A0A087YM03_POEFO Loading...

FERM domain-containing protein 8

AlphaFold DB , UniProt , Accession A0A087YM03, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 467 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	36.3	Very low	34.9	Very low	220 Å²	220	139.4 Å²	139.4	100%	1.084	81%	0.809	S	S	*	*				0	97.7	0	-69.4	175.7	172.1	0	0	104.8
2	E	34.8	Very low	34.9	Very low	190 Å²	190	140.8 Å²	140.8	89%	0.888	81%	0.809	S	S	*	*				54.9	122.5	81.9	-63.4	164.1	148.8	0	0	108.4
3	G	33.4	Very low	34.7	Very low	74 Å²	74	138.6 Å²	138.6	76%	0.763	81%	0.808	S	S	*	*			cis	140.4	106.1	34.9	0	0	0	0	0	104.7
4	D	37.5	Very low	34.5	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	81%	0.808	S	S	*	*			trans	36.4	141.4	146.2	-126.9	5.1	0	0	0	125
5	N	35.5	Very low	34.4	Very low	117 Å²	117	139.3 Å²	139.3	63%	0.626	80%	0.802	S	S	*	*			trans	88.8	101.9	141.3	-73.6	-34.3	0	0	0	124
6	C	32.6	Very low	34.3	Very low	109 Å²	109	142.9 Å²	142.9	74%	0.736	81%	0.81	S	S	*	*				67.9	120.1	115.5	-67.4	0	0	0	0	120.5
7	S	30.6	Very low	34.2	Very low	121 Å²	121	141.5 Å²	141.5	85%	0.846	81%	0.811	S	S	*	*			trans	-141.7	128.3	161.2	-60.8	0	0	0	0	108.5
8	F	37.2	Very low	34.3	Very low	206 Å²	206	143.3 Å²	143.3	90%	0.904	81%	0.811	S	S	*	*			trans	-77.5	157.8	171.3	-70	-84.8	0	0	0	111.1
9	P	39.8	Very low	34.5	Very low	131 Å²	131	148.3 Å²	148.3	85%	0.851	82%	0.816	S	S	*	*			trans	-134.9	171.7	138.8	33.4	-17.1	0	0	0	114.6
10	A	34.1	Very low	34.3	Very low	84 Å²	84	144.2 Å²	144.2	69%	0.694	81%	0.808	S	S	*	*			trans	-107.3	172.8	-159	0	0	0	0	0	115.8
11	D	32	Very low	34.8	Very low	138 Å²	138	143.5 Å²	143.5	74%	0.738	81%	0.813	S	S	*	*			trans	71.2	115	157.3	-66.4	-18.4	0	0	0	119.3
12	L	34.9	Very low	34.9	Very low	156 Å²	156	139 Å²	139	82%	0.817	80%	0.798	S	S	*	*				72.8	104.5	71.9	-73.2	177.2	0	0	0	113.9
13	S	32.7	Very low	35.3	Very low	113 Å²	113	134.6 Å²	134.6	79%	0.79	79%	0.794	S	S	*	*				177.5	132.8	128.9	36	0	0	0	0	112.9
14	D	31.5	Very low	35.8	Very low	151 Å²	151	134.8 Å²	134.8	81%	0.807	78%	0.784	S	S	*	*			trans	68.3	104.4	142.7	-67.8	-5	0	0	0	123.6
15	D	32.8	Very low	36.1	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	79%	0.792	S	S	*	*				87	96	102.8	-149	18.2	0	0	0	117.8
16	H	32.4	Very low	36.3	Very low	198 Å²	198	132 Å²	132	92%	0.917	79%	0.788	S	S	*	*			trans	-164.1	108.6	145.6	-85.2	-35.8	0	0	0	109.8
17	S	32.7	Very low	37	Very low	119 Å²	119	133.4 Å²	133.4	83%	0.832	79%	0.794	S	S	*	*			trans	-140.9	106.4	155.7	-167.7	0	0	0	0	111
18	Q	36.3	Very low	37.9	Very low	173 Å²	173	134.6 Å²	134.6	81%	0.808	79%	0.79	S	S	*	*			trans	-74.5	149.8	168.6	-70.2	-155.5	-8.3	0	0	111.2
19	R	37.6	Very low	39	Very low	239 Å²	239	128.2 Å²	128.2	90%	0.902	77%	0.771	S	S	*	*			trans	78.3	105.7	139.1	-151.8	173.4	-164	-146.6	3.6	116.7
20	G	30.8	Very low	40.6	Very low	65 Å²	65	132.1 Å²	132.1	67%	0.67	77%	0.769	S	S	*	*			trans	-169.7	64	165.2	0	0	0	0	0	113	V22	G20-V22 PolarHBondContact O-N 3.3Å; G20-V22 VanDerWaalsContact O-N 3.08Å
21	S	44.6	Very low	43	Very low	131 Å²	131	130.3 Å²	130.3	92%	0.916	75%	0.754	S	S	*	*			trans	-60.4	107.4	153.5	-71.4	0	0	0	0	108
22	V	38.5	Very low	45.7	Very low	124 Å²	124	128 Å²	128	75%	0.752	74%	0.738	S	S	*	*			trans	-118.9	95.9	161.2	-84.8	0	0	0	0	107.8	G20 S24	G20-V22 PolarHBondContact O-N 3.3Å; G20-V22 VanDerWaalsContact O-N 3.08Å; V22-S24 PolarHBondContact O-N 3.46Å
23	A	44.5	Very low	48.5	Very low	98 Å²	98	126.7 Å²	126.7	81%	0.81	73%	0.732	S	S	*	*			trans	-67	117.2	145.2	0	0	0	0	0	107.1
24	S	43.7	Very low	51.4	Low	79 Å²	79	122.2 Å²	122.2	55%	0.552	70%	0.7	S	S	*	*			trans	-149	83	162.7	-62.1	0	0	0	0	105.8	V22 A26	V22-S24 PolarHBondContact O-N 3.46Å; S24-A26 PolarHBondContact O-N 3.42Å
25	S	42.6	Very low	54.4	Low	135 Å²	135	118.2 Å²	118.2	94%	0.944	68%	0.679	S	S	*	*				28.1	14.5	79	-67.8	0	0	0	0	117
26	A	40.3	Very low	57.5	Low	65 Å²	65	111.8 Å²	111.8	54%	0.537	64%	0.644	S	S	.	*			trans	-135	18.6	-176.1	0	0	0	0	0	113.8	S24 L28	S24-A26 PolarHBondContact O-N 3.42Å; A26-L28 PolarHBondContact O-N 3.32Å; A26-L28 VanDerWaalsContact O-N 3.09Å
27	T	47.9	Very low	60.6	Low	140 Å²	140	107.2 Å²	107.2	86%	0.859	62%	0.62	S	S	*	*			trans	-81.1	67.1	152.1	44.5	0	0	0	0	108.7	S29	T27-S29 PolarHBondContact O-N 3.49Å
28	L	49	Very low	63.7	Low	145 Å²	145	102.4 Å²	102.4	76%	0.759	58%	0.584	S	S	*	*			trans	-54.1	115.9	162.6	-82.3	152.3	0	0	0	108.6	A26 R30	A26-L28 PolarHBondContact O-N 3.32Å; A26-L28 VanDerWaalsContact O-N 3.09Å; L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 3.04Å
