9 Å²	58.9	4%	0.042	30%	0.297	C	S	.	.	H	α-helix	trans	-64.3	-51.2	172.4	162.5	79.4	0	0	0	111.4	C114 C117 Y121 L126 L127 K128 K132 S133 V134 H135	C114-H130 VanDerWaalsContact SG-CD2 3.53Å; C114-H130 PolarHBondContact SG-NE2 3.21Å; C117-H130 PolarHBondContact SG-NE2 3.26Å; Y121-H130 HydrophobicContact CE1-CB 4.11Å; Y121-H130 HydrophobicContact CE2-CB 3.76Å; Y121-H130 AromaticContact CE2-CD2 3.79Å; Y121-H130 AromaticContact CE2-CG 3.65Å; Y121-H130 VanDerWaalsContact CZ-CB 3.46Å; Y121-H130 AromaticContact CZ-CG 3.46Å; Y121-H130 VanDerWaalsContact CZ-CG 3.46Å; Y121-H130 AromaticContact CZ-ND1 3.79Å; Y121-H130 WeakPolarHBondContact OH-CB 3.5Å; Y121-H130 PolarHBondContact OH-ND1 3.29Å; L126-H130 WeakPolarHBondContact O-CB 3.49Å; L126-H130 PolarHBondContact O-N 2.97Å; L127-H130 WeakPolarHBondContact O-CA 3.47Å; L127-H130 WeakPolarHBondContact O-CB 3.46Å; L127-H130 PolarHBondContact O-N 3.02Å; K128-H130 VanDerWaalsContact C-N 3.3Å; K128-H130 PolarHBondContact O-N 3.14Å; H130-K132 VanDerWaalsContact C-N 3.35Å; H130-K132 PolarHBondContact O-N 3.48Å; H130-S133 PolarHBondContact O-N 3.17Å; H130-S133 VanDerWaalsContact O-N 3.16Å; H130-S133 PolarHBondContact O-OG 3.19Å; H130-V134 WeakPolarHBondContact O-CB 3.48Å; H130-V134 WeakPolarHBondContact O-CG2 3.07Å; H130-V134 PolarHBondContact O-N 2.58Å; H130-H135 AromaticContact CD2-CD2 3.97Å; H130-H135 AromaticContact CE1-NE2 3.68Å; H130-H135 AromaticContact NE2-CD2 3.35Å; H130-H135 PolarHBondContact NE2-CD2 3.47Å; H130-H135 AromaticContact NE2-NE2 2.99Å; H130-H135 PolarHBondContact NE2-NE2 3.38Å
131	V	83.1	Confident	83	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.03	29%	0.289	C	S	.	.	I	π-helix	trans	-57.5	-50.6	179.8	176.2	0	0	0	0	110.5	V53 F116 L127 K128 S133 V134 H135 E136	V53-V131 HydrophobicContact CG2-CG1 3.9Å; F116-V131 HydrophobicContact CD2-CG1 4.41Å; F116-V131 HydrophobicContact CE2-CG1 4.04Å; L127-V131 HydrophobicContact CD1-CG2 4.01Å; L127-V131 HydrophobicContact CG-CG2 4.47Å; L127-V131 WeakPolarHBondContact O-CG2 3.33Å; L127-V131 PolarHBondContact O-N 3.34Å; K128-V131 PolarHBondContact O-N 2.94Å; V131-S133 VanDerWaalsContact C-N 3.3Å; V131-S133 PolarHBondContact O-N 3.1Å; V131-V134 PolarHBondContact O-N 3.07Å; V131-H135 HydrophobicContact CG1-CB 4.38Å; V131-H135 PolarHBondContact O-N 3.49Å; V131-E136 HydrophobicContact CG1-CG 4.26Å; V131-E136 PolarHBondContact O-N 3.32Å
132	K	83.6	Confident	83.2	Confident	67 Å²	67	58.6 Å²	58.6	29%	0.291	30%	0.3	S	S	.	.	I	π-helix	trans	-52.5	-46.1	175.5	-174.5	174.2	-171.7	176.9	0	112.9	K128 H130 E136 N137 I138 D140	K128-K132 WeakPolarHBondContact O-CB 3.41Å; K128-K132 PolarHBondContact O-N 3.15Å; H130-K132 VanDerWaalsContact C-N 3.35Å; H130-K132 PolarHBondContact O-N 3.48Å; K132-E136 WeakPolarHBondContact CA-OE2 3Å; K132-N137 PolarHBondContact O-N 3.37Å; K132-I138 HydrophobicContact CD-CB 4.4Å; K132-I138 HydrophobicContact CD-CG2 4.45Å; K132-I138 HydrophobicContact CG-CB 3.67Å; K132-I138 HydrophobicContact CG-CD1 4.14Å; K132-I138 HydrophobicContact CG-CG1 4.25Å; K132-I138 HydrophobicContact CG-CG2 4.24Å; K132-I138 PolarHBondContact O-N 3.24Å; K132-D140 VanDerWaalsContact NZ-CG 3.29Å; K132-D140 IonicContact NZ-OD1 3.39Å; K132-D140 IonicContact NZ-OD2 3.89Å; K132-D140 PolarHBondContact NZ-OD2 3.49Å
133	S	81.2	Confident	83	Confident	24 Å²	24	57.7 Å²	57.7	17%	0.168	29%	0.292	C	S	.	.	I	π-helix	trans	-88.2	-23.5	-171.5	61.9	0	0	0	0	115.3	A129 H130 V131	A129-S133 VanDerWaalsContact O-CB 3.27Å; A129-S133 WeakPolarHBondContact O-CB 3.5Å; A129-S133 PolarHBondContact O-N 2.88Å; A129-S133 VanDerWaalsContact O-N 3.08Å; A129-S133 PolarHBondContact O-OG 3.39Å; H130-S133 PolarHBondContact O-N 3.17Å; H130-S133 VanDerWaalsContact O-N 3.16Å; H130-S133 PolarHBondContact O-OG 3.19Å; V131-S133 VanDerWaalsContact C-N 3.3Å; V131-S133 PolarHBondContact O-N 3.1Å
134	V	78.7	Confident	83.1	Confident	70 Å²	70	59.7 Å²	59.7	42%	0.424	31%	0.311	S	S	.	.	I	π-helix	trans	-111.2	-42.6	-172.8	179.7	0	0	0	0	112.2	H130 V131 N137	H130-V134 WeakPolarHBondContact O-CB 3.48Å; H130-V134 WeakPolarHBondContact O-CG2 3.07Å; H130-V134 PolarHBondContact O-N 2.58Å; V131-V134 PolarHBondContact O-N 3.07Å; V134-N137 PolarHBondContact O-ND2 2.94Å
135	H	80.8	Confident	83.1	Confident	58 Å²	58	64.2 Å²	64.2	27%	0.269	33%	0.33	S	S	.	.	I	π-helix	trans	-93.4	-49.3	-175.8	-64.9	-60.3	0	0	0	111	C114 F116 C117 H130 V131 N137	C114-H135 VanDerWaalsContact SG-CD2 3.52Å; C114-H135 PolarHBondContact SG-NE2 2.83Å; F116-H135 WeakPolarHBondContact CB-CE1 3.46Å; F116-H135 WeakPolarHBondContact CB-ND1 3.5Å; F116-H135 WeakPolarHBondContact CB-NE2 3.38Å; F116-H135 HydrophobicContact CD2-CB 4.11Å; F116-H135 AromaticContact CD2-CD2 3.8Å; F116-H135 AromaticContact CD2-CG 3.81Å; F116-H135 HydrophobicContact CG-CB 4.38Å; F116-H135 AromaticContact CG-CG 3.87Å; F116-H135 AromaticContact CG-ND1 3.99Å; C117-H135 PolarHBondContact SG-NE2 2.86Å; H130-H135 AromaticContact CD2-CD2 3.97Å; H130-H135 AromaticContact CE1-NE2 3.68Å; H130-H135 AromaticContact NE2-CD2 3.35Å; H130-H135 PolarHBondContact NE2-CD2 3.47Å; H130-H135 AromaticContact NE2-NE2 2.99Å; H130-H135 PolarHBondContact NE2-NE2 3.38Å; V131-H135 HydrophobicContact CG1-CB 4.38Å; V131-H135 PolarHBondContact O-N 3.49Å; H135-N137 VanDerWaalsContact C-N 3.33Å; H135-N137 PolarHBondContact O-ND2 3.31Å
136	E	82.6	Confident	83	Confident	67 Å²	67	61 Å²	61	31%	0.313	32%	0.323	S	S	.	.	S	Bend	trans	-83.6	-12.8	178.6	-57.5	170.4	177.8	0	0	112.5	V53 V131 K132 I138	V53-E136 WeakPolarHBondContact CG2-OE1 3.42Å; V131-E136 HydrophobicContact CG1-CG 4.26Å; V131-E136 PolarHBondContact O-N 3.32Å; K132-E136 WeakPolarHBondContact CA-OE2 3Å; E136-I138 HydrophobicContact CB-CD1 3.9Å; E136-I138 HydrophobicContact CB-CG1 3.66Å; E136-I138 PolarHBondContact O-N 3.11Å; E136-I138 WeakPolarHBondContact OE2-CD1 3.27Å
137	N	81.8	Confident	83	Confident	96 Å²	96	63.8 Å²	63.8	51%	0.513	33%	0.334	S	S	.	.			trans	52	26.4	-177.9	-71.7	-81.1	0	0	0	114.4	K132 V134 H135 R139	K132-N137 PolarHBondContact O-N 3.37Å; V134-N137 PolarHBondContact O-ND2 2.94Å; H135-N137 VanDerWaalsContact C-N 3.33Å; H135-N137 PolarHBondContact O-ND2 3.31Å; N137-R139 PolarHBondContact O-N 2.92Å
138	I	81.8	Confident	82.7	Confident	53 Å²	53	68.4 Å²	68.4	27%	0.272	35%	0.354	S	S	.	.			trans	-69	126.8	-178	-56.5	-179.3	0	0	0	109.4	K132 E136 D140 S151	K132-I138 HydrophobicContact CD-CB 4.4Å; K132-I138 HydrophobicContact CD-CG2 4.45Å; K132-I138 HydrophobicContact CG-CB 3.67Å; K132-I138 HydrophobicContact CG-CD1 4.14Å; K132-I138 HydrophobicContact CG-CG1 4.25Å; K132-I138 HydrophobicContact CG-CG2 4.24Å; K132-I138 PolarHBondContact O-N 3.24Å; E136-I138 HydrophobicContact CB-CD1 3.9Å; E136-I138 HydrophobicContact CB-CG1 3.66Å; E136-I138 PolarHBondContact O-N 3.11Å; E136-I138 WeakPolarHBondContact OE2-CD1 3.27Å; I138-D140 HydrophobicContact CG2-CB 4.25Å; I138-S151 WeakPolarHBondContact O-CA 3.5Å; I138-S151 WeakPolarHBondContact O-CB 3.48Å
139	R	83.9	Confident	82.6	Confident	128 Å²	128	64.3 Å²	64.3	48%	0.483	34%	0.342	S	S	.	.			trans	-123.7	68.4	-179.5	-68.1	169.4	-178	-110.4	3	109.3	N137 V141 A149 F150	N137-R139 PolarHBondContact O-N 2.92Å; R139-V141 PolarHBondContact O-N 3.35Å; R139-A149 HydrophobicContact CB-CB 3.57Å; R139-A149 PolarHBondContact NH1-O 3.27Å; R139-F150 CarbonylContact C-O 3.57Å; R139-F150 VanDerWaalsContact C-O 3.31Å; R139-F150 VanDerWaalsContact CA-O 3.27Å; R139-F150 WeakPolarHBondContact CA-O 3.49Å
140	D	82.6	Confident	82.4	Confident	91 Å²	91	63.2 Å²	63.2	49%	0.487	33%	0.33	S	S	.	.			trans	-70.1	-11.1	-176.2	58.1	-24.5	0	0	0	114.3	K132 I138	K132-D140 VanDerWaalsContact NZ-CG 3.29Å; K132-D140 IonicContact NZ-OD1 3.39Å; K132-D140 IonicContact NZ-OD2 3.89Å; K132-D140 PolarHBondContact NZ-OD2 3.49Å; I138-D140 HydrophobicContact CG2-CB 4.25Å
141	V	83.3	Confident	82.4	Confident	27 Å²	27	64.7 Å²	64.7	16%	0.164	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	107.6	-177.9	-171.3	0	0	0	0	110.6	R139 F150 R153 M156	R139-V141 PolarHBondContact O-N 3.35Å; V141-F150 PolarHBondContact N-O 3.04Å; V141-F150 VanDerWaalsContact N-O 3.08Å; V141-F150 PolarHBondContact O-N 3.27Å; V141-R153 HydrophobicContact CG1-CB 4.38Å; V141-R153 HydrophobicContact CG1-CG 4.37Å; V141-R153 HydrophobicContact CG2-CB 4.33Å; V141-M156 HydrophobicContact CG1-CB 3.87Å; V141-M156 HydrophobicContact CG1-CE 3.21Å; V141-M156 HydrophobicContact CG1-CG 3.96Å; V141-M156 HydrophobicContact CG1-SD 4.44Å
142	T	85.5	Confident	82.4	Confident	70 Å²	70	69 Å²	69	43%	0.429	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	152.9	178.9	53.7	0	0	0	0	112.4	K148 A149	T142-K148 CarbonylContact C-O 3.56Å; T142-K148 WeakPolarHBondContact CA-O 3.23Å; T142-A149 HydrophobicContact CG2-CB 4.1Å
143	C	79.3	Confident	82.5	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	38%	0.375	C	S	.	.			trans	-81.7	122.4	169.2	168.2	0	0	0	0	109.4	I145 C146 Q147 K148 F150 H159 M160 H164	C143-I145 PolarHBondContact O-N 2.89Å; C143-I145 VanDerWaalsContact O-N 3.15Å; C143-I145 PolarHBondContact SG-N 3.25Å; C143-C146 PolarHBondContact SG-N 3.45Å; C143-C146 PolarHBondContact SG-SG 3.03Å; C143-Q147 WeakPolarHBondContact O-CA 3.39Å; C143-Q147 PolarHBondContact O-N 2.9Å; C143-K148 HydrophobicContact CB-CB 4.44Å; C143-K148 WeakPolarHBondContact CB-O 3.31Å; C143-K148 PolarHBondContact N-O 3.33Å; C143-F150 HydrophobicContact CB-CE2 4.04Å; C143-H159 PolarHBondContact SG-NE2 3.06Å; C143-M160 VanDerWaalsContact CA-CE 3.44Å; C143-M160 HydrophobicContact CB-CE 3.63Å; C143-M160 WeakPolarHBondContact SG-CE 3.07Å; C143-H164 VanDerWaalsContact SG-CD2 3.55Å; C143-H164 PolarHBondContact SG-NE2 2.91Å
144	T	86.5	Confident	82.8	Confident	113 Å²	113	76.2 Å²	76.2	69%	0.693	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-18.9	179.8	52.4	0	0	0	0	114.4
145	I	82.6	Confident	83.1	Confident	110 Å²	110	75.1 Å²	75.1	56%	0.564	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-52.4	-176.2	-59.2	170.5	0	0	0	111.7	C143 M160 H164	C143-I145 PolarHBondContact O-N 2.89Å; C143-I145 VanDerWaalsContact O-N 3.15Å; C143-I145 PolarHBondContact SG-N 3.25Å; I145-M160 HydrophobicContact CD1-SD 4.21Å; I145-H164 HydrophobicContact CD1-CB 3.63Å; I145-H164 VanDerWaalsContact CG2-CE1 3.49Å; I145-H164 WeakPolarHBondContact CG2-CE1 3.33Å; I145-H164 WeakPolarHBondContact CG2-ND1 3.43Å
146	C	83.5	Confident	83.4	Confident	59 Å²	59	73.7 Å²	73.7	40%	0.399	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	6.2	-179.5	68.5	0	0	0	0	114.7	C143 K148 H159 H164	C143-C146 PolarHBondContact SG-N 3.45Å; C143-C146 PolarHBondContact SG-SG 3.03Å; C146-K148 PolarHBondContact O-N 3.12Å; C146-K148 WeakPolarHBondContact SG-CB 3.42Å; C146-H159 PolarHBondContact SG-NE2 3.28Å; C146-H164 PolarHBondContact SG-NE2 3.47Å
147	Q	85.7	Confident	83.7	Confident	131 Å²	131	77 Å²	77	61%	0.612	39%	0.39	S	S	*	.			trans	56.9	10.7	-178.4	-57.6	-62.5	-4.4	0	0	115.5	C143 A149	C143-Q147 WeakPolarHBondContact O-CA 3.39Å; C143-Q147 PolarHBondContact O-N 2.9Å; Q147-A149 PolarHBondContact O-N 3.08Å
148	K	79.3	Confident	83.8	Confident	105 Å²	105	77.5 Å²	77.5	46%	0.457	38%	0.384	S	S	.	.			trans	-67	128.9	178.4	-168.8	166.5	-171.2	-69.5	0	110.9	T142 C143 C146 F150	T142-K148 CarbonylContact C-O 3.56Å; T142-K148 WeakPolarHBondContact CA-O 3.23Å; C143-K148 HydrophobicContact CB-CB 4.44Å; C143-K148 WeakPolarHBondContact CB-O 3.31Å; C143-K148 PolarHBondContact N-O 3.33Å; C146-K148 PolarHBondContact O-N 3.12Å; C146-K148 WeakPolarHBondContact SG-CB 3.42Å; K148-F150 HydrophobicContact CB-CE2 4Å; K148-F150 HydrophobicContact CB-CZ 4.14Å; K148-F150 HydrophobicContact CD-CZ 3.98Å; K148-F150 HydrophobicContact CG-CE2 4.09Å; K148-F150 HydrophobicContact CG-CZ 3.85Å; K148-F150 WeakPolarHBondContact O-CD2 3.48Å; K148-F150 WeakPolarHBondContact O-CE2 3.41Å
149	A	84	Confident	84	Confident	31 Å²	31	76 Å²	76	26%	0.256	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	140.6	-178	0	0	0	0	0	113.2	R139 T142 Q147	R139-A149 HydrophobicContact CB-CB 3.57Å; R139-A149 PolarHBondContact NH1-O 3.27Å; T142-A149 HydrophobicContact CG2-CB 4.1Å; Q147-A149 PolarHBondContact O-N 3.08Å
150	F	78.2	Confident	84.1	Confident	14 Å²	14	71.5 Å²	71.5	6%	0.061	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	148.9	-179.4	-57.5	-88.1	0	0	0	111.3	R139 V141 C143 K148 K152 V155 M156 H159	R139-F150 CarbonylContact C-O 3.57Å; R139-F150 VanDerWaalsContact C-O 3.31Å; R139-F150 VanDerWaalsContact CA-O 3.27Å; R139-F150 WeakPolarHBondContact CA-O 3.49Å; V141-F150 PolarHBondContact N-O 3.04Å; V141-F150 VanDerWaalsContact N-O 3.08Å; V141-F150 PolarHBondContact O-N 3.27Å; C143-F150 HydrophobicContact CB-CE2 4.04Å; K148-F150 HydrophobicContact CB-CE2 4Å; K148-F150 HydrophobicContact CB-CZ 4.14Å; K148-F150 HydrophobicContact CD-CZ 3.98Å; K148-F150 HydrophobicContact CG-CE2 4.09Å; K148-F150 HydrophobicContact CG-CZ 3.85Å; K148-F150 WeakPolarHBondContact O-CD2 3.48Å; K148-F150 WeakPolarHBondContact O-CE2 3.41Å; F150-K152 VanDerWaalsContact C-N 3.34Å; F150-V155 HydrophobicContact CD1-CB 4.48Å; F150-V155 HydrophobicContact CD1-CG1 3.74Å; F150-V155 HydrophobicContact CE1-CG1 4.37Å; F150-M156 HydrophobicContact CB-CB 3.97Å; F150-M156 HydrophobicContact CD2-CB 3.51Å; F150-M156 HydrophobicContact CD2-CG 3.72Å; F150-M156 HydrophobicContact CE2-CB 4.22Å; F150-M156 HydrophobicContact CE2-CG 4.14Å; F150-M156 HydrophobicContact CG-CB 3.83Å; F150-H159 HydrophobicContact CE1-CB 3.78Å; F150-H159 AromaticContact CE1-CG 3.99Å; F150-H159 HydrophobicContact CE2-CB 4.11Å; F150-H159 AromaticContact CE2-CD2 3.48Å; F150-H159 VanDerWaalsContact CE2-CD2 3.48Å; F150-H159 WeakPolarHBondContact CE2-CD2 3.49Å; F150-H159 AromaticContact CE2-CG 3.82Å; F150-H159 HydrophobicContact CZ-CB 3.44Å; F150-H159 VanDerWaalsContact CZ-CB 3.44Å; F150-H159 AromaticContact CZ-CD2 3.33Å; F150-H159 WeakPolarHBondContact CZ-CD2 3.4Å; F150-H159 AromaticContact CZ-CG 3.19Å; F150-H159 AromaticContact CZ-ND1 3.73Å; F150-H159 AromaticContact CZ-NE2 3.88Å
151	S	83.4	Confident	84.3	Confident	39 Å²	39	72.3 Å²	72.3	27%	0.273	36%	0.36	S	S	.	.	S	Bend	trans	-81.6	-9.4	179.2	56.2	0	0	0	0	114.7	I138	I138-S151 WeakPolarHBondContact O-CA 3.5Å; I138-S151 WeakPolarHBondContact O-CB 3.48Å
152	K	81.9	Confident	84.4	Confident	96 Å²	96	73.4 Å²	73.4	42%	0.417	37%	0.369	S	S	.	.	S	Bend	trans	-144.8	136.2	-179.7	-63.4	-175.3	-176.9	-178	0	110.4	F150 S154 V155 M156	F150-K152 VanDerWaalsContact C-N 3.34Å; K152-S154 VanDerWaalsContact C-N 3.26Å; K152-S154 PolarHBondContact O-N 2.76Å; K152-V155 HydrophobicContact CB-CB 4.44Å; K152-V155 HydrophobicContact CB-CG2 4.01Å; K152-V155 PolarHBondContact O-N 3.17Å; K152-M156 PolarHBondContact O-N 3.18Å; K152-M156 VanDerWaalsContact O-N 3.12Å
153	R	86	Confident	84.3	Confident	166 Å²	166	74.4 Å²	74.4	63%	0.626	38%	0.375	S	S	*	.	H	α-helix	trans	-58.5	-34.9	176.8	-165.7	171.6	-173.9	174.4	1.3	113.5	V141 V155 M156 R157	V141-R153 HydrophobicContact CG1-CB 4.38Å; V141-R153 HydrophobicContact CG1-CG 4.37Å; V141-R153 HydrophobicContact CG2-CB 4.33Å; R153-V155 VanDerWaalsContact C-N 3.34Å; R153-V155 PolarHBondContact O-N 3.38Å; R153-M156 HydrophobicContact CG-CE 3.98Å; R153-M156 PolarHBondContact O-N 2.57Å; R153-R157 WeakPolarHBondContact O-CB 2.86Å; R153-R157 PolarHBondContact O-N 3.45Å
154	S	87	Confident	84.5	Confident	77 Å²	77	77 Å²	77	54%	0.538	39%	0.387	S	S	.	.	H	α-helix	trans	-65	-36.3	175.7	55.7	0	0	0	0	112.9	K152 R158	K152-S154 VanDerWaalsContact C-N 3.26Å; K152-S154 PolarHBondContact O-N 2.76Å; S154-R158 WeakPolarHBondContact O-CB 3.37Å; S154-R158 PolarHBondContact O-N 3.32Å
155	V	85	Confident	84.2	Confident	47 Å²	47	73.7 Å²	73.7	29%	0.285	37%	0.371	S	S	.	.	H	α-helix	trans	-71.9	-42.5	177.7	-179.3	0	0	0	0	110.4	F150 K152 R153 R158 H159	F150-V155 HydrophobicContact CD1-CB 4.48Å; F150-V155 HydrophobicContact CD1-CG1 3.74Å; F150-V155 HydrophobicContact CE1-CG1 4.37Å; K152-V155 HydrophobicContact CB-CB 4.44Å; K152-V155 HydrophobicContact CB-CG2 4.01Å; K152-V155 PolarHBondContact O-N 3.17Å; R153-V155 VanDerWaalsContact C-N 3.34Å; R153-V155 PolarHBondContact O-N 3.38Å; V155-R158 PolarHBondContact O-N 3.46Å; V155-H159 PolarHBondContact O-N 3.49Å
156	M	87.1	Confident	84	Confident	28 Å²	28	77.7 Å²	77.7	14%	0.138	39%	0.387	C	S	.	.	H	α-helix	trans	-60.2	-46.3	173.1	177.4	-88.5	-72.6	0	0	111.6	V141 F150 K152 R153 R158 H159 M160	V141-M156 HydrophobicContact CG1-CB 3.87Å; V141-M156 HydrophobicContact CG1-CE 3.21Å; V141-M156 HydrophobicContact CG1-CG 3.96Å; V141-M156 HydrophobicContact CG1-SD 4.44Å; F150-M156 HydrophobicContact CB-CB 3.97Å; F150-M156 HydrophobicContact CD2-CB 3.51Å; F150-M156 HydrophobicContact CD2-CG 3.72Å; F150-M156 HydrophobicContact CE2-CB 4.22Å; F150-M156 HydrophobicContact CE2-CG 4.14Å; F150-M156 HydrophobicContact CG-CB 3.83Å; K152-M156 PolarHBondContact O-N 3.18Å; K152-M156 VanDerWaalsContact O-N 3.12Å; R153-M156 HydrophobicContact CG-CE 3.98Å; R153-M156 PolarHBondContact O-N 2.57Å; M156-R158 VanDerWaalsContact C-N 3.3Å; M156-R158 PolarHBondContact O-N 2.88Å; M156-H159 WeakPolarHBondContact O-CA 3.32Å; M156-H159 VanDerWaalsContact O-CB 3.31Å; M156-H159 WeakPolarHBondContact O-CB 3.49Å; M156-H159 PolarHBondContact O-N 2.99Å; M156-M160 WeakPolarHBondContact O-CG 3.44Å; M156-M160 PolarHBondContact O-N 3.02Å; M156-M160 HydrophobicContact SD-CE 4.03Å; M156-M160 HydrophobicContact SD-CG 3.98Å
157	R	88.7	Confident	83.6	Confident	136 Å²	136	82.4 Å²	82.4	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-60.8	-40.1	177.3	-171.6	-177.9	-65.6	135.5	-3.1	112.1	R153 M160 K161	R153-R157 WeakPolarHBondContact O-CB 2.86Å; R153-R157 PolarHBondContact O-N 3.45Å; R157-M160 WeakPolarHBondContact O-CB 3.31Å; R157-M160 PolarHBondContact O-N 3.05Å; R157-K161 WeakPolarHBondContact O-CG 3.21Å; R157-K161 PolarHBondContact O-N 3.13Å; R157-K161 VanDerWaalsContact O-N 3.12Å
158	R	85.4	Confident	83.3	Confident	106 Å²	106	80.2 Å²	80.2	40%	0.4	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-42.4	172.8	172.7	173.2	53.5	164.9	4.1	111.6	S154 V155 M156 M160 K161 S162 E181	S154-R158 WeakPolarHBondContact O-CB 3.37Å; S154-R158 PolarHBondContact O-N 3.32Å; V155-R158 PolarHBondContact O-N 3.46Å; M156-R158 VanDerWaalsContact C-N 3.3Å; M156-R158 PolarHBondContact O-N 2.88Å; R158-M160 VanDerWaalsContact C-N 3.34Å; R158-M160 PolarHBondContact O-N 3.27Å; R158-K161 PolarHBondContact O-N 2.91Å; R158-S162 WeakPolarHBondContact O-CB 3.15Å; R158-S162 PolarHBondContact O-N 2.67Å; R158-S162 PolarHBondContact O-OG 3.49Å; R158-S162 VanDerWaalsContact O-OG 3.11Å; R158-E181 WeakPolarHBondContact CD-OE1 3.4Å; R158-E181 IonicContact CZ-OE1 2.75Å; R158-E181 IonicContact NE-OE1 3.68Å; R158-E181 IonicContact NH1-OE1 3.34Å; R158-E181 PolarHBondContact NH1-OE1 2.98Å
159	H	85.3	Confident	83.5	Confident	21 Å²	21	79.2 Å²	79.2	10%	0.097	39%	0.389	C	S	.	.	H	α-helix	trans	-57.7	-47.3	175.8	159.5	75.3	0	0	0	111.3	C143 C146 F150 V155 M156 K161 S162 V163 H164	C143-H159 PolarHBondContact SG-NE2 3.06Å; C146-H159 PolarHBondContact SG-NE2 3.28Å; F150-H159 HydrophobicContact CE1-CB 3.78Å; F150-H159 AromaticContact CE1-CG 3.99Å; F150-H159 HydrophobicContact CE2-CB 4.11Å; F150-H159 AromaticContact CE2-CD2 3.48Å; F150-H159 VanDerWaalsContact CE2-CD2 3.48Å; F150-H159 WeakPolarHBondContact CE2-CD2 3.49Å; F150-H159 AromaticContact CE2-CG 3.82Å; F150-H159 HydrophobicContact CZ-CB 3.44Å; F150-H159 VanDerWaalsContact CZ-CB 3.44Å; F150-H159 AromaticContact CZ-CD2 3.33Å; F150-H159 WeakPolarHBondContact CZ-CD2 3.4Å; F150-H159 AromaticContact CZ-CG 3.19Å; F150-H159 AromaticContact CZ-ND1 3.73Å; F150-H159 AromaticContact CZ-NE2 3.88Å; V155-H159 PolarHBondContact O-N 3.49Å; M156-H159 WeakPolarHBondContact O-CA 3.32Å; M156-H159 VanDerWaalsContact O-CB 3.31Å; M156-H159 WeakPolarHBondContact O-CB 3.49Å; M156-H159 PolarHBondContact O-N 2.99Å; H159-K161 VanDerWaalsContact C-N 3.34Å; H159-K161 PolarHBondContact O-N 2.95Å; H159-S162 WeakPolarHBondContact CA-OG 3.22Å; H159-S162 PolarHBondContact O-N 3.4Å; H159-S162 PolarHBondContact O-OG 3.01Å; H159-V163 WeakPolarHBondContact ND1-CG2 3.34Å; H159-V163 PolarHBondContact O-N 2.89Å; H159-H164 AromaticContact CE1-NE2 3.82Å; H159-H164 AromaticContact NE2-CD2 3.66Å; H159-H164 AromaticContact NE2-NE2 3.32Å; H159-H164 PolarHBondContact NE2-NE2 2.87Å
160	M	86	Confident	83.7	Confident	34 Å²	34	80.9 Å²	80.9	17%	0.167	39%	0.391	C	S	.	.	I	π-helix	trans	-52.2	-52.2	174.2	-70	-65.4	-175.4	0	0	111.6	C143 I145 M156 R157 R158 S162 H164 A165	C143-M160 VanDerWaalsContact CA-CE 3.44Å; C143-M160 HydrophobicContact CB-CE 3.63Å; C143-M160 WeakPolarHBondContact SG-CE 3.07Å; I145-M160 HydrophobicContact CD1-SD 4.21Å; M156-M160 WeakPolarHBondContact O-CG 3.44Å; M156-M160 PolarHBondContact O-N 3.02Å; M156-M160 HydrophobicContact SD-CE 4.03Å; M156-M160 HydrophobicContact SD-CG 3.98Å; R157-M160 WeakPolarHBondContact O-CB 3.31Å; R157-M160 PolarHBondContact O-N 3.05Å; R158-M160 VanDerWaalsContact C-N 3.34Å; R158-M160 PolarHBondContact O-N 3.27Å; M160-S162 PolarHBondContact O-N 3.24Å; M160-H164 CarbonylContact O-C 3.52Å; M160-H164 WeakPolarHBondContact O-CA 3.45Å; M160-H164 PolarHBondContact O-N 2.94Å; M160-H164 HydrophobicContact SD-CB 4.39Å; M160-H164 VanDerWaalsContact SD-CD2 3.56Å; M160-A165 PolarHBondContact O-N 3.48Å
161	K	86.8	Confident	84.2	Confident	109 Å²	109	84.7 Å²	84.7	47%	0.474	41%	0.409	S	S	.	.	I	π-helix	trans	-62.5	-22.7	177.4	-70.7	-169.9	174	-153.4	0	114.4	R157 R158 H159	R157-K161 WeakPolarHBondContact O-CG 3.21Å; R157-K161 PolarHBondContact O-N 3.13Å; R157-K161 VanDerWaalsContact O-N 3.12Å; R158-K161 PolarHBondContact O-N 2.91Å; H159-K161 VanDerWaalsContact C-N 3.34Å; H159-K161 PolarHBondContact O-N 2.95Å
162	S	84.8	Confident	84.3	Confident	49 Å²	49	82.9 Å²	82.9	34%	0.343	40%	0.396	S	S	.	.	I	π-helix	trans	-100	-26.6	-174.1	65	0	0	0	0	115.3	R158 H159 M160	R158-S162 WeakPolarHBondContact O-CB 3.15Å; R158-S162 PolarHBondContact O-N 2.67Å; R158-S162 PolarHBondContact O-OG 3.49Å; R158-S162 VanDerWaalsContact O-OG 3.11Å; H159-S162 WeakPolarHBondContact CA-OG 3.22Å; H159-S162 PolarHBondContact O-N 3.4Å; H159-S162 PolarHBondContact O-OG 3.01Å; M160-S162 PolarHBondContact O-N 3.24Å
163	V	82.8	Confident	84.5	Confident	92 Å²	92	83.9 Å²	83.9	56%	0.558	41%	0.406	S	S	*	.	I	π-helix	trans	-114.8	-39.3	-173.4	-179.8	0	0	0	0	111.1	H159	H159-V163 WeakPolarHBondContact ND1-CG2 3.34Å; H159-V163 PolarHBondContact O-N 2.89Å
164	H	84	Confident	84.4	Confident	53 Å²	53	81.8 Å²	81.8	25%	0.245	41%	0.406	C	S	.	.	I	π-helix	trans	-103.9	-26.4	-173.6	-62.7	-57.5	0	0	0	113.6	C143 I145 C146 H159 M160 E166	C143-H164 VanDerWaalsContact SG-CD2 3.55Å; C143-H164 PolarHBondContact SG-NE2 2.91Å; I145-H164 HydrophobicContact CD1-CB 3.63Å; I145-H164 VanDerWaalsContact CG2-CE1 3.49Å; I145-H164 WeakPolarHBondContact CG2-CE1 3.33Å; I145-H164 WeakPolarHBondContact CG2-ND1 3.43Å; C146-H164 PolarHBondContact SG-NE2 3.47Å; H159-H164 AromaticContact CE1-NE2 3.82Å; H159-H164 AromaticContact NE2-CD2 3.66Å; H159-H164 AromaticContact NE2-NE2 3.32Å; H159-H164 PolarHBondContact NE2-NE2 2.87Å; M160-H164 CarbonylContact O-C 3.52Å; M160-H164 WeakPolarHBondContact O-CA 3.45Å; M160-H164 PolarHBondContact O-N 2.94Å; M160-H164 HydrophobicContact SD-CB 4.39Å; M160-H164 VanDerWaalsContact SD-CD2 3.56Å; H164-E166 PolarHBondContact O-N 3.44Å
165	A	80.9	Confident	84.3	Confident	44 Å²	44	80.9 Å²	80.9	36%	0.364	40%	0.399	S	S	.	.			trans	-75.9	120.8	171.1	0	0	0	0	0	109.6	M160 K167	M160-A165 PolarHBondContact O-N 3.48Å; A165-K167 PolarHBondContact O-N 2.92Å
166	E	77.2	Confident	84.3	Confident	194 Å²	194	84.5 Å²	84.5	91%	0.907	41%	0.413	S	S	*	.	S	Bend	trans	-65	-34.1	174.4	-61.1	-179.2	169.7	0	0	111.3	H164	H164-E166 PolarHBondContact O-N 3.44Å
167	K	76.5	Confident	84.2	Confident	158 Å²	158	88.3 Å²	88.3	69%	0.687	43%	0.429	S	S	*	.			trans	-86.5	123.1	-178.4	-168.6	174.4	-179.2	176.1	0	111.7	A165	A165-K167 PolarHBondContact O-N 2.92Å
168	K	79.5	Confident	84	Confident	85 Å²	85	86.7 Å²	86.7	37%	0.37	43%	0.427	S	S	.	.			trans	-97.6	109.6	168.2	-71.7	179.2	-175.7	166.3	0	109	F170 Q178 T180	K168-F170 PolarHBondContact O-N 3.31Å; K168-F170 VanDerWaalsContact O-N 3.17Å; K168-Q178 HydrophobicContact CB-CB 3.64Å; K168-Q178 HydrophobicContact CD-CB 3.84Å; K168-Q178 HydrophobicContact CG-CB 4.37Å; K168-T180 HydrophobicContact CD-CG2 4.27Å; K168-T180 HydrophobicContact CG-CG2 3.83Å
169	D	83.2	Confident	84.1	Confident	85 Å²	85	82.8 Å²	82.8	46%	0.455	41%	0.413	S	S	.	.	S	Bend	trans	-63.2	-23.2	-171.4	-60.6	-31.4	0	0	0	114.4