29	S	59.8	Low	66.4	Low	73 Å²	73	95.5 Å²	95.5	51%	0.51	55%	0.552	S	S	.	*			trans	36.3	40.4	146.3	81.7	0	0	0	0	118.8	T27 A31	T27-S29 PolarHBondContact O-N 3.49Å; S29-A31 PolarHBondContact O-N 3.43Å
30	R	73.8	Confident	68.6	Low	212 Å²	212	86.4 Å²	86.4	80%	0.8	53%	0.533	S	S	*	.			trans	-81.3	118.1	165.5	-163.1	170.3	179.9	170.6	-0.9	107.8	L28 Q32	L28-R30 VanDerWaalsContact C-N 3.29Å; L28-R30 PolarHBondContact O-N 3.04Å; R30-Q32 PolarHBondContact O-N 2.95Å
31	A	83.9	Confident	71	Confident	46 Å²	46	93 Å²	93	38%	0.38	55%	0.546	S	S	.	.			trans	-52.6	127.7	167.9	0	0	0	0	0	108.6	S29 M48 E49	S29-A31 PolarHBondContact O-N 3.43Å; A31-M48 WeakPolarHBondContact CA-O 3.46Å; A31-E49 HydrophobicContact CB-CG 4.24Å
32	Q	89.9	Confident	73.2	Confident	89 Å²	89	90.4 Å²	90.4	42%	0.416	53%	0.528	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.8	177.3	-75.9	170.9	80.6	0	0	108.3	R30 M48 L51	R30-Q32 PolarHBondContact O-N 2.95Å; Q32-M48 PolarHBondContact N-O 2.91Å; Q32-M48 PolarHBondContact O-N 3.49Å; Q32-L51 HydrophobicContact CB-CB 4.29Å; Q32-L51 HydrophobicContact CB-CD2 4.15Å
33	D	92.1	Very high	76	Confident	129 Å²	129	86 Å²	86	69%	0.69	51%	0.505	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	133.9	177.6	-60.3	-30.3	0	0	0	109.9	L46 S47	D33-L46 CarbonylContact C-O 3.35Å; D33-L46 WeakPolarHBondContact CA-O 3.39Å; D33-S47 WeakPolarHBondContact OD1-CB 3.37Å; D33-S47 PolarHBondContact OD1-OG 2.99Å
34	V	94	Very high	78.5	Confident	19 Å²	19	81.9 Å²	81.9	12%	0.115	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.4	174.6	62.5	0	0	0	0	109.2	L46 M48 L51 L59	V34-L46 HydrophobicContact CG1-CB 3.77Å; V34-L46 PolarHBondContact N-O 3.33Å; V34-L46 PolarHBondContact O-N 3.48Å; V34-M48 HydrophobicContact CG1-CG 4.36Å; V34-M48 HydrophobicContact CG1-SD 4.13Å; V34-L51 HydrophobicContact CB-CD1 4.02Å; V34-L51 HydrophobicContact CB-CD2 4.25Å; V34-L51 HydrophobicContact CG1-CD1 4.22Å; V34-L51 HydrophobicContact CG2-CD1 4.25Å; V34-L59 HydrophobicContact CG1-CD1 4.23Å
35	L	95.8	Very high	81	Confident	68 Å²	68	84.9 Å²	84.9	36%	0.356	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	125.8	173	-60.1	-178.4	0	0	0	109.1	Y37 H45	L35-Y37 HydrophobicContact CB-CE2 4.41Å; L35-H45 HydrophobicContact CD2-CB 4.23Å; L35-H45 WeakPolarHBondContact CD2-CE1 3.37Å; L35-H45 VanDerWaalsContact CD2-CG 3.44Å; L35-H45 WeakPolarHBondContact CD2-ND1 3.48Å
36	V	97.8	Very high	83.5	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	108.5	172.5	-175.6	0	0	0	0	107.8	A43 V44 V63 F79 L125	V36-A43 CarbonylContact O-C 3.56Å; V36-A43 VanDerWaalsContact O-CA 3.29Å; V36-A43 WeakPolarHBondContact O-CA 3.49Å; V36-V44 HydrophobicContact CB-CB 4.34Å; V36-V44 PolarHBondContact N-O 3.4Å; V36-V44 PolarHBondContact O-N 2.79Å; V36-V63 HydrophobicContact CB-CG2 4.29Å; V36-V63 HydrophobicContact CG1-CG2 4.28Å; V36-V63 HydrophobicContact CG2-CG2 3.93Å; V36-F79 HydrophobicContact CG1-CD1 4.19Å; V36-F79 HydrophobicContact CG1-CE1 3.71Å; V36-F79 HydrophobicContact CG2-CE1 4.14Å; V36-L125 HydrophobicContact CG2-CD2 4.22Å
37	Y	97.8	Very high	86.1	Confident	103 Å²	103	80 Å²	80	40%	0.404	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	141.8	-178.5	-68.5	-87.7	0	0	0	110.9	L35 A43 Y124 L125 Q126 Y127	L35-Y37 HydrophobicContact CB-CE2 4.41Å; Y37-A43 HydrophobicContact CD1-CB 4.32Å; Y37-Y124 AromaticContact CD2-CD2 3.7Å; Y37-Y124 HydrophobicContact CD2-CD2 3.7Å; Y37-Y124 HydrophobicContact CD2-CG 4.16Å; Y37-Y124 HydrophobicContact CE2-CD2 4.44Å; Y37-Y124 HydrophobicContact CE2-CG 4.48Å; Y37-Y124 HydrophobicContact CG-CD2 4.02Å; Y37-L125 PolarHBondContact N-O 3.37Å; Y37-Q126 CarbonylContact O-C 3.5Å; Y37-Q126 VanDerWaalsContact O-CA 3.29Å; Y37-Q126 WeakPolarHBondContact O-CA 3.34Å; Y37-Y127 PolarHBondContact O-N 2.85Å
38	L	97.1	Very high	88.1	Confident	17 Å²	17	74.5 Å²	74.5	9%	0.089	40%	0.399	C	S	.	.			trans	-106.5	170	169.7	-54.2	176.9	0	0	0	109	S42 V44 L67 Y127 L149	L38-S42 PolarHBondContact N-O 3.45Å; L38-V44 HydrophobicContact CD1-CG2 4.14Å; L38-V44 HydrophobicContact CD2-CG2 4.33Å; L38-V44 HydrophobicContact CG-CG2 4.4Å; L38-L67 HydrophobicContact CD1-CD2 3.98Å; L38-L67 HydrophobicContact CD2-CD1 4.2Å; L38-Y127 HydrophobicContact CD2-CD1 4.2Å; L38-L149 HydrophobicContact CD1-CD2 3.99Å; L38-L149 HydrophobicContact CD2-CD2 4.48Å