170	F	88.1	Confident	84.1	Confident	65 Å²	65	83.2 Å²	83.2	29%	0.285	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	114	-172.5	-55.7	-76.9	0	0	0	110.8	K168 Q178 F179 K182 L185	K168-F170 PolarHBondContact O-N 3.31Å; K168-F170 VanDerWaalsContact O-N 3.17Å; F170-Q178 CarbonylContact O-C 3.06Å; F170-Q178 WeakPolarHBondContact O-CA 3.29Å; F170-F179 HydrophobicContact CB-CB 4.29Å; F170-F179 WeakPolarHBondContact CB-O 3.48Å; F170-F179 PolarHBondContact N-O 3.33Å; F170-F179 VanDerWaalsContact N-O 3.11Å; F170-F179 PolarHBondContact O-N 3.44Å; F170-K182 HydrophobicContact CD1-CB 3.91Å; F170-K182 HydrophobicContact CD1-CG 4.28Å; F170-K182 HydrophobicContact CE1-CB 3.66Å; F170-K182 HydrophobicContact CE1-CD 4.44Å; F170-K182 HydrophobicContact CE1-CG 4.17Å; F170-K182 HydrophobicContact CE2-CB 4.38Å; F170-K182 HydrophobicContact CG-CB 4.38Å; F170-K182 HydrophobicContact CZ-CB 3.91Å; F170-L185 HydrophobicContact CB-CB 4.15Å; F170-L185 HydrophobicContact CB-CD2 3.85Å
171	H	88.6	Confident	84.1	Confident	95 Å²	95	83.5 Å²	83.5	44%	0.44	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.8	-179.6	60.5	-52.6	0	0	0	110.1	Q178 L185	H171-Q178 HydrophobicContact CB-CG 4.29Å; H171-L185 WeakPolarHBondContact O-CD2 3.31Å
172	C	84.4	Confident	84.3	Confident	0 Å²	0	85.1 Å²	85.1	0%	0	43%	0.425	C	S	.	.			trans	-86.8	116.4	173.4	-176.5	0	0	0	0	109.9	L174 C175 Q176 K177 F179 L185 H193	C172-L174 PolarHBondContact O-N 3.43Å; C172-C175 PolarHBondContact O-N 2.87Å; C172-Q176 WeakPolarHBondContact O-CA 3.3Å; C172-Q176 PolarHBondContact O-N 3.34Å; C172-K177 PolarHBondContact N-O 2.87Å; C172-F179 HydrophobicContact CB-CE2 4.47Å; C172-L185 HydrophobicContact CB-CD1 3.6Å; C172-H193 PolarHBondContact SG-CD2 3.09Å; C172-H193 PolarHBondContact SG-NE2 2.99Å
173	N	87.2	Confident	84.4	Confident	117 Å²	117	88.6 Å²	88.6	63%	0.626	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.4	-180	-59.2	-4.9	0	0	0	113.7
174	L	82.9	Confident	84.7	Confident	122 Å²	122	86.6 Å²	86.6	64%	0.639	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-27.7	-176.6	-60.5	174.4	0	0	0	113.8	C172 H193	C172-L174 PolarHBondContact O-N 3.43Å; L174-H193 HydrophobicContact CD1-CB 3.44Å; L174-H193 VanDerWaalsContact CD1-CB 3.44Å; L174-H193 VanDerWaalsContact CD1-CG 3.45Å
175	C	85.7	Confident	84.9	Confident	59 Å²	59	85 Å²	85	40%	0.399	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	6.3	177.8	68.3	0	0	0	0	114.3	C172 K177 H188 H193	C172-C175 PolarHBondContact O-N 2.87Å; C175-K177 PolarHBondContact O-N 3.12Å; C175-K177 VanDerWaalsContact SG-CB 3.5Å; C175-H188 PolarHBondContact SG-CE1 3.12Å; C175-H188 PolarHBondContact SG-NE2 2.79Å; C175-H193 PolarHBondContact SG-NE2 3.38Å; C175-H193 VanDerWaalsContact SG-NE2 3.39Å
176	Q	85.2	Confident	85.2	Confident	122 Å²	122	86.7 Å²	86.7	57%	0.57	41%	0.414	S	S	*	.			trans	56.7	10.9	-177.2	-56	-60.2	-13.5	0	0	115.5	C172 Q178	C172-Q176 WeakPolarHBondContact O-CA 3.3Å; C172-Q176 PolarHBondContact O-N 3.34Å; Q176-Q178 PolarHBondContact O-N 2.94Å
177	K	84.6	Confident	85.7	Confident	108 Å²	108	81 Å²	81	47%	0.47	39%	0.388	S	S	.	.			trans	-67.9	132.2	176.3	-165.8	168.9	-167.7	-70.1	0	110.5	C172 C175 F179	C172-K177 PolarHBondContact N-O 2.87Å; C175-K177 PolarHBondContact O-N 3.12Å; C175-K177 VanDerWaalsContact SG-CB 3.5Å; K177-F179 HydrophobicContact CB-CE2 4.01Å; K177-F179 HydrophobicContact CB-CZ 4.29Å; K177-F179 HydrophobicContact CD-CE2 4.47Å; K177-F179 HydrophobicContact CD-CZ 3.92Å; K177-F179 HydrophobicContact CG-CE2 3.99Å; K177-F179 HydrophobicContact CG-CZ 3.89Å; K177-F179 WeakPolarHBondContact O-CD2 3.37Å; K177-F179 WeakPolarHBondContact O-CE2 3.43Å
178	Q	85.5	Confident	86.2	Confident	102 Å²	102	74.3 Å²	74.3	48%	0.477	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	147.2	-176.6	-55.4	179.8	-10.3	0	0	113.1	K168 F170 H171 Q176	K168-Q178 HydrophobicContact CB-CB 3.64Å; K168-Q178 HydrophobicContact CD-CB 3.84Å; K168-Q178 HydrophobicContact CG-CB 4.37Å; F170-Q178 CarbonylContact O-C 3.06Å; F170-Q178 WeakPolarHBondContact O-CA 3.29Å; H171-Q178 HydrophobicContact CB-CG 4.29Å; Q176-Q178 PolarHBondContact O-N 2.94Å
179	F	85.9	Confident	86.5	Confident	25 Å²	25	71.8 Å²	71.8	11%	0.11	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.9	-174.1	-59.4	-90.3	0	0	0	111.1	F170 C172 K177 N184 L185 H188	F170-F179 HydrophobicContact CB-CB 4.29Å; F170-F179 WeakPolarHBondContact CB-O 3.48Å; F170-F179 PolarHBondContact N-O 3.33Å; F170-F179 VanDerWaalsContact N-O 3.11Å; F170-F179 PolarHBondContact O-N 3.44Å; C172-F179 HydrophobicContact CB-CE2 4.47Å; K177-F179 HydrophobicContact CB-CE2 4.01Å; K177-F179 HydrophobicContact CB-CZ 4.29Å; K177-F179 HydrophobicContact CD-CE2 4.47Å; K177-F179 HydrophobicContact CD-CZ 3.92Å; K177-F179 HydrophobicContact CG-CE2 3.99Å; K177-F179 HydrophobicContact CG-CZ 3.89Å; K177-F179 WeakPolarHBondContact O-CD2 3.37Å; K177-F179 WeakPolarHBondContact O-CE2 3.43Å; F179-N184 HydrophobicContact CD1-CB 4.01Å; F179-L185 HydrophobicContact CB-CB 4.19Å; F179-L185 HydrophobicContact CD2-CB 3.89Å; F179-L185 HydrophobicContact CD2-CD1 3.65Å; F179-L185 HydrophobicContact CD2-CG 4.38Å; F179-L185 HydrophobicContact CE2-CD1 3.81Å; F179-L185 HydrophobicContact CG-CB 4.13Å; F179-H188 HydrophobicContact CE1-CB 3.87Å; F179-H188 HydrophobicContact CE2-CB 4.03Å; F179-H188 AromaticContact CE2-CD2 3.51Å; F179-H188 AromaticContact CE2-CG 3.72Å; F179-H188 AromaticContact CE2-NE2 4Å; F179-H188 HydrophobicContact CZ-CB 3.4Å; F179-H188 VanDerWaalsContact CZ-CB 3.4Å; F179-H188 AromaticContact CZ-CD2 3.54Å; F179-H188 AromaticContact CZ-CG 3.23Å; F179-H188 AromaticContact CZ-ND1 3.62Å
180	T	86.7	Confident	86.6	Confident	30 Å²	30	70 Å²	70	18%	0.184	34%	0.34	C	S	.	.	S	Bend	trans	-90.5	-17.1	-178	55.8	0	0	0	0	112.9	K168	K168-T180 HydrophobicContact CD-CG2 4.27Å; K168-T180 HydrophobicContact CG-CG2 3.83Å
181	E	86	Confident	86.4	Confident	39 Å²	39	68.3 Å²	68.3	18%	0.182	34%	0.338	C	S	.	.	S	Bend	trans	-132.5	134.5	179.9	-60	-167.4	-131.5	0	0	110.8	R158 K183 N184 L185	R158-E181 WeakPolarHBondContact CD-OE1 3.4Å; R158-E181 IonicContact CZ-OE1 2.75Å; R158-E181 IonicContact NE-OE1 3.68Å; R158-E181 IonicContact NH1-OE1 3.34Å; R158-E181 PolarHBondContact NH1-OE1 2.98Å; E181-K183 HydrophobicContact CB-CG 4.14Å; E181-K183 PolarHBondContact O-N 2.89Å; E181-K183 IonicContact OE1-NZ 3.4Å; E181-K183 VanDerWaalsContact OE2-CD 3.31Å; E181-K183 WeakPolarHBondContact OE2-CD 3.33Å; E181-K183 WeakPolarHBondContact OE2-CE 3.2Å; E181-K183 IonicContact OE2-NZ 2.67Å; E181-K183 PolarHBondContact OE2-NZ 3.37Å; E181-N184 HydrophobicContact CB-CB 4.47Å; E181-N184 WeakPolarHBondContact O-CB 3.35Å; E181-N184 PolarHBondContact O-N 3.01Å; E181-L185 PolarHBondContact O-N 2.7Å
182	K	89.8	Confident	86.1	Confident	144 Å²	144	68.2 Å²	68.2	63%	0.626	34%	0.34	S	S	*	.	H	α-helix	trans	-52.9	-39.4	176.1	-170.5	175.5	-179.7	177.2	0	113	F170 N184 L185 Q186	F170-K182 HydrophobicContact CD1-CB 3.91Å; F170-K182 HydrophobicContact CD1-CG 4.28Å; F170-K182 HydrophobicContact CE1-CB 3.66Å; F170-K182 HydrophobicContact CE1-CD 4.44Å; F170-K182 HydrophobicContact CE1-CG 4.17Å; F170-K182 HydrophobicContact CE2-CB 4.38Å; F170-K182 HydrophobicContact CG-CB 4.38Å; F170-K182 HydrophobicContact CZ-CB 3.91Å; K182-N184 VanDerWaalsContact C-N 3.29Å; K182-N184 PolarHBondContact O-N 3.2Å; K182-L185 PolarHBondContact O-N 3.12Å; K182-Q186 PolarHBondContact O-N 2.9Å
183	K	87.4	Confident	86	Confident	121 Å²	121	71.5 Å²	71.5	53%	0.526	36%	0.355	S	S	.	.	H	α-helix	trans	-63.1	-34.8	179.3	76.3	-168	-166.5	-152.2	0	112.8	E181 M187	E181-K183 HydrophobicContact CB-CG 4.14Å; E181-K183 PolarHBondContact O-N 2.89Å; E181-K183 IonicContact OE1-NZ 3.4Å; E181-K183 VanDerWaalsContact OE2-CD 3.31Å; E181-K183 WeakPolarHBondContact OE2-CD 3.33Å; E181-K183 WeakPolarHBondContact OE2-CE 3.2Å; E181-K183 IonicContact OE2-NZ 2.67Å; E181-K183 PolarHBondContact OE2-NZ 3.37Å; K183-M187 VanDerWaalsContact O-CB 3.32Å; K183-M187 WeakPolarHBondContact O-CB 3.38Å; K183-M187 PolarHBondContact O-N 2.63Å
184	N	88.9	Confident	85.7	Confident	50 Å²	50	72 Å²	72	27%	0.267	35%	0.352	S	S	.	.	H	α-helix	trans	-74.5	-38.8	178.9	-66.7	-11.4	0	0	0	110.6	F179 E181 K182 H188	F179-N184 HydrophobicContact CD1-CB 4.01Å; E181-N184 HydrophobicContact CB-CB 4.47Å; E181-N184 WeakPolarHBondContact O-CB 3.35Å; E181-N184 PolarHBondContact O-N 3.01Å; K182-N184 VanDerWaalsContact C-N 3.29Å; K182-N184 PolarHBondContact O-N 3.2Å; N184-H188 WeakPolarHBondContact O-CB 3.33Å; N184-H188 PolarHBondContact O-N 2.74Å
185	L	88	Confident	85.7	Confident	21 Å²	21	68.3 Å²	68.3	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-60	-49.2	170.9	171.8	62.6	0	0	0	111	F170 H171 C172 F179 E181 K182 M187 H188 I189	F170-L185 HydrophobicContact CB-CB 4.15Å; F170-L185 HydrophobicContact CB-CD2 3.85Å; H171-L185 WeakPolarHBondContact O-CD2 3.31Å; C172-L185 HydrophobicContact CB-CD1 3.6Å; F179-L185 HydrophobicContact CB-CB 4.19Å; F179-L185 HydrophobicContact CD2-CB 3.89Å; F179-L185 HydrophobicContact CD2-CD1 3.65Å; F179-L185 HydrophobicContact CD2-CG 4.38Å; F179-L185 HydrophobicContact CE2-CD1 3.81Å; F179-L185 HydrophobicContact CG-CB 4.13Å; E181-L185 PolarHBondContact O-N 2.7Å; K182-L185 PolarHBondContact O-N 3.12Å; L185-M187 VanDerWaalsContact C-N 3.34Å; L185-M187 PolarHBondContact O-N 3.24Å; L185-H188 WeakPolarHBondContact O-CB 3.32Å; L185-H188 PolarHBondContact O-N 2.87Å; L185-H188 VanDerWaalsContact O-N 3.12Å; L185-I189 HydrophobicContact CD1-CD1 3.82Å; L185-I189 HydrophobicContact CD1-CG1 4.05Å; L185-I189 HydrophobicContact CD2-CD1 4.5Å; L185-I189 HydrophobicContact CG-CD1 3.89Å; L185-I189 HydrophobicContact CG-CG1 4.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.27Å; L185-I189 PolarHBondContact O-N 2.64Å
186	Q	88.9	Confident	85.7	Confident	79 Å²	79	69.6 Å²	69.6	37%	0.369	35%	0.346	S	S	.	.	H	α-helix	trans	-61.8	-43.7	-179.2	-169.6	61.7	48.4	0	0	111.8	K182 H188 I189 N190	K182-Q186 PolarHBondContact O-N 2.9Å; Q186-H188 VanDerWaalsContact C-N 3.3Å; Q186-H188 PolarHBondContact O-N 3.03Å; Q186-I189 PolarHBondContact O-N 3.49Å; Q186-N190 PolarHBondContact NE2-OD1 3.33Å; Q186-N190 WeakPolarHBondContact O-CB 2.87Å; Q186-N190 PolarHBondContact O-N 3.02Å; Q186-N190 PolarHBondContact O-OD1 3.19Å
187	M	87.5	Confident	85.7	Confident	74 Å²	74	70.3 Å²	70.3	37%	0.365	34%	0.343	S	S	.	.	H	α-helix	trans	-59.2	-42.5	174	178.6	-174.6	67.7	0	0	111.5	K183 L185 N190 A191 R210	K183-M187 VanDerWaalsContact O-CB 3.32Å; K183-M187 WeakPolarHBondContact O-CB 3.38Å; K183-M187 PolarHBondContact O-N 2.63Å; L185-M187 VanDerWaalsContact C-N 3.34Å; L185-M187 PolarHBondContact O-N 3.24Å; M187-N190 PolarHBondContact O-N 3.41Å; M187-A191 WeakPolarHBondContact O-CB 3.31Å; M187-A191 PolarHBondContact O-N 3.37Å; M187-R210 HydrophobicContact CG-CG 4.29Å; M187-R210 WeakPolarHBondContact SD-CD 3.29Å; M187-R210 HydrophobicContact SD-CG 3.74Å
188	H	86.3	Confident	85.7	Confident	18 Å²	18	69.9 Å²	69.9	8%	0.083	35%	0.352	C	S	.	.	H	α-helix	trans	-62.9	-46.7	176.4	159.2	81.8	0	0	0	112.3	C175 F179 N184 L185 Q186 N190 A191 L192 H193	C175-H188 PolarHBondContact SG-CE1 3.12Å; C175-H188 PolarHBondContact SG-NE2 2.79Å; F179-H188 HydrophobicContact CE1-CB 3.87Å; F179-H188 HydrophobicContact CE2-CB 4.03Å; F179-H188 AromaticContact CE2-CD2 3.51Å; F179-H188 AromaticContact CE2-CG 3.72Å; F179-H188 AromaticContact CE2-NE2 4Å; F179-H188 HydrophobicContact CZ-CB 3.4Å; F179-H188 VanDerWaalsContact CZ-CB 3.4Å; F179-H188 AromaticContact CZ-CD2 3.54Å; F179-H188 AromaticContact CZ-CG 3.23Å; F179-H188 AromaticContact CZ-ND1 3.62Å; N184-H188 WeakPolarHBondContact O-CB 3.33Å; N184-H188 PolarHBondContact O-N 2.74Å; L185-H188 WeakPolarHBondContact O-CB 3.32Å; L185-H188 PolarHBondContact O-N 2.87Å; L185-H188 VanDerWaalsContact O-N 3.12Å; Q186-H188 VanDerWaalsContact C-N 3.3Å; Q186-H188 PolarHBondContact O-N 3.03Å; H188-N190 VanDerWaalsContact C-N 3.34Å; H188-N190 PolarHBondContact O-N 3.47Å; H188-A191 PolarHBondContact O-N 2.79Å; H188-L192 WeakPolarHBondContact ND1-CD1 3.46Å; H188-L192 PolarHBondContact O-N 3.15Å; H188-H193 AromaticContact CE1-NE2 3.88Å; H188-H193 AromaticContact NE2-CD2 3.77Å; H188-H193 AromaticContact NE2-NE2 3.38Å; H188-H193 PolarHBondContact NE2-NE2 3.46Å
189	I	85.6	Confident	85.8	Confident	31 Å²	31	68 Å²	68	16%	0.159	34%	0.343	C	S	.	.	I	π-helix	trans	-59.6	-47.7	176.1	-68.6	169.2	0	0	0	110.2	L185 Q186 A191 H193 K194	L185-I189 HydrophobicContact CD1-CD1 3.82Å; L185-I189 HydrophobicContact CD1-CG1 4.05Å; L185-I189 HydrophobicContact CD2-CD1 4.5Å; L185-I189 HydrophobicContact CG-CD1 3.89Å; L185-I189 HydrophobicContact CG-CG1 4.48Å; L185-I189 WeakPolarHBondContact O-CG1 3.27Å; L185-I189 PolarHBondContact O-N 2.64Å; Q186-I189 PolarHBondContact O-N 3.49Å; I189-A191 PolarHBondContact O-N 2.86Å; I189-H193 HydrophobicContact CG2-CB 4.38Å; I189-H193 WeakPolarHBondContact O-CA 3.33Å; I189-H193 WeakPolarHBondContact O-CB 3.4Å; I189-H193 PolarHBondContact O-N 3.43Å; I189-K194 HydrophobicContact CG2-CD 4.3Å; I189-K194 HydrophobicContact CG2-CG 4.1Å; I189-K194 PolarHBondContact O-N 2.98Å
190	N	85	Confident	86	Confident	49 Å²	49	70.9 Å²	70.9	26%	0.262	36%	0.356	S	S	.	.	I	π-helix	trans	-60.7	-47.1	179.3	-70.8	1.7	0	0	0	110.9	Q186 M187 H188 G195 L196	Q186-N190 PolarHBondContact NE2-OD1 3.33Å; Q186-N190 WeakPolarHBondContact O-CB 2.87Å; Q186-N190 PolarHBondContact O-N 3.02Å; Q186-N190 PolarHBondContact O-OD1 3.19Å; M187-N190 PolarHBondContact O-N 3.41Å; H188-N190 VanDerWaalsContact C-N 3.34Å; H188-N190 PolarHBondContact O-N 3.47Å; N190-G195 CarbonylContact O-C 3.3Å; N190-G195 PolarHBondContact O-N 2.87Å; N190-G195 VanDerWaalsContact O-N 3.11Å; N190-L196 HydrophobicContact CB-CB 4.21Å; N190-L196 HydrophobicContact CB-CD1 4.33Å; N190-L196 PolarHBondContact O-N 3.36Å
191	A	84.7	Confident	85.9	Confident	28 Å²	28	69.6 Å²	69.6	23%	0.231	35%	0.349	C	S	.	.	I	π-helix	trans	-69.9	-43.8	-175.5	0	0	0	0	0	114.1	M187 H188 I189 A209	M187-A191 WeakPolarHBondContact O-CB 3.31Å; M187-A191 PolarHBondContact O-N 3.37Å; H188-A191 PolarHBondContact O-N 2.79Å; I189-A191 PolarHBondContact O-N 2.86Å; A191-A209 HydrophobicContact CB-CB 3.49Å; A191-A209 VanDerWaalsContact CB-CB 3.49Å
192	L	82	Confident	86	Confident	93 Å²	93	74.4 Å²	74.4	49%	0.487	38%	0.376	S	S	.	.	I	π-helix	trans	-103.7	-35.3	-169.7	-64.1	-173.5	0	0	0	113.8	H188	H188-L192 WeakPolarHBondContact ND1-CD1 3.46Å; H188-L192 PolarHBondContact O-N 3.15Å
193	H	81.5	Confident	85.7	Confident	69 Å²	69	72.5 Å²	72.5	32%	0.319	37%	0.372	S	S	.	.	I	π-helix	trans	-99.7	-42.3	-172.5	-66.1	-56.1	0	0	0	112.9	C172 L174 C175 H188 I189	C172-H193 PolarHBondContact SG-CD2 3.09Å; C172-H193 PolarHBondContact SG-NE2 2.99Å; L174-H193 HydrophobicContact CD1-CB 3.44Å; L174-H193 VanDerWaalsContact CD1-CB 3.44Å; L174-H193 VanDerWaalsContact CD1-CG 3.45Å; C175-H193 PolarHBondContact SG-NE2 3.38Å; C175-H193 VanDerWaalsContact SG-NE2 3.39Å; H188-H193 AromaticContact CE1-NE2 3.88Å; H188-H193 AromaticContact NE2-CD2 3.77Å; H188-H193 AromaticContact NE2-NE2 3.38Å; H188-H193 PolarHBondContact NE2-NE2 3.46Å; I189-H193 HydrophobicContact CG2-CB 4.38Å; I189-H193 WeakPolarHBondContact O-CA 3.33Å; I189-H193 WeakPolarHBondContact O-CB 3.4Å; I189-H193 PolarHBondContact O-N 3.43Å
194	K	81.4	Confident	85.7	Confident	128 Å²	128	69 Å²	69	56%	0.557	36%	0.363	S	S	*	.	S	Bend	trans	-88.6	-12.1	175.3	-59.4	-173.5	174.7	-170.3	0	112.9	I189 L196	I189-K194 HydrophobicContact CG2-CD 4.3Å; I189-K194 HydrophobicContact CG2-CG 4.1Å; I189-K194 PolarHBondContact O-N 2.98Å; K194-L196 HydrophobicContact CB-CD1 3.95Å; K194-L196 HydrophobicContact CB-CG 3.7Å; K194-L196 HydrophobicContact CD-CD1 3.87Å; K194-L196 PolarHBondContact O-N 3.32Å; K194-L196 VanDerWaalsContact O-N 3.15Å
195	G	84	Confident	85.7	Confident	44 Å²	44	72 Å²	72	45%	0.454	38%	0.378	S	S	.	.			trans	61.8	18.3	-176.1	0	0	0	0	0	114.2	N190 R197	N190-G195 CarbonylContact O-C 3.3Å; N190-G195 PolarHBondContact O-N 2.87Å; N190-G195 VanDerWaalsContact O-N 3.11Å; G195-R197 PolarHBondContact O-N 2.77Å
196	L	83.9	Confident	85.5	Confident	86 Å²	86	77 Å²	77	45%	0.45	40%	0.399	S	S	.	.			trans	-71.6	120.9	-178.1	-63.3	175.7	0	0	0	110.4	N190 K194 P198	N190-L196 HydrophobicContact CB-CB 4.21Å; N190-L196 HydrophobicContact CB-CD1 4.33Å; N190-L196 PolarHBondContact O-N 3.36Å; K194-L196 HydrophobicContact CB-CD1 3.95Å; K194-L196 HydrophobicContact CB-CG 3.7Å; K194-L196 HydrophobicContact CD-CD1 3.87Å; K194-L196 PolarHBondContact O-N 3.32Å; K194-L196 VanDerWaalsContact O-N 3.15Å; L196-P198 WeakPolarHBondContact O-CD 3.37Å
197	R	86.3	Confident	85.2	Confident	137 Å²	137	77.8 Å²	77.8	52%	0.517	40%	0.402	S	S	.	.			trans	-126.4	73.3	179.9	-64.2	177.5	176	-164.3	6.3	110.3	G195 H199 E207 F208	G195-R197 PolarHBondContact O-N 2.77Å; R197-H199 PolarHBondContact O-N 3.11Å; R197-E207 HydrophobicContact CB-CB 3.52Å; R197-E207 WeakPolarHBondContact CD-O 3.41Å; R197-E207 HydrophobicContact CG-CB 4.4Å; R197-F208 CarbonylContact C-O 3.59Å; R197-F208 VanDerWaalsContact C-O 3.31Å; R197-F208 WeakPolarHBondContact CA-O 3.49Å
198	P	84.4	Confident	85	Confident	100 Å²	100	76.1 Å²	76.1	65%	0.649	39%	0.393	S	S	*	.			trans	-70.4	-4.8	-170.7	30.4	-36.9	0	0	0	114.3	L196	L196-P198 WeakPolarHBondContact O-CD 3.37Å
199	H	88.3	Confident	84.9	Confident	62 Å²	62	76.6 Å²	76.6	29%	0.287	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	97.6	-176.4	-57.3	-61.6	0	0	0	110.2	R197 E207 F208 K211 L214	R197-H199 PolarHBondContact O-N 3.11Å; H199-E207 CarbonylContact O-C 3.54Å; H199-F208 HydrophobicContact CB-CB 4.42Å; H199-F208 WeakPolarHBondContact CB-O 3.5Å; H199-F208 PolarHBondContact N-O 2.93Å; H199-F208 VanDerWaalsContact N-O 3.16Å; H199-F208 PolarHBondContact O-N 2.98Å; H199-K211 PolarHBondContact CD2-N 3.24Å; H199-K211 PolarHBondContact NE2-N 3.45Å; H199-L214 HydrophobicContact CB-CB 4.22Å; H199-L214 HydrophobicContact CB-CD2 3.94Å
200	Q	89.9	Confident	84.8	Confident	85 Å²	85	78.8 Å²	78.8	40%	0.397	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	145.1	176.2	-168.2	169.7	38.3	0	0	111.2	L205 E207 L214	Q200-L205 PolarHBondContact NE2-O 3.08Å; Q200-L205 VanDerWaalsContact NE2-O 3.12Å; Q200-E207 HydrophobicContact CB-CG 4.47Å; Q200-E207 HydrophobicContact CG-CG 4.25Å; Q200-L214 WeakPolarHBondContact O-CD2 3.39Å
201	C	83.2	Confident	84.9	Confident	3 Å²	3	83.8 Å²	83.8	2%	0.02	43%	0.426	C	S	.	.			trans	-85.6	120.1	169	-174.8	0	0	0	0	109.7	D203 C204 L205 K206 F208 L214 H222	C201-D203 VanDerWaalsContact C-N 3.26Å; C201-D203 PolarHBondContact O-N 2.89Å; C201-C204 PolarHBondContact O-N 3.43Å; C201-L205 WeakPolarHBondContact O-CA 3.44Å; C201-L205 PolarHBondContact O-N 3.33Å; C201-K206 WeakPolarHBondContact CB-O 3.4Å; C201-K206 PolarHBondContact N-O 2.71Å; C201-F208 HydrophobicContact CB-CE2 4.26Å; C201-L214 VanDerWaalsContact CA-CD1 3.45Å; C201-L214 HydrophobicContact CB-CD1 3.48Å; C201-L214 VanDerWaalsContact CB-CD1 3.48Å; C201-H222 PolarHBondContact SG-CD2 3.02Å; C201-H222 PolarHBondContact SG-NE2 3.21Å
202	D	88.5	Confident	84.9	Confident	141 Å²	141	86 Å²	86	75%	0.754	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-34.7	-178.1	-52.5	-37.7	0	0	0	112
203	D	84.9	Confident	85	Confident	104 Å²	104	82.7 Å²	82.7	56%	0.556	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-25.5	-176.5	-54.3	-45	0	0	0	115.1	C201 H222	C201-D203 VanDerWaalsContact C-N 3.26Å; C201-D203 PolarHBondContact O-N 2.89Å; D203-H222 HydrophobicContact CB-CB 4.2Å; D203-H222 VanDerWaalsContact OD2-CB 3.27Å; D203-H222 WeakPolarHBondContact OD2-CB 3.27Å; D203-H222 IonicContact OD2-CD2 3.08Å; D203-H222 IonicContact OD2-CG 2.81Å
204	C	86.9	Confident	85.2	Confident	48 Å²	48	81 Å²	81	32%	0.324	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.5	6.7	-177.9	68.1	0	0	0	0	115.1	C201 K206 H217 H222	C201-C204 PolarHBondContact O-N 3.43Å; C204-K206 PolarHBondContact O-N 2.81Å; C204-H217 PolarHBondContact SG-NE2 3.35Å; C204-H222 PolarHBondContact SG-NE2 3.42Å
205	L	88	Confident	85.4	Confident	113 Å²	113	78.4 Å²	78.4	59%	0.592	41%	0.407	S	S	*	.			trans	58.5	9.7	179.6	-53.1	179.1	0	0	0	114.9	Q200 C201 E207	Q200-L205 PolarHBondContact NE2-O 3.08Å; Q200-L205 VanDerWaalsContact NE2-O 3.12Å; C201-L205 WeakPolarHBondContact O-CA 3.44Å; C201-L205 PolarHBondContact O-N 3.33Å; L205-E207 PolarHBondContact O-N 3.38Å
206	K	84.5	Confident	85.4	Confident	124 Å²	124	81.2 Å²	81.2	54%	0.539	40%	0.404	S	S	.	.			trans	-67.2	130.4	174.9	-76.5	-174.7	-179.2	-178.8	0	110.7	C201 C204 F208	C201-K206 WeakPolarHBondContact CB-O 3.4Å; C201-K206 PolarHBondContact N-O 2.71Å; C204-K206 PolarHBondContact O-N 2.81Å; K206-F208 HydrophobicContact CB-CE2 3.85Å; K206-F208 HydrophobicContact CB-CZ 4.02Å; K206-F208 WeakPolarHBondContact O-CD2 3.48Å; K206-F208 VanDerWaalsContact O-CE2 3.3Å; K206-F208 WeakPolarHBondContact O-CE2 3.41Å
207	E	83.2	Confident	85.3	Confident	96 Å²	96	78 Å²	78	45%	0.449	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	141	-178.6	-53.1	177.8	160.2	0	0	112	R197 H199 Q200 L205	R197-E207 HydrophobicContact CB-CB 3.52Å; R197-E207 WeakPolarHBondContact CD-O 3.41Å; R197-E207 HydrophobicContact CG-CB 4.4Å; H199-E207 CarbonylContact O-C 3.54Å; Q200-E207 HydrophobicContact CB-CG 4.47Å; Q200-E207 HydrophobicContact CG-CG 4.25Å; L205-E207 PolarHBondContact O-N 3.38Å
208	F	82.3	Confident	85.2	Confident	40 Å²	40	71.8 Å²	71.8	18%	0.175	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	145.4	-178.9	-60.2	-86.2	0	0	0	111.2	R197 H199 C201 K206 R210 D213 L214 H217	R197-F208 CarbonylContact C-O 3.59Å; R197-F208 VanDerWaalsContact C-O 3.31Å; R197-F208 WeakPolarHBondContact CA-O 3.49Å; H199-F208 HydrophobicContact CB-CB 4.42Å; H199-F208 WeakPolarHBondContact CB-O 3.5Å; H199-F208 PolarHBondContact N-O 2.93Å; H199-F208 VanDerWaalsContact N-O 3.16Å; H199-F208 PolarHBondContact O-N 2.98Å; C201-F208 HydrophobicContact CB-CE2 4.26Å; K206-F208 HydrophobicContact CB-CE2 3.85Å; K206-F208 HydrophobicContact CB-CZ 4.02Å; K206-F208 WeakPolarHBondContact O-CD2 3.48Å; K206-F208 VanDerWaalsContact O-CE2 3.3Å; K206-F208 WeakPolarHBondContact O-CE2 3.41Å; F208-R210 VanDerWaalsContact C-N 3.33Å; F208-D213 HydrophobicContact CB-CB 4.15Å; F208-D213 HydrophobicContact CD1-CB 3.86Å; F208-D213 HydrophobicContact CG-CB 4.27Å; F208-L214 HydrophobicContact CB-CB 4.22Å; F208-L214 HydrophobicContact CD2-CB 3.82Å; F208-L214 HydrophobicContact CD2-CD1 3.78Å; F208-L214 HydrophobicContact CD2-CG 4.41Å; F208-L214 HydrophobicContact CE2-CD1 3.95Å; F208-L214 HydrophobicContact CG-CB 4.18Å; F208-H217 HydrophobicContact CE1-CB 3.84Å; F208-H217 HydrophobicContact CE2-CB 3.87Å; F208-H217 AromaticContact CE2-CD2 3.67Å; F208-H217 AromaticContact CE2-CG 3.67Å; F208-H217 HydrophobicContact CZ-CB 3.34Å; F208-H217 AromaticContact CZ-CD2 3.69Å; F208-H217 AromaticContact CZ-CG 3.2Å; F208-H217 AromaticContact CZ-ND1 3.59Å
209	A	83.7	Confident	85.2	Confident	27 Å²	27	68 Å²	68	22%	0.223	34%	0.338	C	S	.	.	S	Bend	trans	-74.9	-22.3	176	0	0	0	0	0	113.3	A191	A191-A209 HydrophobicContact CB-CB 3.49Å; A191-A209 VanDerWaalsContact CB-CB 3.49Å
210	R	85.1	Confident	84.9	Confident	77 Å²	77	67.6 Å²	67.6	29%	0.291	34%	0.342	S	S	.	.	S	Bend	trans	-129.7	139.6	-178.9	-53.7	-178.1	-64.4	-177.7	-1	111.4	M187 F208 C212 D213 L214	M187-R210 HydrophobicContact CG-CG 4.29Å; M187-R210 WeakPolarHBondContact SD-CD 3.29Å; M187-R210 HydrophobicContact SD-CG 3.74Å; F208-R210 VanDerWaalsContact C-N 3.33Å; R210-C212 PolarHBondContact O-N 3.43Å; R210-D213 HydrophobicContact CB-CB 4.43Å; R210-D213 WeakPolarHBondContact CB-OD2 3.39Å; R210-D213 IonicContact CZ-OD1 2.64Å; R210-D213 IonicContact CZ-OD2 3.24Å; R210-D213 IonicContact NE-OD1 3.75Å; R210-D213 IonicContact NE-OD2 2.9Å; R210-D213 PolarHBondContact NE-OD2 3.3Å; R210-D213 VanDerWaalsContact NH2-CG 3.33Å; R210-D213 IonicContact NH2-OD1 3.74Å; R210-D213 PolarHBondContact NH2-OD1 2.84Å; R210-D213 IonicContact NH2-OD2 3.52Å; R210-D213 PolarHBondContact NH2-OD2 3.33Å; R210-D213 VanDerWaalsContact NH2-OD2 3.08Å; R210-D213 WeakPolarHBondContact O-CB 3.19Å; R210-D213 PolarHBondContact O-N 3.19Å; R210-L214 PolarHBondContact O-N 3.46Å
211	K	86.3	Confident	84.4	Confident	155 Å²	155	67.7 Å²	67.7	67%	0.674	35%	0.348	S	S	*	.	H	α-helix	trans	-57.2	-35.3	174.7	-171.5	172.9	-177.2	172.5	0	113	H199 D213 L214 L215	H199-K211 PolarHBondContact CD2-N 3.24Å; H199-K211 PolarHBondContact NE2-N 3.45Å; K211-D213 VanDerWaalsContact C-N 3.32Å; K211-D213 PolarHBondContact O-N 3.19Å; K211-L214 PolarHBondContact O-N 3.34Å; K211-L215 PolarHBondContact O-N 2.84Å