39	F	93.8	Very high	90.1	Very high	28 Å²	28	73.6 Å²	73.6	12%	0.123	39%	0.391	C	S	.	.	S	Bend	trans	-68.5	145.5	162.7	-84.4	-85.1	0	0	0	110.5	R128 E152 E153 S156	F39-R128 HydrophobicContact CD2-CB 3.86Å; F39-R128 HydrophobicContact CE2-CB 3.59Å; F39-R128 HydrophobicContact CE2-CG 4.24Å; F39-E152 HydrophobicContact CB-CB 4.09Å; F39-E153 HydrophobicContact CB-CB 4.13Å; F39-E153 HydrophobicContact CD1-CB 4.43Å; F39-E153 HydrophobicContact CD2-CB 3.46Å; F39-E153 VanDerWaalsContact CD2-CB 3.46Å; F39-E153 HydrophobicContact CD2-CG 3.62Å; F39-E153 HydrophobicContact CE1-CG 4.42Å; F39-E153 HydrophobicContact CE2-CB 3.86Å; F39-E153 HydrophobicContact CE2-CG 3.43Å; F39-E153 VanDerWaalsContact CE2-CG 3.43Å; F39-E153 VanDerWaalsContact CG-CA 3.49Å; F39-E153 HydrophobicContact CG-CB 3.77Å; F39-E153 HydrophobicContact CG-CG 4.19Å; F39-E153 HydrophobicContact CZ-CB 4.5Å; F39-E153 HydrophobicContact CZ-CG 3.87Å; F39-S156 VanDerWaalsContact CD1-CB 3.42Å
40	G	82.2	Confident	91.5	Very high	49 Å²	49	71.7 Å²	71.7	51%	0.505	38%	0.383	S	S	.	.	S	Bend	trans	95.9	-152.4	-169.7	0	0	0	0	0	111.9
41	E	82	Confident	92.1	Very high	203 Å²	203	62.8 Å²	62.8	95%	0.949	35%	0.351	S	S	*	.	S	Bend	trans	-106.8	37	-178.5	-61.4	-175.6	174	0	0	111.6
42	S	91.3	Very high	92.4	Very high	76 Å²	76	61.9 Å²	61.9	53%	0.531	35%	0.347	S	S	.	.			trans	-132.8	153.4	-172	-63.2	0	0	0	0	113.2	L38	L38-S42 PolarHBondContact N-O 3.45Å
43	A	96.6	Very high	92.5	Very high	33 Å²	33	61 Å²	61	27%	0.273	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	151.8	176.2	0	0	0	0	0	110.6	V36 Y37	V36-A43 CarbonylContact O-C 3.56Å; V36-A43 VanDerWaalsContact O-CA 3.29Å; V36-A43 WeakPolarHBondContact O-CA 3.49Å; Y37-A43 HydrophobicContact CD1-CB 4.32Å
44	V	97.1	Very high	92.6	Very high	11 Å²	11	55.5 Å²	55.5	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	123.5	170.4	-177.7	0	0	0	0	108.4	V36 L38 L46 V63 A66 L67	V36-V44 HydrophobicContact CB-CB 4.34Å; V36-V44 PolarHBondContact N-O 3.4Å; V36-V44 PolarHBondContact O-N 2.79Å; L38-V44 HydrophobicContact CD1-CG2 4.14Å; L38-V44 HydrophobicContact CD2-CG2 4.33Å; L38-V44 HydrophobicContact CG-CG2 4.4Å; V44-L46 HydrophobicContact CG1-CD2 3.81Å; V44-L46 HydrophobicContact CG1-CG 3.93Å; V44-V63 HydrophobicContact CG2-CG1 4.42Å; V44-A66 HydrophobicContact CG1-CB 3.65Å; V44-L67 HydrophobicContact CG2-CD1 4.01Å; V44-L67 HydrophobicContact CG2-CD2 3.6Å; V44-L67 HydrophobicContact CG2-CG 3.75Å
45	H	96.5	Very high	92.7	Very high	142 Å²	142	55.4 Å²	55.4	66%	0.657	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.9	176.7	-68.1	-123	0	0	0	108.7	L35	L35-H45 HydrophobicContact CD2-CB 4.23Å; L35-H45 WeakPolarHBondContact CD2-CE1 3.37Å; L35-H45 VanDerWaalsContact CD2-CG 3.44Å; L35-H45 WeakPolarHBondContact CD2-ND1 3.48Å
46	L	95.5	Very high	92.8	Very high	22 Å²	22	52.8 Å²	52.8	12%	0.115	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	143.7	177.1	-58.1	174.6	0	0	0	109.8	D33 V34 V44 M48 L59 V63 A66	D33-L46 CarbonylContact C-O 3.35Å; D33-L46 WeakPolarHBondContact CA-O 3.39Å; V34-L46 HydrophobicContact CG1-CB 3.77Å; V34-L46 PolarHBondContact N-O 3.33Å; V34-L46 PolarHBondContact O-N 3.48Å; V44-L46 HydrophobicContact CG1-CD2 3.81Å; V44-L46 HydrophobicContact CG1-CG 3.93Å; L46-M48 HydrophobicContact CB-CG 4.1Å; L46-M48 HydrophobicContact CB-SD 4.41Å; L46-M48 HydrophobicContact CD1-SD 4.27Å; L46-L59 HydrophobicContact CD1-CD1 3.69Å; L46-V63 HydrophobicContact CD1-CG2 3.66Å; L46-A66 HydrophobicContact CD2-CB 4.08Å
47	S	94.1	Very high	92.7	Very high	76 Å²	76	58.7 Å²	58.7	53%	0.531	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	118.5	168.9	-153.8	0	0	0	0	108.5	D33	D33-S47 WeakPolarHBondContact OD1-CB 3.37Å; D33-S47 PolarHBondContact OD1-OG 2.99Å
48	M	89.8	Confident	92.5	Very high	24 Å²	24	58 Å²	58	12%	0.118	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	136.6	-170.1	-59.2	-170.3	77.4	0	0	112.1	A31 Q32 V34 L46 V54 L59	A31-M48 WeakPolarHBondContact CA-O 3.46Å; Q32-M48 PolarHBondContact N-O 2.91Å; Q32-M48 PolarHBondContact O-N 3.49Å; V34-M48 HydrophobicContact CG1-CG 4.36Å; V34-M48 HydrophobicContact CG1-SD 4.13Å; L46-M48 HydrophobicContact CB-CG 4.1Å; L46-M48 HydrophobicContact CB-SD 4.41Å; L46-M48 HydrophobicContact CD1-SD 4.27Å; M48-V54 HydrophobicContact CE-CG1 3.84Å; M48-V54 HydrophobicContact CE-CG2 4.15Å; M48-V54 HydrophobicContact SD-CG1 4.45Å; M48-L59 HydrophobicContact CE-CD1 4.26Å; M48-L59 HydrophobicContact SD-CD1 3.34Å; M48-L59 WeakPolarHBondContact SD-CD1 3.37Å
49	E	91	Very high	92.5	Very high	125 Å²	125	57.4 Å²	57.4	58%	0.584	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	145.2	170.1	-65.7	-174.7	-177.2	0	0	110.9	A31 L51	A31-E49 HydrophobicContact CB-CG 4.24Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.08Å