212	C	84.4	Confident	84.3	Confident	74 Å²	74	70.5 Å²	70.5	50%	0.5	36%	0.361	S	S	.	.	H	α-helix	trans	-68	-30.9	176.6	58.7	0	0	0	0	113	R210 R216	R210-C212 PolarHBondContact O-N 3.43Å; C212-R216 WeakPolarHBondContact O-CB 3.2Å; C212-R216 PolarHBondContact O-N 2.85Å
213	D	85.1	Confident	83.6	Confident	23 Å²	23	68 Å²	68	12%	0.123	34%	0.341	C	S	.	.	H	α-helix	trans	-71.1	-42	174.5	-67.8	-39.8	0	0	0	111	F208 R210 K211 R216 H217	F208-D213 HydrophobicContact CB-CB 4.15Å; F208-D213 HydrophobicContact CD1-CB 3.86Å; F208-D213 HydrophobicContact CG-CB 4.27Å; R210-D213 HydrophobicContact CB-CB 4.43Å; R210-D213 WeakPolarHBondContact CB-OD2 3.39Å; R210-D213 IonicContact CZ-OD1 2.64Å; R210-D213 IonicContact CZ-OD2 3.24Å; R210-D213 IonicContact NE-OD1 3.75Å; R210-D213 IonicContact NE-OD2 2.9Å; R210-D213 PolarHBondContact NE-OD2 3.3Å; R210-D213 VanDerWaalsContact NH2-CG 3.33Å; R210-D213 IonicContact NH2-OD1 3.74Å; R210-D213 PolarHBondContact NH2-OD1 2.84Å; R210-D213 IonicContact NH2-OD2 3.52Å; R210-D213 PolarHBondContact NH2-OD2 3.33Å; R210-D213 VanDerWaalsContact NH2-OD2 3.08Å; R210-D213 WeakPolarHBondContact O-CB 3.19Å; R210-D213 PolarHBondContact O-N 3.19Å; K211-D213 VanDerWaalsContact C-N 3.32Å; K211-D213 PolarHBondContact O-N 3.19Å; D213-R216 PolarHBondContact O-N 2.7Å; D213-R216 IonicContact OD1-CZ 3.02Å; D213-R216 IonicContact OD1-NE 3.92Å; D213-R216 IonicContact OD1-NH2 3.32Å; D213-R216 PolarHBondContact OD1-NH2 2.7Å; D213-H217 WeakPolarHBondContact O-CB 3.34Å; D213-H217 PolarHBondContact O-N 3.25Å
214	L	85.7	Confident	82.9	Confident	34 Å²	34	70.4 Å²	70.4	18%	0.178	35%	0.354	C	S	.	.	H	α-helix	trans	-58.5	-49.5	172.7	170.1	60.9	0	0	0	111.5	H199 Q200 C201 F208 R210 K211 R216 H217 S218	H199-L214 HydrophobicContact CB-CB 4.22Å; H199-L214 HydrophobicContact CB-CD2 3.94Å; Q200-L214 WeakPolarHBondContact O-CD2 3.39Å; C201-L214 VanDerWaalsContact CA-CD1 3.45Å; C201-L214 HydrophobicContact CB-CD1 3.48Å; C201-L214 VanDerWaalsContact CB-CD1 3.48Å; F208-L214 HydrophobicContact CB-CB 4.22Å; F208-L214 HydrophobicContact CD2-CB 3.82Å; F208-L214 HydrophobicContact CD2-CD1 3.78Å; F208-L214 HydrophobicContact CD2-CG 4.41Å; F208-L214 HydrophobicContact CE2-CD1 3.95Å; F208-L214 HydrophobicContact CG-CB 4.18Å; R210-L214 PolarHBondContact O-N 3.46Å; K211-L214 PolarHBondContact O-N 3.34Å; L214-R216 VanDerWaalsContact C-N 3.31Å; L214-R216 PolarHBondContact O-N 3.08Å; L214-H217 WeakPolarHBondContact O-CB 2.79Å; L214-H217 PolarHBondContact O-N 3.16Å; L214-S218 WeakPolarHBondContact O-CB 3.32Å; L214-S218 PolarHBondContact O-N 3.28Å
215	L	84.8	Confident	82.1	Confident	74 Å²	74	69 Å²	69	39%	0.387	35%	0.345	S	S	.	.	H	α-helix	trans	-61.4	-42.6	179.7	-175.8	63.8	0	0	0	111.4	K211 H217 S218 N219	K211-L215 PolarHBondContact O-N 2.84Å; L215-H217 VanDerWaalsContact C-N 3.35Å; L215-S218 PolarHBondContact O-N 2.86Å; L215-N219 WeakPolarHBondContact O-CB 3.15Å; L215-N219 VanDerWaalsContact O-CG 3.25Å; L215-N219 PolarHBondContact O-N 3.2Å; L215-N219 PolarHBondContact O-OD1 3.34Å
216	R	83.1	Confident	81.6	Confident	103 Å²	103	68.8 Å²	68.8	39%	0.389	34%	0.339	S	S	.	.	H	α-helix	trans	-61.5	-43	175.7	177.3	173.3	62.6	169.6	-0.8	111.9	C212 D213 L214 S220 Q239	C212-R216 WeakPolarHBondContact O-CB 3.2Å; C212-R216 PolarHBondContact O-N 2.85Å; D213-R216 PolarHBondContact O-N 2.7Å; D213-R216 IonicContact OD1-CZ 3.02Å; D213-R216 IonicContact OD1-NE 3.92Å; D213-R216 IonicContact OD1-NH2 3.32Å; D213-R216 PolarHBondContact OD1-NH2 2.7Å; L214-R216 VanDerWaalsContact C-N 3.31Å; L214-R216 PolarHBondContact O-N 3.08Å; R216-S220 WeakPolarHBondContact O-CB 3.47Å; R216-S220 PolarHBondContact O-N 3.04Å; R216-S220 PolarHBondContact O-OG 2.96Å; R216-Q239 VanDerWaalsContact CG-CD 3.42Å; R216-Q239 HydrophobicContact CG-CG 4.01Å
217	H	83.7	Confident	81.3	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.083	32%	0.316	C	S	.	.	H	α-helix	trans	-60.7	-54.4	175.6	164.3	78.8	0	0	0	110.7	C204 F208 D213 L214 L215 N219 S220 V221 H222	C204-H217 PolarHBondContact SG-NE2 3.35Å; F208-H217 HydrophobicContact CE1-CB 3.84Å; F208-H217 HydrophobicContact CE2-CB 3.87Å; F208-H217 AromaticContact CE2-CD2 3.67Å; F208-H217 AromaticContact CE2-CG 3.67Å; F208-H217 HydrophobicContact CZ-CB 3.34Å; F208-H217 AromaticContact CZ-CD2 3.69Å; F208-H217 AromaticContact CZ-CG 3.2Å; F208-H217 AromaticContact CZ-ND1 3.59Å; D213-H217 WeakPolarHBondContact O-CB 3.34Å; D213-H217 PolarHBondContact O-N 3.25Å; L214-H217 WeakPolarHBondContact O-CB 2.79Å; L214-H217 PolarHBondContact O-N 3.16Å; L215-H217 VanDerWaalsContact C-N 3.35Å; H217-N219 VanDerWaalsContact C-N 3.31Å; H217-N219 PolarHBondContact O-N 2.74Å; H217-S220 PolarHBondContact O-N 3.19Å; H217-S220 PolarHBondContact O-OG 2.83Å; H217-V221 PolarHBondContact O-N 3.05Å; H217-H222 AromaticContact CD2-CD2 3.89Å; H217-H222 AromaticContact CD2-NE2 3.89Å; H217-H222 AromaticContact CE1-NE2 3.64Å; H217-H222 AromaticContact NE2-CD2 3.34Å; H217-H222 PolarHBondContact NE2-CD2 3.37Å; H217-H222 VanDerWaalsContact NE2-CD2 3.34Å; H217-H222 AromaticContact NE2-NE2 2.9Å; H217-H222 PolarHBondContact NE2-NE2 3.03Å
218	S	84	Confident	81.1	Confident	6 Å²	6	61.4 Å²	61.4	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-56.2	-44.8	-179.5	178.4	0	0	0	0	111.7	L214 L215 S220 H222 R223	L214-S218 WeakPolarHBondContact O-CB 3.32Å; L214-S218 PolarHBondContact O-N 3.28Å; L215-S218 PolarHBondContact O-N 2.86Å; S218-S220 PolarHBondContact O-N 2.82Å; S218-H222 PolarHBondContact O-N 3.46Å; S218-R223 PolarHBondContact O-N 2.93Å; S218-R223 PolarHBondContact OG-NH1 3.43Å
219	N	83.2	Confident	81.1	Confident	20 Å²	20	63.2 Å²	63.2	11%	0.107	32%	0.315	C	S	.	.	H	α-helix	trans	-67.3	-18.1	177	-69.8	0.8	0	0	0	114.6	L215 H217 R223 P238	L215-N219 WeakPolarHBondContact O-CB 3.15Å; L215-N219 VanDerWaalsContact O-CG 3.25Å; L215-N219 PolarHBondContact O-N 3.2Å; L215-N219 PolarHBondContact O-OD1 3.34Å; H217-N219 VanDerWaalsContact C-N 3.31Å; H217-N219 PolarHBondContact O-N 2.74Å; N219-R223 VanDerWaalsContact O-O 3.1Å; N219-P238 VanDerWaalsContact O-CB 3.22Å; N219-P238 WeakPolarHBondContact O-CB 3.37Å
220	S	82.6	Confident	81	Confident	54 Å²	54	61.9 Å²	61.9	38%	0.378	30%	0.304	S	S	.	.	H	α-helix	trans	-103	-21.9	-178.5	62.4	0	0	0	0	114.4	R216 H217 S218	R216-S220 WeakPolarHBondContact O-CB 3.47Å; R216-S220 PolarHBondContact O-N 3.04Å; R216-S220 PolarHBondContact O-OG 2.96Å; H217-S220 PolarHBondContact O-N 3.19Å; H217-S220 PolarHBondContact O-OG 2.83Å; S218-S220 PolarHBondContact O-N 2.82Å
221	V	79.7	Confident	80.7	Confident	87 Å²	87	62.1 Å²	62.1	53%	0.527	32%	0.316	S	S	.	.	H	α-helix	trans	-118.8	-41.6	-170.5	-178.1	0	0	0	0	112.2	H217	H217-V221 PolarHBondContact O-N 3.05Å
222	H	81	Confident	80.5	Confident	62 Å²	62	59.5 Å²	59.5	29%	0.287	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-40.9	-171.7	-62.1	-55.6	0	0	0	112.7	C201 D203 C204 H217 S218	C201-H222 PolarHBondContact SG-CD2 3.02Å; C201-H222 PolarHBondContact SG-NE2 3.21Å; D203-H222 HydrophobicContact CB-CB 4.2Å; D203-H222 VanDerWaalsContact OD2-CB 3.27Å; D203-H222 WeakPolarHBondContact OD2-CB 3.27Å; D203-H222 IonicContact OD2-CD2 3.08Å; D203-H222 IonicContact OD2-CG 2.81Å; C204-H222 PolarHBondContact SG-NE2 3.42Å; H217-H222 AromaticContact CD2-CD2 3.89Å; H217-H222 AromaticContact CD2-NE2 3.89Å; H217-H222 AromaticContact CE1-NE2 3.64Å; H217-H222 AromaticContact NE2-CD2 3.34Å; H217-H222 PolarHBondContact NE2-CD2 3.37Å; H217-H222 VanDerWaalsContact NE2-CD2 3.34Å; H217-H222 AromaticContact NE2-NE2 2.9Å; H217-H222 PolarHBondContact NE2-NE2 3.03Å; S218-H222 PolarHBondContact O-N 3.46Å
223	R	73.1	Confident	80.5	Confident	90 Å²	90	58.3 Å²	58.3	34%	0.34	30%	0.301	S	S	.	.			trans	-95.4	131.2	178.5	-57.3	-176.5	168.5	116.9	6.4	108.6	S218 N219 S225	S218-R223 PolarHBondContact O-N 2.93Å; S218-R223 PolarHBondContact OG-NH1 3.43Å; N219-R223 VanDerWaalsContact O-O 3.1Å; R223-S225 PolarHBondContact O-N 3.35Å
224	D	71.3	Confident	80.4	Confident	154 Å²	154	63 Å²	63	82%	0.824	33%	0.325	S	S	*	.			trans	-69	14	161.8	-74.9	-49.3	0	0	0	113.1	K226	D224-K226 PolarHBondContact O-N 3.5Å
225	S	69.9	Low	80.3	Confident	19 Å²	19	67.3 Å²	67.3	13%	0.133	34%	0.343	C	S	.	.			trans	-58.5	101.3	172.5	-102.5	0	0	0	0	111.1	R223 P227 Q266	R223-S225 PolarHBondContact O-N 3.35Å; S225-P227 WeakPolarHBondContact O-CD 3.46Å; S225-Q266 PolarHBondContact OG-NE2 3.31Å; S225-Q266 PolarHBondContact OG-OE1 2.93Å
226	K	77.5	Confident	80.2	Confident	107 Å²	107	64.6 Å²	64.6	47%	0.465	33%	0.332	S	S	.	.			trans	-104.4	82.6	170.8	-70.6	162.1	-178.5	179	0	109.6	D224 Y228 M229 G236 F237	D224-K226 PolarHBondContact O-N 3.5Å; K226-Y228 PolarHBondContact O-N 3.37Å; K226-M229 HydrophobicContact CB-SD 4.3Å; K226-G236 WeakPolarHBondContact CD-O 3.13Å; K226-F237 CarbonylContact C-O 3.45Å; K226-F237 WeakPolarHBondContact CA-O 3.44Å
227	P	76.6	Confident	80.1	Confident	10 Å²	10	61.3 Å²	61.3	7%	0.065	32%	0.321	C	S	.	.			trans	-70.7	-17.6	-173.5	24.9	-27.5	0	0	0	112.5	S225 F237 P263 R264 Q266	S225-P227 WeakPolarHBondContact O-CD 3.46Å; P227-F237 WeakPolarHBondContact CD-O 3.5Å; P227-P263 HydrophobicContact CB-CB 4.18Å; P227-P263 CarbonylContact O-C 3.55Å; P227-P263 WeakPolarHBondContact O-CA 3.4Å; P227-R264 PolarHBondContact O-N 3.34Å; P227-Q266 HydrophobicContact CB-CG 4.46Å; P227-Q266 VanDerWaalsContact N-NE2 3.12Å
228	Y	80.9	Confident	79.9	Confident	55 Å²	55	62 Å²	62	22%	0.216	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	101.1	179.3	-56.3	-85.8	0	0	0	109.7	K226 G236 F237 Q239 K240 F243 P263	K226-Y228 PolarHBondContact O-N 3.37Å; Y228-G236 CarbonylContact O-C 3.51Å; Y228-G236 WeakPolarHBondContact O-CA 3.5Å; Y228-F237 PolarHBondContact N-O 3.39Å; Y228-F237 PolarHBondContact O-N 2.76Å; Y228-Q239 VanDerWaalsContact CD2-C 3.41Å; Y228-K240 HydrophobicContact CD1-CB 4.02Å; Y228-K240 HydrophobicContact CD1-CG 4.23Å; Y228-K240 HydrophobicContact CD2-CB 4.49Å; Y228-K240 VanDerWaalsContact CD2-N 3.34Å; Y228-K240 HydrophobicContact CE1-CB 3.49Å; Y228-K240 VanDerWaalsContact CE1-CB 3.49Å; Y228-K240 HydrophobicContact CE1-CD 4.12Å; Y228-K240 HydrophobicContact CE1-CG 3.83Å; Y228-K240 HydrophobicContact CE2-CB 4.06Å; Y228-K240 HydrophobicContact CG-CB 4.49Å; Y228-F243 HydrophobicContact CG-CB 4.36Å; Y228-P263 HydrophobicContact CD1-CB 4.43Å; Y228-P263 HydrophobicContact CD1-CG 4.41Å; Y228-P263 HydrophobicContact CE1-CB 4.05Å; Y228-P263 HydrophobicContact CE1-CG 3.66Å
229	M	82.2	Confident	79.7	Confident	78 Å²	78	62.9 Å²	62.9	38%	0.384	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.2	176.5	-64	-62.6	-66.1	0	0	109.9	K226 P231 N234 G236	K226-M229 HydrophobicContact CB-SD 4.3Å; M229-P231 WeakPolarHBondContact O-CD 3.42Å; M229-N234 WeakPolarHBondContact CE-O 3.15Å; M229-G236 WeakPolarHBondContact SD-CA 3.44Å
230	C	81.3	Confident	79.7	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	35%	0.345	C	S	.	.			trans	-77.9	118.9	168.1	-178.1	0	0	0	0	109.9	L232 C233 N234 K235 F237 F243 H246 H251	C230-L232 PolarHBondContact O-N 3.04Å; C230-C233 VanDerWaalsContact SG-SG 3.69Å; C230-N234 WeakPolarHBondContact O-CA 3.47Å; C230-N234 PolarHBondContact O-N 3.21Å; C230-K235 PolarHBondContact N-O 2.84Å; C230-F237 HydrophobicContact CB-CE2 4.34Å; C230-F243 HydrophobicContact CB-CD2 4.19Å; C230-F243 HydrophobicContact CB-CE2 3.78Å; C230-H246 PolarHBondContact SG-NE2 3.1Å; C230-H251 PolarHBondContact SG-NE2 3.41Å; C230-H251 VanDerWaalsContact SG-NE2 3.44Å
231	P	79.1	Confident	79.6	Confident	82 Å²	82	68.7 Å²	68.7	53%	0.532	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-20.1	-180	29.2	-34.9	0	0	0	112.2	M229 M261	M229-P231 WeakPolarHBondContact O-CD 3.42Å; P231-M261 HydrophobicContact CG-CE 3.55Å
232	L	81	Confident	79.8	Confident	99 Å²	99	68.3 Å²	68.3	52%	0.518	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-28	-176	-57.2	168	0	0	0	112.7	C230 H251 T254	C230-L232 PolarHBondContact O-N 3.04Å; L232-H251 HydrophobicContact CD1-CB 3.7Å; L232-T254 HydrophobicContact CD1-CG2 3.17Å
233	C	85.6	Confident	79.9	Confident	50 Å²	50	65.5 Å²	65.5	34%	0.338	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.7	5.3	179.5	71.2	0	0	0	0	114.2	C230 K235 H246	C230-C233 VanDerWaalsContact SG-SG 3.69Å; C233-K235 PolarHBondContact O-N 3.23Å; C233-H246 PolarHBondContact SG-CE1 2.82Å; C233-H246 PolarHBondContact SG-NE2 3.34Å
234	N	83	Confident	80.3	Confident	120 Å²	120	64.3 Å²	64.3	64%	0.642	32%	0.32	S	S	*	.			trans	51.4	22.1	-176.3	-68	-37.2	0	0	0	115	M229 C230 G236	M229-N234 WeakPolarHBondContact CE-O 3.15Å; C230-N234 WeakPolarHBondContact O-CA 3.47Å; C230-N234 PolarHBondContact O-N 3.21Å; N234-G236 PolarHBondContact O-N 3.16Å
235	K	82.7	Confident	80.8	Confident	126 Å²	126	64 Å²	64	55%	0.548	31%	0.308	S	S	.	.			trans	-76.1	126.5	170.9	-73.6	-176.3	-175.1	-66.7	0	110.3	C230 C233 F237	C230-K235 PolarHBondContact N-O 2.84Å; C233-K235 PolarHBondContact O-N 3.23Å; K235-F237 HydrophobicContact CB-CE2 3.86Å; K235-F237 HydrophobicContact CB-CZ 3.89Å; K235-F237 WeakPolarHBondContact O-CD2 3.46Å; K235-F237 VanDerWaalsContact O-CE2 3.25Å; K235-F237 WeakPolarHBondContact O-CE2 3.26Å
236	G	83.2	Confident	81.4	Confident	16 Å²	16	63.9 Å²	63.9	17%	0.165	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	142.2	174.1	0	0	0	0	0	113.4	K226 Y228 M229 N234	K226-G236 WeakPolarHBondContact CD-O 3.13Å; Y228-G236 CarbonylContact O-C 3.51Å; Y228-G236 WeakPolarHBondContact O-CA 3.5Å; M229-G236 WeakPolarHBondContact SD-CA 3.44Å; N234-G236 PolarHBondContact O-N 3.16Å
237	F	80.4	Confident	81.6	Confident	34 Å²	34	59.1 Å²	59.1	15%	0.149	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	140.6	178.1	-57.3	-87.3	0	0	0	111	K226 P227 Y228 C230 K235 Q239 F243 H246	K226-F237 CarbonylContact C-O 3.45Å; K226-F237 WeakPolarHBondContact CA-O 3.44Å; P227-F237 WeakPolarHBondContact CD-O 3.5Å; Y228-F237 PolarHBondContact N-O 3.39Å; Y228-F237 PolarHBondContact O-N 2.76Å; C230-F237 HydrophobicContact CB-CE2 4.34Å; K235-F237 HydrophobicContact CB-CE2 3.86Å; K235-F237 HydrophobicContact CB-CZ 3.89Å; K235-F237 WeakPolarHBondContact O-CD2 3.46Å; K235-F237 VanDerWaalsContact O-CE2 3.25Å; K235-F237 WeakPolarHBondContact O-CE2 3.26Å; F237-Q239 VanDerWaalsContact C-N 3.29Å; F237-Q239 PolarHBondContact O-N 3.13Å; F237-F243 HydrophobicContact CB-CB 3.93Å; F237-F243 HydrophobicContact CD2-CB 3.69Å; F237-F243 AromaticContact CD2-CD2 3.8Å; F237-F243 HydrophobicContact CD2-CD2 3.8Å; F237-F243 HydrophobicContact CD2-CG 4.26Å; F237-F243 HydrophobicContact CE2-CD2 4.1Å; F237-F243 HydrophobicContact CG-CB 3.94Å; F237-H246 HydrophobicContact CE1-CB 3.78Å; F237-H246 HydrophobicContact CE2-CB 3.88Å; F237-H246 AromaticContact CE2-CD2 3.37Å; F237-H246 WeakPolarHBondContact CE2-CD2 3.4Å; F237-H246 AromaticContact CE2-CG 3.62Å; F237-H246 HydrophobicContact CZ-CB 3.34Å; F237-H246 AromaticContact CZ-CD2 3.42Å; F237-H246 VanDerWaalsContact CZ-CD2 3.42Å; F237-H246 WeakPolarHBondContact CZ-CD2 3.43Å; F237-H246 AromaticContact CZ-CG 3.16Å; F237-H246 AromaticContact CZ-ND1 3.67Å
238	P	80.5	Confident	81.9	Confident	33 Å²	33	61.8 Å²	61.8	21%	0.214	31%	0.308	C	S	.	.	S	Bend	trans	-72.1	-22.2	179.6	28.5	-34.8	0	0	0	113	N219 Y242	N219-P238 VanDerWaalsContact O-CB 3.22Å; N219-P238 WeakPolarHBondContact O-CB 3.37Å; P238-Y242 HydrophobicContact CG-CD2 4.33Å
239	Q	79.6	Confident	82.1	Confident	25 Å²	25	62.3 Å²	62.3	12%	0.117	32%	0.32	C	S	.	.	S	Bend	trans	-136	146.2	-176.6	-45.5	179.7	15.8	0	0	111.3	R216 Y228 F237 W241 Y242 F243	R216-Q239 VanDerWaalsContact CG-CD 3.42Å; R216-Q239 HydrophobicContact CG-CG 4.01Å; Y228-Q239 VanDerWaalsContact CD2-C 3.41Å; F237-Q239 VanDerWaalsContact C-N 3.29Å; F237-Q239 PolarHBondContact O-N 3.13Å; Q239-W241 VanDerWaalsContact C-N 3.32Å; Q239-W241 PolarHBondContact O-N 2.97Å; Q239-W241 VanDerWaalsContact OE1-CD1 3.28Å; Q239-Y242 HydrophobicContact CB-CD2 3.76Å; Q239-Y242 HydrophobicContact CB-CE2 4.31Å; Q239-Y242 HydrophobicContact CG-CD2 3.99Å; Q239-Y242 HydrophobicContact CG-CE2 4.1Å; Q239-Y242 PolarHBondContact O-N 2.69Å; Q239-F243 PolarHBondContact O-N 3Å
240	K	82.2	Confident	82.1	Confident	95 Å²	95	62.9 Å²	62.9	41%	0.413	33%	0.327	S	S	.	.	H	α-helix	trans	-53.9	-45.8	-177.6	-174.9	166.9	165.5	168.3	0	112.7	Y228 Y242 F243 E244	Y228-K240 HydrophobicContact CD1-CB 4.02Å; Y228-K240 HydrophobicContact CD1-CG 4.23Å; Y228-K240 HydrophobicContact CD2-CB 4.49Å; Y228-K240 VanDerWaalsContact CD2-N 3.34Å; Y228-K240 HydrophobicContact CE1-CB 3.49Å; Y228-K240 VanDerWaalsContact CE1-CB 3.49Å; Y228-K240 HydrophobicContact CE1-CD 4.12Å; Y228-K240 HydrophobicContact CE1-CG 3.83Å; Y228-K240 HydrophobicContact CE2-CB 4.06Å; Y228-K240 HydrophobicContact CG-CB 4.49Å; K240-Y242 VanDerWaalsContact C-N 3.31Å; K240-Y242 PolarHBondContact O-N 3.49Å; K240-F243 CarbonylContact O-C 3.49Å; K240-F243 WeakPolarHBondContact O-CA 3.49Å; K240-F243 VanDerWaalsContact O-CB 3.31Å; K240-F243 WeakPolarHBondContact O-CB 3.43Å; K240-F243 PolarHBondContact O-N 3.17Å; K240-F243 VanDerWaalsContact O-N 3.1Å; K240-E244 WeakPolarHBondContact CE-OE1 3.25Å; K240-E244 HydrophobicContact CG-CG 4.09Å; K240-E244 IonicContact NZ-OE1 3.91Å; K240-E244 WeakPolarHBondContact O-CG 3.44Å; K240-E244 PolarHBondContact O-N 3.24Å
241	W	81.4	Confident	82.2	Confident	100 Å²	100	64.7 Å²	64.7	38%	0.379	34%	0.336	S	S	.	.	H	α-helix	trans	-65.4	-33.4	-176	75.5	-94.1	0	0	0	113	Q239 F243 R245	Q239-W241 VanDerWaalsContact C-N 3.32Å; Q239-W241 PolarHBondContact O-N 2.97Å; Q239-W241 VanDerWaalsContact OE1-CD1 3.28Å; W241-F243 VanDerWaalsContact C-N 3.31Å; W241-R245 WeakPolarHBondContact O-CB 3.22Å; W241-R245 PolarHBondContact O-N 2.78Å
242	Y	82.9	Confident	81.9	Confident	79 Å²	79	69 Å²	69	31%	0.31	35%	0.346	S	S	.	.	H	α-helix	trans	-66.1	-40.4	175	-74.6	-64.2	0	0	0	110.3	P238 Q239 K240 H246	P238-Y242 HydrophobicContact CG-CD2 4.33Å; Q239-Y242 HydrophobicContact CB-CD2 3.76Å; Q239-Y242 HydrophobicContact CB-CE2 4.31Å; Q239-Y242 HydrophobicContact CG-CD2 3.99Å; Q239-Y242 HydrophobicContact CG-CE2 4.1Å; Q239-Y242 PolarHBondContact O-N 2.69Å; K240-Y242 VanDerWaalsContact C-N 3.31Å; K240-Y242 PolarHBondContact O-N 3.49Å; Y242-H246 VanDerWaalsContact O-CB 3.24Å; Y242-H246 WeakPolarHBondContact O-CB 3.44Å; Y242-H246 PolarHBondContact O-N 3.03Å
243	F	83.4	Confident	80.8	Confident	4 Å²	4	73.8 Å²	73.8	2%	0.018	36%	0.363	C	S	.	.	H	α-helix	trans	-64.4	-50.7	174.9	165.4	-106.5	0	0	0	112	Y228 C230 F237 Q239 K240 W241 R245 H246 V247 M261	Y228-F243 HydrophobicContact CG-CB 4.36Å; C230-F243 HydrophobicContact CB-CD2 4.19Å; C230-F243 HydrophobicContact CB-CE2 3.78Å; F237-F243 HydrophobicContact CB-CB 3.93Å; F237-F243 HydrophobicContact CD2-CB 3.69Å; F237-F243 AromaticContact CD2-CD2 3.8Å; F237-F243 HydrophobicContact CD2-CD2 3.8Å; F237-F243 HydrophobicContact CD2-CG 4.26Å; F237-F243 HydrophobicContact CE2-CD2 4.1Å; F237-F243 HydrophobicContact CG-CB 3.94Å; Q239-F243 PolarHBondContact O-N 3Å; K240-F243 CarbonylContact O-C 3.49Å; K240-F243 WeakPolarHBondContact O-CA 3.49Å; K240-F243 VanDerWaalsContact O-CB 3.31Å; K240-F243 WeakPolarHBondContact O-CB 3.43Å; K240-F243 PolarHBondContact O-N 3.17Å; K240-F243 VanDerWaalsContact O-N 3.1Å; W241-F243 VanDerWaalsContact C-N 3.31Å; F243-R245 PolarHBondContact O-N 3.39Å; F243-H246 WeakPolarHBondContact O-CA 3.45Å; F243-H246 WeakPolarHBondContact O-CB 3.34Å; F243-H246 PolarHBondContact O-N 3Å; F243-H246 VanDerWaalsContact O-N 3.09Å; F243-V247 HydrophobicContact CD2-CG2 4.04Å; F243-V247 HydrophobicContact CE1-CG2 4.27Å; F243-V247 HydrophobicContact CE2-CG2 3.3Å; F243-V247 HydrophobicContact CZ-CG2 3.43Å; F243-V247 VanDerWaalsContact CZ-CG2 3.43Å; F243-V247 WeakPolarHBondContact O-CG2 3.31Å; F243-V247 PolarHBondContact O-N 3Å; F243-M261 HydrophobicContact CE1-CB 4.44Å; F243-M261 HydrophobicContact CE1-CE 4.04Å; F243-M261 HydrophobicContact CE1-SD 3.66Å; F243-M261 HydrophobicContact CE2-CE 4.16Å; F243-M261 HydrophobicContact CZ-CE 3.33Å; F243-M261 HydrophobicContact CZ-SD 3.38Å; F243-M261 WeakPolarHBondContact CZ-SD 3.42Å
244	E	82.7	Confident	79.3	Confident	64 Å²	64	73.8 Å²	73.8	30%	0.299	36%	0.361	S	S	.	.	H	α-helix	trans	-59.5	-46	178.1	-70.5	179.4	152.8	0	0	111.7	K240 H246 V247 A248 I258	K240-E244 WeakPolarHBondContact CE-OE1 3.25Å; K240-E244 HydrophobicContact CG-CG 4.09Å; K240-E244 IonicContact NZ-OE1 3.91Å; K240-E244 WeakPolarHBondContact O-CG 3.44Å; K240-E244 PolarHBondContact O-N 3.24Å; E244-H246 VanDerWaalsContact C-N 3.28Å; E244-H246 PolarHBondContact O-N 2.86Å; E244-V247 PolarHBondContact O-N 2.72Å; E244-A248 VanDerWaalsContact O-CB 3.32Å; E244-A248 WeakPolarHBondContact O-CB 3.35Å; E244-A248 PolarHBondContact O-N 2.76Å; E244-I258 HydrophobicContact CG-CG2 3.83Å
245	R	81	Confident	77.8	Confident	147 Å²	147	73.9 Å²	73.9	56%	0.555	37%	0.368	S	S	*	.	H	α-helix	trans	-61.2	-40.4	175.2	-175.2	-179.8	67.2	165.5	2.8	111.2	W241 F243 S249	W241-R245 WeakPolarHBondContact O-CB 3.22Å; W241-R245 PolarHBondContact O-N 2.78Å; F243-R245 PolarHBondContact O-N 3.39Å; R245-S249 WeakPolarHBondContact O-CB 3.31Å; R245-S249 PolarHBondContact O-N 3.47Å; R245-S249 PolarHBondContact O-OG 3.17Å
246	H	82.7	Confident	76.2	Confident	18 Å²	18	75.9 Å²	75.9	8%	0.083	38%	0.377	C	S	.	.	H	α-helix	trans	-61.1	-51	176	160.8	73.7	0	0	0	111.1	C230 C233 F237 Y242 F243 E244 A248 S249 V250 H251	C230-H246 PolarHBondContact SG-NE2 3.1Å; C233-H246 PolarHBondContact SG-CE1 2.82Å; C233-H246 PolarHBondContact SG-NE2 3.34Å; F237-H246 HydrophobicContact CE1-CB 3.78Å; F237-H246 HydrophobicContact CE2-CB 3.88Å; F237-H246 AromaticContact CE2-CD2 3.37Å; F237-H246 WeakPolarHBondContact CE2-CD2 3.4Å; F237-H246 AromaticContact CE2-CG 3.62Å; F237-H246 HydrophobicContact CZ-CB 3.34Å; F237-H246 AromaticContact CZ-CD2 3.42Å; F237-H246 VanDerWaalsContact CZ-CD2 3.42Å; F237-H246 WeakPolarHBondContact CZ-CD2 3.43Å; F237-H246 AromaticContact CZ-CG 3.16Å; F237-H246 AromaticContact CZ-ND1 3.67Å; Y242-H246 VanDerWaalsContact O-CB 3.24Å; Y242-H246 WeakPolarHBondContact O-CB 3.44Å; Y242-H246 PolarHBondContact O-N 3.03Å; F243-H246 WeakPolarHBondContact O-CA 3.45Å; F243-H246 WeakPolarHBondContact O-CB 3.34Å; F243-H246 PolarHBondContact O-N 3Å; F243-H246 VanDerWaalsContact O-N 3.09Å; E244-H246 VanDerWaalsContact C-N 3.28Å; E244-H246 PolarHBondContact O-N 2.86Å; H246-A248 PolarHBondContact O-N 3.18Å; H246-S249 PolarHBondContact O-N 2.93Å; H246-S249 PolarHBondContact O-OG 3.09Å; H246-V250 WeakPolarHBondContact ND1-CG2 3.24Å; H246-V250 VanDerWaalsContact O-CB 3.31Å; H246-V250 WeakPolarHBondContact O-CB 3.32Å; H246-V250 WeakPolarHBondContact O-CG2 3.46Å; H246-V250 PolarHBondContact O-N 3.29Å; H246-H251 AromaticContact CE1-NE2 3.7Å; H246-H251 AromaticContact NE2-CD2 3.6Å; H246-H251 AromaticContact NE2-NE2 3.34Å; H246-H251 PolarHBondContact NE2-NE2 2.89Å
247	V	82.5	Confident	74.6	Confident	7 Å²	7	78.8 Å²	78.8	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-58.7	-48.1	176.9	176.6	0	0	0	0	111	F243 E244 S249 H251 T254	F243-V247 HydrophobicContact CD2-CG2 4.04Å; F243-V247 HydrophobicContact CE1-CG2 4.27Å; F243-V247 HydrophobicContact CE2-CG2 3.3Å; F243-V247 HydrophobicContact CZ-CG2 3.43Å; F243-V247 VanDerWaalsContact CZ-CG2 3.43Å; F243-V247 WeakPolarHBondContact O-CG2 3.31Å; F243-V247 PolarHBondContact O-N 3Å; E244-V247 PolarHBondContact O-N 2.72Å; V247-S249 VanDerWaalsContact C-N 3.32Å; V247-S249 PolarHBondContact O-N 2.81Å; V247-H251 HydrophobicContact CG1-CB 4.26Å; V247-H251 CarbonylContact O-C 3.31Å; V247-H251 WeakPolarHBondContact O-CA 3.3Å; V247-H251 WeakPolarHBondContact O-CB 3.33Å; V247-H251 PolarHBondContact O-N 3.33Å; V247-T254 HydrophobicContact CG1-CG2 4.35Å
248	A	82.6	Confident	73.4	Confident	66 Å²	66	80 Å²	80	55%	0.545	40%	0.401	S	S	.	.	H	α-helix	trans	-62	-36.8	179.1	0	0	0	0	0	113.2	E244 H246 K252	E244-A248 VanDerWaalsContact O-CB 3.32Å; E244-A248 WeakPolarHBondContact O-CB 3.35Å; E244-A248 PolarHBondContact O-N 2.76Å; H246-A248 PolarHBondContact O-N 3.18Å; A248-K252 WeakPolarHBondContact O-CG 3.41Å
249	S	84.1	Confident	72	Confident	66 Å²	66	83.6 Å²	83.6	46%	0.462	43%	0.427	S	S	.	.	H	α-helix	trans	-86.1	-37.8	-176.3	66.3	0	0	0	0	114.4	R245 H246 V247 K252	R245-S249 WeakPolarHBondContact O-CB 3.31Å; R245-S249 PolarHBondContact O-N 3.47Å; R245-S249 PolarHBondContact O-OG 3.17Å; H246-S249 PolarHBondContact O-N 2.93Å; H246-S249 PolarHBondContact O-OG 3.09Å; V247-S249 VanDerWaalsContact C-N 3.32Å; V247-S249 PolarHBondContact O-N 2.81Å; S249-K252 WeakPolarHBondContact O-CE 3.34Å
250	V	83	Confident	70.3	Confident	90 Å²	90	90.4 Å²	90.4	55%	0.545	46%	0.456	S	S	.	.	H	α-helix	trans	-98.7	-36.2	-173.3	-178.8	0	0	0	0	110.9	H246	H246-V250 WeakPolarHBondContact ND1-CG2 3.24Å; H246-V250 VanDerWaalsContact O-CB 3.31Å; H246-V250 WeakPolarHBondContact O-CB 3.32Å; H246-V250 WeakPolarHBondContact O-CG2 3.46Å; H246-V250 PolarHBondContact O-N 3.29Å
251	H	83.3	Confident	68.8	Low	37 Å²	37	88.9 Å²	88.9	17%	0.171	45%	0.451	C	S	.	.			trans	-113.9	43.4	-176	-54.8	-66.1	0	0	0	111.2	C230 L232 H246 V247 K253 T254	C230-H251 PolarHBondContact SG-NE2 3.41Å; C230-H251 VanDerWaalsContact SG-NE2 3.44Å; L232-H251 HydrophobicContact CD1-CB 3.7Å; H246-H251 AromaticContact CE1-NE2 3.7Å; H246-H251 AromaticContact NE2-CD2 3.6Å; H246-H251 AromaticContact NE2-NE2 3.34Å; H246-H251 PolarHBondContact NE2-NE2 2.89Å; V247-H251 HydrophobicContact CG1-CB 4.26Å; V247-H251 CarbonylContact O-C 3.31Å; V247-H251 WeakPolarHBondContact O-CA 3.3Å; V247-H251 WeakPolarHBondContact O-CB 3.33Å; V247-H251 PolarHBondContact O-N 3.33Å; H251-K253 PolarHBondContact O-N 3.46Å; H251-T254 HydrophobicContact CB-CG2 3.6Å; H251-T254 WeakPolarHBondContact O-CG2 3.48Å; H251-T254 PolarHBondContact O-N 3.13Å
252	K	72.5	Confident	67.3	Low	172 Å²	172	89.4 Å²	89.4	75%	0.748	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.9	-15.4	-173.8	-73.2	177.4	179.5	-177.4	0	117.2	A248 S249	A248-K252 WeakPolarHBondContact O-CG 3.41Å; S249-K252 WeakPolarHBondContact O-CE 3.34Å
253	K	58.3	Low	65.6	Low	201 Å²	201	87.7 Å²	87.7	87%	0.874	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.2	47.2	-177.8	-65.5	-172.1	176.5	-175.4	0	113.3	H251 P255	H251-K253 PolarHBondContact O-N 3.46Å; K253-P255 WeakPolarHBondContact O-CD 3.48Å
254	T	54.2	Low	64.1	Low	50 Å²	50	97.6 Å²	97.6	31%	0.307	50%	0.501	S	S	.	.			trans	-87.7	122.5	175.3	47.8	0	0	0	0	111.9	L232 V247 H251 F256	L232-T254 HydrophobicContact CD1-CG2 3.17Å; V247-T254 HydrophobicContact CG1-CG2 4.35Å; H251-T254 HydrophobicContact CB-CG2 3.6Å; H251-T254 WeakPolarHBondContact O-CG2 3.48Å; H251-T254 PolarHBondContact O-N 3.13Å; T254-F256 PolarHBondContact O-N 3.03Å
255	P	51.2	Low	62.4	Low	122 Å²	122	100.9 Å²	100.9	79%	0.792	52%	0.517	S	S	*	.			trans	-71.6	-12.9	177.9	-17	30.6	0	0	0	114.6	K253	K253-P255 WeakPolarHBondContact O-CD 3.48Å
256	F	48.9	Very low	60.6	Low	167 Å²	167	96.7 Å²	96.7	73%	0.732	50%	0.503	S	S	*	.	S	Bend	trans	-84.7	127.6	-176.2	-75.9	-81.2	0	0	0	111.8	T254 I258	T254-F256 PolarHBondContact O-N 3.03Å; F256-I258 PolarHBondContact O-N 3.06Å
257	P	50.3	Low	58.8	Low	78 Å²	78	97.8 Å²	97.8	51%	0.506	51%	0.511	S	S	.	.			trans	-60.2	122.6	169.7	-17	28.2	0	0	0	109.6	S259 F260	P257-S259 PolarHBondContact O-N 2.88Å; P257-F260 HydrophobicContact CB-CD2 4.4Å; P257-F260 HydrophobicContact CG-CD2 4.47Å; P257-F260 PolarHBondContact O-N 2.83Å; P257-F260 VanDerWaalsContact O-N 3.17Å
258	I	53.6	Low	57.1	Low	59 Å²	59	104.5 Å²	104.5	30%	0.303	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-47.1	-24.2	171.9	-64.7	170.5	0	0	0	111.8	E244 F256 F260 M261	E244-I258 HydrophobicContact CG-CG2 3.83Å; F256-I258 PolarHBondContact O-N 3.06Å; I258-F260 VanDerWaalsContact C-N 3.28Å; I258-F260 PolarHBondContact O-N 3.01Å; I258-M261 WeakPolarHBondContact O-CB 3.48Å; I258-M261 PolarHBondContact O-N 2.83Å
259	S	51.5	Low	55.3	Low	109 Å²	109	107.6 Å²	107.6	76%	0.762	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-61.2	-25.4	-178.4	-157	0	0	0	0	115.2	P257 M261	P257-S259 PolarHBondContact O-N 2.88Å; S259-M261 VanDerWaalsContact C-N 3.31Å
260	F	44.9	Very low	53.7	Low	168 Å²	168	109 Å²	109	74%	0.737	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-84.1	-4	178.8	-79.1	-81.7	0	0	0	114	P257 I258 V262	P257-F260 HydrophobicContact CB-CD2 4.4Å; P257-F260 HydrophobicContact CG-CD2 4.47Å; P257-F260 PolarHBondContact O-N 2.83Å; P257-F260 VanDerWaalsContact O-N 3.17Å; I258-F260 VanDerWaalsContact C-N 3.28Å; I258-F260 PolarHBondContact O-N 3.01Å; F260-V262 PolarHBondContact O-N 3.05Å
261	M	50.4	Low	52.1	Low	63 Å²	63	109.4 Å²	109.4	31%	0.31	54%	0.541	S	S	.	.			trans	-86.5	89.5	-173.9	-53.8	-172.7	79	0	0	109.9	P231 F243 I258 S259	P231-M261 HydrophobicContact CG-CE 3.55Å; F243-M261 HydrophobicContact CE1-CB 4.44Å; F243-M261 HydrophobicContact CE1-CE 4.04Å; F243-M261 HydrophobicContact CE1-SD 3.66Å; F243-M261 HydrophobicContact CE2-CE 4.16Å; F243-M261 HydrophobicContact CZ-CE 3.33Å; F243-M261 HydrophobicContact CZ-SD 3.38Å; F243-M261 WeakPolarHBondContact CZ-SD 3.42Å; I258-M261 WeakPolarHBondContact O-CB 3.48Å; I258-M261 PolarHBondContact O-N 2.83Å; S259-M261 VanDerWaalsContact C-N 3.31Å
262	V	49.6	Very low	50.6	Low	110 Å²	110	113 Å²	113	67%	0.667	56%	0.558	S	S	*	*			trans	-66.8	130.2	171.4	-171.5	0	0	0	0	107.4	F260 R264	F260-V262 PolarHBondContact O-N 3.05Å; V262-R264 PolarHBondContact O-N 2.79Å
263	P	47.9	Very low	50.1	Low	44 Å²	44	110.7 Å²	110.7	29%	0.286	55%	0.549	S	S	.	.			trans	-51.6	137	167.5	-13.8	22.2	0	0	0	108	P227 Y228 Q265	P227-P263 HydrophobicContact CB-CB 4.18Å; P227-P263 CarbonylContact O-C 3.55Å; P227-P263 WeakPolarHBondContact O-CA 3.4Å; Y228-P263 HydrophobicContact CD1-CB 4.43Å; Y228-P263 HydrophobicContact CD1-CG 4.41Å; Y228-P263 HydrophobicContact CE1-CB 4.05Å; Y228-P263 HydrophobicContact CE1-CG 3.66Å; P263-Q265 PolarHBondContact O-N 3.19Å
264	R	50.8	Low	50.4	Low	211 Å²	211	107.2 Å²	107.2	80%	0.796	54%	0.536	S	S	*	.			trans	-58.4	104.7	161	-103.2	-168.5	173.3	-155.5	-0.5	104.2	P227 V262 Q266	P227-R264 PolarHBondContact O-N 3.34Å; V262-R264 PolarHBondContact O-N 2.79Å; R264-Q266 PolarHBondContact O-N 3.05Å
265	Q	47.4	Very low	51.2	Low	134 Å²	134	107.9 Å²	107.9	63%	0.626	54%	0.54	S	S	*	.			trans	-56.4	119.6	-177.7	-65.8	-177.9	20.4	0	0	104.8	P263 T267	P263-Q265 PolarHBondContact O-N 3.19Å; Q265-T267 HydrophobicContact CB-CG2 3.82Å; Q265-T267 WeakPolarHBondContact CB-OG1 3.27Å; Q265-T267 PolarHBondContact O-N 3.26Å; Q265-T267 PolarHBondContact O-OG1 3.3Å; Q265-T267 VanDerWaalsContact O-OG1 3.07Å
266	Q	43.4	Very low	52.2	Low	58 Å²	58	106.2 Å²	106.2	27%	0.271	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	58	164.4	-75.4	156.2	3.2	0	0	107.5	S225 P227 R264	S225-Q266 PolarHBondContact OG-NE2 3.31Å; S225-Q266 PolarHBondContact OG-OE1 2.93Å; P227-Q266 HydrophobicContact CB-CG 4.46Å; P227-Q266 VanDerWaalsContact N-NE2 3.12Å; R264-Q266 PolarHBondContact O-N 3.05Å
267	T	45.3	Very low	53.4	Low	42 Å²	42	103.5 Å²	103.5	26%	0.258	51%	0.514	S	S	.	.	H	α-helix	trans	-80.9	-30.4	169.6	30	0	0	0	0	108.4	Q265 Q269 Q271	Q265-T267 HydrophobicContact CB-CG2 3.82Å; Q265-T267 WeakPolarHBondContact CB-OG1 3.27Å; Q265-T267 PolarHBondContact O-N 3.26Å; Q265-T267 PolarHBondContact O-OG1 3.3Å; Q265-T267 VanDerWaalsContact O-OG1 3.07Å; T267-Q269 PolarHBondContact O-N 3.19Å; T267-Q271 VanDerWaalsContact CB-NE2 3.33Å; T267-Q271 HydrophobicContact CG2-CG 4.09Å; T267-Q271 VanDerWaalsContact O-CA 3.22Å; T267-Q271 WeakPolarHBondContact O-CA 3.48Å; T267-Q271 WeakPolarHBondContact O-CB 3.38Å; T267-Q271 WeakPolarHBondContact O-CG 3.33Å; T267-Q271 PolarHBondContact O-N 3.45Å
268	Q	45.7	Very low	54.6	Low	147 Å²	147	102.7 Å²	102.7	69%	0.687	51%	0.508	S	S	*	.	H	α-helix	trans	-60.7	-47.1	-175.4	-75.2	-178.7	1.1	0	0	114.7	Q272	Q268-Q272 WeakPolarHBondContact O-CA 3.18Å; Q268-Q272 WeakPolarHBondContact O-CB 3.31Å; Q268-Q272 VanDerWaalsContact O-CD 3.24Å; Q268-Q272 WeakPolarHBondContact O-CG 3.49Å; Q268-Q272 PolarHBondContact O-N 2.87Å
269	Q	45.6	Very low	55.8	Low	131 Å²	131	104.6 Å²	104.6	61%	0.612	52%	0.515	S	S	*	.	H	α-helix	trans	-82.6	-38.2	-178.8	-74.3	-179.2	0.7	0	0	113.9	T267 Q272 H273	T267-Q269 PolarHBondContact O-N 3.19Å; Q269-Q272 PolarHBondContact O-N 3.34Å; Q269-H273 WeakPolarHBondContact O-CB 3.47Å; Q269-H273 PolarHBondContact O-N 3.35Å
270	Q	49.7	Very low	57.2	Low	97 Å²	97	105.1 Å²	105.1	45%	0.453	51%	0.505	S	S	.	.	H	α-helix	trans	-72.6	-37	174.8	-93.5	-178.1	9.9	0	0	112.3	Q274	Q270-Q274 VanDerWaalsContact O-CB 3.28Å; Q270-Q274 WeakPolarHBondContact O-CB 3.32Å; Q270-Q274 PolarHBondContact O-N 3.29Å
271	Q	49	Very low	59.2	Low	98 Å²	98	102.9 Å²	102.9	46%	0.458	50%	0.497	S	S	.	.	H	α-helix	trans	-65.9	-43.8	166.1	-63.9	173.3	-16.7	0	0	109.2	T267 H273 Q274 T275	T267-Q271 VanDerWaalsContact CB-NE2 3.33Å; T267-Q271 HydrophobicContact CG2-CG 4.09Å; T267-Q271 VanDerWaalsContact O-CA 3.22Å; T267-Q271 WeakPolarHBondContact O-CA 3.48Å; T267-Q271 WeakPolarHBondContact O-CB 3.38Å; T267-Q271 WeakPolarHBondContact O-CG 3.33Å; T267-Q271 PolarHBondContact O-N 3.45Å; Q271-H273 VanDerWaalsContact C-N 3.32Å; Q271-H273 PolarHBondContact O-N 3.03Å; Q271-Q274 CarbonylContact O-C 3.55Å; Q271-Q274 PolarHBondContact O-N 3.43Å; Q271-T275 WeakPolarHBondContact O-CA 3.45Å; Q271-T275 WeakPolarHBondContact O-CB 3.45Å; Q271-T275 PolarHBondContact O-N 2.85Å; Q271-T275 PolarHBondContact O-OG1 2.95Å
272	Q	53.4	Low	60.8	Low	112 Å²	112	105.4 Å²	105.4	52%	0.523	51%	0.508	S	S	.	.	H	α-helix	trans	-57.9	-43.7	175.5	-82.9	164.4	7.5	0	0	112	Q268 Q269 T275 L276	Q268-Q272 WeakPolarHBondContact O-CA 3.18Å; Q268-Q272 WeakPolarHBondContact O-CB 3.31Å; Q268-Q272 VanDerWaalsContact O-CD 3.24Å; Q268-Q272 WeakPolarHBondContact O-CG 3.49Å; Q268-Q272 PolarHBondContact O-N 2.87Å; Q269-Q272 PolarHBondContact O-N 3.34Å; Q272-T275 PolarHBondContact O-N 3.39Å; Q272-L276 WeakPolarHBondContact O-CB 3.34Å; Q272-L276 WeakPolarHBondContact O-CD1 3.34Å; Q272-L276 WeakPolarHBondContact O-CG 3.39Å; Q272-L276 PolarHBondContact O-N 2.94Å
273	H	61.4	Low	62.7	Low	123 Å²	123	105.8 Å²	105.8	57%	0.569	50%	0.503	S	S	*	.	H	α-helix	trans	-68.1	-42.9	177.4	-124.4	51.5	0	0	0	112.3	Q269 Q271 T275 L276 Q277	Q269-H273 WeakPolarHBondContact O-CB 3.47Å; Q269-H273 PolarHBondContact O-N 3.35Å; Q271-H273 VanDerWaalsContact C-N 3.32Å; Q271-H273 PolarHBondContact O-N 3.03Å; H273-T275 VanDerWaalsContact C-N 3.34Å; H273-L276 PolarHBondContact O-N 2.9Å; H273-Q277 WeakPolarHBondContact O-CB 3.45Å; H273-Q277 VanDerWaalsContact O-CG 3.26Å; H273-Q277 WeakPolarHBondContact O-CG 3.1Å; H273-Q277 PolarHBondContact O-N 3.49Å
274	Q	63.6	Low	64.7	Low	128 Å²	128	109.7 Å²	109.7	60%	0.598	52%	0.517	S	S	*	.	H	α-helix	trans	-65.5	-37.6	173.1	-84.3	-172	-39.8	0	0	112.1	Q270 Q271 Q277 T278	Q270-Q274 VanDerWaalsContact O-CB 3.28Å; Q270-Q274 WeakPolarHBondContact O-CB 3.32Å; Q270-Q274 PolarHBondContact O-N 3.29Å; Q271-Q274 CarbonylContact O-C 3.55Å; Q271-Q274 PolarHBondContact O-N 3.43Å; Q274-Q277 PolarHBondContact O-N 3Å; Q274-T278 VanDerWaalsContact O-CB 3.22Å; Q274-T278 WeakPolarHBondContact O-CB 3.46Å; Q274-T278 PolarHBondContact O-N 3.33Å; Q274-T278 PolarHBondContact O-OG1 3.12Å
275	T	71.5	Confident	66.5	Low	64 Å²	64	104.2 Å²	104.2	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-70.8	-40.2	179.2	-60.9	0	0	0	0	109.4	Q271 Q272 H273 T278 Q279	Q271-T275 WeakPolarHBondContact O-CA 3.45Å; Q271-T275 WeakPolarHBondContact O-CB 3.45Å; Q271-T275 PolarHBondContact O-N 2.85Å; Q271-T275 PolarHBondContact O-OG1 2.95Å; Q272-T275 PolarHBondContact O-N 3.39Å; H273-T275 VanDerWaalsContact C-N 3.34Å; T275-T278 PolarHBondContact O-N 2.8Å; T275-Q279 HydrophobicContact CG2-CG 4.24Å; T275-Q279 WeakPolarHBondContact O-CA 3.33Å; T275-Q279 WeakPolarHBondContact O-CB 3.45Å; T275-Q279 WeakPolarHBondContact O-CG 3.43Å; T275-Q279 PolarHBondContact O-N 3.12Å
276	L	72.9	Confident	68.4	Low	87 Å²	87	104.5 Å²	104.5	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-45.6	172.7	-78	163	0	0	0	110.8	Q272 H273 Q279 Q280	Q272-L276 WeakPolarHBondContact O-CB 3.34Å; Q272-L276 WeakPolarHBondContact O-CD1 3.34Å; Q272-L276 WeakPolarHBondContact O-CG 3.39Å; Q272-L276 PolarHBondContact O-N 2.94Å; H273-L276 PolarHBondContact O-N 2.9Å; L276-Q279 PolarHBondContact O-N 2.95Å; L276-Q280 WeakPolarHBondContact O-CB 3.41Å; L276-Q280 WeakPolarHBondContact O-CG 3.48Å; L276-Q280 PolarHBondContact O-N 3.39Å
277	Q	73.5	Confident	70.8	Confident	111 Å²	111	107.2 Å²	107.2	52%	0.519	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-44.8	174.8	-74	175.8	-0.8	0	0	111.4	H273 Q274 Q279 Q280 E281	H273-Q277 WeakPolarHBondContact O-CB 3.45Å; H273-Q277 VanDerWaalsContact O-CG 3.26Å; H273-Q277 WeakPolarHBondContact O-CG 3.1Å; H273-Q277 PolarHBondContact O-N 3.49Å; Q274-Q277 PolarHBondContact O-N 3Å; Q277-Q279 VanDerWaalsContact C-N 3.33Å; Q277-Q279 PolarHBondContact O-N 3.36Å; Q277-Q280 PolarHBondContact O-N 3.17Å; Q277-E281 VanDerWaalsContact O-CB 3.3Å; Q277-E281 WeakPolarHBondContact O-CB 3.14Å; Q277-E281 PolarHBondContact O-N 2.84Å
278	T	74.8	Confident	73	Confident	61 Å²	61	111.3 Å²	111.3	37%	0.374	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-35.9	177.4	-51.8	0	0	0	0	111	Q274 T275 Q282	Q274-T278 VanDerWaalsContact O-CB 3.22Å; Q274-T278 WeakPolarHBondContact O-CB 3.46Å; Q274-T278 PolarHBondContact O-N 3.33Å; Q274-T278 PolarHBondContact O-OG1 3.12Å; T275-T278 PolarHBondContact O-N 2.8Å; T278-Q282 HydrophobicContact CG2-CG 4.35Å; T278-Q282 WeakPolarHBondContact O-CB 3.4Å; T278-Q282 WeakPolarHBondContact O-CG 3.48Å; T278-Q282 PolarHBondContact O-N 2.84Å
279	Q	79.1	Confident	75.3	Confident	99 Å²	99	108.6 Å²	108.6	46%	0.463	52%	0.524	S	S	.	.	H	α-helix	trans	-68.9	-41.6	176.1	-81.7	174.9	-5.9	0	0	111.4	T275 L276 Q277 Q282 Q283	T275-Q279 HydrophobicContact CG2-CG 4.24Å; T275-Q279 WeakPolarHBondContact O-CA 3.33Å; T275-Q279 WeakPolarHBondContact O-CB 3.45Å; T275-Q279 WeakPolarHBondContact O-CG 3.43Å; T275-Q279 PolarHBondContact O-N 3.12Å; L276-Q279 PolarHBondContact O-N 2.95Å; Q277-Q279 VanDerWaalsContact C-N 3.33Å; Q277-Q279 PolarHBondContact O-N 3.36Å; Q279-Q282 PolarHBondContact O-N 3.13Å; Q279-Q283 WeakPolarHBondContact O-CB 3.24Å; Q279-Q283 WeakPolarHBondContact O-CG 3.3Å; Q279-Q283 PolarHBondContact O-N 3.04Å
280	Q	82.5	Confident	77.6	Confident	119 Å²	119	108.8 Å²	108.8	56%	0.556	53%	0.525	S	S	*	.	H	α-helix	trans	-63.8	-43.8	173.8	-75.7	177.9	-19.2	0	0	111.3	L276 Q277 Q283 Q284	L276-Q280 WeakPolarHBondContact O-CB 3.41Å; L276-Q280 WeakPolarHBondContact O-CG 3.48Å; L276-Q280 PolarHBondContact O-N 3.39Å; Q277-Q280 PolarHBondContact O-N 3.17Å; Q280-Q283 PolarHBondContact O-N 3.22Å; Q280-Q284 WeakPolarHBondContact O-CG 3.43Å; Q280-Q284 PolarHBondContact O-N 3.1Å
281	E	85.1	Confident	79.7	Confident	121 Å²	121	109.9 Å²	109.9	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-66.2	-39.6	177.5	-159.5	171.6	-164.1	0	0	111.2	Q277 Q284 I285	Q277-E281 VanDerWaalsContact O-CB 3.3Å; Q277-E281 WeakPolarHBondContact O-CB 3.14Å; Q277-E281 PolarHBondContact O-N 2.84Å; E281-Q284 PolarHBondContact O-N 3.35Å; E281-I285 VanDerWaalsContact O-CG1 3.25Å; E281-I285 WeakPolarHBondContact O-CG1 3.33Å; E281-I285 PolarHBondContact O-N 3.43Å
282	Q	85.2	Confident	81.8	Confident	116 Å²	116	110.3 Å²	110.3	54%	0.542	53%	0.532	S	S	.	.	H	α-helix	trans	-65.6	-41.2	172.7	-78.4	176.4	-4.1	0	0	112.5	T278 Q279 I285 Q286	T278-Q282 HydrophobicContact CG2-CG 4.35Å; T278-Q282 WeakPolarHBondContact O-CB 3.4Å; T278-Q282 WeakPolarHBondContact O-CG 3.48Å; T278-Q282 PolarHBondContact O-N 2.84Å; Q279-Q282 PolarHBondContact O-N 3.13Å; Q282-I285 PolarHBondContact O-N 2.84Å; Q282-Q286 VanDerWaalsContact O-CB 3.28Å; Q282-Q286 WeakPolarHBondContact O-CB 3.23Å; Q282-Q286 PolarHBondContact O-N 3.12Å
283	Q	88.6	Confident	83.7	Confident	118 Å²	118	110.1 Å²	110.1	55%	0.551	53%	0.532	S	S	*	.	H	α-helix	trans	-61.3	-45	174.2	-84.8	-179.5	-24.7	0	0	111.2	Q279 Q280 I285 Q286 E287	Q279-Q283 WeakPolarHBondContact O-CB 3.24Å; Q279-Q283 WeakPolarHBondContact O-CG 3.3Å; Q279-Q283 PolarHBondContact O-N 3.04Å; Q280-Q283 PolarHBondContact O-N 3.22Å; Q283-I285 PolarHBondContact O-N 2.78Å; Q283-Q286 PolarHBondContact O-N 2.81Å; Q283-Q286 VanDerWaalsContact O-N 3.16Å; Q283-E287 WeakPolarHBondContact O-CG 3.17Å; Q283-E287 PolarHBondContact O-N 2.84Å
284	Q	89.9	Confident	85.2	Confident	126 Å²	126	109.5 Å²	109.5	59%	0.589	53%	0.529	S	S	*	.	H	α-helix	trans	-62.1	-42.6	176.3	-74.8	180	-11.6	0	0	112.6	Q280 E281 Q286 M288	Q280-Q284 WeakPolarHBondContact O-CG 3.43Å; Q280-Q284 PolarHBondContact O-N 3.1Å; E281-Q284 PolarHBondContact O-N 3.35Å; Q284-Q286 VanDerWaalsContact C-N 3.3Å; Q284-Q286 PolarHBondContact O-N 3Å; Q284-M288 WeakPolarHBondContact O-CB 3.37Å; Q284-M288 PolarHBondContact O-N 3.19Å
285	I	88.5	Confident	86.7	Confident	97 Å²	97	108.8 Å²	108.8	50%	0.497	53%	0.526	S	S	.	.	H	α-helix	trans	-63.4	-39.4	175.2	-68.9	165.6	0	0	0	110.4	E281 Q282 Q283 M288 L289	E281-I285 VanDerWaalsContact O-CG1 3.25Å; E281-I285 WeakPolarHBondContact O-CG1 3.33Å; E281-I285 PolarHBondContact O-N 3.43Å; Q282-I285 PolarHBondContact O-N 2.84Å; Q283-I285 PolarHBondContact O-N 2.78Å; I285-M288 PolarHBondContact O-N 2.75Å; I285-L289 WeakPolarHBondContact O-CB 3.5Å; I285-L289 PolarHBondContact O-N 3.43Å
286	Q	88.8	Confident	87.7	Confident	140 Å²	140	111.3 Å²	111.3	65%	0.654	53%	0.533	S	S	*	.	H	α-helix	trans	-69.5	-41.5	-179.6	-161.9	169.3	20	0	0	112.2	Q282 Q283 Q284 L289 Q290	Q282-Q286 VanDerWaalsContact O-CB 3.28Å; Q282-Q286 WeakPolarHBondContact O-CB 3.23Å; Q282-Q286 PolarHBondContact O-N 3.12Å; Q283-Q286 PolarHBondContact O-N 2.81Å; Q283-Q286 VanDerWaalsContact O-N 3.16Å; Q284-Q286 VanDerWaalsContact C-N 3.3Å; Q284-Q286 PolarHBondContact O-N 3Å; Q286-L289 PolarHBondContact O-N 2.94Å; Q286-Q290 WeakPolarHBondContact O-CB 3.42Å; Q286-Q290 PolarHBondContact O-N 2.85Å
287	E	92	Very high	88.7	Confident	114 Å²	114	113.1 Å²	113.1	53%	0.533	54%	0.539	S	S	.	.	H	α-helix	trans	-62.2	-43.7	172.8	-74.6	176	178	0	0	111.5	Q283 L289 Q290 Q291	Q283-E287 WeakPolarHBondContact O-CG 3.17Å; Q283-E287 PolarHBondContact O-N 2.84Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 3.4Å; E287-Q290 PolarHBondContact O-N 3.19Å; E287-Q291 WeakPolarHBondContact O-CG 3.42Å; E287-Q291 PolarHBondContact O-N 3.44Å
288	M	92.3	Very high	89.7	Confident	128 Å²	128	112.1 Å²	112.1	63%	0.631	53%	0.534	S	S	*	.	H	α-helix	trans	-61.4	-42.7	175.8	-172.5	-168.2	-52.7	0	0	111.8	Q284 I285 Q290 Q291 Q292	Q284-M288 WeakPolarHBondContact O-CB 3.37Å; Q284-M288 PolarHBondContact O-N 3.19Å; I285-M288 PolarHBondContact O-N 2.75Å; M288-Q290 VanDerWaalsContact C-N 3.33Å; M288-Q290 PolarHBondContact O-N 3.4Å; M288-Q291 PolarHBondContact O-N 3.31Å; M288-Q292 PolarHBondContact O-N 2.87Å
289	L	94.7	Very high	90.5	Very high	91 Å²	91	114.5 Å²	114.5	48%	0.476	54%	0.541	S	S	.	.	H	α-helix	trans	-65.4	-38	177.7	-142.7	79	0	0	0	111.6	I285 Q286 E287 Q292 Q293	I285-L289 WeakPolarHBondContact O-CB 3.5Å; I285-L289 PolarHBondContact O-N 3.43Å; Q286-L289 PolarHBondContact O-N 2.94Å; E287-L289 VanDerWaalsContact C-N 3.35Å; E287-L289 PolarHBondContact O-N 3.4Å; L289-Q292 PolarHBondContact O-N 2.84Å; L289-Q293 PolarHBondContact O-N 3.15Å
290	Q	93	Very high	91.3	Very high	135 Å²	135	114.8 Å²	114.8	63%	0.631	54%	0.542	S	S	*	.	H	α-helix	trans	-66.6	-41.6	177.1	-168.1	171	48	0	0	111.8	Q286 E287 M288 Q292 Q293 Q294	Q286-Q290 WeakPolarHBondContact O-CB 3.42Å; Q286-Q290 PolarHBondContact O-N 2.85Å; E287-Q290 PolarHBondContact O-N 3.19Å; M288-Q290 VanDerWaalsContact C-N 3.33Å; M288-Q290 PolarHBondContact O-N 3.4Å; Q290-Q292 VanDerWaalsContact C-N 3.31Å; Q290-Q292 PolarHBondContact O-N 3.23Å; Q290-Q293 PolarHBondContact O-N 2.72Å; Q290-Q294 PolarHBondContact O-N 3.33Å
291	Q	93	Very high	91.8	Very high	119 Å²	119	114.7 Å²	114.7	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-61.6	-40.3	173.4	-71.7	175.9	14.4	0	0	111.9	E287 M288 Q294 Q295	E287-Q291 WeakPolarHBondContact O-CG 3.42Å; E287-Q291 PolarHBondContact O-N 3.44Å; M288-Q291 PolarHBondContact O-N 3.31Å; Q291-Q294 PolarHBondContact O-N 2.9Å; Q291-Q295 WeakPolarHBondContact O-CG 3.48Å; Q291-Q295 PolarHBondContact O-N 2.92Å
292	Q	93.3	Very high	92.2	Very high	107 Å²	107	114.8 Å²	114.8	50%	0.5	54%	0.542	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.5	-171	-179.9	48.4	0	0	112	M288 L289 Q290 Q295 Q296	M288-Q292 PolarHBondContact O-N 2.87Å; L289-Q292 PolarHBondContact O-N 2.84Å; Q290-Q292 VanDerWaalsContact C-N 3.31Å; Q290-Q292 PolarHBondContact O-N 3.23Å; Q292-Q295 PolarHBondContact O-N 2.99Å; Q292-Q296 WeakPolarHBondContact O-CG 3.37Å; Q292-Q296 PolarHBondContact O-N 3.37Å; Q292-Q296 VanDerWaalsContact O-N 3.07Å
293	Q	93.3	Very high	92.5	Very high	109 Å²	109	114.9 Å²	114.9	51%	0.509	54%	0.543	S	S	.	.	H	α-helix	trans	-63.5	-40.8	175.1	-74.4	-178.8	7.7	0	0	112.1	L289 Q290 Q296 Q297	L289-Q293 PolarHBondContact O-N 3.15Å; Q290-Q293 PolarHBondContact O-N 2.72Å; Q293-Q296 PolarHBondContact O-N 3.14Å; Q293-Q297 WeakPolarHBondContact O-CG 3.22Å; Q293-Q297 PolarHBondContact O-N 2.98Å
294	Q	93.8	Very high	92.7	Very high	109 Å²	109	113.8 Å²	113.8	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-43.3	177.3	-169.2	171.3	3.7	0	0	111.5	Q290 Q291 Q296 Q297 E298	Q290-Q294 PolarHBondContact O-N 3.33Å; Q291-Q294 PolarHBondContact O-N 2.9Å; Q294-Q296 VanDerWaalsContact C-N 3.32Å; Q294-Q296 PolarHBondContact O-N 3.49Å; Q294-Q297 PolarHBondContact O-N 3.44Å; Q294-E298 WeakPolarHBondContact O-CG 3.18Å; Q294-E298 PolarHBondContact O-N 2.98Å
295	Q	93.9	Very high	92.9	Very high	114 Å²	114	113.2 Å²	113.2	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-61	-38.9	174.2	-74	179.5	7.3	0	0	112.6	Q291 Q292 E298 Q299	Q291-Q295 WeakPolarHBondContact O-CG 3.48Å; Q291-Q295 PolarHBondContact O-N 2.92Å; Q292-Q295 PolarHBondContact O-N 2.99Å; Q295-E298 PolarHBondContact O-N 3.43Å; Q295-Q299 WeakPolarHBondContact O-CB 3.36Å; Q295-Q299 WeakPolarHBondContact O-CG 3.45Å; Q295-Q299 PolarHBondContact O-N 2.8Å
296	Q	93.2	Very high	93	Very high	116 Å²	116	114.7 Å²	114.7	54%	0.542	54%	0.54	S	S	.	.	H	α-helix	trans	-65.7	-39.1	175.7	-72.1	-179.8	11.7	0	0	112.1	Q292 Q293 Q294 Q299 H300	Q292-Q296 WeakPolarHBondContact O-CG 3.37Å; Q292-Q296 PolarHBondContact O-N 3.37Å; Q292-Q296 VanDerWaalsContact O-N 3.07Å; Q293-Q296 PolarHBondContact O-N 3.14Å; Q294-Q296 VanDerWaalsContact C-N 3.32Å; Q294-Q296 PolarHBondContact O-N 3.49Å; Q296-Q299 PolarHBondContact O-N 3.12Å; Q296-H300 WeakPolarHBondContact O-CB 3.29Å; Q296-H300 PolarHBondContact O-N 3.42Å
297	Q	93.4	Very high	93.2	Very high	125 Å²	125	114.4 Å²	114.4	58%	0.584	54%	0.538	S	S	*	.	H	α-helix	trans	-65.5	-42.5	175.6	-71.1	178.9	6.1	0	0	111.8	Q293 Q294 H300 Q301	Q293-Q297 WeakPolarHBondContact O-CG 3.22Å; Q293-Q297 PolarHBondContact O-N 2.98Å; Q294-Q297 PolarHBondContact O-N 3.44Å; Q297-H300 PolarHBondContact O-N 3.28Å; Q297-Q301 PolarHBondContact O-N 3.2Å
298	E	94.3	Very high	93.2	Very high	90 Å²	90	115.3 Å²	115.3	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.5	-72.6	174.3	-177.9	0	0	111.6	Q294 Q295 H300 Q301 Q302	Q294-E298 WeakPolarHBondContact O-CG 3.18Å; Q294-E298 PolarHBondContact O-N 2.98Å; Q295-E298 PolarHBondContact O-N 3.43Å; E298-H300 VanDerWaalsContact C-N 3.34Å; E298-H300 PolarHBondContact O-N 3.23Å; E298-Q301 PolarHBondContact O-N 2.78Å; E298-Q302 VanDerWaalsContact O-CG 3.32Å; E298-Q302 WeakPolarHBondContact O-CG 3.46Å; E298-Q302 PolarHBondContact O-N 2.83Å
299	Q	93.3	Very high	93.2	Very high	112 Å²	112	115 Å²	115	52%	0.523	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-41.1	174.2	-75.1	-178.1	4.3	0	0	112	Q295 Q296 Q302 Q303	Q295-Q299 WeakPolarHBondContact O-CB 3.36Å; Q295-Q299 WeakPolarHBondContact O-CG 3.45Å; Q295-Q299 PolarHBondContact O-N 2.8Å; Q296-Q299 PolarHBondContact O-N 3.12Å; Q299-Q302 PolarHBondContact O-N 3.22Å; Q299-Q303 WeakPolarHBondContact O-CG 3.46Å; Q299-Q303 PolarHBondContact O-N 3.35Å
300	H	94.3	Very high	92.9	Very high	105 Å²	105	114.7 Å²	114.7	49%	0.486	54%	0.541	S	S	.	.	H	α-helix	trans	-66.1	-41	177.7	-165.8	67.2	0	0	0	111.7	Q296 Q297 E298 Q303 Q304	Q296-H300 WeakPolarHBondContact O-CB 3.29Å; Q296-H300 PolarHBondContact O-N 3.42Å; Q297-H300 PolarHBondContact O-N 3.28Å; E298-H300 VanDerWaalsContact C-N 3.34Å; E298-H300 PolarHBondContact O-N 3.23Å; H300-Q303 PolarHBondContact O-N 2.98Å; H300-Q304 PolarHBondContact CD2-NE2 3.3Å; H300-Q304 PolarHBondContact NE2-NE2 2.78Å; H300-Q304 WeakPolarHBondContact O-CG 3.25Å; H300-Q304 PolarHBondContact O-N 3.41Å
301	Q	93.5	Very high	92.8	Very high	117 Å²	117	112.9 Å²	112.9	55%	0.547	53%	0.532	S	S	.	.	H	α-helix	trans	-62.8	-42.3	173.2	-79.9	-175.1	0.7	0	0	112.2	Q297 E298 Q303 Q304 Q305	Q297-Q301 PolarHBondContact O-N 3.2Å; E298-Q301 PolarHBondContact O-N 2.78Å; Q301-Q303 VanDerWaalsContact C-N 3.33Å; Q301-Q303 PolarHBondContact O-N 2.89Å; Q301-Q304 PolarHBondContact O-N 2.8Å; Q301-Q305 WeakPolarHBondContact O-CG 3.37Å; Q301-Q305 PolarHBondContact O-N 3.16Å
302	Q	93.5	Very high	92.6	Very high	122 Å²	122	111.8 Å²	111.8	57%	0.57	53%	0.527	S	S	*	.	H	α-helix	trans	-62.5	-40.2	175.8	-73.5	176.4	26.5	0	0	112	E298 Q299 Q305 Q306	E298-Q302 VanDerWaalsContact O-CG 3.32Å; E298-Q302 WeakPolarHBondContact O-CG 3.46Å; E298-Q302 PolarHBondContact O-N 2.83Å; Q299-Q302 PolarHBondContact O-N 3.22Å; Q302-Q305 PolarHBondContact O-N 3.31Å; Q302-Q306 PolarHBondContact O-N 2.97Å