50	G	88.7	Confident	92.5	Very high	33 Å²	33	56.2 Å²	56.2	34%	0.34	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.8	30.3	173.8	0	0	0	0	0	114.8	G52 S53 V54	G50-G52 PolarHBondContact O-N 3.39Å; G50-S53 PolarHBondContact O-N 2.91Å; G50-S53 PolarHBondContact O-OG 3.41Å; G50-V54 PolarHBondContact O-N 3.02Å
51	L	87.2	Confident	93.1	Very high	25 Å²	25	60.3 Å²	60.3	13%	0.131	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-33.6	-177.5	-174.1	64.2	0	0	0	114.1	Q32 V34 E49 S53 V54	Q32-L51 HydrophobicContact CB-CB 4.29Å; Q32-L51 HydrophobicContact CB-CD2 4.15Å; V34-L51 HydrophobicContact CB-CD1 4.02Å; V34-L51 HydrophobicContact CB-CD2 4.25Å; V34-L51 HydrophobicContact CG1-CD1 4.22Å; V34-L51 HydrophobicContact CG2-CD1 4.25Å; E49-L51 VanDerWaalsContact C-N 3.34Å; E49-L51 PolarHBondContact O-N 3.08Å; L51-S53 PolarHBondContact O-N 3.36Å; L51-V54 PolarHBondContact O-N 3.02Å
52	G	89.1	Confident	93.7	Very high	28 Å²	28	52.3 Å²	52.3	29%	0.289	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.5	177.1	0	0	0	0	0	115.8	G50	G50-G52 PolarHBondContact O-N 3.39Å
53	S	92.1	Very high	93.9	Very high	71 Å²	71	48.7 Å²	48.7	50%	0.497	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121	-5.6	177.7	50.9	0	0	0	0	114.4	G50 L51 S55 Q95	G50-S53 PolarHBondContact O-N 2.91Å; G50-S53 PolarHBondContact O-OG 3.41Å; L51-S53 PolarHBondContact O-N 3.36Å; S53-S55 PolarHBondContact O-N 3.33Å; S53-Q95 PolarHBondContact O-NE2 3.23Å
54	V	95.1	Very high	93.9	Very high	12 Å²	12	48.9 Å²	48.9	7%	0.073	26%	0.264	C	S	.	.			trans	-60.9	128.1	178.8	171	0	0	0	0	110	M48 G50 L51 E58 L59 Q95 P96	M48-V54 HydrophobicContact CE-CG1 3.84Å; M48-V54 HydrophobicContact CE-CG2 4.15Å; M48-V54 HydrophobicContact SD-CG1 4.45Å; G50-V54 PolarHBondContact O-N 3.02Å; L51-V54 PolarHBondContact O-N 3.02Å; V54-E58 HydrophobicContact CG1-CB 4.18Å; V54-L59 HydrophobicContact CG1-CB 3.92Å; V54-Q95 WeakPolarHBondContact O-CA 3.48Å; V54-P96 WeakPolarHBondContact O-CD 3.4Å
55	S	96.6	Very high	93.8	Very high	18 Å²	18	55.6 Å²	55.6	13%	0.126	30%	0.295	C	S	.	.			trans	-81.8	158.1	174.2	64.6	0	0	0	0	111.9	S53 Q57 E58 L59 H94	S53-S55 PolarHBondContact O-N 3.33Å; S55-Q57 PolarHBondContact O-N 2.86Å; S55-E58 PolarHBondContact N-OE2 2.95Å; S55-E58 PolarHBondContact O-N 3.23Å; S55-E58 VanDerWaalsContact OG-CD 3.24Å; S55-E58 VanDerWaalsContact OG-CG 3.31Å; S55-E58 WeakPolarHBondContact OG-CG 3.49Å; S55-E58 PolarHBondContact OG-N 3.08Å; S55-E58 PolarHBondContact OG-OE2 3.37Å; S55-L59 WeakPolarHBondContact O-CB 3.33Å; S55-L59 PolarHBondContact O-N 3.14Å; S55-H94 CarbonylContact C-O 3.56Å; S55-H94 VanDerWaalsContact CA-O 3.3Å; S55-H94 WeakPolarHBondContact CA-O 3.32Å
56	V	96.9	Very high	93.8	Very high	13 Å²	13	51.4 Å²	51.4	8%	0.079	29%	0.285	C	S	.	.	H	α-helix	trans	-55.6	-36.8	171.8	166.5	0	0	0	0	111.8	G60 F79 L90 K91 A92 H94 P96	V56-G60 PolarHBondContact O-N 3.41Å; V56-F79 HydrophobicContact CG1-CB 4.19Å; V56-F79 HydrophobicContact CG1-CD2 3.62Å; V56-F79 HydrophobicContact CG1-CE2 4.38Å; V56-F79 HydrophobicContact CG1-CG 4.23Å; V56-L90 HydrophobicContact CG2-CB 3.66Å; V56-L90 HydrophobicContact CG2-CD1 3.78Å; V56-L90 HydrophobicContact CG2-CG 4.41Å; V56-K91 WeakPolarHBondContact CB-O 3.28Å; V56-A92 PolarHBondContact N-O 3.05Å; V56-H94 HydrophobicContact CG2-CB 4.13Å; V56-H94 WeakPolarHBondContact CG2-O 3.49Å; V56-H94 PolarHBondContact N-O 3.33Å; V56-P96 HydrophobicContact CG2-CG 3.81Å
57	Q	95.4	Very high	93.7	Very high	124 Å²	124	51.9 Å²	51.9	58%	0.579	29%	0.287	S	S	*	.	H	α-helix	trans	-64.2	-45.2	177.9	-174.2	178.5	2.9	0	0	112.3	S55 G60 R61 A92	S55-Q57 PolarHBondContact O-N 2.86Å; Q57-G60 PolarHBondContact O-N 3.32Å; Q57-R61 PolarHBondContact O-N 3.37Å; Q57-A92 HydrophobicContact CB-CB 4.29Å; Q57-A92 PolarHBondContact N-O 3.23Å
58	E	94.8	Very high	93.8	Very high	89 Å²	89	55.9 Å²	55.9	42%	0.416	30%	0.298	S	S	.	.	H	α-helix	trans	-67.2	-47.1	178.1	-71.4	159.6	154.4	0	0	111.1	V54 S55 G60 R61 S62	V54-E58 HydrophobicContact CG1-CB 4.18Å; S55-E58 PolarHBondContact N-OE2 2.95Å; S55-E58 PolarHBondContact O-N 3.23Å; S55-E58 VanDerWaalsContact OG-CD 3.24Å; S55-E58 VanDerWaalsContact OG-CG 3.31Å; S55-E58 WeakPolarHBondContact OG-CG 3.49Å; S55-E58 PolarHBondContact OG-N 3.08Å; S55-E58 PolarHBondContact OG-OE2 3.37Å; E58-G60 VanDerWaalsContact C-N 3.26Å; E58-G60 PolarHBondContact O-N 3.16Å; E58-R61 WeakPolarHBondContact O-CB 3.33Å; E58-R61 PolarHBondContact O-N 3.09Å; E58-R61 VanDerWaalsContact O-N 3.16Å; E58-S62 PolarHBondContact O-N 3.44Å
59	L	95.7	Very high	93.9	Very high	3 Å²	3	55.1 Å²	55.1	2%	0.016	29%	0.294	C	S	.	.	H	α-helix	trans	-59.3	-39.4	176.1	-175	62.6	0	0	0	111.8	V34 L46 M48 V54 S55 R61 S62 V63 F79 P96 L125	V34-L59 HydrophobicContact CG1-CD1 4.23Å; L46-L59 HydrophobicContact CD1-CD1 3.69Å; M48-L59 HydrophobicContact CE-CD1 4.26Å; M48-L59 HydrophobicContact SD-CD1 3.34Å; M48-L59 WeakPolarHBondContact SD-CD1 3.37Å; V54-L59 HydrophobicContact CG1-CB 3.92Å; S55-L59 WeakPolarHBondContact O-CB 3.33Å; S55-L59 PolarHBondContact O-N 3.14Å; L59-R61 VanDerWaalsContact C-N 3.31Å; L59-R61 PolarHBondContact O-N 2.97Å; L59-S62 PolarHBondContact O-N 2.96Å; L59-V63 WeakPolarHBondContact O-CG2 3.23Å; L59-V63 PolarHBondContact O-N 3.14Å; L59-F79 HydrophobicContact CB-CZ 4.16Å; L59-F79 HydrophobicContact CD2-CD1 4Å; L59-F79 HydrophobicContact CD2-CE1 3.53Å; L59-F79 HydrophobicContact CD2-CZ 3.93Å; L59-F79 HydrophobicContact CG-CE1 3.71Å; L59-F79 HydrophobicContact CG-CE2 4.48Å; L59-F79 HydrophobicContact CG-CZ 3.63Å; L59-P96 HydrophobicContact CD2-CG 4.27Å; L59-L125 HydrophobicContact CD2-CD2 3.47Å; L59-L125 VanDerWaalsContact CD2-CD2 3.47Å
60	G	95	Very high	93.9	Very high	3 Å²	3	51 Å²	51	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-63	-33.6	177.5	0	0	0	0	0	114	V56 Q57 E58 R64	V56-G60 PolarHBondContact O-N 3.41Å; Q57-G60 PolarHBondContact O-N 3.32Å; E58-G60 VanDerWaalsContact C-N 3.26Å; E58-G60 PolarHBondContact O-N 3.16Å; G60-R64 WeakPolarHBondContact O-CB 3.43Å; G60-R64 WeakPolarHBondContact O-CG 3.42Å; G60-R64 PolarHBondContact O-N 2.8Å
61	R	94.1	Very high	93.8	Very high	135 Å²	135	56.2 Å²	56.2	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-49.2	172.9	-169.6	-174.2	-59.8	116.9	0.3	110.6	Q57 E58 L59 V63 R64 E65	Q57-R61 PolarHBondContact O-N 3.37Å; E58-R61 WeakPolarHBondContact O-CB 3.33Å; E58-R61 PolarHBondContact O-N 3.09Å; E58-R61 VanDerWaalsContact O-N 3.16Å; L59-R61 VanDerWaalsContact C-N 3.31Å; L59-R61 PolarHBondContact O-N 2.97Å; R61-V63 PolarHBondContact O-N 3.38Å; R61-R64 PolarHBondContact O-N 3.05Å; R61-E65 WeakPolarHBondContact O-CB 3.46Å; R61-E65 PolarHBondContact O-N 3.1Å
62	S	95.4	Very high	93.6	Very high	35 Å²	35	60.1 Å²	60.1	25%	0.245	32%	0.323	C	S	.	.	H	α-helix	trans	-63.5	-40.3	179.9	-58.9	0	0	0	0	112.9	E58 L59 A66	E58-S62 PolarHBondContact O-N 3.44Å; L59-S62 PolarHBondContact O-N 2.96Å; S62-A66 WeakPolarHBondContact O-CB 3.31Å; S62-A66 PolarHBondContact O-N 3.08Å
63	V	96.3	Very high	93.3	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-44	175.9	170	0	0	0	0	111.5	V36 V44 L46 L59 R61 E65 A66 L67 F79 Y127	V36-V63 HydrophobicContact CB-CG2 4.29Å; V36-V63 HydrophobicContact CG1-CG2 4.28Å; V36-V63 HydrophobicContact CG2-CG2 3.93Å; V44-V63 HydrophobicContact CG2-CG1 4.42Å; L46-V63 HydrophobicContact CD1-CG2 3.66Å; L59-V63 WeakPolarHBondContact O-CG2 3.23Å; L59-V63 PolarHBondContact O-N 3.14Å; R61-V63 PolarHBondContact O-N 3.38Å; V63-E65 VanDerWaalsContact C-N 3.35Å; V63-E65 PolarHBondContact O-N 3Å; V63-A66 PolarHBondContact O-N 3.16Å; V63-L67 HydrophobicContact CG1-CD1 3.68Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact O-CB 2.96Å; V63-L67 WeakPolarHBondContact O-CG 3.31Å; V63-L67 PolarHBondContact O-N 3.18Å; V63-F79 HydrophobicContact CB-CZ 4.07Å; V63-F79 HydrophobicContact CG2-CE1 3.95Å; V63-F79 HydrophobicContact CG2-CZ 3.65Å; V63-Y127 HydrophobicContact CG1-CD1 3.75Å; V63-Y127 HydrophobicContact CG1-CD2 4.18Å; V63-Y127 HydrophobicContact CG1-CE1 3.78Å; V63-Y127 HydrophobicContact CG1-CE2 4.23Å; V63-Y127 HydrophobicContact CG1-CG 3.93Å
64	R	95.7	Very high	92.7	Very high	38 Å²	38	57.7 Å²	57.7	14%	0.143	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-40.3	177.8	-75	-166.6	-56.6	-86.7	-5.5	112.4	G60 R61 L67 Q68 I69 P74 Y127	G60-R64 WeakPolarHBondContact O-CB 3.43Å; G60-R64 WeakPolarHBondContact O-CG 3.42Å; G60-R64 PolarHBondContact O-N 2.8Å; R61-R64 PolarHBondContact O-N 3.05Å; R64-L67 CarbonylContact O-C 3.52Å; R64-L67 PolarHBondContact O-N 3.24Å; R64-Q68 WeakPolarHBondContact O-CA 3.48Å; R64-Q68 PolarHBondContact O-N 3.34Å; R64-I69 HydrophobicContact CB-CB 4.07Å; R64-I69 HydrophobicContact CG-CB 4.03Å; R64-I69 HydrophobicContact CG-CD1 4.1Å; R64-I69 HydrophobicContact CG-CG2 4.15Å; R64-I69 PolarHBondContact O-N 2.93Å; R64-P74 PolarHBondContact NH1-O 2.96Å; R64-Y127 WeakPolarHBondContact CG-OH 3.36Å
65	E	94.7	Very high	92.5	Very high	151 Å²	151	62.1 Å²	62.1	71%	0.706	32%	0.324	S	S	*	.	H	α-helix	trans	-61.9	-48.3	175	-176.3	176.3	-173.9	0	0	111.2	R61 V63 L67 Q68	R61-E65 WeakPolarHBondContact O-CB 3.46Å; R61-E65 PolarHBondContact O-N 3.1Å; V63-E65 VanDerWaalsContact C-N 3.35Å; V63-E65 PolarHBondContact O-N 3Å; E65-L67 VanDerWaalsContact C-N 3.28Å; E65-L67 PolarHBondContact O-N 3.43Å; E65-Q68 PolarHBondContact O-N 2.92Å; E65-Q68 VanDerWaalsContact O-N 3.08Å