303	Q	92.4	Very high	92.3	Very high	118 Å²	118	112.5 Å²	112.5	55%	0.551	53%	0.53	S	S	*	.	H	α-helix	trans	-63.9	-41.9	174.4	-74.4	178.1	17.1	0	0	112	Q299 H300 Q301 Q306 H307	Q299-Q303 WeakPolarHBondContact O-CG 3.46Å; Q299-Q303 PolarHBondContact O-N 3.35Å; H300-Q303 PolarHBondContact O-N 2.98Å; Q301-Q303 VanDerWaalsContact C-N 3.33Å; Q301-Q303 PolarHBondContact O-N 2.89Å; Q303-Q306 PolarHBondContact O-N 2.85Å; Q303-H307 WeakPolarHBondContact O-CB 3.42Å; Q303-H307 PolarHBondContact O-N 3.46Å
304	Q	92.9	Very high	92.1	Very high	95 Å²	95	112.2 Å²	112.2	44%	0.444	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-43	176.1	-72	-178.1	7.6	0	0	111.9	H300 Q301 H307 Q308	H300-Q304 PolarHBondContact CD2-NE2 3.3Å; H300-Q304 PolarHBondContact NE2-NE2 2.78Å; H300-Q304 WeakPolarHBondContact O-CG 3.25Å; H300-Q304 PolarHBondContact O-N 3.41Å; Q301-Q304 PolarHBondContact O-N 2.8Å; Q304-H307 PolarHBondContact O-N 3.45Å; Q304-Q308 WeakPolarHBondContact O-CG 3.5Å; Q304-Q308 PolarHBondContact O-N 3.34Å
305	Q	92.9	Very high	91.7	Very high	115 Å²	115	110.9 Å²	110.9	54%	0.537	52%	0.522	S	S	.	.	H	α-helix	trans	-63.7	-41.9	175.8	-71.7	178.3	16	0	0	111.9	Q301 Q302 H307 Q308 L309	Q301-Q305 WeakPolarHBondContact O-CG 3.37Å; Q301-Q305 PolarHBondContact O-N 3.16Å; Q302-Q305 PolarHBondContact O-N 3.31Å; Q305-H307 VanDerWaalsContact C-N 3.35Å; Q305-H307 PolarHBondContact O-N 3.06Å; Q305-Q308 PolarHBondContact O-N 3.47Å; Q305-L309 WeakPolarHBondContact O-CG 3.27Å; Q305-L309 PolarHBondContact O-N 2.71Å
306	Q	92.2	Very high	91.2	Very high	127 Å²	127	110.6 Å²	110.6	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-60.5	-43.8	172.3	-89.4	-170.8	5.6	0	0	112	Q302 Q303 Q308 L309 I310	Q302-Q306 PolarHBondContact O-N 2.97Å; Q303-Q306 PolarHBondContact O-N 2.85Å; Q306-Q308 VanDerWaalsContact C-N 3.33Å; Q306-Q308 PolarHBondContact O-N 3.34Å; Q306-L309 PolarHBondContact O-N 3.44Å; Q306-I310 VanDerWaalsContact O-CG1 3.29Å; Q306-I310 WeakPolarHBondContact O-CG1 3.47Å; Q306-I310 PolarHBondContact O-N 3.12Å
307	H	91.5	Very high	90.6	Very high	134 Å²	134	110.7 Å²	110.7	62%	0.62	52%	0.522	S	S	*	.	H	α-helix	trans	-63.2	-40.9	179.7	-160.9	76.8	0	0	0	111.8	Q303 Q304 Q305 I310 H311	Q303-H307 WeakPolarHBondContact O-CB 3.42Å; Q303-H307 PolarHBondContact O-N 3.46Å; Q304-H307 PolarHBondContact O-N 3.45Å; Q305-H307 VanDerWaalsContact C-N 3.35Å; Q305-H307 PolarHBondContact O-N 3.06Å; H307-I310 PolarHBondContact O-N 3.31Å; H307-H311 WeakPolarHBondContact O-CB 3.41Å; H307-H311 PolarHBondContact O-N 3.25Å
308	Q	91.9	Very high	90	Very high	133 Å²	133	111 Å²	111	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-64	-41.4	174.5	-71.4	176.5	10.4	0	0	112.3	Q304 Q305 Q306 H311 H312	Q304-Q308 WeakPolarHBondContact O-CG 3.5Å; Q304-Q308 PolarHBondContact O-N 3.34Å; Q305-Q308 PolarHBondContact O-N 3.47Å; Q306-Q308 VanDerWaalsContact C-N 3.33Å; Q306-Q308 PolarHBondContact O-N 3.34Å; Q308-H311 PolarHBondContact O-N 3.27Å; Q308-H312 WeakPolarHBondContact O-CB 3.49Å; Q308-H312 PolarHBondContact O-N 3.04Å
309	L	92.9	Very high	89.1	Confident	122 Å²	122	112.9 Å²	112.9	64%	0.639	53%	0.532	S	S	*	.	H	α-helix	trans	-63.9	-42	175.9	-77.4	165.8	0	0	0	112.3	Q305 Q306 H312 Q313	Q305-L309 WeakPolarHBondContact O-CG 3.27Å; Q305-L309 PolarHBondContact O-N 2.71Å; Q306-L309 PolarHBondContact O-N 3.44Å; L309-H312 PolarHBondContact O-N 3.06Å; L309-Q313 WeakPolarHBondContact O-CB 3.16Å; L309-Q313 PolarHBondContact O-N 3.3Å
310	I	89.6	Confident	88.2	Confident	85 Å²	85	113.3 Å²	113.3	44%	0.436	54%	0.537	S	S	.	.	H	α-helix	trans	-63.9	-45.6	176.5	-67.3	164.7	0	0	0	110.3	Q306 H307 H312 Q313 Q314	Q306-I310 VanDerWaalsContact O-CG1 3.29Å; Q306-I310 WeakPolarHBondContact O-CG1 3.47Å; Q306-I310 PolarHBondContact O-N 3.12Å; H307-I310 PolarHBondContact O-N 3.31Å; I310-H312 PolarHBondContact O-N 2.99Å; I310-Q313 PolarHBondContact O-N 3.35Å; I310-Q314 WeakPolarHBondContact O-CG 3.39Å; I310-Q314 PolarHBondContact O-N 2.82Å
311	H	89	Confident	87	Confident	96 Å²	96	112.7 Å²	112.7	44%	0.444	54%	0.541	S	S	.	.	H	α-helix	trans	-61	-45.2	177.8	-167.2	-85.1	0	0	0	111.5	H307 Q308 Q313 Q314 E315	H307-H311 WeakPolarHBondContact O-CB 3.41Å; H307-H311 PolarHBondContact O-N 3.25Å; Q308-H311 PolarHBondContact O-N 3.27Å; H311-Q313 VanDerWaalsContact C-N 3.35Å; H311-Q313 PolarHBondContact O-N 3.49Å; H311-Q314 PolarHBondContact O-N 2.92Å; H311-E315 IonicContact CE1-OE1 3.1Å; H311-E315 PolarHBondContact CE1-OE1 2.73Å; H311-E315 IonicContact ND1-OE1 3.7Å; H311-E315 PolarHBondContact ND1-OE1 3.01Å; H311-E315 PolarHBondContact O-N 3.34Å
312	H	89.3	Confident	85.8	Confident	97 Å²	97	112.2 Å²	112.2	45%	0.449	55%	0.545	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177.4	-170.6	64.5	0	0	0	112.5	Q308 L309 I310 Q314 E315 Q316	Q308-H312 WeakPolarHBondContact O-CB 3.49Å; Q308-H312 PolarHBondContact O-N 3.04Å; L309-H312 PolarHBondContact O-N 3.06Å; I310-H312 PolarHBondContact O-N 2.99Å; H312-Q314 VanDerWaalsContact C-N 3.35Å; H312-E315 IonicContact ND1-OE2 3.51Å; H312-E315 PolarHBondContact O-N 2.92Å; H312-Q316 PolarHBondContact CD2-NE2 3.22Å; H312-Q316 VanDerWaalsContact CD2-NE2 3.35Å; H312-Q316 PolarHBondContact NE2-NE2 2.9Å; H312-Q316 WeakPolarHBondContact O-CG 3.37Å; H312-Q316 PolarHBondContact O-N 2.94Å
313	Q	88	Confident	84.2	Confident	122 Å²	122	113.1 Å²	113.1	57%	0.57	55%	0.554	S	S	*	*	H	α-helix	trans	-66.4	-36.7	176.2	-171.2	174.4	77.9	0	0	112	L309 I310 H311 Q316 Q317	L309-Q313 WeakPolarHBondContact O-CB 3.16Å; L309-Q313 PolarHBondContact O-N 3.3Å; I310-Q313 PolarHBondContact O-N 3.35Å; H311-Q313 VanDerWaalsContact C-N 3.35Å; H311-Q313 PolarHBondContact O-N 3.49Å; Q313-Q316 PolarHBondContact O-N 3.47Å; Q313-Q317 WeakPolarHBondContact O-CG 3.44Å; Q313-Q317 PolarHBondContact O-N 3.09Å
314	Q	88	Confident	82.5	Confident	103 Å²	103	115.3 Å²	115.3	48%	0.481	56%	0.564	S	S	.	*	H	α-helix	trans	-65.8	-42	173.9	-74.7	-178.9	-7	0	0	112.1	I310 H311 H312 Q316 Q317 Q318	I310-Q314 WeakPolarHBondContact O-CG 3.39Å; I310-Q314 PolarHBondContact O-N 2.82Å; H311-Q314 PolarHBondContact O-N 2.92Å; H312-Q314 VanDerWaalsContact C-N 3.35Å; Q314-Q316 VanDerWaalsContact C-N 3.34Å; Q314-Q316 PolarHBondContact O-N 3.34Å; Q314-Q317 PolarHBondContact O-N 3.34Å; Q314-Q318 WeakPolarHBondContact O-CG 3.41Å; Q314-Q318 PolarHBondContact O-N 3.02Å
315	E	84.9	Confident	80.2	Confident	80 Å²	80	115.9 Å²	115.9	37%	0.374	57%	0.574	S	S	.	*	H	α-helix	trans	-60.3	-43.7	174.1	-73.9	176.3	163.7	0	0	111.6	H311 H312 Q317 Q318 Q319	H311-E315 IonicContact CE1-OE1 3.1Å; H311-E315 PolarHBondContact CE1-OE1 2.73Å; H311-E315 IonicContact ND1-OE1 3.7Å; H311-E315 PolarHBondContact ND1-OE1 3.01Å; H311-E315 PolarHBondContact O-N 3.34Å; H312-E315 IonicContact ND1-OE2 3.51Å; H312-E315 PolarHBondContact O-N 2.92Å; E315-Q317 PolarHBondContact O-N 3.21Å; E315-Q318 PolarHBondContact O-N 2.93Å; E315-Q319 WeakPolarHBondContact O-CG 3.32Å; E315-Q319 PolarHBondContact O-N 3.01Å
316	Q	84.9	Confident	77.9	Confident	108 Å²	108	118 Å²	118	51%	0.505	58%	0.584	S	S	.	*	H	α-helix	trans	-62.7	-41.4	175.5	-71.2	-170.4	16.2	0	0	112.2	H312 Q313 Q314 Q319 L320	H312-Q316 PolarHBondContact CD2-NE2 3.22Å; H312-Q316 VanDerWaalsContact CD2-NE2 3.35Å; H312-Q316 PolarHBondContact NE2-NE2 2.9Å; H312-Q316 WeakPolarHBondContact O-CG 3.37Å; H312-Q316 PolarHBondContact O-N 2.94Å; Q313-Q316 PolarHBondContact O-N 3.47Å; Q314-Q316 VanDerWaalsContact C-N 3.34Å; Q314-Q316 PolarHBondContact O-N 3.34Å; Q316-Q319 PolarHBondContact O-N 3.29Å; Q316-L320 PolarHBondContact O-N 3.4Å
317	Q	80.6	Confident	75.6	Confident	119 Å²	119	116.8 Å²	116.8	56%	0.556	59%	0.587	S	S	*	*	H	α-helix	trans	-64.8	-40	175.6	-75.4	-177.5	16.5	0	0	112.4	Q313 Q314 E315 L320 T321	Q313-Q317 WeakPolarHBondContact O-CG 3.44Å; Q313-Q317 PolarHBondContact O-N 3.09Å; Q314-Q317 PolarHBondContact O-N 3.34Å; E315-Q317 PolarHBondContact O-N 3.21Å; Q317-L320 PolarHBondContact O-N 3.05Å; Q317-T321 WeakPolarHBondContact O-CB 3.45Å; Q317-T321 PolarHBondContact O-N 2.91Å; Q317-T321 PolarHBondContact O-OG1 2.97Å
318	Q	79.3	Confident	73.2	Confident	130 Å²	130	119.5 Å²	119.5	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-62.7	-44	175.3	-73.8	179.3	29	0	0	111.2	Q314 E315 L320 T321 V322	Q314-Q318 WeakPolarHBondContact O-CG 3.41Å; Q314-Q318 PolarHBondContact O-N 3.02Å; E315-Q318 PolarHBondContact O-N 2.93Å; Q318-L320 PolarHBondContact O-N 2.93Å; Q318-T321 PolarHBondContact O-N 3.02Å; Q318-V322 VanDerWaalsContact O-CG2 3.32Å; Q318-V322 WeakPolarHBondContact O-CG2 3.41Å; Q318-V322 PolarHBondContact O-N 2.86Å
319	Q	76.8	Confident	70.5	Confident	131 Å²	131	118.3 Å²	118.3	61%	0.612	61%	0.606	S	S	*	*	H	α-helix	trans	-62.8	-40.8	176.1	-71.1	177.2	27.1	0	0	112.3	E315 Q316 T321 V322 L323	E315-Q319 WeakPolarHBondContact O-CG 3.32Å; E315-Q319 PolarHBondContact O-N 3.01Å; Q316-Q319 PolarHBondContact O-N 3.29Å; Q319-T321 VanDerWaalsContact C-N 3.32Å; Q319-T321 PolarHBondContact O-N 3Å; Q319-V322 PolarHBondContact O-N 3.23Å; Q319-L323 PolarHBondContact O-N 3.49Å
320	L	74.9	Confident	67.8	Low	120 Å²	120	121.5 Å²	121.5	63%	0.628	62%	0.618	S	S	*	*	H	α-helix	trans	-65.3	-36.4	176.4	-141.3	88	0	0	0	112.1	Q316 Q317 Q318 L323	Q316-L320 PolarHBondContact O-N 3.4Å; Q317-L320 PolarHBondContact O-N 3.05Å; Q318-L320 PolarHBondContact O-N 2.93Å; L320-L323 PolarHBondContact O-N 3.02Å
321	T	68.2	Low	64.9	Low	92 Å²	92	126.9 Å²	126.9	56%	0.564	64%	0.641	S	S	*	*	H	α-helix	trans	-69.8	-40.6	179.6	-52.7	0	0	0	0	111.5	Q317 Q318 Q319 L323 Q324	Q317-T321 WeakPolarHBondContact O-CB 3.45Å; Q317-T321 PolarHBondContact O-N 2.91Å; Q317-T321 PolarHBondContact O-OG1 2.97Å; Q318-T321 PolarHBondContact O-N 3.02Å; Q319-T321 VanDerWaalsContact C-N 3.32Å; Q319-T321 PolarHBondContact O-N 3Å; T321-L323 VanDerWaalsContact C-N 3.26Å; T321-L323 PolarHBondContact O-N 3.08Å; T321-Q324 PolarHBondContact O-N 2.92Å
322	V	67.4	Low	62.4	Low	107 Å²	107	128.8 Å²	128.8	65%	0.648	66%	0.659	S	S	*	*	H	α-helix	trans	-64.7	-30.8	177.5	173.5	0	0	0	0	111.8	Q318 Q319 Q324 T325	Q318-V322 VanDerWaalsContact O-CG2 3.32Å; Q318-V322 WeakPolarHBondContact O-CG2 3.41Å; Q318-V322 PolarHBondContact O-N 2.86Å; Q319-V322 PolarHBondContact O-N 3.23Å; V322-Q324 VanDerWaalsContact C-N 3.3Å; V322-Q324 PolarHBondContact O-N 2.96Å; V322-T325 PolarHBondContact O-OG1 2.75Å
323	L	60.1	Low	59.5	Low	142 Å²	142	130.9 Å²	130.9	74%	0.743	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-17.2	177.4	-83.5	158	0	0	0	114.2	Q319 L320 T321	Q319-L323 PolarHBondContact O-N 3.49Å; L320-L323 PolarHBondContact O-N 3.02Å; T321-L323 VanDerWaalsContact C-N 3.26Å; T321-L323 PolarHBondContact O-N 3.08Å
324	Q	56.6	Low	56.9	Low	164 Å²	164	132.2 Å²	132.2	77%	0.766	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-4.4	-179.7	-74.7	-171	-9.1	0	0	114.8	T321 V322 Q326	T321-Q324 PolarHBondContact O-N 2.92Å; V322-Q324 VanDerWaalsContact C-N 3.3Å; V322-Q324 PolarHBondContact O-N 2.96Å; Q324-Q326 PolarHBondContact O-N 3.39Å
325	T	45.8	Very low	54.3	Low	107 Å²	107	133.1 Å²	133.1	66%	0.656	70%	0.698	S	S	*	*			trans	-89.6	83.6	175.9	56.4	0	0	0	0	111.2	V322	V322-T325 PolarHBondContact O-OG1 2.75Å
326	Q	44.9	Very low	51.5	Low	158 Å²	158	138.2 Å²	138.2	74%	0.738	72%	0.724	S	S	*	*			trans	-101.7	128.3	160.7	-78.4	-74.6	-15.5	0	0	109.4	Q324 H328	Q324-Q326 PolarHBondContact O-N 3.39Å; Q326-H328 PolarHBondContact O-N 3.15Å
327	P	42.9	Very low	48.9	Very low	103 Å²	103	136.2 Å²	136.2	67%	0.669	73%	0.733	S	S	*	*			trans	-85.2	100.5	-177.7	32.6	-29.5	0	0	0	109.8	S329	P327-S329 PolarHBondContact O-N 3.29Å
328	H	42.2	Very low	46.8	Very low	191 Å²	191	137.4 Å²	137.4	88%	0.884	75%	0.749	S	S	*	*			trans	-91.3	83.8	162	-79.1	-44.2	0	0	0	109.9	Q326	Q326-H328 PolarHBondContact O-N 3.15Å
329	S	33.4	Very low	44.3	Very low	107 Å²	107	138.6 Å²	138.6	75%	0.748	76%	0.758	S	S	*	*			trans	-97.8	88.8	163.4	45.1	0	0	0	0	109.8	P327	P327-S329 PolarHBondContact O-N 3.29Å
330	Q	37	Very low	42.3	Very low	190 Å²	190	140.6 Å²	140.6	89%	0.888	77%	0.771	S	S	*	*			trans	-134.2	109.4	153.6	-75	-168	5.5	0	0	109.1
331	Q	29.5	Very low	40.1	Very low	197 Å²	197	138.2 Å²	138.2	92%	0.921	77%	0.768	S	S	*	*			trans	-71.5	124.7	167.1	-77.3	173.4	-59.2	0	0	109.7
332	V	35.4	Very low	38.1	Very low	136 Å²	136	140 Å²	140	82%	0.824	78%	0.779	S	S	*	*			trans	-145.2	142.1	145.5	-168.2	0	0	0	0	109.1
333	N	29.6	Very low	36.5	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	79%	0.787	S	S	*	*			trans	-33.6	149.2	-174.5	-81.2	-63.1	0	0	0	121.9
334	L	32.3	Very low	35.1	Very low	150 Å²	150	137.6 Å²	137.6	79%	0.785	79%	0.787	S	S	*	*			trans	-7.7	153.3	147.9	-80	86	0	0	0	118.8
335	P	33.8	Very low	33.8	Very low	121 Å²	121	135 Å²	135	79%	0.786	79%	0.788	S	S	*	*				-147.3	157.9	50.1	38.1	-16.5	0	0	0	120.1
336	M	26.4	Very low	33	Very low	187 Å²	187	135.5 Å²	135.5	92%	0.921	79%	0.79	S	S	*	*			trans	19.3	120.9	142.9	-148.6	81.2	122.8	0	0	121
337	G	30.5	Very low	32.1	Very low	67 Å²	67	135.6 Å²	135.6	69%	0.691	79%	0.791	S	S	*	*			trans	108.1	104	135.9	0	0	0	0	0	118
338	T	36.1	Very low	31.4	Very low	143 Å²	143	138 Å²	138	88%	0.877	80%	0.798	S	S	*	*				163.2	134.4	113.3	-63.7	0	0	0	0	110.6
339	I	26.1	Very low	30.6	Very low	156 Å²	156	133.9 Å²	133.9	80%	0.8	80%	0.797	S	S	*	*			trans	-75.8	132.5	-175.3	-62.7	165.2	0	0	0	110.8
340	I	35.6	Very low	30.4	Very low	172 Å²	172	137.9 Å²	137.9	88%	0.882	81%	0.806	S	S	*	*			trans	-138	135	149.4	-56.6	-177.9	0	0	0	109
341	A	27.3	Very low	30.4	Very low	70 Å²	70	134.4 Å²	134.4	58%	0.579	80%	0.8	S	S	*	*			trans	-83.8	154.9	-164.1	0	0	0	0	0	114.9
342	T	27	Very low	30.3	Very low	130 Å²	130	131.1 Å²	131.1	80%	0.798	80%	0.799	S	S	*	*			trans	30.3	154.8	132.6	64.5	0	0	0	0	120.7
343	P	34.8	Very low	30.2	Very low	125 Å²	125	128 Å²	128	81%	0.812	80%	0.795	S	S	*	*			cis	-148	168.8	27.1	37.5	-15.5	0	0	0	118.6
344	G	29.5	Very low	30.2	Very low	73 Å²	73	127.6 Å²	127.6	75%	0.753	80%	0.797	S	S	*	*			trans	90.1	135.6	153.1	0	0	0	0	0	115.5
345	S	30.4	Very low	30.1	Very low	110 Å²	110	129.5 Å²	129.5	77%	0.769	80%	0.802	S	S	*	*			cis	-165.2	142.6	2.1	-100.4	0	0	0	0	107.7
346	V	27.3	Very low	29.7	Very low	118 Å²	118	129.6 Å²	129.6	72%	0.715	80%	0.8	S	S	*	*			trans	9.5	135.3	146.3	-91.1	0	0	0	0	117.5
347	Q	27.4	Very low	29.7	Very low	159 Å²	159	129.3 Å²	129.3	74%	0.743	80%	0.799	S	S	*	*			cis	-177.3	147.7	43.8	-122.4	157.1	13.1	0	0	110.7
348	N	27.1	Very low	29.4	Very low	154 Å²	154	134.8 Å²	134.8	82%	0.824	81%	0.809	S	S	*	*			trans	62.7	91	146.6	-61.8	-7.4	0	0	0	120.8
349	A	25.1	Very low	28.9	Very low	105 Å²	105	134.9 Å²	134.9	87%	0.868	81%	0.809	S	S	*	*			trans	-109.6	126.4	143.1	0	0	0	0	0	108.4
350	M	30.8	Very low	29.1	Very low	190 Å²	190	131.9 Å²	131.9	94%	0.936	81%	0.807	S	S	*	*			trans	-113.7	153.7	161.7	-92.5	-167.2	179	0	0	109.4
351	P	36.8	Very low	28.7	Very low	118 Å²	118	130 Å²	130	77%	0.766	81%	0.806	S	S	*	*			trans	-110.3	154.3	-142.9	36.3	-26.4	0	0	0	114.7
352	S	27.6	Very low	28.7	Very low	128 Å²	128	129.8 Å²	129.8	90%	0.895	81%	0.811	S	S	*	*			trans	-70.2	123.6	161.7	-53.1	0	0	0	0	109.9
353	G	32.6	Very low	28.8	Very low	71 Å²	71	130.5 Å²	130.5	73%	0.732	82%	0.815	S	S	*	*			trans	-164.7	70.9	-180	0	0	0	0	0	110.9	Q355	G353-Q355 PolarHBondContact O-N 2.99Å
354	T	29.6	Very low	28.4	Very low	133 Å²	133	131.4 Å²	131.4	82%	0.816	81%	0.813	S	S	*	*			trans	-57.8	111.4	172.1	-42.6	0	0	0	0	109.9
355	Q	30.9	Very low	28.2	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	82%	0.815	S	S	*	*			trans	-125.5	124.8	151.9	-77.4	-150.3	-5.9	0	0	110.3	G353	G353-Q355 PolarHBondContact O-N 2.99Å
356	V	24.6	Very low	28.1	Very low	123 Å²	123	136.4 Å²	136.4	75%	0.745	82%	0.818	S	S	*	*			trans	-72.9	122.8	174.9	175.3	0	0	0	0	108
357	M	25.6	Very low	28	Very low	182 Å²	182	138.8 Å²	138.8	90%	0.897	82%	0.823	S	S	*	*			trans	-143.3	146.2	152.6	-93.3	-138.7	-86.1	0	0	112.1
358	M	26	Very low	28.2	Very low	182 Å²	182	136.8 Å²	136.8	90%	0.897	82%	0.824	S	S	*	*			trans	-66	150.9	-161.4	-66	-83.8	-130.2	0	0	114.3
359	V	25.5	Very low	28	Very low	144 Å²	144	133.6 Å²	133.6	87%	0.873	82%	0.818	S	S	*	*			trans	-73	128.3	178	178.8	0	0	0	0	111.1
360	A	29.4	Very low	28.2	Very low	93 Å²	93	137.8 Å²	137.8	77%	0.769	82%	0.817	S	S	*	*			trans	-135.8	135.8	151.8	0	0	0	0	0	109.2
361	P	27.9	Very low	27.8	Very low	132 Å²	132	138 Å²	138	86%	0.857	81%	0.813	S	S	*	*			trans	-94.9	136	-168.7	34.2	-30.1	0	0	0	113
362	G	27.1	Very low	27	Very low	66 Å²	66	141.9 Å²	141.9	68%	0.68	82%	0.819	S	S	*	*			trans	163.9	104.9	168.5	0	0	0	0	0	115.2
363	V	28.8	Very low	26.9	Very low	145 Å²	145	144.4 Å²	144.4	88%	0.879	82%	0.816	S	S	*	*			trans	64.5	120	148.1	-113	0	0	0	0	121.9
364	N	26.8	Very low	26.8	Very low	145 Å²	145	146.2 Å²	146.2	78%	0.775	82%	0.815	S	S	*	*			trans	97.8	120.4	134.2	-133.8	-22.9	0	0	0	120.4
365	M	24.9	Very low	26.7	Very low	160 Å²	160	148.1 Å²	148.1	79%	0.788	82%	0.815	S	S	*	*			trans	-9.5	149.7	161.1	-99.4	144.2	175.9	0	0	119.6
366	P	28.7	Very low	26.5	Very low	128 Å²	128	147.4 Å²	147.4	83%	0.831	81%	0.811	S	S	*	*				-145.7	157.2	89.8	32.7	-12.7	0	0	0	117.6
367	M	24.8	Very low	26.4	Very low	168 Å²	168	146.5 Å²	146.5	83%	0.828	82%	0.817	S	S	*	*			trans	-59.6	145.2	173	-73.9	-100	-93.9	0	0	113.7
368	P	31.4	Very low	26.4	Very low	117 Å²	117	142.4 Å²	142.4	76%	0.76	81%	0.812	S	S	*	*			trans	-91.3	127.3	165.8	32.7	-26.8	0	0	0	111.3
369	A	24.2	Very low	26.8	Very low	86 Å²	86	139.4 Å²	139.4	71%	0.711	81%	0.806	S	S	*	*			trans	-105.5	117	165.9	0	0	0	0	0	108.8
370	F	28	Very low	27	Very low	193 Å²	193	142.5 Å²	142.5	85%	0.846	81%	0.808	S	S	*	*			trans	-145	101.3	163.3	-81.2	-78.8	0	0	0	107.5
371	F	22.6	Very low	26.9	Very low	194 Å²	194	142.3 Å²	142.3	85%	0.851	81%	0.807	S	S	*	*				65.7	101.6	92.5	-102.6	-88.5	0	0	0	114.7
372	F	20.4	Very low	26.7	Very low	200 Å²	200	143.7 Å²	143.7	88%	0.877	81%	0.807	S	S	*	*			trans	-76.9	141.5	169.3	-108.7	-104.1	0	0	0	110.9
373	Q	24.5	Very low	26.6	Very low	181 Å²	181	146.2 Å²	146.2	85%	0.846	81%	0.809	S	S	*	*			trans	-152	141.3	145	-146.2	151.8	-17.7	0	0	111.4
374	P	31	Very low	26.3	Very low	109 Å²	109	146 Å²	146	71%	0.708	80%	0.802	S	S	*	*			trans	-101.7	150.6	-164.9	37.6	-30	0	0	0	112.9
375	Q	27.5	Very low	26.2	Very low	173 Å²	173	144.8 Å²	144.8	81%	0.808	80%	0.8	S	S	*	*			trans	-140.9	118.5	160.5	-84.9	-167	9.6	0	0	113.3
376	Q	27.1	Very low	26	Very low	174 Å²	174	144.9 Å²	144.9	81%	0.813	80%	0.8	S	S	*	*			trans	81.7	108.5	133.5	-60	-173.5	25.8	0	0	120.1
377	A	21.8	Very low	25.9	Very low	104 Å²	104	146 Å²	146	86%	0.86	80%	0.799	S	S	*	*			trans	-87.9	140.9	161.5	0	0	0	0	0	111
378	A	25.7	Very low	26.1	Very low	96 Å²	96	142.5 Å²	142.5	79%	0.793	79%	0.789	S	S	*	*			trans	-169.6	154.3	148.4	0	0	0	0	0	109.4
379	P	35.2	Very low	26.2	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	79%	0.792	S	S	*	*				-113.9	149.7	-129.7	37.9	-30.1	0	0	0	114.3
380	F	30.2	Very low	26.3	Very low	210 Å²	210	147 Å²	147	92%	0.921	79%	0.793	S	S	*	*			trans	-110.8	119.6	155.5	-79.5	-79.5	0	0	0	109.4
381	A	26.2	Very low	26	Very low	89 Å²	89	142.1 Å²	142.1	74%	0.736	79%	0.788	S	S	*	*			trans	-66.7	125.6	-175.3	0	0	0	0	0	111.8	T383	A381-T383 PolarHBondContact O-N 3.07Å
382	N	24.8	Very low	26.3	Very low	160 Å²	160	139.4 Å²	139.4	86%	0.856	79%	0.787	S	S	*	*			trans	-76.8	101.4	161.5	-79.6	-33.4	0	0	0	108.7	I384	N382-I384 PolarHBondContact O-N 2.78Å
383	T	23.2	Very low	26.4	Very low	119 Å²	119	136.5 Å²	136.5	73%	0.73	78%	0.78	S	S	*	*			trans	-92.2	94.3	166.1	-25.8	0	0	0	0	108.2	A381 T385	A381-T383 PolarHBondContact O-N 3.07Å; T383-T385 PolarHBondContact O-N 3.32Å
384	I	23.5	Very low	26.5	Very low	141 Å²	141	134 Å²	134	72%	0.723	78%	0.78	S	S	*	*			trans	-74	98.3	164.4	-62.9	177.8	0	0	0	106.5	N382 M386	N382-I384 PolarHBondContact O-N 2.78Å; I384-M386 HydrophobicContact CG2-CG 4.24Å; I384-M386 PolarHBondContact O-N 2.75Å
385	T	24.1	Very low	26	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	78%	0.779	S	S	*	*			trans	-90.8	94	168.9	-40	0	0	0	0	108.2	T383	T383-T385 PolarHBondContact O-N 3.32Å
386	M	21.1	Very low	25.9	Very low	161 Å²	161	131.3 Å²	131.3	79%	0.793	78%	0.778	S	S	*	*			trans	-70.5	127.3	157	-74.4	-78.5	-176.8	0	0	107.8	I384	I384-M386 HydrophobicContact CG2-CG 4.24Å; I384-M386 PolarHBondContact O-N 2.75Å
387	N	25.6	Very low	25.9	Very low	151 Å²	151	129 Å²	129	81%	0.807	78%	0.776	S	S	*	*			trans	-150.7	138.9	151.9	-125.3	10.8	0	0	0	112.5
388	P	30.6	Very low	25.9	Very low	96 Å²	96	132.1 Å²	132.1	62%	0.623	78%	0.778	S	S	*	*			trans	-102.7	142.9	-163.4	37.6	-29.1	0	0	0	112.4
389	H	32.3	Very low	26.1	Very low	179 Å²	179	132.4 Å²	132.4	83%	0.829	77%	0.774	S	S	*	*			trans	-134.9	92.3	156.6	-80.5	-72.4	0	0	0	110.2
390	T	26.8	Very low	25.7	Very low	118 Å²	118	133.9 Å²	133.9	72%	0.724	78%	0.775	S	S	*	*			trans	34.5	111.1	133.2	45	0	0	0	0	118.7
391	A	22.3	Very low	25.4	Very low	90 Å²	90	133.1 Å²	133.1	74%	0.744	77%	0.772	S	S	*	*			trans	-49.1	131.5	152.8	0	0	0	0	0	112.3
392	V	28.5	Very low	25.4	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	78%	0.779	S	S	*	*			trans	-113.9	96.6	156.5	179.3	0	0	0	0	106.7
393	L	21.5	Very low	25.4	Very low	139 Å²	139	137.3 Å²	137.3	73%	0.728	77%	0.771	S	S	*	*			trans	-82.4	128	162.9	-79	156.5	0	0	0	107.9	T395	L393-T395 PolarHBondContact O-N 2.97Å
394	P	26.8	Very low	25.4	Very low	129 Å²	129	139 Å²	139	84%	0.838	78%	0.776	S	S	*	*			trans	-82.9	101.3	156.4	27.2	-20.5	0	0	0	108.3
395	T	21.6	Very low	25.4	Very low	113 Å²	113	138.1 Å²	138.1	69%	0.693	78%	0.781	S	S	*	*			trans	-91.2	145.8	161.6	45.7	0	0	0	0	110.5	L393	L393-T395 PolarHBondContact O-N 2.97Å
396	S	23.8	Very low	25.3	Very low	112 Å²	112	137 Å²	137	78%	0.783	78%	0.784	S	S	*	*			trans	82.4	138.4	161.1	93.7	0	0	0	0	114.9
397	T	28.7	Very low	25.7	Very low	126 Å²	126	135.4 Å²	135.4	77%	0.773	78%	0.784	S	S	*	*			cis	-154.2	151.6	16.8	37.9	0	0	0	0	110.9
398	N	22.2	Very low	25.6	Very low	170 Å²	170	134.4 Å²	134.4	91%	0.909	78%	0.783	S	S	*	*			trans	-64	131.6	157.7	-85.2	-53.4	0	0	0	111.9
399	S	29.7	Very low	25.4	Very low	102 Å²	102	135 Å²	135	71%	0.713	79%	0.789	S	S	*	*			trans	-168.1	105.7	143	64	0	0	0	0	108.7
400	L	25.4	Very low	24.9	Very low	150 Å²	150	130.8 Å²	130.8	79%	0.785	79%	0.786	S	S	*	*				65.3	113.9	96	-75.2	-177.7	0	0	0	115.9
401	F	23.9	Very low	25	Very low	194 Å²	194	131.4 Å²	131.4	85%	0.851	79%	0.79	S	S	*	*			trans	64.8	132.5	161.2	-71.2	-91.2	0	0	0	116.3
402	R	26	Very low	25	Very low	238 Å²	238	136.5 Å²	136.5	90%	0.898	80%	0.795	S	S	*	*				-166.9	160.5	52	-138	-179.4	-164.9	-162.1	5.5	110.3
403	S	26.3	Very low	25	Very low	98 Å²	98	138 Å²	138	69%	0.685	80%	0.797	S	S	*	*			trans	-69.4	156.1	-178.2	-50.8	0	0	0	0	115.8
404	N	22.9	Very low	25.2	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	80%	0.8	S	S	*	*			trans	86.7	146.4	135.8	-76.8	1.3	0	0	0	122.2
405	C	24.2	Very low	25.4	Very low	122 Å²	122	136.3 Å²	136.3	82%	0.824	79%	0.794	S	S	*	*			trans	80.6	112.2	157	74	0	0	0	0	119.6
406	A	22.1	Very low	26.2	Very low	97 Å²	97	136.5 Å²	136.5	80%	0.802	80%	0.797	S	S	*	*			trans	-47.2	136.1	154.4	0	0	0	0	0	111.9
407	T	28.6	Very low	26.8	Very low	128 Å²	128	140.4 Å²	140.4	79%	0.785	80%	0.801	S	S	*	*			trans	-154.3	126	135.7	-56.5	0	0	0	0	107.4
408	T	22.5	Very low	26.7	Very low	129 Å²	129	138 Å²	138	79%	0.791	80%	0.801	S	S	*	*			trans	-50.9	129.1	165.8	39.8	0	0	0	0	111.8
409	S	26.5	Very low	27.3	Very low	109 Å²	109	136.9 Å²	136.9	76%	0.762	80%	0.8	S	S	*	*			trans	-162.4	110.9	149	-77.4	0	0	0	0	109.2	T411	S409-T411 PolarHBondContact O-N 2.98Å
410	A	23.4	Very low	27.3	Very low	91 Å²	91	136.4 Å²	136.4	75%	0.752	80%	0.797	S	S	*	*			trans	-58	128.8	165.3	0	0	0	0	0	109.5
411	T	27.7	Very low	27.3	Very low	131 Å²	131	137.2 Å²	137.2	80%	0.804	80%	0.796	S	S	*	*			trans	-136.4	124	158.2	30.7	0	0	0	0	108.2	S409	S409-T411 PolarHBondContact O-N 2.98Å
412	F	23.7	Very low	27.5	Very low	196 Å²	196	135.1 Å²	135.1	86%	0.86	79%	0.793	S	S	*	*			trans	-66	135.7	-178.4	-72	-101.8	0	0	0	110.3
413	I	28.3	Very low	27.6	Very low	168 Å²	168	129 Å²	129	86%	0.862	78%	0.784	S	S	*	*			trans	-113.2	114.4	158.4	-54.3	-179.5	0	0	0	106.4
414	T	24.3	Very low	27.8	Very low	131 Å²	131	131 Å²	131	80%	0.804	79%	0.792	S	S	*	*			trans	-68.2	137.3	176.2	41.9	0	0	0	0	110.4
415	S	32.3	Very low	27.9	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	79%	0.791	S	S	*	*			trans	-113.8	135.6	166.5	103	0	0	0	0	108.9	F417	S415-F417 PolarHBondContact O-N 2.72Å
416	P	38.5	Very low	28.2	Very low	117 Å²	117	132.2 Å²	132.2	76%	0.76	79%	0.788	S	S	*	*			trans	-102.1	47.9	-164.8	40.6	-36.1	0	0	0	114.2
417	F	35.8	Very low	28.5	Very low	195 Å²	195	134 Å²	134	86%	0.855	78%	0.783	S	S	*	*			trans	-113.9	92.7	167.2	-73.3	-76.6	0	0	0	110.1	S415	S415-F417 PolarHBondContact O-N 2.72Å
418	G	26.7	Very low	28.2	Very low	76 Å²	76	133.8 Å²	133.8	78%	0.784	78%	0.781	S	S	*	*			trans	-70	122.9	169	0	0	0	0	0	110.5
419	V	35.4	Very low	28.5	Very low	145 Å²	145	136.7 Å²	136.7	88%	0.879	78%	0.783	S	S	*	*			trans	-130.2	117.2	152.6	-150	0	0	0	0	106.2
420	S	28	Very low	28.5	Very low	93 Å²	93	138.4 Å²	138.4	65%	0.65	78%	0.784	S	S	*	*			trans	-78.5	153.3	-171.8	-55.7	0	0	0	0	112.3
421	H	27.2	Very low	28.6	Very low	166 Å²	166	139.8 Å²	139.8	77%	0.769	79%	0.788	S	S	*	*			trans	62	135.1	149.5	75.2	-84.6	0	0	0	118.4
422	L	27.3	Very low	28.8	Very low	151 Å²	151	139.6 Å²	139.6	79%	0.791	79%	0.787	S	S	*	*			cis	-157.5	172.2	24.4	-105.3	134.2	0	0	0	108.9
423	P	27.1	Very low	29.1	Very low	110 Å²	110	139.5 Å²	139.5	71%	0.714	79%	0.789	S	S	*	*			trans	-93.4	134.7	-151.7	35.1	-32.8	0	0	0	114.1
424	V	30.4	Very low	29.2	Very low	138 Å²	138	138.8 Å²	138.8	84%	0.836	79%	0.785	S	S	*	*			trans	-96	114.7	163.7	-179.7	0	0	0	0	108
425	K	25.8	Very low	29.5	Very low	186 Å²	186	137.4 Å²	137.4	81%	0.809	79%	0.787	S	S	*	*			trans	-59.4	145.3	174.6	-80.3	178.8	176	177.5	0	110.5	I427	K425-I427 PolarHBondContact O-N 3.12Å
426	P	29.9	Very low	29.5	Very low	118 Å²	118	138.3 Å²	138.3	77%	0.766	79%	0.788	S	S	*	*			trans	-63.5	122.6	-178.1	24.6	-32	0	0	0	110.5	T428	P426-T428 PolarHBondContact O-N 3.13Å
427	I	28.3	Very low	29.2	Very low	135 Å²	135	138.9 Å²	138.9	69%	0.692	79%	0.79	S	S	*	*			trans	-69.1	104.1	170.8	-60	173.5	0	0	0	107	K425 F429	K425-I427 PolarHBondContact O-N 3.12Å; I427-F429 HydrophobicContact CG2-CD2 3.62Å; I427-F429 HydrophobicContact CG2-CE2 3.58Å; I427-F429 PolarHBondContact O-N 3.49Å
428	T	23.2	Very low	28.9	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	78%	0.782	S	S	*	*			trans	-65.5	104.3	165	44.3	0	0	0	0	108.7	P426	P426-T428 PolarHBondContact O-N 3.13Å
429	F	28.6	Very low	29.3	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.833	78%	0.779	S	S	*	*			trans	-86.5	107.3	163.1	-96.8	-84.4	0	0	0	108.8	I427	I427-F429 HydrophobicContact CG2-CD2 3.62Å; I427-F429 HydrophobicContact CG2-CE2 3.58Å; I427-F429 PolarHBondContact O-N 3.49Å
430	N	27.3	Very low	29.2	Very low	146 Å²	146	133.9 Å²	133.9	78%	0.781	78%	0.776	S	S	*	*			trans	-61.8	140	171	-90.6	-19.8	0	0	0	111	T432	N430-T432 PolarHBondContact O-N 2.79Å
431	S	25.5	Very low	29.4	Very low	120 Å²	120	135.3 Å²	135.3	84%	0.839	78%	0.781	S	S	*	*			trans	-47	120.2	167.2	-65.1	0	0	0	0	112.4
432	T	32.3	Very low	29.9	Very low	127 Å²	127	133.1 Å²	133.1	78%	0.779	78%	0.781	S	S	*	*			trans	-155.1	100	145.8	4.7	0	0	0	0	109.5	N430	N430-T432 PolarHBondContact O-N 2.79Å
433	Q	29.9	Very low	30.1	Very low	194 Å²	194	131.2 Å²	131.2	91%	0.907	78%	0.781	S	S	*	*			trans	40.3	83	149.4	-55.3	-150.8	13.6	0	0	117.8
434	I	30.7	Very low	30.5	Very low	152 Å²	152	131.9 Å²	131.9	78%	0.779	79%	0.785	S	S	*	*			trans	-113.2	115.8	146.6	-59	178.5	0	0	0	105.6	V436	I434-V436 PolarHBondContact O-N 3.09Å
435	A	29.5	Very low	30.9	Very low	102 Å²	102	130.6 Å²	130.6	84%	0.843	78%	0.782	S	S	*	*			trans	-64.3	83.2	177	0	0	0	0	0	109.5	T437	A435-T437 PolarHBondContact O-N 3.03Å; A435-T437 VanDerWaalsContact O-N 3.11Å
436	V	33.3	Very low	31.7	Very low	121 Å²	121	132.7 Å²	132.7	73%	0.733	79%	0.785	S	S	*	*			trans	-69.1	107.2	165.4	-178.2	0	0	0	0	105.7	I434 A438	I434-V436 PolarHBondContact O-N 3.09Å; V436-A438 PolarHBondContact O-N 3.36Å; V436-A438 VanDerWaalsContact O-N 3.1Å
437	T	30.6	Very low	32.3	Very low	130 Å²	130	132.5 Å²	132.5	80%	0.798	78%	0.784	S	S	*	*			trans	-43	117.6	162.8	20.8	0	0	0	0	108	A435	A435-T437 PolarHBondContact O-N 3.03Å; A435-T437 VanDerWaalsContact O-N 3.11Å
438	A	30.2	Very low	33.4	Very low	83 Å²	83	130.2 Å²	130.2	69%	0.686	78%	0.78	S	S	*	*			trans	-50.5	132.8	-177.2	0	0	0	0	0	109.8	V436 S440	V436-A438 PolarHBondContact O-N 3.36Å; V436-A438 VanDerWaalsContact O-N 3.1Å; A438-S440 PolarHBondContact O-N 2.77Å
439	P	34.4	Very low	35.5	Very low	113 Å²	113	132 Å²	132	73%	0.734	78%	0.777	S	S	*	*			trans	-55.2	121.5	173.9	20.9	-29.9	0	0	0	107.9	T441	P439-T441 PolarHBondContact O-N 3.19Å
440	S	33.8	Very low	38.1	Very low	115 Å²	115	129.5 Å²	129.5	80%	0.804	77%	0.768	S	S	*	*			trans	-56.1	113.4	176.5	-22.2	0	0	0	0	106.6	A438	A438-S440 PolarHBondContact O-N 2.77Å
441	T	32.1	Very low	41	Very low	123 Å²	123	125.7 Å²	125.7	76%	0.755	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-55.1	125.4	173.1	42	0	0	0	0	107.7	P439 S443	P439-T441 PolarHBondContact O-N 3.19Å; T441-S443 PolarHBondContact O-N 3.28Å
442	P	38.2	Very low	44	Very low	120 Å²	120	125.4 Å²	125.4	78%	0.779	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-56.9	121.7	173.4	20.1	-28.4	0	0	0	106.9
443	S	31.3	Very low	46.6	Very low	111 Å²	111	119.3 Å²	119.3	78%	0.776	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-48.5	129.1	178	-66.2	0	0	0	0	108.5	T441 S445	T441-S443 PolarHBondContact O-N 3.28Å; S443-S445 PolarHBondContact O-N 3.27Å
444	P	36	Very low	49.3	Very low	124 Å²	124	114.9 Å²	114.9	81%	0.805	69%	0.688	S	S	*	*			trans	-57.2	114.5	-171.6	19.1	-30.2	0	0	0	109	R446	P444-R446 PolarHBondContact O-N 2.74Å
445	S	38.9	Very low	52	Low	111 Å²	111	112.7 Å²	112.7	78%	0.776	68%	0.682	S	S	*	*			trans	-51.4	113.9	164.1	47.2	0	0	0	0	106.6	S443	S443-S445 PolarHBondContact O-N 3.27Å
446	R	42.7	Very low	54.9	Low	229 Å²	229	110 Å²	110	86%	0.864	66%	0.656	S	S	*	*			trans	-44.2	126.5	178.1	-173.5	179.6	-172.3	-152.1	4.5	108.5	P444 S448	P444-R446 PolarHBondContact O-N 2.74Å; R446-S448 PolarHBondContact O-N 2.96Å
447	P	41.3	Very low	57.6	Low	115 Å²	115	107.7 Å²	107.7	75%	0.747	65%	0.645	S	S	*	*			trans	-53.7	120.3	-173.3	17.9	-30.1	0	0	0	109.1	K449	P447-K449 PolarHBondContact O-N 2.81Å
448	S	52.8	Low	60.4	Low	87 Å²	87	107 Å²	107	61%	0.608	63%	0.631	S	S	*	*			trans	-61.6	109.9	174.7	42	0	0	0	0	107	R446 E450	R446-S448 PolarHBondContact O-N 2.96Å; S448-E450 PolarHBondContact O-N 3.09Å
449	K	67	Low	63.1	Low	159 Å²	159	106.5 Å²	106.5	69%	0.691	62%	0.62	S	S	*	*			trans	-62.1	106.9	169.8	-75.4	-173.4	177.2	-172.2	0	107.4	P447 Y451	P447-K449 PolarHBondContact O-N 2.81Å; K449-Y451 HydrophobicContact CB-CE2 4.22Å; K449-Y451 VanDerWaalsContact O-CD2 3.24Å; K449-Y451 WeakPolarHBondContact O-CD2 3.48Å; K449-Y451 WeakPolarHBondContact O-CE2 3.33Å
450	E	82.4	Confident	65.6	Low	137 Å²	137	103.4 Å²	103.4	64%	0.64	59%	0.594	S	S	*	*			trans	-81.1	139.3	174	-73.3	178.4	-177.9	0	0	109.4	S448 V459	S448-E450 PolarHBondContact O-N 3.09Å; E450-V459 HydrophobicContact CB-CG1 3.62Å; E450-V459 HydrophobicContact CG-CG1 4.09Å
451	Y	88.6	Confident	68	Low	67 Å²	67	102.2 Å²	102.2	26%	0.263	58%	0.583	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.7	111.9	-175.6	-64.1	-86.9	0	0	0	109.3	K449 Y460 R463	K449-Y451 HydrophobicContact CB-CE2 4.22Å; K449-Y451 VanDerWaalsContact O-CD2 3.24Å; K449-Y451 WeakPolarHBondContact O-CD2 3.48Å; K449-Y451 WeakPolarHBondContact O-CE2 3.33Å; Y451-Y460 PolarHBondContact N-O 2.84Å; Y451-Y460 PolarHBondContact O-N 2.97Å; Y451-R463 HydrophobicContact CD1-CB 4.08Å; Y451-R463 HydrophobicContact CD1-CG 4.46Å; Y451-R463 HydrophobicContact CD2-CB 4.36Å; Y451-R463 VanDerWaalsContact CD2-N 3.28Å; Y451-R463 HydrophobicContact CE1-CB 3.92Å; Y451-R463 HydrophobicContact CE1-CG 4.42Å; Y451-R463 HydrophobicContact CE2-CB 4.19Å; Y451-R463 HydrophobicContact CG-CB 4.29Å
452	Q	87.3	Confident	70.6	Confident	113 Å²	113	104.1 Å²	104.1	53%	0.528	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-95.4	140.4	-177.4	-175	172.7	-18	0	0	112	S457 K458 V459 L466	Q452-S457 VanDerWaalsContact NE2-CB 3.29Å; Q452-S457 PolarHBondContact NE2-OG 2.97Å; Q452-K458 CarbonylContact C-O 3.55Å; Q452-K458 WeakPolarHBondContact CA-O 3.28Å; Q452-V459 HydrophobicContact CB-CG2 4.17Å; Q452-V459 HydrophobicContact CG-CG2 4.08Å; Q452-L466 WeakPolarHBondContact O-CD2 3.41Å
453	C	86.6	Confident	73	Confident	0 Å²	0	106.3 Å²	106.3	0%	0	57%	0.569	C	S	.	*			trans	-73.1	125.2	169	-179.8	0	0	0	0	110.4	T455 S457 K458 L466 H469 H474	C453-T455 VanDerWaalsContact C-N 3.28Å; C453-T455 PolarHBondContact O-N 3.46Å; C453-T455 PolarHBondContact SG-N 3.42Å; C453-S457 WeakPolarHBondContact O-CA 3.48Å; C453-S457 PolarHBondContact O-N 3.34Å; C453-K458 PolarHBondContact N-O 3.37Å; C453-L466 VanDerWaalsContact CA-CD1 3.43Å; C453-L466 HydrophobicContact CB-CD1 3.54Å; C453-H469 PolarHBondContact SG-NE2 2.81Å; C453-H469 VanDerWaalsContact SG-NE2 3.35Å; C453-H474 PolarHBondContact SG-NE2 2.72Å
454	A	88.1	Confident	75.5	Confident	101 Å²	101	107.5 Å²	107.5	84%	0.835	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.5	-27.8	179.1	0	0	0	0	0	113.4
455	T	86.7	Confident	77.8	Confident	106 Å²	106	103.2 Å²	103.2	65%	0.65	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-34.9	-173.7	-45.1	0	0	0	0	113.3	C453 H474	C453-T455 VanDerWaalsContact C-N 3.28Å; C453-T455 PolarHBondContact O-N 3.46Å; C453-T455 PolarHBondContact SG-N 3.42Å; T455-H474 VanDerWaalsContact CG2-CE1 3.49Å; T455-H474 WeakPolarHBondContact CG2-CE1 3.47Å
456	C	91.4	Very high	80.1	Confident	46 Å²	46	98.9 Å²	98.9	31%	0.311	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	5.9	-179.7	75.1	0	0	0	0	114.8	K458 H469	C456-K458 PolarHBondContact O-N 2.94Å; C456-H469 PolarHBondContact SG-CE1 3.48Å; C456-H469 PolarHBondContact SG-NE2 2.72Å
457	S	89	Confident	82.2	Confident	71 Å²	71	93 Å²	93	50%	0.497	49%	0.486	S	S	.	.			trans	60.6	11	176.9	-65.2	0	0	0	0	116.7	Q452 C453 V459	Q452-S457 VanDerWaalsContact NE2-CB 3.29Å; Q452-S457 PolarHBondContact NE2-OG 2.97Å; C453-S457 WeakPolarHBondContact O-CA 3.48Å; C453-S457 PolarHBondContact O-N 3.34Å; S457-V459 PolarHBondContact O-N 3.2Å
458	K	88.9	Confident	84.3	Confident	116 Å²	116	87.8 Å²	87.8	50%	0.504	45%	0.452	S	S	.	.			trans	-66.3	130.7	173	-71.4	-179.2	-176.2	-179.5	0	110.9	Q452 C453 C456 Y460	Q452-K458 CarbonylContact C-O 3.55Å; Q452-K458 WeakPolarHBondContact CA-O 3.28Å; C453-K458 PolarHBondContact N-O 3.37Å; C456-K458 PolarHBondContact O-N 2.94Å; K458-Y460 HydrophobicContact CB-CE2 3.68Å; K458-Y460 WeakPolarHBondContact O-CD2 3.41Å; K458-Y460 WeakPolarHBondContact O-CE2 3.11Å
459	V	87.7	Confident	85.9	Confident	73 Å²	73	84.1 Å²	84.1	44%	0.442	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	136	-178	-176.3	0	0	0	0	110.7	E450 Q452 S457	E450-V459 HydrophobicContact CB-CG1 3.62Å; E450-V459 HydrophobicContact CG-CG1 4.09Å; Q452-V459 HydrophobicContact CB-CG2 4.17Å; Q452-V459 HydrophobicContact CG-CG2 4.08Å; S457-V459 PolarHBondContact O-N 3.2Å
460	Y	86.7	Confident	86.8	Confident	48 Å²	48	78.9 Å²	78.9	19%	0.188	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	141.3	-178.1	-64.1	-85	0	0	0	111.4	Y451 K458 R462 L466 H469	Y451-Y460 PolarHBondContact N-O 2.84Å; Y451-Y460 PolarHBondContact O-N 2.97Å; K458-Y460 HydrophobicContact CB-CE2 3.68Å; K458-Y460 WeakPolarHBondContact O-CD2 3.41Å; K458-Y460 WeakPolarHBondContact O-CE2 3.11Å; Y460-R462 PolarHBondContact O-N 3.26Å; Y460-L466 HydrophobicContact CD2-CB 3.83Å; Y460-L466 HydrophobicContact CD2-CD1 3.73Å; Y460-L466 HydrophobicContact CD2-CG 4.4Å; Y460-L466 HydrophobicContact CE2-CD1 3.98Å; Y460-L466 HydrophobicContact CG-CB 4.16Å; Y460-H469 HydrophobicContact CE1-CB 4.06Å; Y460-H469 HydrophobicContact CE2-CB 3.78Å; Y460-H469 AromaticContact CE2-CD2 3.46Å; Y460-H469 VanDerWaalsContact CE2-CD2 3.46Å; Y460-H469 WeakPolarHBondContact CE2-CD2 3.22Å; Y460-H469 AromaticContact CE2-CG 3.62Å; Y460-H469 VanDerWaalsContact CZ-CB 3.43Å; Y460-H469 AromaticContact CZ-CD2 3.76Å; Y460-H469 AromaticContact CZ-CG 3.42Å; Y460-H469 VanDerWaalsContact CZ-CG 3.42Å; Y460-H469 VanDerWaalsContact OH-CB 3.26Å; Y460-H469 WeakPolarHBondContact OH-CB 3.33Å; Y460-H469 PolarHBondContact OH-CD2 3.47Å; Y460-H469 PolarHBondContact OH-ND1 2.91Å
461	P	85.3	Confident	86.8	Confident	90 Å²	90	73.7 Å²	73.7	58%	0.584	38%	0.381	S	S	*	.	S	Bend	trans	-73.1	-12	180	28.9	-35.8	0	0	0	113.5
462	R	86.5	Confident	86.5	Confident	163 Å²	163	75.5 Å²	75.5	62%	0.615	39%	0.392	S	S	*	.	S	Bend	trans	-140.3	138.8	-176.3	-75.4	-174.7	-83	-173.3	-6.3	110.5	Y460 Q464 S465 L466	Y460-R462 PolarHBondContact O-N 3.26Å; R462-Q464 PolarHBondContact O-N 2.81Å; R462-S465 WeakPolarHBondContact O-CB 3.48Å; R462-S465 PolarHBondContact O-N 3.35Å; R462-L466 PolarHBondContact O-N 2.83Å
463	R	87.2	Confident	86.3	Confident	166 Å²	166	73.7 Å²	73.7	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-53.7	-39.1	175.4	-174.6	-176	-76.3	-168.6	-5.5	112.4	Y451 S465 L466 Q467	Y451-R463 HydrophobicContact CD1-CB 4.08Å; Y451-R463 HydrophobicContact CD1-CG 4.46Å; Y451-R463 HydrophobicContact CD2-CB 4.36Å; Y451-R463 VanDerWaalsContact CD2-N 3.28Å; Y451-R463 HydrophobicContact CE1-CB 3.92Å; Y451-R463 HydrophobicContact CE1-CG 4.42Å; Y451-R463 HydrophobicContact CE2-CB 4.19Å; Y451-R463 HydrophobicContact CG-CB 4.29Å; R463-S465 VanDerWaalsContact C-N 3.32Å; R463-S465 PolarHBondContact O-N 3.35Å; R463-L466 PolarHBondContact O-N 2.69Å; R463-Q467 WeakPolarHBondContact O-CB 3.11Å; R463-Q467 PolarHBondContact O-N 3.33Å
464	Q	83.9	Confident	86.2	Confident	136 Å²	136	76.9 Å²	76.9	64%	0.636	40%	0.403	S	S	*	.	H	α-helix	trans	-66.5	-33.3	179.7	-59.8	84.1	-0.5	0	0	112.7	R462 A468	R462-Q464 PolarHBondContact O-N 2.81Å; Q464-A468 WeakPolarHBondContact O-CB 3.43Å; Q464-A468 PolarHBondContact O-N 3.24Å
465	S	85.9	Confident	85.9	Confident	33 Å²	33	75.1 Å²	75.1	23%	0.231	38%	0.382	C	S	.	.	H	α-helix	trans	-69.7	-41.9	176.4	-61.7	0	0	0	0	111	R462 R463 A468 H469	R462-S465 WeakPolarHBondContact O-CB 3.48Å; R462-S465 PolarHBondContact O-N 3.35Å; R463-S465 VanDerWaalsContact C-N 3.32Å; R463-S465 PolarHBondContact O-N 3.35Å; S465-A468 PolarHBondContact O-N 3.1Å; S465-H469 WeakPolarHBondContact O-CB 3.49Å; S465-H469 PolarHBondContact O-N 3.04Å
466	L	87.1	Confident	85.3	Confident	21 Å²	21	76.2 Å²	76.2	11%	0.11	38%	0.384	C	S	.	.	H	α-helix	trans	-60.3	-48.4	171.9	172.2	60.4	0	0	0	111.1	Q452 C453 Y460 R462 R463 A468 H469 I470	Q452-L466 WeakPolarHBondContact O-CD2 3.41Å; C453-L466 VanDerWaalsContact CA-CD1 3.43Å; C453-L466 HydrophobicContact CB-CD1 3.54Å; Y460-L466 HydrophobicContact CD2-CB 3.83Å; Y460-L466 HydrophobicContact CD2-CD1 3.73Å; Y460-L466 HydrophobicContact CD2-CG 4.4Å; Y460-L466 HydrophobicContact CE2-CD1 3.98Å; Y460-L466 HydrophobicContact CG-CB 4.16Å; R462-L466 PolarHBondContact O-N 2.83Å; R463-L466 PolarHBondContact O-N 2.69Å; L466-A468 VanDerWaalsContact C-N 3.33Å; L466-A468 PolarHBondContact O-N 3.04Å; L466-H469 WeakPolarHBondContact O-CB 3.38Å; L466-H469 PolarHBondContact O-N 2.89Å; L466-H469 VanDerWaalsContact O-N 3.09Å; L466-I470 HydrophobicContact CD1-CD1 3.85Å; L466-I470 HydrophobicContact CD1-CG1 3.96Å; L466-I470 HydrophobicContact CD2-CD1 4.45Å; L466-I470 HydrophobicContact CG-CD1 3.85Å; L466-I470 HydrophobicContact CG-CG1 4.39Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 3.02Å
467	Q	86.7	Confident	84.8	Confident	105 Å²	105	81.1 Å²	81.1	49%	0.491	40%	0.4	S	S	.	.	H	α-helix	trans	-57.7	-46	179	-173.3	65.5	16.4	0	0	111.8	R463 H469 I470 I471	R463-Q467 WeakPolarHBondContact O-CB 3.11Å; R463-Q467 PolarHBondContact O-N 3.33Å; Q467-H469 VanDerWaalsContact C-N 3.3Å; Q467-H469 PolarHBondContact O-N 3.35Å; Q467-I470 PolarHBondContact O-N 3.37Å; Q467-I471 HydrophobicContact CG-CD1 3.99Å; Q467-I471 VanDerWaalsContact O-CG1 3.3Å; Q467-I471 WeakPolarHBondContact O-CG1 3.05Å; Q467-I471 PolarHBondContact O-N 3.42Å
468	A	85.1	Confident	84.6	Confident	5 Å²	5	83.8 Å²	83.8	4%	0.041	40%	0.402	C	S	.	.	H	α-helix	trans	-62.2	-39.4	176.8	0	0	0	0	0	111.9	Q464 S465 L466 I471 Q472 V490 R491	Q464-A468 WeakPolarHBondContact O-CB 3.43Å; Q464-A468 PolarHBondContact O-N 3.24Å; S465-A468 PolarHBondContact O-N 3.1Å; L466-A468 VanDerWaalsContact C-N 3.33Å; L466-A468 PolarHBondContact O-N 3.04Å; A468-I471 PolarHBondContact O-N 2.75Å; A468-Q472 WeakPolarHBondContact O-CB 3.01Å; A468-Q472 PolarHBondContact O-N 3.4Å; A468-V490 HydrophobicContact CB-CG1 4.19Å; A468-V490 VanDerWaalsContact O-CG1 3.29Å; A468-V490 WeakPolarHBondContact O-CG1 3.46Å; A468-R491 HydrophobicContact CB-CG 3.75Å
469	H	85.2	Confident	84.3	Confident	10 Å²	10	81.4 Å²	81.4	5%	0.046	40%	0.399	C	S	.	.	H	α-helix	trans	-64	-46	175.5	159.6	67.8	0	0	0	112.3	C453 C456 Y460 S465 L466 Q467 I471 Q472 V473 H474	C453-H469 PolarHBondContact SG-NE2 2.81Å; C453-H469 VanDerWaalsContact SG-NE2 3.35Å; C456-H469 PolarHBondContact SG-CE1 3.48Å; C456-H469 PolarHBondContact SG-NE2 2.72Å; Y460-H469 HydrophobicContact CE1-CB 4.06Å; Y460-H469 HydrophobicContact CE2-CB 3.78Å; Y460-H469 AromaticContact CE2-CD2 3.46Å; Y460-H469 VanDerWaalsContact CE2-CD2 3.46Å; Y460-H469 WeakPolarHBondContact CE2-CD2 3.22Å; Y460-H469 AromaticContact CE2-CG 3.62Å; Y460-H469 VanDerWaalsContact CZ-CB 3.43Å; Y460-H469 AromaticContact CZ-CD2 3.76Å; Y460-H469 AromaticContact CZ-CG 3.42Å; Y460-H469 VanDerWaalsContact CZ-CG 3.42Å; Y460-H469 VanDerWaalsContact OH-CB 3.26Å; Y460-H469 WeakPolarHBondContact OH-CB 3.33Å; Y460-H469 PolarHBondContact OH-CD2 3.47Å; Y460-H469 PolarHBondContact OH-ND1 2.91Å; S465-H469 WeakPolarHBondContact O-CB 3.49Å; S465-H469 PolarHBondContact O-N 3.04Å; L466-H469 WeakPolarHBondContact O-CB 3.38Å; L466-H469 PolarHBondContact O-N 2.89Å; L466-H469 VanDerWaalsContact O-N 3.09Å; Q467-H469 VanDerWaalsContact C-N 3.3Å; Q467-H469 PolarHBondContact O-N 3.35Å; H469-I471 VanDerWaalsContact C-N 3.29Å; H469-I471 PolarHBondContact O-N 3.46Å; H469-Q472 PolarHBondContact O-N 2.62Å; H469-V473 WeakPolarHBondContact ND1-CG2 3.42Å; H469-V473 WeakPolarHBondContact O-CB 3.33Å; H469-V473 PolarHBondContact O-N 2.77Å; H469-H474 AromaticContact CE1-NE2 3.96Å; H469-H474 AromaticContact NE2-NE2 3.65Å
470	I	86.1	Confident	84.4	Confident	50 Å²	50	80.7 Å²	80.7	26%	0.256	39%	0.389	S	S	.	.	H	α-helix	trans	-58	-47	177.4	-67.3	167.8	0	0	0	109.7	L466 Q467 Q472 H474 T475	L466-I470 HydrophobicContact CD1-CD1 3.85Å; L466-I470 HydrophobicContact CD1-CG1 3.96Å; L466-I470 HydrophobicContact CD2-CD1 4.45Å; L466-I470 HydrophobicContact CG-CD1 3.85Å; L466-I470 HydrophobicContact CG-CG1 4.39Å; L466-I470 WeakPolarHBondContact O-CG1 3.18Å; L466-I470 PolarHBondContact O-N 3.02Å; Q467-I470 PolarHBondContact O-N 3.37Å; I470-Q472 PolarHBondContact O-N 3.31Å; I470-H474 WeakPolarHBondContact O-CA 3.42Å; I470-H474 WeakPolarHBondContact O-CB 3.33Å; I470-H474 PolarHBondContact O-N 2.6Å; I470-T475 PolarHBondContact O-N 3.18Å
471	I	84	Confident	84.5	Confident	28 Å²	28	83.4 Å²	83.4	14%	0.144	40%	0.403	C	S	.	.	I	π-helix	trans	-64.1	-43.6	-180	-66.1	169	0	0	0	111.4	Q467 A468 H469 T475 D476 K477 P479 V490	Q467-I471 HydrophobicContact CG-CD1 3.99Å; Q467-I471 VanDerWaalsContact O-CG1 3.3Å; Q467-I471 WeakPolarHBondContact O-CG1 3.05Å; Q467-I471 PolarHBondContact O-N 3.42Å; A468-I471 PolarHBondContact O-N 2.75Å; H469-I471 VanDerWaalsContact C-N 3.29Å; H469-I471 PolarHBondContact O-N 3.46Å; I471-T475 VanDerWaalsContact CA-OG1 3.31Å; I471-T475 WeakPolarHBondContact CA-OG1 3.27Å; I471-T475 PolarHBondContact O-OG1 2.73Å; I471-D476 PolarHBondContact O-N 3.31Å; I471-K477 WeakPolarHBondContact CG2-O 3.28Å; I471-P479 HydrophobicContact CD1-CG 4.43Å; I471-P479 HydrophobicContact CG2-CG 4.16Å; I471-V490 HydrophobicContact CB-CG1 4.05Å; I471-V490 HydrophobicContact CG2-CG1 3.89Å
472	Q	81.6	Confident	84.7	Confident	104 Å²	104	79.1 Å²	79.1	49%	0.486	38%	0.375	S	S	.	.	I	π-helix	trans	-75.4	-33.2	-175.4	-173.4	173.5	-16.1	0	0	114.4	A468 H469 I470 V490	A468-Q472 WeakPolarHBondContact O-CB 3.01Å; A468-Q472 PolarHBondContact O-N 3.4Å; H469-Q472 PolarHBondContact O-N 2.62Å; I470-Q472 PolarHBondContact O-N 3.31Å; Q472-V490 HydrophobicContact CB-CG1 3.97Å; Q472-V490 HydrophobicContact CB-CG2 3.88Å; Q472-V490 HydrophobicContact CG-CG2 4Å
473	V	81.8	Confident	84.9	Confident	75 Å²	75	74.8 Å²	74.8	46%	0.455	36%	0.364	S	S	.	.	I	π-helix	trans	-106.8	-27.9	-169.8	-180	0	0	0	0	112.2	H469	H469-V473 WeakPolarHBondContact ND1-CG2 3.42Å; H469-V473 WeakPolarHBondContact O-CB 3.33Å; H469-V473 PolarHBondContact O-N 2.77Å
474	H	85.8	Confident	84.9	Confident	67 Å²	67	69.8 Å²	69.8	31%	0.31	35%	0.352	S	S	.	.	I	π-helix	trans	-113.7	-20.4	-173.8	-62.5	-57.1	0	0	0	113.9	C453 T455 H469 I470	C453-H474 PolarHBondContact SG-NE2 2.72Å; T455-H474 VanDerWaalsContact CG2-CE1 3.49Å; T455-H474 WeakPolarHBondContact CG2-CE1 3.47Å; H469-H474 AromaticContact CE1-NE2 3.96Å; H469-H474 AromaticContact NE2-NE2 3.65Å; I470-H474 WeakPolarHBondContact O-CA 3.42Å; I470-H474 WeakPolarHBondContact O-CB 3.33Å; I470-H474 PolarHBondContact O-N 2.6Å
475	T	81.3	Confident	85.3	Confident	64 Å²	64	65.9 Å²	65.9	39%	0.393	34%	0.339	S	S	.	.	I	π-helix	trans	-117.6	-14.1	179.7	75.2	0	0	0	0	114.1	I470 I471 K477	I470-T475 PolarHBondContact O-N 3.18Å; I471-T475 VanDerWaalsContact CA-OG1 3.31Å; I471-T475 WeakPolarHBondContact CA-OG1 3.27Å; I471-T475 PolarHBondContact O-OG1 2.73Å; T475-K477 WeakPolarHBondContact O-CG 3.31Å; T475-K477 PolarHBondContact O-N 3.01Å
476	D	73.3	Confident	85.5	Confident	130 Å²	130	70.8 Å²	70.8	70%	0.695	36%	0.358	S	S	*	.			trans	48.8	10	-173.5	-68.5	-47.2	0	0	0	115.2	I471	I471-D476 PolarHBondContact O-N 3.31Å
477	K	81.3	Confident	85.6	Confident	148 Å²	148	75.5 Å²	75.5	64%	0.643	38%	0.378	S	S	*	.			trans	-74.9	141	179.5	-65.7	-172.8	-178.6	-175.9	0	108.9	I471 T475 P479	I471-K477 WeakPolarHBondContact CG2-O 3.28Å; T475-K477 WeakPolarHBondContact O-CG 3.31Å; T475-K477 PolarHBondContact O-N 3.01Å; K477-P479 WeakPolarHBondContact O-CD 3.22Å
478	K	84.8	Confident	85.7	Confident	127 Å²	127	71.4 Å²	71.4	55%	0.552	36%	0.364	S	S	*	.			trans	-116.8	87.1	172.6	-72.1	170.7	179.6	179.4	0	108.1	Y480 F489 V490	K478-Y480 PolarHBondContact O-N 3.28Å; K478-F489 CarbonylContact C-O 3.4Å; K478-V490 HydrophobicContact CG-CG2 4.41Å
479	P	84	Confident	85.9	Confident	66 Å²	66	72.3 Å²	72.3	43%	0.429	37%	0.367	S	S	.	.			trans	-64.9	-14.3	-170.4	-20.5	32.3	0	0	0	114.5	I471 K477	I471-P479 HydrophobicContact CD1-CG 4.43Å; I471-P479 HydrophobicContact CG2-CG 4.16Å; K477-P479 WeakPolarHBondContact O-CD 3.22Å
480	Y	88.8	Confident	86	Confident	59 Å²	59	73 Å²	73	23%	0.231	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	108.3	-177.6	-57.9	-88.3	0	0	0	108.9	K478 G488 F489 R492 F495	K478-Y480 PolarHBondContact O-N 3.28Å; Y480-G488 CarbonylContact O-C 3.57Å; Y480-G488 WeakPolarHBondContact O-CA 3.3Å; Y480-F489 PolarHBondContact N-O 2.87Å; Y480-F489 PolarHBondContact O-N 2.91Å; Y480-R492 HydrophobicContact CD1-CB 4.27Å; Y480-R492 HydrophobicContact CD1-CG 4.42Å; Y480-R492 HydrophobicContact CD2-CB 4.44Å; Y480-R492 HydrophobicContact CE1-CB 3.68Å; Y480-R492 HydrophobicContact CE1-CG 3.78Å; Y480-R492 HydrophobicContact CE2-CB 3.9Å; Y480-R492 VanDerWaalsContact CZ-CB 3.49Å; Y480-F495 HydrophobicContact CD1-CD1 4.06Å; Y480-F495 HydrophobicContact CG-CB 4.33Å; Y480-F495 HydrophobicContact CG-CD1 4.42Å
481	E	89.2	Confident	85.9	Confident	105 Å²	105	75.9 Å²	75.9	49%	0.491	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	149.5	174.6	65.5	-175.3	172.4	0	0	111	K487 F495	E481-K487 WeakPolarHBondContact CA-O 3.29Å; E481-F495 VanDerWaalsContact O-CE2 3.23Å; E481-F495 WeakPolarHBondContact O-CE2 3.12Å; E481-F495 VanDerWaalsContact O-CZ 3.31Å; E481-F495 WeakPolarHBondContact O-CZ 3.15Å
482	C	90.2	Very high	86.2	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.38	C	S	.	.			trans	-85	127.3	171.4	179.3	0	0	0	0	110.3	V484 C485 H486 K487 F495 H503	C482-V484 PolarHBondContact O-N 3.05Å; C482-V484 PolarHBondContact SG-N 2.98Å; C482-V484 VanDerWaalsContact SG-N 3.44Å; C482-C485 VanDerWaalsContact SG-SG 3.69Å; C482-H486 WeakPolarHBondContact O-CA 2.88Å; C482-H486 PolarHBondContact O-N 2.94Å; C482-K487 PolarHBondContact N-O 3.39Å; C482-K487 VanDerWaalsContact N-O 3.12Å; C482-F495 HydrophobicContact CB-CE2 3.99Å; C482-H503 PolarHBondContact SG-CD2 3.26Å
483	N	90.4	Very high	86.3	Confident	71 Å²	71	78 Å²	78	38%	0.38	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.4	-179.6	-57.1	-18.4	0	0	0	113.5	H486 T509 A510 G512	N483-H486 PolarHBondContact O-CE1 3.32Å; N483-T509 WeakPolarHBondContact CB-O 3.43Å; N483-T509 PolarHBondContact ND2-O 3.23Å; N483-A510 PolarHBondContact N-O 2.9Å; N483-A510 VanDerWaalsContact N-O 3.11Å; N483-G512 PolarHBondContact ND2-N 3.47Å