66	A	96	Very high	92.5	Very high	55 Å²	55	61.3 Å²	61.3	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-62.1	-34.7	178.2	0	0	0	0	0	113	V44 L46 S62 V63	V44-A66 HydrophobicContact CG1-CB 3.65Å; L46-A66 HydrophobicContact CD2-CB 4.08Å; S62-A66 WeakPolarHBondContact O-CB 3.31Å; S62-A66 PolarHBondContact O-N 3.08Å; V63-A66 PolarHBondContact O-N 3.16Å
67	L	95.1	Very high	92.5	Very high	31 Å²	31	61.2 Å²	61.2	16%	0.162	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-2.5	176.9	-67.3	176.4	0	0	0	113.7	L38 V44 V63 R64 E65 I69 Y127 T145 L149	L38-L67 HydrophobicContact CD1-CD2 3.98Å; L38-L67 HydrophobicContact CD2-CD1 4.2Å; V44-L67 HydrophobicContact CG2-CD1 4.01Å; V44-L67 HydrophobicContact CG2-CD2 3.6Å; V44-L67 HydrophobicContact CG2-CG 3.75Å; V63-L67 HydrophobicContact CG1-CD1 3.68Å; V63-L67 HydrophobicContact CG1-CG 4.34Å; V63-L67 WeakPolarHBondContact O-CB 2.96Å; V63-L67 WeakPolarHBondContact O-CG 3.31Å; V63-L67 PolarHBondContact O-N 3.18Å; R64-L67 CarbonylContact O-C 3.52Å; R64-L67 PolarHBondContact O-N 3.24Å; E65-L67 VanDerWaalsContact C-N 3.28Å; E65-L67 PolarHBondContact O-N 3.43Å; L67-I69 HydrophobicContact CB-CD1 3.89Å; L67-I69 HydrophobicContact CB-CG1 3.81Å; L67-I69 HydrophobicContact CD1-CD1 3.85Å; L67-I69 PolarHBondContact O-N 3.17Å; L67-Y127 HydrophobicContact CD1-CD1 4.14Å; L67-Y127 HydrophobicContact CD1-CE1 4.16Å; L67-T145 WeakPolarHBondContact O-CG2 3.31Å; L67-L149 HydrophobicContact CD1-CD1 4.11Å
68	Q	94.5	Very high	92.6	Very high	161 Å²	161	55.9 Å²	55.9	75%	0.752	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	34.7	-174.5	-53.7	177.6	3.4	0	0	113.2	R64 E65	R64-Q68 WeakPolarHBondContact O-CA 3.48Å; R64-Q68 PolarHBondContact O-N 3.34Å; E65-Q68 PolarHBondContact O-N 2.92Å; E65-Q68 VanDerWaalsContact O-N 3.08Å
69	I	92.9	Very high	92.8	Very high	8 Å²	8	51.8 Å²	51.8	4%	0.041	28%	0.275	C	S	.	.			trans	-71.2	129.4	177.2	-68.6	169.9	0	0	0	108.8	R64 L67 F77 Y127 V146 L149	R64-I69 HydrophobicContact CB-CB 4.07Å; R64-I69 HydrophobicContact CG-CB 4.03Å; R64-I69 HydrophobicContact CG-CD1 4.1Å; R64-I69 HydrophobicContact CG-CG2 4.15Å; R64-I69 PolarHBondContact O-N 2.93Å; L67-I69 HydrophobicContact CB-CD1 3.89Å; L67-I69 HydrophobicContact CB-CG1 3.81Å; L67-I69 HydrophobicContact CD1-CD1 3.85Å; L67-I69 PolarHBondContact O-N 3.17Å; I69-F77 HydrophobicContact CD1-CD2 3.91Å; I69-F77 HydrophobicContact CD1-CE2 4.03Å; I69-Y127 HydrophobicContact CD1-CE1 3.87Å; I69-V146 HydrophobicContact CG2-CG2 4.1Å; I69-L149 HydrophobicContact CD1-CD1 3.91Å; I69-L149 HydrophobicContact CG1-CD1 4.36Å
70	P	90.6	Very high	92.9	Very high	37 Å²	37	52.1 Å²	52.1	24%	0.24	28%	0.276	C	S	.	.			trans	-66.2	143.2	-178.2	26.7	-35.3	0	0	0	112.4	S72 A73 D143 V146	P70-S72 PolarHBondContact O-N 3.3Å; P70-A73 HydrophobicContact CG-CB 4.47Å; P70-A73 PolarHBondContact O-N 3.06Å; P70-D143 HydrophobicContact CG-CB 4.04Å; P70-V146 HydrophobicContact CG-CG2 4.27Å
71	E	85.8	Confident	93	Very high	143 Å²	143	52 Å²	52	67%	0.668	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.5	177.3	-68.6	-63.5	157.3	0	0	113.7	A73 P74	E71-A73 PolarHBondContact O-N 3.42Å; E71-P74 WeakPolarHBondContact O-CD 3.44Å
72	S	84.8	Confident	93.2	Very high	108 Å²	108	45.7 Å²	45.7	76%	0.755	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13	173	58.8	0	0	0	0	113.7	P70 P74	P70-S72 PolarHBondContact O-N 3.3Å; S72-P74 VanDerWaalsContact C-CD 3.45Å
73	A	80.9	Confident	93.3	Very high	8 Å²	8	44.4 Å²	44.4	7%	0.066	24%	0.242	C	C	.	.			trans	-130.6	42.1	-173	0	0	0	0	0	113.4	P70 E71 D75 T76	P70-A73 HydrophobicContact CG-CB 4.47Å; P70-A73 PolarHBondContact O-N 3.06Å; E71-A73 PolarHBondContact O-N 3.42Å; A73-D75 VanDerWaalsContact C-N 3.28Å; A73-D75 PolarHBondContact O-N 3.16Å; A73-T76 WeakPolarHBondContact CB-OG1 3.33Å; A73-T76 PolarHBondContact O-N 2.88Å; A73-T76 PolarHBondContact O-OG1 2.81Å
74	P	81.5	Confident	93.2	Very high	40 Å²	40	50.2 Å²	50.2	26%	0.26	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-25.8	-163.9	30.8	-35.4	0	0	0	113.4	R64 E71 S72	R64-P74 PolarHBondContact NH1-O 2.96Å; E71-P74 WeakPolarHBondContact O-CD 3.44Å; S72-P74 VanDerWaalsContact C-CD 3.45Å
75	D	90.7	Very high	93.2	Very high	105 Å²	105	50.5 Å²	50.5	56%	0.561	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	10.2	-174.1	-58.8	-37.8	0	0	0	113.4	A73 F77 N130 Y133	A73-D75 VanDerWaalsContact C-N 3.28Å; A73-D75 PolarHBondContact O-N 3.16Å; D75-F77 PolarHBondContact O-N 3.21Å; D75-N130 VanDerWaalsContact O-CB 3.24Å; D75-N130 WeakPolarHBondContact O-CB 3.43Å; D75-N130 PolarHBondContact O-ND2 3.35Å; D75-Y133 WeakPolarHBondContact O-CD2 3.14Å