484	V	87.4	Confident	86.6	Confident	62 Å²	62	75.9 Å²	75.9	38%	0.376	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-46.8	-178.5	176.1	0	0	0	0	111.7	C482 H503 T509 A510	C482-V484 PolarHBondContact O-N 3.05Å; C482-V484 PolarHBondContact SG-N 2.98Å; C482-V484 VanDerWaalsContact SG-N 3.44Å; V484-H503 VanDerWaalsContact CG1-CE1 3.49Å; V484-H503 WeakPolarHBondContact CG1-CE1 3.07Å; V484-T509 HydrophobicContact CG2-CG2 4.11Å; V484-A510 HydrophobicContact CB-CB 4.45Å; V484-A510 HydrophobicContact CG2-CB 3.93Å
485	C	90.9	Very high	86.9	Confident	54 Å²	54	72.7 Å²	72.7	37%	0.365	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	1.2	-179.5	71.1	0	0	0	0	114.3	C482 K487 H498 H503	C482-C485 VanDerWaalsContact SG-SG 3.69Å; C485-K487 PolarHBondContact O-N 3.47Å; C485-K487 VanDerWaalsContact SG-CB 3.53Å; C485-H498 PolarHBondContact SG-CE1 2.98Å; C485-H498 PolarHBondContact SG-NE2 3.42Å; C485-H503 PolarHBondContact SG-NE2 2.94Å
486	H	90	Very high	87.3	Confident	136 Å²	136	69.6 Å²	69.6	63%	0.63	33%	0.334	S	S	*	.			trans	54.2	18.8	-178.4	-55.9	-66.4	0	0	0	114.9	C482 N483 G488	C482-H486 WeakPolarHBondContact O-CA 2.88Å; C482-H486 PolarHBondContact O-N 2.94Å; N483-H486 PolarHBondContact O-CE1 3.32Å; H486-G488 PolarHBondContact O-N 3.33Å
487	K	89.3	Confident	88	Confident	119 Å²	119	69.8 Å²	69.8	52%	0.517	33%	0.325	S	S	.	.			trans	-73	115.8	176.2	-169	166.7	-177.9	172.8	0	109.7	E481 C482 C485 F489	E481-K487 WeakPolarHBondContact CA-O 3.29Å; C482-K487 PolarHBondContact N-O 3.39Å; C482-K487 VanDerWaalsContact N-O 3.12Å; C485-K487 PolarHBondContact O-N 3.47Å; C485-K487 VanDerWaalsContact SG-CB 3.53Å; K487-F489 HydrophobicContact CB-CE2 3.98Å; K487-F489 HydrophobicContact CB-CZ 4.11Å; K487-F489 HydrophobicContact CD-CE1 4.33Å; K487-F489 HydrophobicContact CD-CE2 4.45Å; K487-F489 HydrophobicContact CD-CZ 3.74Å; K487-F489 HydrophobicContact CG-CE1 4.35Å; K487-F489 HydrophobicContact CG-CE2 3.92Å; K487-F489 HydrophobicContact CG-CZ 3.66Å; K487-F489 WeakPolarHBondContact O-CD2 3.26Å; K487-F489 WeakPolarHBondContact O-CE2 3.38Å
488	G	88.6	Confident	88.3	Confident	19 Å²	19	63.7 Å²	63.7	20%	0.196	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	144.5	174	0	0	0	0	0	113.3	Y480 H486	Y480-G488 CarbonylContact O-C 3.57Å; Y480-G488 WeakPolarHBondContact O-CA 3.3Å; H486-G488 PolarHBondContact O-N 3.33Å
489	F	90.1	Very high	88.5	Confident	25 Å²	25	57.6 Å²	57.6	11%	0.11	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	140.3	178.8	-58.7	-90.1	0	0	0	110.4	K478 Y480 K487 D494 F495 H498	K478-F489 CarbonylContact C-O 3.4Å; Y480-F489 PolarHBondContact N-O 2.87Å; Y480-F489 PolarHBondContact O-N 2.91Å; K487-F489 HydrophobicContact CB-CE2 3.98Å; K487-F489 HydrophobicContact CB-CZ 4.11Å; K487-F489 HydrophobicContact CD-CE1 4.33Å; K487-F489 HydrophobicContact CD-CE2 4.45Å; K487-F489 HydrophobicContact CD-CZ 3.74Å; K487-F489 HydrophobicContact CG-CE1 4.35Å; K487-F489 HydrophobicContact CG-CE2 3.92Å; K487-F489 HydrophobicContact CG-CZ 3.66Å; K487-F489 WeakPolarHBondContact O-CD2 3.26Å; K487-F489 WeakPolarHBondContact O-CE2 3.38Å; F489-D494 HydrophobicContact CD1-CB 3.99Å; F489-F495 HydrophobicContact CB-CB 3.9Å; F489-F495 HydrophobicContact CD2-CB 3.7Å; F489-F495 AromaticContact CD2-CD2 3.65Å; F489-F495 HydrophobicContact CD2-CD2 3.65Å; F489-F495 HydrophobicContact CD2-CG 4.15Å; F489-F495 HydrophobicContact CE2-CB 4.48Å; F489-F495 AromaticContact CE2-CD2 3.91Å; F489-F495 HydrophobicContact CE2-CD2 3.91Å; F489-F495 HydrophobicContact CG-CB 3.86Å; F489-H498 HydrophobicContact CE1-CB 3.71Å; F489-H498 HydrophobicContact CE2-CB 3.92Å; F489-H498 AromaticContact CE2-CD2 3.45Å; F489-H498 VanDerWaalsContact CE2-CD2 3.45Å; F489-H498 WeakPolarHBondContact CE2-CD2 3.34Å; F489-H498 AromaticContact CE2-CG 3.72Å; F489-H498 HydrophobicContact CZ-CB 3.23Å; F489-H498 AromaticContact CZ-CD2 3.46Å; F489-H498 VanDerWaalsContact CZ-CD2 3.46Å; F489-H498 WeakPolarHBondContact CZ-CD2 3.38Å; F489-H498 AromaticContact CZ-CG 3.2Å; F489-H498 AromaticContact CZ-ND1 3.85Å
490	V	87	Confident	88.6	Confident	23 Å²	23	56.4 Å²	56.4	14%	0.139	26%	0.262	C	S	.	.	S	Bend	trans	-73.7	-43.7	174.5	175.3	0	0	0	0	110.5	A468 I471 Q472 K478	A468-V490 HydrophobicContact CB-CG1 4.19Å; A468-V490 VanDerWaalsContact O-CG1 3.29Å; A468-V490 WeakPolarHBondContact O-CG1 3.46Å; I471-V490 HydrophobicContact CB-CG1 4.05Å; I471-V490 HydrophobicContact CG2-CG1 3.89Å; Q472-V490 HydrophobicContact CB-CG1 3.97Å; Q472-V490 HydrophobicContact CB-CG2 3.88Å; Q472-V490 HydrophobicContact CG-CG2 4Å; K478-V490 HydrophobicContact CG-CG2 4.41Å
491	R	85.2	Confident	88.2	Confident	112 Å²	112	57.5 Å²	57.5	42%	0.423	28%	0.278	S	S	.	.	S	Bend	trans	-104.2	133.4	-178.2	-49.5	-172	-171.5	115.4	-1.6	110.9	A468 W493 D494 F495	A468-R491 HydrophobicContact CB-CG 3.75Å; R491-W493 VanDerWaalsContact C-N 3.28Å; R491-W493 PolarHBondContact O-N 2.95Å; R491-D494 HydrophobicContact CB-CB 4.35Å; R491-D494 WeakPolarHBondContact CB-OD2 3.16Å; R491-D494 WeakPolarHBondContact CD-OD2 3.22Å; R491-D494 IonicContact NH1-OD2 3.86Å; R491-D494 PolarHBondContact NH1-OD2 3.47Å; R491-D494 WeakPolarHBondContact O-CB 3.25Å; R491-D494 PolarHBondContact O-N 3.16Å; R491-F495 PolarHBondContact O-N 2.83Å; R491-F495 VanDerWaalsContact O-N 3.15Å
492	R	88.4	Confident	88	Confident	41 Å²	41	56.5 Å²	56.5	16%	0.155	28%	0.279	C	S	.	.	H	α-helix	trans	-43.1	-48	168.6	-176.3	-176.4	155.1	80.2	-6.4	114.6	Y480 D494 F495 Y496 E518	Y480-R492 HydrophobicContact CD1-CB 4.27Å; Y480-R492 HydrophobicContact CD1-CG 4.42Å; Y480-R492 HydrophobicContact CD2-CB 4.44Å; Y480-R492 HydrophobicContact CE1-CB 3.68Å; Y480-R492 HydrophobicContact CE1-CG 3.78Å; Y480-R492 HydrophobicContact CE2-CB 3.9Å; Y480-R492 VanDerWaalsContact CZ-CB 3.49Å; R492-D494 VanDerWaalsContact C-N 3.32Å; R492-D494 PolarHBondContact O-N 3.37Å; R492-F495 WeakPolarHBondContact O-CB 3.22Å; R492-F495 PolarHBondContact O-N 3.44Å; R492-Y496 HydrophobicContact CG-CD2 4.21Å; R492-Y496 HydrophobicContact CG-CE2 3.86Å; R492-Y496 PolarHBondContact NH1-OH 3.41Å; R492-Y496 PolarHBondContact O-N 3.07Å; R492-E518 IonicContact CZ-OE2 2.79Å; R492-E518 VanDerWaalsContact NH1-CD 3.26Å; R492-E518 IonicContact NH1-OE1 2.58Å; R492-E518 IonicContact NH1-OE2 3.44Å; R492-E518 PolarHBondContact NH1-OE2 2.88Å; R492-E518 PolarHBondContact NH2-O 2.92Å; R492-E518 IonicContact NH2-OE1 3.64Å; R492-E518 IonicContact NH2-OE2 3.77Å
493	W	85.1	Confident	87.7	Confident	134 Å²	134	57.8 Å²	57.8	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-71.3	-28.5	-176.4	-50.4	124.5	0	0	0	113.2	R491 Y496 R497 W522	R491-W493 VanDerWaalsContact C-N 3.28Å; R491-W493 PolarHBondContact O-N 2.95Å; W493-Y496 HydrophobicContact CE3-CD2 4.08Å; W493-Y496 HydrophobicContact CZ3-CD2 4.33Å; W493-Y496 HydrophobicContact CZ3-CE2 4.5Å; W493-R497 VanDerWaalsContact O-CB 3.27Å; W493-R497 WeakPolarHBondContact O-CB 3.16Å; W493-R497 PolarHBondContact O-N 3.34Å; W493-W522 AromaticContact CD2-NE1 3.91Å; W493-W522 HydrophobicContact CE3-CB 4.44Å; W493-W522 AromaticContact CE3-CD1 2.99Å; W493-W522 AromaticContact CE3-CG 3.78Å; W493-W522 HydrophobicContact CE3-CG 3.78Å; W493-W522 AromaticContact CE3-NE1 3.14Å; W493-W522 AromaticContact CH2-CD1 3.96Å; W493-W522 HydrophobicContact CZ3-CB 3.83Å; W493-W522 AromaticContact CZ3-CD1 2.98Å; W493-W522 AromaticContact CZ3-CG 3.6Å; W493-W522 HydrophobicContact CZ3-CG 3.6Å; W493-W522 AromaticContact CZ3-NE1 3.69Å
494	D	88.3	Confident	87.1	Confident	31 Å²	31	58.9 Å²	58.9	17%	0.166	29%	0.287	C	S	.	.	H	α-helix	trans	-72.1	-39.3	175.9	-67	-44.5	0	0	0	109.9	F489 R491 R492 R497 H498	F489-D494 HydrophobicContact CD1-CB 3.99Å; R491-D494 HydrophobicContact CB-CB 4.35Å; R491-D494 WeakPolarHBondContact CB-OD2 3.16Å; R491-D494 WeakPolarHBondContact CD-OD2 3.22Å; R491-D494 IonicContact NH1-OD2 3.86Å; R491-D494 PolarHBondContact NH1-OD2 3.47Å; R491-D494 WeakPolarHBondContact O-CB 3.25Å; R491-D494 PolarHBondContact O-N 3.16Å; R492-D494 VanDerWaalsContact C-N 3.32Å; R492-D494 PolarHBondContact O-N 3.37Å; D494-R497 PolarHBondContact O-N 3.46Å; D494-R497 IonicContact OD1-CZ 3.98Å; D494-R497 VanDerWaalsContact OD1-CZ 3.24Å; D494-R497 IonicContact OD1-NH1 3.95Å; D494-R497 PolarHBondContact OD1-NH1 2.97Å; D494-R497 IonicContact OD1-NH2 3.24Å; D494-R497 PolarHBondContact OD1-NH2 3.04Å; D494-H498 WeakPolarHBondContact O-CB 2.96Å; D494-H498 PolarHBondContact O-N 3.39Å
495	F	91.5	Very high	86.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.7	-54.2	170.7	170.2	-126.4	0	0	0	112.4	Y480 E481 C482 F489 R491 R492 R497 H498 V499 I511 K515	Y480-F495 HydrophobicContact CD1-CD1 4.06Å; Y480-F495 HydrophobicContact CG-CB 4.33Å; Y480-F495 HydrophobicContact CG-CD1 4.42Å; E481-F495 VanDerWaalsContact O-CE2 3.23Å; E481-F495 WeakPolarHBondContact O-CE2 3.12Å; E481-F495 VanDerWaalsContact O-CZ 3.31Å; E481-F495 WeakPolarHBondContact O-CZ 3.15Å; C482-F495 HydrophobicContact CB-CE2 3.99Å; F489-F495 HydrophobicContact CB-CB 3.9Å; F489-F495 HydrophobicContact CD2-CB 3.7Å; F489-F495 AromaticContact CD2-CD2 3.65Å; F489-F495 HydrophobicContact CD2-CD2 3.65Å; F489-F495 HydrophobicContact CD2-CG 4.15Å; F489-F495 HydrophobicContact CE2-CB 4.48Å; F489-F495 AromaticContact CE2-CD2 3.91Å; F489-F495 HydrophobicContact CE2-CD2 3.91Å; F489-F495 HydrophobicContact CG-CB 3.86Å; R491-F495 PolarHBondContact O-N 2.83Å; R491-F495 VanDerWaalsContact O-N 3.15Å; R492-F495 WeakPolarHBondContact O-CB 3.22Å; R492-F495 PolarHBondContact O-N 3.44Å; F495-R497 VanDerWaalsContact C-N 3.28Å; F495-R497 PolarHBondContact O-N 3.45Å; F495-H498 WeakPolarHBondContact O-CA 3.44Å; F495-H498 WeakPolarHBondContact O-CB 3.05Å; F495-H498 PolarHBondContact O-N 3.1Å; F495-V499 HydrophobicContact CD2-CG2 3.99Å; F495-V499 HydrophobicContact CE2-CG2 3.55Å; F495-V499 HydrophobicContact CZ-CG2 3.97Å; F495-V499 PolarHBondContact O-N 2.98Å; F495-I511 HydrophobicContact CE1-CG1 4.26Å; F495-I511 HydrophobicContact CE1-CG2 4.36Å; F495-I511 HydrophobicContact CZ-CB 4.45Å; F495-I511 HydrophobicContact CZ-CG1 4.1Å; F495-K515 HydrophobicContact CE1-CD 4.25Å
496	Y	90.1	Very high	85.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-35.4	178.7	-66.8	-17.2	0	0	0	113.1	R492 W493 H498 N500 I511 K515 E518 Y519 W522	R492-Y496 HydrophobicContact CG-CD2 4.21Å; R492-Y496 HydrophobicContact CG-CE2 3.86Å; R492-Y496 PolarHBondContact NH1-OH 3.41Å; R492-Y496 PolarHBondContact O-N 3.07Å; W493-Y496 HydrophobicContact CE3-CD2 4.08Å; W493-Y496 HydrophobicContact CZ3-CD2 4.33Å; W493-Y496 HydrophobicContact CZ3-CE2 4.5Å; Y496-H498 VanDerWaalsContact C-N 3.34Å; Y496-N500 VanDerWaalsContact O-CB 3.31Å; Y496-N500 WeakPolarHBondContact O-CB 3.49Å; Y496-N500 PolarHBondContact O-N 3.49Å; Y496-I511 HydrophobicContact CE1-CG2 4.45Å; Y496-K515 PolarHBondContact OH-O 3.01Å; Y496-K515 VanDerWaalsContact OH-O 3.07Å; Y496-E518 VanDerWaalsContact OH-CB 3.29Å; Y496-E518 WeakPolarHBondContact OH-CB 3.02Å; Y496-Y519 AromaticContact CD1-CD2 3.77Å; Y496-Y519 HydrophobicContact CD1-CD2 3.77Å; Y496-Y519 HydrophobicContact CD2-CD2 4.28Å; Y496-Y519 HydrophobicContact CE1-CD2 4.27Å; Y496-Y519 AromaticContact CG-CD2 3.77Å; Y496-Y519 HydrophobicContact CG-CD2 3.77Å; Y496-Y519 PolarHBondContact OH-N 3.29Å; Y496-W522 VanDerWaalsContact CB-CH2 3.48Å; Y496-W522 VanDerWaalsContact CB-CZ2 3.41Å; Y496-W522 HydrophobicContact CD2-CB 3.98Å; Y496-W522 AromaticContact CD2-CD2 3.96Å; Y496-W522 HydrophobicContact CD2-CD2 3.96Å; Y496-W522 HydrophobicContact CD2-CE3 4.4Å; Y496-W522 AromaticContact CD2-CG 3.86Å; Y496-W522 HydrophobicContact CD2-CG 3.86Å; Y496-W522 HydrophobicContact CE2-CB 4.25Å; Y496-W522 HydrophobicContact CG-CD2 4.42Å; Y496-W522 VanDerWaalsContact O-CH2 3.23Å; Y496-W522 WeakPolarHBondContact O-CH2 3.35Å
497	R	87.4	Confident	85.6	Confident	134 Å²	134	56.8 Å²	56.8	51%	0.506	28%	0.275	S	S	.	.	H	α-helix	trans	-60.9	-46.1	172.6	-176.2	177.3	64.5	-136.2	-11.3	110.6	W493 D494 F495 N500 S501 W522	W493-R497 VanDerWaalsContact O-CB 3.27Å; W493-R497 WeakPolarHBondContact O-CB 3.16Å; W493-R497 PolarHBondContact O-N 3.34Å; D494-R497 PolarHBondContact O-N 3.46Å; D494-R497 IonicContact OD1-CZ 3.98Å; D494-R497 VanDerWaalsContact OD1-CZ 3.24Å; D494-R497 IonicContact OD1-NH1 3.95Å; D494-R497 PolarHBondContact OD1-NH1 2.97Å; D494-R497 IonicContact OD1-NH2 3.24Å; D494-R497 PolarHBondContact OD1-NH2 3.04Å; F495-R497 VanDerWaalsContact C-N 3.28Å; F495-R497 PolarHBondContact O-N 3.45Å; R497-N500 PolarHBondContact O-N 3.27Å; R497-S501 WeakPolarHBondContact O-CB 3.33Å; R497-S501 PolarHBondContact O-N 3.36Å; R497-S501 PolarHBondContact O-OG 3.45Å; R497-S501 VanDerWaalsContact O-OG 3.05Å; R497-W522 HydrophobicContact CB-CH2 4.47Å; R497-W522 HydrophobicContact CB-CZ2 4.41Å
498	H	88.4	Confident	85.2	Confident	19 Å²	19	52.8 Å²	52.8	9%	0.088	26%	0.261	C	S	.	.	H	α-helix	trans	-61.1	-50.1	177.2	158.4	75.9	0	0	0	112.1	C485 F489 D494 F495 Y496 N500 S501 V502 H503	C485-H498 PolarHBondContact SG-CE1 2.98Å; C485-H498 PolarHBondContact SG-NE2 3.42Å; F489-H498 HydrophobicContact CE1-CB 3.71Å; F489-H498 HydrophobicContact CE2-CB 3.92Å; F489-H498 AromaticContact CE2-CD2 3.45Å; F489-H498 VanDerWaalsContact CE2-CD2 3.45Å; F489-H498 WeakPolarHBondContact CE2-CD2 3.34Å; F489-H498 AromaticContact CE2-CG 3.72Å; F489-H498 HydrophobicContact CZ-CB 3.23Å; F489-H498 AromaticContact CZ-CD2 3.46Å; F489-H498 VanDerWaalsContact CZ-CD2 3.46Å; F489-H498 WeakPolarHBondContact CZ-CD2 3.38Å; F489-H498 AromaticContact CZ-CG 3.2Å; F489-H498 AromaticContact CZ-ND1 3.85Å; D494-H498 WeakPolarHBondContact O-CB 2.96Å; D494-H498 PolarHBondContact O-N 3.39Å; F495-H498 WeakPolarHBondContact O-CA 3.44Å; F495-H498 WeakPolarHBondContact O-CB 3.05Å; F495-H498 PolarHBondContact O-N 3.1Å; Y496-H498 VanDerWaalsContact C-N 3.34Å; H498-N500 VanDerWaalsContact C-N 3.28Å; H498-N500 PolarHBondContact O-N 2.98Å; H498-S501 PolarHBondContact O-N 2.85Å; H498-S501 VanDerWaalsContact O-N 3.12Å; H498-S501 PolarHBondContact O-OG 3.33Å; H498-S501 VanDerWaalsContact O-OG 3.13Å; H498-V502 WeakPolarHBondContact ND1-CG2 3.21Å; H498-V502 WeakPolarHBondContact O-CB 3.4Å; H498-V502 PolarHBondContact O-N 2.99Å; H498-H503 AromaticContact CE1-CD2 3.83Å; H498-H503 AromaticContact CE1-NE2 3.69Å; H498-H503 AromaticContact NE2-CD2 3.42Å; H498-H503 PolarHBondContact NE2-CD2 3.35Å; H498-H503 AromaticContact NE2-NE2 3.52Å
499	V	88.6	Confident	85	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-57.6	-46.1	178.3	173.9	0	0	0	0	110.2	F495 S501 H503 H504 A507 A510 I511	F495-V499 HydrophobicContact CD2-CG2 3.99Å; F495-V499 HydrophobicContact CE2-CG2 3.55Å; F495-V499 HydrophobicContact CZ-CG2 3.97Å; F495-V499 PolarHBondContact O-N 2.98Å; V499-S501 VanDerWaalsContact C-N 3.28Å; V499-S501 PolarHBondContact O-N 3.22Å; V499-H503 HydrophobicContact CG1-CB 4.3Å; V499-H503 CarbonylContact O-C 3.59Å; V499-H503 WeakPolarHBondContact O-CA 3.44Å; V499-H503 PolarHBondContact O-N 3.11Å; V499-H504 PolarHBondContact O-N 3.45Å; V499-A507 HydrophobicContact CG1-CB 3.79Å; V499-A510 HydrophobicContact CG1-CB 3.88Å; V499-A510 HydrophobicContact CG2-CB 4.09Å; V499-I511 HydrophobicContact CB-CD1 4.31Å; V499-I511 HydrophobicContact CB-CG1 4.2Å; V499-I511 HydrophobicContact CG1-CD1 3.76Å; V499-I511 HydrophobicContact CG1-CG1 3.82Å; V499-I511 HydrophobicContact CG2-CD1 4.48Å; V499-I511 HydrophobicContact CG2-CG1 3.85Å
500	N	85.1	Confident	84.8	Confident	41 Å²	41	55 Å²	55	22%	0.219	27%	0.272	C	S	.	.	H	α-helix	trans	-67.6	-24.7	-179.2	-167.3	66.5	0	0	0	114.3	Y496 R497 H498 H504 Y519 W522 M523 R541	Y496-N500 VanDerWaalsContact O-CB 3.31Å; Y496-N500 WeakPolarHBondContact O-CB 3.49Å; Y496-N500 PolarHBondContact O-N 3.49Å; R497-N500 PolarHBondContact O-N 3.27Å; H498-N500 VanDerWaalsContact C-N 3.28Å; H498-N500 PolarHBondContact O-N 2.98Å; N500-H504 WeakPolarHBondContact O-CB 3.42Å; N500-Y519 HydrophobicContact CB-CE2 4.36Å; N500-Y519 PolarHBondContact OD1-OH 3.46Å; N500-Y519 VanDerWaalsContact OD1-OH 3.12Å; N500-W522 HydrophobicContact CB-CH2 4.34Å; N500-W522 HydrophobicContact CB-CZ3 4.21Å; N500-M523 WeakPolarHBondContact OD1-CE 3.45Å; N500-M523 PolarHBondContact OD1-SD 3.47Å; N500-R541 PolarHBondContact OD1-NH1 3.02Å; N500-R541 PolarHBondContact OD1-NH2 3.35Å
501	S	82.3	Confident	84.7	Confident	82 Å²	82	53.9 Å²	53.9	57%	0.573	27%	0.266	S	S	*	.	H	α-helix	trans	-95.4	-31.4	-179.9	62.5	0	0	0	0	114	R497 H498 V499	R497-S501 WeakPolarHBondContact O-CB 3.33Å; R497-S501 PolarHBondContact O-N 3.36Å; R497-S501 PolarHBondContact O-OG 3.45Å; R497-S501 VanDerWaalsContact O-OG 3.05Å; H498-S501 PolarHBondContact O-N 2.85Å; H498-S501 VanDerWaalsContact O-N 3.12Å; H498-S501 PolarHBondContact O-OG 3.33Å; H498-S501 VanDerWaalsContact O-OG 3.13Å; V499-S501 VanDerWaalsContact C-N 3.28Å; V499-S501 PolarHBondContact O-N 3.22Å
502	V	83	Confident	84.6	Confident	83 Å²	83	49.1 Å²	49.1	50%	0.503	25%	0.252	S	S	.	.	H	α-helix	trans	-106.2	-44.4	-173.2	-176.4	0	0	0	0	111.3	H498	H498-V502 WeakPolarHBondContact ND1-CG2 3.21Å; H498-V502 WeakPolarHBondContact O-CB 3.4Å; H498-V502 PolarHBondContact O-N 2.99Å
503	H	84.5	Confident	84.1	Confident	28 Å²	28	54 Å²	54	13%	0.13	28%	0.281	C	S	.	.	S	Bend	trans	-110.2	46.6	-177.1	-58.4	-62.6	0	0	0	110.6	C482 V484 C485 H498 V499 D505 N506 A507 A510	C482-H503 PolarHBondContact SG-CD2 3.26Å; V484-H503 VanDerWaalsContact CG1-CE1 3.49Å; V484-H503 WeakPolarHBondContact CG1-CE1 3.07Å; C485-H503 PolarHBondContact SG-NE2 2.94Å; H498-H503 AromaticContact CE1-CD2 3.83Å; H498-H503 AromaticContact CE1-NE2 3.69Å; H498-H503 AromaticContact NE2-CD2 3.42Å; H498-H503 PolarHBondContact NE2-CD2 3.35Å; H498-H503 AromaticContact NE2-NE2 3.52Å; V499-H503 HydrophobicContact CG1-CB 4.3Å; V499-H503 CarbonylContact O-C 3.59Å; V499-H503 WeakPolarHBondContact O-CA 3.44Å; V499-H503 PolarHBondContact O-N 3.11Å; H503-D505 VanDerWaalsContact C-N 3.29Å; H503-D505 PolarHBondContact O-N 2.77Å; H503-N506 CarbonylContact O-C 3.43Å; H503-N506 PolarHBondContact O-N 2.93Å; H503-A507 WeakPolarHBondContact O-CA 3.28Å; H503-A507 PolarHBondContact O-N 3.48Å; H503-A507 VanDerWaalsContact O-N 3.09Å; H503-A510 HydrophobicContact CB-CB 3.74Å
504	H	77.5	Confident	83.9	Confident	94 Å²	94	53.3 Å²	53.3	44%	0.435	29%	0.287	S	S	.	.	S	Bend	trans	-65.7	-31.5	-172.4	76.8	-70.1	0	0	0	113.2	V499 N500 R541	V499-H504 PolarHBondContact O-N 3.45Å; N500-H504 WeakPolarHBondContact O-CB 3.42Å; H504-R541 VanDerWaalsContact CB-NH2 3.27Å; H504-R541 VanDerWaalsContact O-CZ 3.29Å; H504-R541 PolarHBondContact O-NE 3.49Å; H504-R541 PolarHBondContact O-NH2 2.94Å
505	D	74.4	Confident	83.7	Confident	113 Å²	113	53.7 Å²	53.7	60%	0.604	29%	0.287	S	S	*	.	S	Bend	trans	-84.2	-26.4	177.7	-58.3	-41.6	0	0	0	112.8	H503	H503-D505 VanDerWaalsContact C-N 3.29Å; H503-D505 PolarHBondContact O-N 2.77Å
506	N	79.5	Confident	83.3	Confident	94 Å²	94	54.2 Å²	54.2	50%	0.503	29%	0.29	S	S	.	.	S	Bend	trans	-119.5	39.3	-174.7	-63.4	-13.8	0	0	0	111.6	H503 T508 T509 A510	H503-N506 CarbonylContact O-C 3.43Å; H503-N506 PolarHBondContact O-N 2.93Å; N506-T508 VanDerWaalsContact C-N 3.33Å; N506-T508 PolarHBondContact O-N 2.93Å; N506-T509 PolarHBondContact O-N 3.39Å; N506-A510 WeakPolarHBondContact O-CB 3.46Å; N506-A510 PolarHBondContact O-N 2.93Å
507	A	83.1	Confident	82.9	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64	-37.6	-171.3	0	0	0	0	0	112.6	V499 H503 A510 I511 Y519	V499-A507 HydrophobicContact CG1-CB 3.79Å; H503-A507 WeakPolarHBondContact O-CA 3.28Å; H503-A507 PolarHBondContact O-N 3.48Å; H503-A507 VanDerWaalsContact O-N 3.09Å; A507-A510 PolarHBondContact O-N 3.49Å; A507-I511 WeakPolarHBondContact O-CB 3.39Å; A507-I511 VanDerWaalsContact O-CD1 3.3Å; A507-I511 WeakPolarHBondContact O-CD1 3.4Å; A507-I511 WeakPolarHBondContact O-CG1 3.4Å; A507-I511 PolarHBondContact O-N 3.43Å; A507-Y519 HydrophobicContact CB-CE1 4.06Å
508	T	81.9	Confident	82.6	Confident	36 Å²	36	59.1 Å²	59.1	22%	0.221	32%	0.319	C	S	.	.	H	α-helix	trans	-59.3	-51.8	177	47.7	0	0	0	0	111.5	N506 A510 I511 G512 L516 L544	N506-T508 VanDerWaalsContact C-N 3.33Å; N506-T508 PolarHBondContact O-N 2.93Å; T508-A510 PolarHBondContact O-N 3.25Å; T508-I511 PolarHBondContact O-N 3.18Å; T508-G512 PolarHBondContact O-N 2.99Å; T508-G512 VanDerWaalsContact O-N 3.09Å; T508-L516 HydrophobicContact CG2-CD1 3.97Å; T508-L516 HydrophobicContact CG2-CD2 4.27Å; T508-L544 HydrophobicContact CG2-CD2 3.63Å
509	T	83.2	Confident	82.4	Confident	89 Å²	89	58.2 Å²	58.2	55%	0.546	32%	0.315	S	S	.	.	H	α-helix	trans	-61.6	-44.1	177.7	-47.2	0	0	0	0	111.5	N483 V484 N506 I511	N483-T509 WeakPolarHBondContact CB-O 3.43Å; N483-T509 PolarHBondContact ND2-O 3.23Å; V484-T509 HydrophobicContact CG2-CG2 4.11Å; N506-T509 PolarHBondContact O-N 3.39Å; T509-I511 PolarHBondContact O-N 2.97Å
510	A	86.2	Confident	82.1	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.9	-21.9	-178.7	0	0	0	0	0	114.4	N483 V484 V499 H503 N506 A507 T508	N483-A510 PolarHBondContact N-O 2.9Å; N483-A510 VanDerWaalsContact N-O 3.11Å; V484-A510 HydrophobicContact CB-CB 4.45Å; V484-A510 HydrophobicContact CG2-CB 3.93Å; V499-A510 HydrophobicContact CG1-CB 3.88Å; V499-A510 HydrophobicContact CG2-CB 4.09Å; H503-A510 HydrophobicContact CB-CB 3.74Å; N506-A510 WeakPolarHBondContact O-CB 3.46Å; N506-A510 PolarHBondContact O-N 2.93Å; A507-A510 PolarHBondContact O-N 3.49Å; T508-A510 PolarHBondContact O-N 3.25Å
511	I	86	Confident	81.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-100.1	-38.5	-175.1	-68.4	166.6	0	0	0	112.8	F495 Y496 V499 A507 T508 T509 K515 Y519	F495-I511 HydrophobicContact CE1-CG1 4.26Å; F495-I511 HydrophobicContact CE1-CG2 4.36Å; F495-I511 HydrophobicContact CZ-CB 4.45Å; F495-I511 HydrophobicContact CZ-CG1 4.1Å; Y496-I511 HydrophobicContact CE1-CG2 4.45Å; V499-I511 HydrophobicContact CB-CD1 4.31Å; V499-I511 HydrophobicContact CB-CG1 4.2Å; V499-I511 HydrophobicContact CG1-CD1 3.76Å; V499-I511 HydrophobicContact CG1-CG1 3.82Å; V499-I511 HydrophobicContact CG2-CD1 4.48Å; V499-I511 HydrophobicContact CG2-CG1 3.85Å; A507-I511 WeakPolarHBondContact O-CB 3.39Å; A507-I511 VanDerWaalsContact O-CD1 3.3Å; A507-I511 WeakPolarHBondContact O-CD1 3.4Å; A507-I511 WeakPolarHBondContact O-CG1 3.4Å; A507-I511 PolarHBondContact O-N 3.43Å; T508-I511 PolarHBondContact O-N 3.18Å; T509-I511 PolarHBondContact O-N 2.97Å; I511-K515 HydrophobicContact CG2-CB 3.36Å; I511-Y519 HydrophobicContact CD1-CD1 3.41Å; I511-Y519 VanDerWaalsContact CD1-CD1 3.41Å; I511-Y519 HydrophobicContact CD1-CD2 3.43Å; I511-Y519 VanDerWaalsContact CD1-CD2 3.43Å; I511-Y519 HydrophobicContact CD1-CE1 3.8Å; I511-Y519 HydrophobicContact CD1-CE2 3.8Å; I511-Y519 HydrophobicContact CD1-CG 3.21Å
512	G	82.1	Confident	81.6	Confident	13 Å²	13	56.9 Å²	56.9	13%	0.134	31%	0.308	C	S	.	.			trans	86.8	155.3	-165.5	0	0	0	0	0	112	N483 T508 D514	N483-G512 PolarHBondContact ND2-N 3.47Å; T508-G512 PolarHBondContact O-N 2.99Å; T508-G512 VanDerWaalsContact O-N 3.09Å; G512-D514 VanDerWaalsContact C-N 3.3Å; G512-D514 PolarHBondContact O-N 3.25Å
513	N	79	Confident	81.2	Confident	142 Å²	142	54.5 Å²	54.5	76%	0.759	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-66.9	-31.5	-176.1	-69.5	-29.7	0	0	0	112.5	K515 L516	N513-K515 VanDerWaalsContact C-N 3.32Å; N513-K515 PolarHBondContact O-N 3.45Å; N513-L516 PolarHBondContact O-N 2.94Å
514	D	80.3	Confident	80.5	Confident	120 Å²	120	58.4 Å²	58.4	64%	0.642	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-61.3	-35.1	-179.2	63.7	-44.5	0	0	0	113.4	G512	G512-D514 VanDerWaalsContact C-N 3.3Å; G512-D514 PolarHBondContact O-N 3.25Å
515	K	83.7	Confident	79.9	Confident	39 Å²	39	56.8 Å²	56.8	17%	0.17	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-104.5	4.4	-176	-71.6	160.5	-164.7	159.1	0	113.3	F495 Y496 I511 N513 E518 Y519	F495-K515 HydrophobicContact CE1-CD 4.25Å; Y496-K515 PolarHBondContact OH-O 3.01Å; Y496-K515 VanDerWaalsContact OH-O 3.07Å; I511-K515 HydrophobicContact CG2-CB 3.36Å; N513-K515 VanDerWaalsContact C-N 3.32Å; N513-K515 PolarHBondContact O-N 3.45Å; K515-E518 WeakPolarHBondContact O-CB 3.33Å; K515-Y519 PolarHBondContact O-N 3.25Å
516	L	83.5	Confident	79.2	Confident	12 Å²	12	56.3 Å²	56.3	6%	0.063	30%	0.303	C	S	.	.	H	α-helix	trans	-69.8	-50	-170.2	-176.5	58	0	0	0	112.9	T508 N513 E518 Y519 V520 L544 V547	T508-L516 HydrophobicContact CG2-CD1 3.97Å; T508-L516 HydrophobicContact CG2-CD2 4.27Å; N513-L516 PolarHBondContact O-N 2.94Å; L516-E518 PolarHBondContact O-N 3.4Å; L516-Y519 WeakPolarHBondContact O-CB 3.36Å; L516-Y519 PolarHBondContact O-N 2.96Å; L516-Y519 VanDerWaalsContact O-N 3.15Å; L516-V520 WeakPolarHBondContact O-CG2 3.42Å; L516-V520 PolarHBondContact O-N 3.33Å; L516-L544 HydrophobicContact CD1-CD2 3.78Å; L516-V547 HydrophobicContact CD2-CG2 3.84Å
517	E	81	Confident	77.9	Confident	141 Å²	141	60.1 Å²	60.1	66%	0.659	31%	0.311	S	S	*	.	H	α-helix	trans	-57.2	-41.5	178.5	-67.8	-165	148.8	0	0	111.8	V520 A521	E517-V520 PolarHBondContact O-N 3.42Å; E517-A521 WeakPolarHBondContact O-CB 3.45Å; E517-A521 PolarHBondContact O-N 2.91Å
518	E	82.3	Confident	76	Confident	96 Å²	96	64.3 Å²	64.3	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-65.2	-39.2	179.6	-93.7	-163.6	152.3	0	0	112.8	R492 Y496 K515 L516 W522	R492-E518 IonicContact CZ-OE2 2.79Å; R492-E518 VanDerWaalsContact NH1-CD 3.26Å; R492-E518 IonicContact NH1-OE1 2.58Å; R492-E518 IonicContact NH1-OE2 3.44Å; R492-E518 PolarHBondContact NH1-OE2 2.88Å; R492-E518 PolarHBondContact NH2-O 2.92Å; R492-E518 IonicContact NH2-OE1 3.64Å; R492-E518 IonicContact NH2-OE2 3.77Å; Y496-E518 VanDerWaalsContact OH-CB 3.29Å; Y496-E518 WeakPolarHBondContact OH-CB 3.02Å; K515-E518 WeakPolarHBondContact O-CB 3.33Å; L516-E518 PolarHBondContact O-N 3.4Å; E518-W522 WeakPolarHBondContact O-CB 3.32Å; E518-W522 PolarHBondContact O-N 2.89Å
519	Y	83.2	Confident	74.5	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-66.6	-42.5	171.7	171.3	-106.8	0	0	0	112	Y496 N500 A507 I511 K515 L516 A521 W522 M523 R541 L544	Y496-Y519 AromaticContact CD1-CD2 3.77Å; Y496-Y519 HydrophobicContact CD1-CD2 3.77Å; Y496-Y519 HydrophobicContact CD2-CD2 4.28Å; Y496-Y519 HydrophobicContact CE1-CD2 4.27Å; Y496-Y519 AromaticContact CG-CD2 3.77Å; Y496-Y519 HydrophobicContact CG-CD2 3.77Å; Y496-Y519 PolarHBondContact OH-N 3.29Å; N500-Y519 HydrophobicContact CB-CE2 4.36Å; N500-Y519 PolarHBondContact OD1-OH 3.46Å; N500-Y519 VanDerWaalsContact OD1-OH 3.12Å; A507-Y519 HydrophobicContact CB-CE1 4.06Å; I511-Y519 HydrophobicContact CD1-CD1 3.41Å; I511-Y519 VanDerWaalsContact CD1-CD1 3.41Å; I511-Y519 HydrophobicContact CD1-CD2 3.43Å; I511-Y519 VanDerWaalsContact CD1-CD2 3.43Å; I511-Y519 HydrophobicContact CD1-CE1 3.8Å; I511-Y519 HydrophobicContact CD1-CE2 3.8Å; I511-Y519 HydrophobicContact CD1-CG 3.21Å; K515-Y519 PolarHBondContact O-N 3.25Å; L516-Y519 WeakPolarHBondContact O-CB 3.36Å; L516-Y519 PolarHBondContact O-N 2.96Å; L516-Y519 VanDerWaalsContact O-N 3.15Å; Y519-A521 VanDerWaalsContact C-N 3.35Å; Y519-A521 PolarHBondContact O-N 2.91Å; Y519-W522 HydrophobicContact CD2-CE3 4.03Å; Y519-W522 HydrophobicContact CD2-CZ3 4.18Å; Y519-W522 HydrophobicContact CE2-CE3 4.03Å; Y519-W522 AromaticContact CE2-CZ3 3.74Å; Y519-W522 HydrophobicContact CE2-CZ3 3.74Å; Y519-W522 WeakPolarHBondContact O-CB 3.41Å; Y519-W522 PolarHBondContact O-N 3.17Å; Y519-M523 HydrophobicContact CD1-CG 4.43Å; Y519-M523 HydrophobicContact CE1-CG 4.04Å; Y519-M523 HydrophobicContact CE2-CG 4.25Å; Y519-M523 WeakPolarHBondContact O-CG 3.43Å; Y519-M523 PolarHBondContact O-N 2.98Å; Y519-R541 PolarHBondContact OH-NH1 3.44Å; Y519-L544 HydrophobicContact CE1-CD1 4.01Å; Y519-L544 HydrophobicContact CE1-CD2 4.35Å
520	V	82.2	Confident	72.3	Confident	12 Å²	12	69.3 Å²	69.3	7%	0.073	37%	0.369	C	S	.	.	H	α-helix	trans	-62.1	-43.8	176	172.6	0	0	0	0	110.7	L516 E517 W522 M523 R524 W534 L544	L516-V520 WeakPolarHBondContact O-CG2 3.42Å; L516-V520 PolarHBondContact O-N 3.33Å; E517-V520 PolarHBondContact O-N 3.42Å; V520-W522 VanDerWaalsContact C-N 3.29Å; V520-W522 PolarHBondContact O-N 3.21Å; V520-M523 WeakPolarHBondContact O-CB 3.29Å; V520-M523 PolarHBondContact O-N 3.41Å; V520-R524 WeakPolarHBondContact O-CG 3.48Å; V520-R524 PolarHBondContact O-N 3.42Å; V520-W534 HydrophobicContact CG1-CH2 3.51Å; V520-W534 HydrophobicContact CG1-CZ3 3.96Å; V520-L544 HydrophobicContact CG2-CB 4.43Å
521	A	77.6	Confident	70.1	Confident	57 Å²	57	76.2 Å²	76.2	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-60.1	-39.8	174.8	0	0	0	0	0	112.1	E517 Y519 R524 G525	E517-A521 WeakPolarHBondContact O-CB 3.45Å; E517-A521 PolarHBondContact O-N 2.91Å; Y519-A521 VanDerWaalsContact C-N 3.35Å; Y519-A521 PolarHBondContact O-N 2.91Å; A521-R524 WeakPolarHBondContact O-CB 3.42Å; A521-R524 PolarHBondContact O-N 2.95Å; A521-G525 PolarHBondContact O-N 3.36Å
522	W	80.3	Confident	68.1	Low	26 Å²	26	81.4 Å²	81.4	10%	0.098	43%	0.432	C	S	.	.	H	α-helix	trans	-66.6	-41.1	174.9	174	76.6	0	0	0	113.5	W493 Y496 R497 N500 E518 Y519 V520 R524 G525 R526	W493-W522 AromaticContact CD2-NE1 3.91Å; W493-W522 HydrophobicContact CE3-CB 4.44Å; W493-W522 AromaticContact CE3-CD1 2.99Å; W493-W522 AromaticContact CE3-CG 3.78Å; W493-W522 HydrophobicContact CE3-CG 3.78Å; W493-W522 AromaticContact CE3-NE1 3.14Å; W493-W522 AromaticContact CH2-CD1 3.96Å; W493-W522 HydrophobicContact CZ3-CB 3.83Å; W493-W522 AromaticContact CZ3-CD1 2.98Å; W493-W522 AromaticContact CZ3-CG 3.6Å; W493-W522 HydrophobicContact CZ3-CG 3.6Å; W493-W522 AromaticContact CZ3-NE1 3.69Å; Y496-W522 VanDerWaalsContact CB-CH2 3.48Å; Y496-W522 VanDerWaalsContact CB-CZ2 3.41Å; Y496-W522 HydrophobicContact CD2-CB 3.98Å; Y496-W522 AromaticContact CD2-CD2 3.96Å; Y496-W522 HydrophobicContact CD2-CD2 3.96Å; Y496-W522 HydrophobicContact CD2-CE3 4.4Å; Y496-W522 AromaticContact CD2-CG 3.86Å; Y496-W522 HydrophobicContact CD2-CG 3.86Å; Y496-W522 HydrophobicContact CE2-CB 4.25Å; Y496-W522 HydrophobicContact CG-CD2 4.42Å; Y496-W522 VanDerWaalsContact O-CH2 3.23Å; Y496-W522 WeakPolarHBondContact O-CH2 3.35Å; R497-W522 HydrophobicContact CB-CH2 4.47Å; R497-W522 HydrophobicContact CB-CZ2 4.41Å; N500-W522 HydrophobicContact CB-CH2 4.34Å; N500-W522 HydrophobicContact CB-CZ3 4.21Å; E518-W522 WeakPolarHBondContact O-CB 3.32Å; E518-W522 PolarHBondContact O-N 2.89Å; Y519-W522 HydrophobicContact CD2-CE3 4.03Å; Y519-W522 HydrophobicContact CD2-CZ3 4.18Å; Y519-W522 HydrophobicContact CE2-CE3 4.03Å; Y519-W522 AromaticContact CE2-CZ3 3.74Å; Y519-W522 HydrophobicContact CE2-CZ3 3.74Å; Y519-W522 WeakPolarHBondContact O-CB 3.41Å; Y519-W522 PolarHBondContact O-N 3.17Å; V520-W522 VanDerWaalsContact C-N 3.29Å; V520-W522 PolarHBondContact O-N 3.21Å; W522-R524 VanDerWaalsContact C-N 3.31Å; W522-R524 PolarHBondContact O-N 3.45Å; W522-G525 PolarHBondContact O-N 3.24Å; W522-G525 VanDerWaalsContact O-N 3.1Å; W522-R526 VanDerWaalsContact CH2-NE 3.28Å; W522-R526 VanDerWaalsContact CH2-NH1 3.27Å; W522-R526 PolarHBondContact O-N 2.97Å; W522-R526 VanDerWaalsContact O-N 3.17Å
523	M	74.2	Confident	66.6	Low	32 Å²	32	83.2 Å²	83.2	16%	0.158	44%	0.443	C	S	.	.	H	α-helix	trans	-58.9	-45.1	172.9	-75.9	-68.8	-76.2	0	0	110.6	N500 Y519 V520 G525 R526 L537 R541	N500-M523 WeakPolarHBondContact OD1-CE 3.45Å; N500-M523 PolarHBondContact OD1-SD 3.47Å; Y519-M523 HydrophobicContact CD1-CG 4.43Å; Y519-M523 HydrophobicContact CE1-CG 4.04Å; Y519-M523 HydrophobicContact CE2-CG 4.25Å; Y519-M523 WeakPolarHBondContact O-CG 3.43Å; Y519-M523 PolarHBondContact O-N 2.98Å; V520-M523 WeakPolarHBondContact O-CB 3.29Å; V520-M523 PolarHBondContact O-N 3.41Å; M523-G525 VanDerWaalsContact C-N 3.29Å; M523-G525 PolarHBondContact O-N 3.29Å; M523-R526 PolarHBondContact O-N 3.48Å; M523-L537 HydrophobicContact CE-CD1 3.86Å; M523-R541 VanDerWaalsContact CE-NH1 3.31Å
524	R	68.2	Low	65.4	Low	110 Å²	110	80.2 Å²	80.2	42%	0.415	42%	0.421	S	S	.	.	H	α-helix	trans	-60.3	-36.6	173.8	-68.8	172.2	179.8	173.7	6.7	112	V520 A521 W522 R527 W534	V520-R524 WeakPolarHBondContact O-CG 3.48Å; V520-R524 PolarHBondContact O-N 3.42Å; A521-R524 WeakPolarHBondContact O-CB 3.42Å; A521-R524 PolarHBondContact O-N 2.95Å; W522-R524 VanDerWaalsContact C-N 3.31Å; W522-R524 PolarHBondContact O-N 3.45Å; R524-R527 VanDerWaalsContact O-CG 3.29Å; R524-R527 WeakPolarHBondContact O-CG 3.38Å; R524-R527 PolarHBondContact O-NE 2.93Å; R524-R527 PolarHBondContact O-NH2 3.39Å; R524-W534 HydrophobicContact CG-CE3 3.56Å; R524-W534 HydrophobicContact CG-CH2 4.25Å; R524-W534 HydrophobicContact CG-CZ3 3.35Å
525	G	66.2	Low	63.9	Low	60 Å²	60	81.7 Å²	81.7	62%	0.619	42%	0.424	S	S	*	.	H	α-helix	trans	-70.3	-27.5	-179.9	0	0	0	0	0	114.8	A521 W522 M523 R527	A521-G525 PolarHBondContact O-N 3.36Å; W522-G525 PolarHBondContact O-N 3.24Å; W522-G525 VanDerWaalsContact O-N 3.1Å; M523-G525 VanDerWaalsContact C-N 3.29Å; M523-G525 PolarHBondContact O-N 3.29Å; G525-R527 PolarHBondContact O-N 2.98Å; G525-R527 VanDerWaalsContact O-N 3.12Å
526	R	59.5	Low	62.4	Low	104 Å²	104	82.5 Å²	82.5	39%	0.392	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	12.4	-177.9	-83.4	-177.2	171.5	-158.7	-6.1	115.8	W522 M523 S528	W522-R526 VanDerWaalsContact CH2-NE 3.28Å; W522-R526 VanDerWaalsContact CH2-NH1 3.27Å; W522-R526 PolarHBondContact O-N 2.97Å; W522-R526 VanDerWaalsContact O-N 3.17Å; M523-R526 PolarHBondContact O-N 3.48Å; R526-S528 PolarHBondContact O-N 3.32Å
527	R	52.3	Low	61.1	Low	174 Å²	174	82.7 Å²	82.7	66%	0.657	44%	0.435	S	S	*	.			trans	-59.3	18	-178.8	-78.6	-177.3	-70.5	-122.9	-0.9	116.5	R524 G525	R524-R527 VanDerWaalsContact O-CG 3.29Å; R524-R527 WeakPolarHBondContact O-CG 3.38Å; R524-R527 PolarHBondContact O-NE 2.93Å; R524-R527 PolarHBondContact O-NH2 3.39Å; G525-R527 PolarHBondContact O-N 2.98Å; G525-R527 VanDerWaalsContact O-N 3.12Å
528	S	43.4	Very low	60	Low	87 Å²	87	78.6 Å²	78.6	61%	0.608	42%	0.418	S	S	*	.	S	Bend	trans	-121.3	81.5	178.2	64.8	0	0	0	0	112.1	R526	R526-S528 PolarHBondContact O-N 3.32Å
529	S	50.2	Low	58.6	Low	96 Å²	96	78 Å²	78	67%	0.671	43%	0.429	S	S	*	.	S	Bend		171	-21.4	128.3	-79.4	0	0	0	0	113.4
530	L	36.7	Very low	57.3	Low	134 Å²	134	83.5 Å²	83.5	70%	0.702	46%	0.462	S	S	*	.	S	Bend	trans	-141.5	118	174.9	-72.3	167.1	0	0	0	109.9	I532	L530-I532 PolarHBondContact O-N 2.99Å
531	D	40	Very low	56.4	Low	145 Å²	145	84.1 Å²	84.1	78%	0.775	46%	0.463	S	S	*	.			trans	-57.2	104.7	-166.3	-58.8	-58.4	0	0	0	115.5
532	I	45	Very low	55.6	Low	109 Å²	109	84 Å²	84	56%	0.559	46%	0.458	S	S	*	.			trans	-120.6	110.3	153.6	-59.4	177.7	0	0	0	106.3	L530 C536 L537	L530-I532 PolarHBondContact O-N 2.99Å; I532-C536 HydrophobicContact CG2-CB 3.71Å; I532-L537 HydrophobicContact CG2-CB 4.27Å
533	S	50.3	Low	54.7	Low	52 Å²	52	86 Å²	86	36%	0.364	47%	0.47	S	S	.	.			trans	-66.7	158.9	172.6	68.3	0	0	0	0	110.1	E535 C536 L537	S533-E535 PolarHBondContact O-N 2.95Å; S533-C536 CarbonylContact O-C 3.53Å; S533-C536 WeakPolarHBondContact O-CA 3.38Å; S533-C536 WeakPolarHBondContact O-CB 3.41Å; S533-C536 PolarHBondContact O-N 3.06Å; S533-C536 PolarHBondContact OG-N 3.33Å; S533-C536 PolarHBondContact OG-SG 2.95Å; S533-L537 PolarHBondContact O-N 3.47Å
534	W	52.7	Low	54.1	Low	79 Å²	79	84.9 Å²	84.9	30%	0.299	47%	0.465	S	S	.	.	H	α-helix	trans	-57.6	-37.8	174	-175.7	-109.7	0	0	0	111.1	V520 R524 C536 L537 N538 T545	V520-W534 HydrophobicContact CG1-CH2 3.51Å; V520-W534 HydrophobicContact CG1-CZ3 3.96Å; R524-W534 HydrophobicContact CG-CE3 3.56Å; R524-W534 HydrophobicContact CG-CH2 4.25Å; R524-W534 HydrophobicContact CG-CZ3 3.35Å; W534-C536 PolarHBondContact O-N 2.72Å; W534-L537 HydrophobicContact CE3-CD2 3.83Å; W534-L537 HydrophobicContact CH2-CD2 4.11Å; W534-L537 HydrophobicContact CZ3-CD2 3.4Å; W534-L537 VanDerWaalsContact CZ3-CD2 3.4Å; W534-L537 WeakPolarHBondContact O-CB 3.42Å; W534-L537 PolarHBondContact O-N 3.25Å; W534-L537 VanDerWaalsContact O-N 3.15Å; W534-N538 PolarHBondContact NE1-OD1 3.35Å; W534-N538 VanDerWaalsContact O-CG 3.27Å; W534-N538 PolarHBondContact O-N 3.32Å; W534-N538 PolarHBondContact O-OD1 3.25Å; W534-T545 HydrophobicContact CH2-CG2 4.45Å; W534-T545 HydrophobicContact CZ2-CG2 4.2Å
535	E	48.3	Very low	53.6	Low	150 Å²	150	82.2 Å²	82.2	70%	0.701	46%	0.461	S	S	*	.	H	α-helix	trans	-61	-40.9	172.2	-63.6	158.3	-177.2	0	0	112.3	S533 N538 A539	S533-E535 PolarHBondContact O-N 2.95Å; E535-N538 PolarHBondContact O-N 2.91Å; E535-A539 WeakPolarHBondContact O-CB 3.39Å; E535-A539 PolarHBondContact O-N 2.99Å
536	C	52.2	Low	52.8	Low	56 Å²	56	89 Å²	89	38%	0.378	47%	0.468	S	S	.	.	H	α-helix	trans	-67.1	-36.2	173.7	-71.3	0	0	0	0	111.8	I532 S533 W534 A539 V540	I532-C536 HydrophobicContact CG2-CB 3.71Å; S533-C536 CarbonylContact O-C 3.53Å; S533-C536 WeakPolarHBondContact O-CA 3.38Å; S533-C536 WeakPolarHBondContact O-CB 3.41Å; S533-C536 PolarHBondContact O-N 3.06Å; S533-C536 PolarHBondContact OG-N 3.33Å; S533-C536 PolarHBondContact OG-SG 2.95Å; W534-C536 PolarHBondContact O-N 2.72Å; C536-A539 PolarHBondContact O-N 3.5Å; C536-V540 WeakPolarHBondContact O-CB 3.38Å; C536-V540 WeakPolarHBondContact O-CG2 3.46Å; C536-V540 PolarHBondContact O-N 2.96Å
537	L	56.7	Low	52.3	Low	16 Å²	16	88.1 Å²	88.1	8%	0.084	47%	0.474	C	S	.	.	H	α-helix	trans	-65.8	-41.9	173.7	-169.3	74.6	0	0	0	110.4	M523 I532 S533 W534 A539 V540 R541	M523-L537 HydrophobicContact CE-CD1 3.86Å; I532-L537 HydrophobicContact CG2-CB 4.27Å; S533-L537 PolarHBondContact O-N 3.47Å; W534-L537 HydrophobicContact CE3-CD2 3.83Å; W534-L537 HydrophobicContact CH2-CD2 4.11Å; W534-L537 HydrophobicContact CZ3-CD2 3.4Å; W534-L537 VanDerWaalsContact CZ3-CD2 3.4Å; W534-L537 WeakPolarHBondContact O-CB 3.42Å; W534-L537 PolarHBondContact O-N 3.25Å; W534-L537 VanDerWaalsContact O-N 3.15Å; L537-A539 VanDerWaalsContact C-N 3.3Å; L537-A539 PolarHBondContact O-N 3.27Å; L537-V540 PolarHBondContact O-N 3.38Å; L537-R541 HydrophobicContact CD1-CB 4.32Å; L537-R541 HydrophobicContact CD1-CG 4.46Å; L537-R541 HydrophobicContact CG-CB 4.47Å; L537-R541 CarbonylContact O-C 3.59Å; L537-R541 VanDerWaalsContact O-CA 3.28Å; L537-R541 WeakPolarHBondContact O-CA 3.37Å; L537-R541 WeakPolarHBondContact O-CB 3.44Å; L537-R541 PolarHBondContact O-N 3.43Å
538	N	58	Low	51.4	Low	56 Å²	56	87.1 Å²	87.1	30%	0.299	47%	0.474	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.5	-64	7.2	0	0	0	112.4	W534 E535 P542 T545	W534-N538 PolarHBondContact NE1-OD1 3.35Å; W534-N538 VanDerWaalsContact O-CG 3.27Å; W534-N538 PolarHBondContact O-N 3.32Å; W534-N538 PolarHBondContact O-OD1 3.25Å; E535-N538 PolarHBondContact O-N 2.91Å; N538-P542 WeakPolarHBondContact O-CA 3.45Å; N538-T545 HydrophobicContact CB-CG2 4.12Å; N538-T545 WeakPolarHBondContact OD1-CG2 3.32Å
539	A	52.4	Low	51.1	Low	82 Å²	82	88.4 Å²	88.4	68%	0.678	47%	0.473	S	S	*	.	H	α-helix	trans	-72.2	-36.5	177.5	0	0	0	0	0	112.9	E535 C536 L537	E535-A539 WeakPolarHBondContact O-CB 3.39Å; E535-A539 PolarHBondContact O-N 2.99Å; C536-A539 PolarHBondContact O-N 3.5Å; L537-A539 VanDerWaalsContact C-N 3.3Å; L537-A539 PolarHBondContact O-N 3.27Å
540	V	57.2	Low	50	Low	116 Å²	116	91.1 Å²	91.1	70%	0.703	48%	0.475	S	S	*	.	H	α-helix	trans	-90.5	-29.4	-177.1	178.4	0	0	0	0	112.3	C536 L537	C536-V540 WeakPolarHBondContact O-CB 3.38Å; C536-V540 WeakPolarHBondContact O-CG2 3.46Å; C536-V540 PolarHBondContact O-N 2.96Å; L537-V540 PolarHBondContact O-N 3.38Å
541	R	62.7	Low	49.7	Very low	26 Å²	26	87.9 Å²	87.9	10%	0.098	48%	0.475	C	S	.	.			trans	-135.9	67.2	-176.7	-70.7	-170.9	165.4	162.7	-1.8	111.5	N500 H504 Y519 M523 L537 D543 L544	N500-R541 PolarHBondContact OD1-NH1 3.02Å; N500-R541 PolarHBondContact OD1-NH2 3.35Å; H504-R541 VanDerWaalsContact CB-NH2 3.27Å; H504-R541 VanDerWaalsContact O-CZ 3.29Å; H504-R541 PolarHBondContact O-NE 3.49Å; H504-R541 PolarHBondContact O-NH2 2.94Å; Y519-R541 PolarHBondContact OH-NH1 3.44Å; M523-R541 VanDerWaalsContact CE-NH1 3.31Å; L537-R541 HydrophobicContact CD1-CB 4.32Å; L537-R541 HydrophobicContact CD1-CG 4.46Å; L537-R541 HydrophobicContact CG-CB 4.47Å; L537-R541 CarbonylContact O-C 3.59Å; L537-R541 VanDerWaalsContact O-CA 3.28Å; L537-R541 WeakPolarHBondContact O-CA 3.37Å; L537-R541 WeakPolarHBondContact O-CB 3.44Å; L537-R541 PolarHBondContact O-N 3.43Å; R541-D543 VanDerWaalsContact C-OD1 3.25Å; R541-D543 WeakPolarHBondContact CA-OD1 3.4Å; R541-D543 PolarHBondContact O-N 3.02Å; R541-L544 HydrophobicContact CB-CD1 4.18Å; R541-L544 HydrophobicContact CB-CG 4.38Å; R541-L544 PolarHBondContact O-N 3.21Å
542	P	60.6	Low	49.2	Very low	55 Å²	55	89 Å²	89	36%	0.357	48%	0.475	S	S	.	.	G	3₁₀ helix	trans	-64.1	-28	179.1	25.7	-33.6	0	0	0	112.6	N538 L544 T545 R546	N538-P542 WeakPolarHBondContact O-CA 3.45Å; P542-L544 VanDerWaalsContact C-N 3.32Å; P542-L544 PolarHBondContact O-N 3.21Å; P542-T545 WeakPolarHBondContact CA-OG1 3.44Å; P542-T545 PolarHBondContact O-N 3.37Å; P542-T545 PolarHBondContact O-OG1 2.97Å; P542-R546 WeakPolarHBondContact O-CB 3.38Å; P542-R546 PolarHBondContact O-N 3.42Å
543	D	62.6	Low	48.5	Very low	67 Å²	67	89.2 Å²	89.2	36%	0.358	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-56.1	-41	176.9	64.4	-58.9	0	0	0	112.7	R541 T545	R541-D543 VanDerWaalsContact C-OD1 3.25Å; R541-D543 WeakPolarHBondContact CA-OD1 3.4Å; R541-D543 PolarHBondContact O-N 3.02Å; D543-T545 PolarHBondContact O-N 3.1Å
544	L	60.3	Low	47.4	Very low	9 Å²	9	95.8 Å²	95.8	5%	0.047	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-73.1	-10.2	178.1	-66.5	-178.8	0	0	0	113.8	T508 L516 Y519 V520 R541 P542	T508-L544 HydrophobicContact CG2-CD2 3.63Å; L516-L544 HydrophobicContact CD1-CD2 3.78Å; Y519-L544 HydrophobicContact CE1-CD1 4.01Å; Y519-L544 HydrophobicContact CE1-CD2 4.35Å; V520-L544 HydrophobicContact CG2-CB 4.43Å; R541-L544 HydrophobicContact CB-CD1 4.18Å; R541-L544 HydrophobicContact CB-CG 4.38Å; R541-L544 PolarHBondContact O-N 3.21Å; P542-L544 VanDerWaalsContact C-N 3.32Å; P542-L544 PolarHBondContact O-N 3.21Å
545	T	59.2	Low	46.3	Very low	53 Å²	53	98.1 Å²	98.1	33%	0.325	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-21.7	-171.2	68.3	0	0	0	0	112.6	W534 N538 P542 D543 V547	W534-T545 HydrophobicContact CH2-CG2 4.45Å; W534-T545 HydrophobicContact CZ2-CG2 4.2Å; N538-T545 HydrophobicContact CB-CG2 4.12Å; N538-T545 WeakPolarHBondContact OD1-CG2 3.32Å; P542-T545 WeakPolarHBondContact CA-OG1 3.44Å; P542-T545 PolarHBondContact O-N 3.37Å; P542-T545 PolarHBondContact O-OG1 2.97Å; D543-T545 PolarHBondContact O-N 3.1Å; T545-V547 VanDerWaalsContact C-N 3.33Å
546	R	49.3	Very low	45.3	Very low	202 Å²	202	96.4 Å²	96.4	76%	0.762	54%	0.536	S	S	*	.			trans	-90.6	8.6	-177.1	-149.9	-172.6	-71.8	-172.7	-2.9	113.1	P542 K548	P542-R546 WeakPolarHBondContact O-CB 3.38Å; P542-R546 PolarHBondContact O-N 3.42Å; R546-K548 PolarHBondContact O-N 3.36Å
547	V	48.4	Very low	44.3	Very low	87 Å²	87	102.6 Å²	102.6	53%	0.527	56%	0.56	S	S	.	*			trans	-68.7	87.3	171.4	-172.7	0	0	0	0	108.2	L516 T545 I549	L516-V547 HydrophobicContact CD2-CG2 3.84Å; T545-V547 VanDerWaalsContact C-N 3.33Å; V547-I549 PolarHBondContact O-N 3.45Å
548	K	32.4	Very low	42.6	Very low	153 Å²	153	110.7 Å²	110.7	67%	0.665	60%	0.599	S	S	*	*			trans	-66.6	114.6	169.4	-171.4	-177.7	174.2	-151	0	106.1	R546 E550	R546-K548 PolarHBondContact O-N 3.36Å; K548-E550 HydrophobicContact CD-CG 4.06Å; K548-E550 HydrophobicContact CG-CG 4.06Å; K548-E550 IonicContact NZ-OE1 2.69Å; K548-E550 PolarHBondContact NZ-OE1 3.48Å; K548-E550 PolarHBondContact O-N 3.47Å
549	I	37.2	Very low	41.3	Very low	113 Å²	113	114.7 Å²	114.7	58%	0.579	63%	0.626	S	S	*	*			trans	-70	85.5	171.4	-56.3	175.2	0	0	0	106.2	V547 G551	V547-I549 PolarHBondContact O-N 3.45Å; I549-G551 PolarHBondContact O-N 3.31Å
550	E	27.9	Very low	41	Very low	153 Å²	153	116.3 Å²	116.3	72%	0.715	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	105	163.5	-65.6	-172.4	160.1	0	0	106.1	K548	K548-E550 HydrophobicContact CD-CG 4.06Å; K548-E550 HydrophobicContact CG-CG 4.06Å; K548-E550 IonicContact NZ-OE1 2.69Å; K548-E550 PolarHBondContact NZ-OE1 3.48Å; K548-E550 PolarHBondContact O-N 3.47Å
551	G	31	Very low	39.8	Very low	67 Å²	67	121.1 Å²	121.1	69%	0.691	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	143.4	12	171.3	0	0	0	0	0	119	I549	I549-G551 PolarHBondContact O-N 3.31Å
552	Q	27.8	Very low	38	Very low	169 Å²	169	123.6 Å²	123.6	79%	0.79	67%	0.667	S	S	*	*			trans	-110.4	105.3	161.9	-75	-161.8	-21	0	0	110.3	Q554	Q552-Q554 PolarHBondContact O-N 2.9Å
553	P	32.2	Very low	36.3	Very low	112 Å²	112	129.2 Å²	129.2	73%	0.727	69%	0.688	S	S	*	*			trans	-62.9	133.5	175.1	12.9	-11.5	0	0	0	109.6	T555	P553-T555 PolarHBondContact O-N 3.38Å
554	Q	27	Very low	34.6	Very low	190 Å²	190	133.7 Å²	133.7	89%	0.888	71%	0.707	S	S	*	*			trans	-66.8	91.4	176.4	-63.9	179.3	-4.7	0	0	109.5	Q552	Q552-Q554 PolarHBondContact O-N 2.9Å
555	T	29.1	Very low	32.9	Very low	128 Å²	128	140.7 Å²	140.7	79%	0.785	74%	0.742	S	S	*	*			trans	-102.7	93.7	163.3	50	0	0	0	0	109.4	P553 Q557	P553-T555 PolarHBondContact O-N 3.38Å; T555-Q557 PolarHBondContact O-N 3.29Å
556	S	26.9	Very low	31.2	Very low	115 Å²	115	146 Å²	146	80%	0.804	77%	0.768	S	S	*	*			trans	-62.9	90.1	164.6	-53.2	0	0	0	0	110
557	Q	31.3	Very low	30.2	Very low	186 Å²	186	145 Å²	145	87%	0.869	77%	0.771	S	S	*	*			trans	-140.8	111.1	155.9	-73.4	-163.9	-0.9	0	0	111	T555	T555-Q557 PolarHBondContact O-N 3.29Å
558	M	21.9	Very low	29	Very low	185 Å²	185	150.2 Å²	150.2	91%	0.911	78%	0.783	S	S	*	*			trans	-67.4	129.5	162.9	-61.6	174.3	74.6	0	0	108.8
559	T	29	Very low	28.8	Very low	141 Å²	141	151.2 Å²	151.2	87%	0.865	80%	0.795	S	S	*	*			trans	-168.7	149.6	132.4	33.3	0	0	0	0	110.8
560	P	46.5	Very low	28	Very low	116 Å²	116	153.2 Å²	153.2	75%	0.753	81%	0.805	S	S	*	*			trans	-107.2	143.1	-168.6	37.1	-26.1	0	0	0	112.6
561	K	32.1	Very low	27.9	Very low	216 Å²	216	148.7 Å²	148.7	94%	0.939	80%	0.799	S	S	*	*			trans	-159.7	144.3	145.4	-116.7	172.3	-175.1	-179.7	0	112.5
562	A	25.8	Very low	27.5	Very low	78 Å²	78	150.3 Å²	150.3	65%	0.645	80%	0.801	S	S	*	*			trans	-77.6	167.4	-171.2	0	0	0	0	0	113.2
563	E	25.5	Very low	27.3	Very low	173 Å²	173	149 Å²	149	81%	0.808	80%	0.799	S	S	*	*			trans	78.4	133	138.6	-82.8	170.6	177.5	0	0	120.8
564	Q	26.6	Very low	26.9	Very low	161 Å²	161	149.5 Å²	149.5	75%	0.752	80%	0.8	S	S	*	*			trans	98.8	112	148.7	-76.3	174.9	12	0	0	120.2
565	M	25	Very low	26.9	Very low	157 Å²	157	146.3 Å²	146.3	77%	0.773	79%	0.793	S	S	*	*				95.3	93.9	129.3	-69.4	165.7	96.9	0	0	118.1	H567	M565-H567 PolarHBondContact O-N 3.24Å
566	N	22.5	Very low	26.7	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	79%	0.793	S	S	*	*			trans	-44.8	117.7	131.7	-78.8	-54.9	0	0	0	110.5
567	H	27.5	Very low	26.9	Very low	180 Å²	180	146.2 Å²	146.2	83%	0.833	80%	0.797	S	S	*	*			trans	-153.3	133.1	135.5	-132.9	-95.7	0	0	0	110.7	M565	M565-H567 PolarHBondContact O-N 3.24Å
568	Y	23.9	Very low	26.6	Very low	197 Å²	197	143.6 Å²	143.6	77%	0.773	79%	0.789	S	S	*	*			trans	-44.9	143.7	167.1	-85.4	-116	0	0	0	112.1
569	L	27.3	Very low	26.8	Very low	174 Å²	174	141.3 Å²	141.3	91%	0.911	79%	0.786	S	S	*	*				-157.5	121.8	128.9	-98	166.2	0	0	0	109.3
570	I	22.4	Very low	26.8	Very low	155 Å²	155	138.6 Å²	138.6	80%	0.795	77%	0.772	S	S	*	*			trans	-90.6	127.8	165.6	-65.9	168.2	0	0	0	105.3
571	G	24.1	Very low	25.9	Very low	58 Å²	58	140.2 Å²	140.2	60%	0.598	78%	0.775	S	S	*	*			trans	-169.3	98.3	167.8	0	0	0	0	0	106.2
572	S	22.9	Very low	26.1	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	77%	0.769	S	S	*	*				80.1	119.6	88.2	57.6	0	0	0	0	111.8
573	D	24.7	Very low	26.1	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	78%	0.778	S	S	*	*			trans	94.5	113.8	151.6	-56.7	-32.9	0	0	0	120.1
574	V	23.8	Very low	26.1	Very low	122 Å²	122	140 Å²	140	74%	0.739	78%	0.777	S	S	*	*				70.4	123.9	125.2	-178.3	0	0	0	0	114.6
575	T	26.9	Very low	26.4	Very low	122 Å²	122	144.5 Å²	144.5	75%	0.748	81%	0.805	S	S	*	*			cis	-165.6	155.2	32.1	10.2	0	0	0	0	108.3
576	A	24.5	Very low	26.5	Very low	96 Å²	96	143.9 Å²	143.9	79%	0.793	81%	0.806	S	S	*	*			trans	-52.8	136.5	163.7	0	0	0	0	0	112.6
577	V	30.7	Very low	26.7	Very low	145 Å²	145	142.8 Å²	142.8	88%	0.879	80%	0.802	S	S	*	*			trans	-140.7	142.9	151	-178.5	0	0	0	0	108.5
578	D	25.6	Very low	26.7	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	80%	0.801	S	S	*	*			trans	-61.7	152	-155.8	-133.2	-31.2	0	0	0	117.6
579	T	26.5	Very low	26.8	Very low	137 Å²	137	137.4 Å²	137.4	84%	0.84	80%	0.802	S	S	*	*			trans	-87	94.8	164.1	42.4	0	0	0	0	109.3
580	S	27.3	Very low	26.8	Very low	83 Å²	83	135.1 Å²	135.1	58%	0.58	80%	0.796	S	S	*	*			trans	-156	134.4	159.3	53	0	0	0	0	108.4
581	D	28.6	Very low	27.1	Very low	151 Å²	151	133.8 Å²	133.8	81%	0.807	80%	0.796	S	S	*	*			trans	81.2	104.6	-174.3	-46.9	-30.8	0	0	0	111.9
582	I	37	Very low	27.3	Very low	160 Å²	160	139.2 Å²	139.2	82%	0.821	81%	0.81	S	S	*	*				-152.3	97.3	68.2	-70.7	142	0	0	0	108.3
583	N	24.5	Very low	27.7	Very low	155 Å²	155	142.1 Å²	142.1	83%	0.829	82%	0.817	S	S	*	*			trans	-91	113.6	144.4	-88.7	-34.5	0	0	0	105.4
584	N	26.8	Very low	27.9	Very low	147 Å²	147	142.1 Å²	142.1	79%	0.786	82%	0.822	S	S	*	*			trans	167.2	88.1	149.2	-85.7	-26.6	0	0	0	110.9
585	L	32.7	Very low	28.3	Very low	255 Å²	255	143.9 Å²	143.9	100%	1.335	83%	0.83	S	S	*	*			trans	169	0	131.8	-95.6	154.8	0	0	0	110.2

Retrieved 585 of 585 residues in 97.4 ms (Link to these results)

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