76	T	95.8	Very high	93.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.252	C	S	.	.	S	Bend	trans	-62.8	-32.3	178.5	-51	0	0	0	0	111.6	A73 N130 Y133 I141 V146 L150	A73-T76 WeakPolarHBondContact CB-OG1 3.33Å; A73-T76 PolarHBondContact O-N 2.88Å; A73-T76 PolarHBondContact O-OG1 2.81Å; T76-N130 PolarHBondContact O-N 3.41Å; T76-Y133 HydrophobicContact CG2-CD1 4.16Å; T76-Y133 HydrophobicContact CG2-CE1 4.02Å; T76-I141 HydrophobicContact CG2-CD1 3.93Å; T76-V146 HydrophobicContact CG2-CG1 3.84Å; T76-L150 HydrophobicContact CG2-CD1 4.36Å; T76-L150 HydrophobicContact CG2-CD2 4.36Å
77	F	97.4	Very high	93.4	Very high	12 Å²	12	42.6 Å²	42.6	5%	0.053	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	156.9	-177.5	-55.7	-75.7	0	0	0	110.7	I69 D75 Y127 R128 V146 L149 L150	I69-F77 HydrophobicContact CD1-CD2 3.91Å; I69-F77 HydrophobicContact CD1-CE2 4.03Å; D75-F77 PolarHBondContact O-N 3.21Å; F77-Y127 HydrophobicContact CB-CD1 3.93Å; F77-Y127 HydrophobicContact CB-CD2 4.34Å; F77-Y127 HydrophobicContact CB-CE1 3.34Å; F77-Y127 HydrophobicContact CB-CE2 3.82Å; F77-Y127 HydrophobicContact CB-CG 4.4Å; F77-Y127 AromaticContact CD2-CE1 3.89Å; F77-Y127 HydrophobicContact CD2-CE1 3.89Å; F77-Y127 HydrophobicContact CG-CD1 4.28Å; F77-Y127 AromaticContact CG-CE1 3.71Å; F77-Y127 HydrophobicContact CG-CE1 3.71Å; F77-R128 CarbonylContact C-O 3.52Å; F77-R128 WeakPolarHBondContact CA-O 3.39Å; F77-R128 WeakPolarHBondContact CB-O 3.32Å; F77-V146 HydrophobicContact CE2-CB 4.45Å; F77-V146 HydrophobicContact CE2-CG1 3.86Å; F77-V146 HydrophobicContact CE2-CG2 4.38Å; F77-V146 HydrophobicContact CZ-CG1 3.9Å; F77-L149 HydrophobicContact CE1-CB 3.66Å; F77-L149 HydrophobicContact CE1-CD1 4.39Å; F77-L149 HydrophobicContact CE2-CB 4.35Å; F77-L149 HydrophobicContact CE2-CD1 3.84Å; F77-L149 HydrophobicContact CZ-CB 3.45Å; F77-L149 VanDerWaalsContact CZ-CB 3.45Å; F77-L149 HydrophobicContact CZ-CD1 3.79Å; F77-L149 HydrophobicContact CZ-CG 4.28Å; F77-L150 HydrophobicContact CE1-CD2 3.98Å; F77-L150 HydrophobicContact CE1-CG 4.09Å; F77-L150 HydrophobicContact CZ-CD2 4.41Å; F77-L150 HydrophobicContact CZ-CG 4.11Å
78	A	97.4	Very high	93.5	Very high	11 Å²	11	42.7 Å²	42.7	9%	0.091	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	162.2	177.7	0	0	0	0	0	110.1	Q89 R128 N130	A78-Q89 HydrophobicContact CB-CG 3.85Å; A78-R128 PolarHBondContact N-O 3.28Å; A78-R128 PolarHBondContact O-N 3.4Å; A78-R128 VanDerWaalsContact O-O 3.13Å; A78-N130 HydrophobicContact CB-CB 3.82Å
79	F	98.1	Very high	93.6	Very high	4 Å²	4	37 Å²	37	2%	0.018	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	140.9	173.3	-70.3	-93.7	0	0	0	110.8	V36 V56 L59 V63 L90 L125 Q126 Y127	V36-F79 HydrophobicContact CG1-CD1 4.19Å; V36-F79 HydrophobicContact CG1-CE1 3.71Å; V36-F79 HydrophobicContact CG2-CE1 4.14Å; V56-F79 HydrophobicContact CG1-CB 4.19Å; V56-F79 HydrophobicContact CG1-CD2 3.62Å; V56-F79 HydrophobicContact CG1-CE2 4.38Å; V56-F79 HydrophobicContact CG1-CG 4.23Å; L59-F79 HydrophobicContact CB-CZ 4.16Å; L59-F79 HydrophobicContact CD2-CD1 4Å; L59-F79 HydrophobicContact CD2-CE1 3.53Å; L59-F79 HydrophobicContact CD2-CZ 3.93Å; L59-F79 HydrophobicContact CG-CE1 3.71Å; L59-F79 HydrophobicContact CG-CE2 4.48Å; L59-F79 HydrophobicContact CG-CZ 3.63Å; V63-F79 HydrophobicContact CB-CZ 4.07Å; V63-F79 HydrophobicContact CG2-CE1 3.95Å; V63-F79 HydrophobicContact CG2-CZ 3.65Å; F79-L90 HydrophobicContact CB-CB 4.4Å; F79-L90 HydrophobicContact CB-CD1 4.23Å; F79-L90 HydrophobicContact CB-CG 4.47Å; F79-L90 PolarHBondContact O-N 3.39Å; F79-L125 HydrophobicContact CB-CD1 4.09Å; F79-L125 HydrophobicContact CD1-CD1 3.97Å; F79-L125 HydrophobicContact CD1-CD2 3.87Å; F79-L125 HydrophobicContact CD1-CG 3.86Å; F79-L125 HydrophobicContact CE1-CD2 4.22Å; F79-L125 HydrophobicContact CG-CD1 4.49Å; F79-Q126 CarbonylContact C-O 3.51Å; F79-Q126 WeakPolarHBondContact CA-O 3.32Å; F79-Y127 HydrophobicContact CD1-CD2 4.1Å; F79-Y127 AromaticContact CD2-CD2 3.86Å; F79-Y127 HydrophobicContact CD2-CD2 3.86Å; F79-Y127 HydrophobicContact CD2-CE2 4.04Å; F79-Y127 AromaticContact CE1-CD2 3.89Å; F79-Y127 HydrophobicContact CE1-CD2 3.89Å; F79-Y127 AromaticContact CE2-CD2 3.65Å; F79-Y127 HydrophobicContact CE2-CD2 3.65Å; F79-Y127 AromaticContact CE2-CE2 3.61Å; F79-Y127 HydrophobicContact CE2-CE2 3.61Å; F79-Y127 HydrophobicContact CG-CD2 4.11Å; F79-Y127 AromaticContact CZ-CD2 3.68Å; F79-Y127 HydrophobicContact CZ-CD2 3.68Å; F79-Y127 AromaticContact CZ-CE2 3.93Å; F79-Y127 HydrophobicContact CZ-CE2 3.93Å
80	W	98.3	Very high	93.8	Very high	10 Å²	10	37 Å²	37	4%	0.038	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	139.2	176.2	-67.9	70.8	0	0	0	109.9	E87 L88 Q89 Q126 R128 V131 A270	W80-E87 HydrophobicContact CE3-CB 4.34Å; W80-E87 HydrophobicContact CZ3-CB 4.48Å; W80-L88 CarbonylContact C-O 3.53Å; W80-L88 VanDerWaalsContact CA-O 3.24Å; W80-L88 WeakPolarHBondContact CA-O 3.38Å; W80-Q89 HydrophobicContact CD2-CB 3.61Å; W80-Q89 HydrophobicContact CD2-CG 4.06Å; W80-Q89 VanDerWaalsContact CE2-CB 3.47Å; W80-Q89 VanDerWaalsContact CE2-OE1 3.25Å; W80-Q89 HydrophobicContact CE3-CB 3.85Å; W80-Q89 HydrophobicContact CG-CB 4.28Å; W80-Q89 HydrophobicContact CG-CG 4.37Å; W80-Q89 HydrophobicContact CH2-CB 3.92Å; W80-Q89 HydrophobicContact CZ2-CB 3.68Å; W80-Q89 HydrophobicContact CZ2-CG 4.03Å; W80-Q89 HydrophobicContact CZ3-CB 3.98Å; W80-Q126 PolarHBondContact N-O 2.84Å; W80-Q126 PolarHBondContact O-N 2.94Å; W80-R128 HydrophobicContact CD2-CG 4.46Å; W80-R128 VanDerWaalsContact CD2-NH2 3.3Å; W80-R128 HydrophobicContact CG-CG 3.92Å; W80-R128 VanDerWaalsContact CG-NE 3.28Å; W80-V131 HydrophobicContact CZ2-CB 4.23Å; W80-A270 HydrophobicContact CH2-CB 3.7Å; W80-A270 HydrophobicContact CZ3-CB 4.38Å
81	L	98	Very high	94.1	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	125.3	159.7	-70.7	178.1	0	0	0	107.9	E87 L88 L90 L99 C100 W103 P123 L125	L81-E87 CarbonylContact O-C 3.45Å; L81-E87 WeakPolarHBondContact O-CA 3.5Å; L81-L88 PolarHBondContact N-O 3.11Å; L81-L88 PolarHBondContact O-N 2.94Å; L81-L90 HydrophobicContact CD1-CD2 4.16Å; L81-L90 HydrophobicContact CG-CD1 4.15Å; L81-L90 HydrophobicContact CG-CD2 4.04Å; L81-L90 HydrophobicContact CG-CG 4.43Å; L81-L99 HydrophobicContact CD1-CB 3.59Å; L81-C100 VanDerWaalsContact CD2-SG 3.6Å; L81-W103 HydrophobicContact CB-CH2 4.28Å; L81-W103 HydrophobicContact CB-CZ3 3.81Å; L81-W103 HydrophobicContact CD1-CE3 4.4Å; L81-W103 HydrophobicContact CD1-CZ3 4.34Å; L81-P123 HydrophobicContact CB-CB 4.31Å; L81-P123 HydrophobicContact CD2-CB 4.34Å; L81-L125 HydrophobicContact CD2-CD1 3.9Å
82	C	97.6	Very high	94.5	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.6	-174.9	-63.1	0	0	0	0	109.9	E87 P123 Y124	C82-E87 HydrophobicContact CB-CG 4.36Å; C82-P123 WeakPolarHBondContact O-CA 3.47Å; C82-Y124 HydrophobicContact CB-CD1 4.37Å; C82-Y124 HydrophobicContact CB-CD2 4.4Å; C82-Y124 HydrophobicContact CB-CE1 3.79Å; C82-Y124 HydrophobicContact CB-CE2 3.83Å; C82-Y124 VanDerWaalsContact CB-CZ 3.48Å; C82-Y124 PolarHBondContact N-O 2.79Å; C82-Y124 WeakPolarHBondContact O-CD1 3.47Å; C82-Y124 VanDerWaalsContact O-CE1 3.3Å; C82-Y124 WeakPolarHBondContact O-CE1 3.38Å; C82-Y124 PolarHBondContact O-N 3.33Å
83	S	97	Very high	95.1	Very high	8 Å²	8	41.9 Å²	41.9	6%	0.056	22%	0.218	C	C	.	.			trans	-145.9	173.7	163.4	85.3	0	0	0	0	109.1	L85 L86 W103 D121	S83-L85 PolarHBondContact O-N 3.28Å; S83-L85 VanDerWaalsContact O-N 3.15Å; S83-L85 PolarHBondContact OG-N 3.39Å; S83-L86 PolarHBondContact N-O 2.95Å; S83-L86 PolarHBondContact OG-N 2.86Å; S83-W103 WeakPolarHBondContact OG-CZ2 3.28Å; S83-D121 WeakPolarHBondContact CB-OD1 3.34Å; S83-D121 WeakPolarHBondContact CB-OD2 3.36Å; S83-D121 VanDerWaalsContact OG-CG 3.26Å; S83-D121 PolarHBondContact OG-OD1 3Å; S83-D121 PolarHBondContact OG-OD2 3.48Å
84	P	94.4	Very high	95.9	Very high	122 Å²	122	44.1 Å²	44.1	79%	0.792	23%	0.227	S	C	*	.	S	Bend	trans	-53.7	-25.2	169.6	-28.1	36.3	0	0	0	115	D121	P84-D121 WeakPolarHBondContact CD-OD1 3.37Å
85	L	96.2	Very high	96.6	Very high	44 Å²	44	44.9 Å²	44.9	23%	0.23	23%	0.227	C	C	.	.	S	Bend	trans	-97.1	-32.1	-173.8	-60.3	-177.3	0	0	0	114	S83 L107 T111 A113 D117 D121	S83-L85 PolarHBondContact O-N 3.28Å; S83-L85 VanDerWaalsContact O-N 3.15Å; S83-L85 PolarHBondContact OG-N 3.39Å; L85-L107 HydrophobicContact CB-CD2 3.69Å; L85-L107 HydrophobicContact CD1-CD1 4.02Å; L85-L107 HydrophobicContact CD1-CD2 4.28Å; L85-T111 HydrophobicContact CB-CG2 4.45Å; L85-A113 HydrophobicContact CD1-CB 3.73Å; L85-A113 HydrophobicContact CD2-CB 3.99Å; L85-A113 HydrophobicContact CG-CB 4.44Å; L85-D117 HydrophobicContact CD1-CB 4.36Å; L85-D121 HydrophobicContact CD1-CB 3.73Å; L85-D121 HydrophobicContact CG-CB 4.41Å
86	L	97	Very high	96.9	Very high	6 Å²	6	40.4 Å²	40.4	3%	0.031	20%	0.204	C	C	.	.			trans	-153	143.3	-173.8	-172.8	64.7	0	0	0	112.5	S83 L88 W103 L106 L107 F110 T111	S83-L86 PolarHBondContact N-O 2.95Å; S83-L86 PolarHBondContact OG-N 2.86Å; L86-L88 HydrophobicContact CD1-CD2 4.15Å; L86-L88 HydrophobicContact CD2-CD1 3.84Å; L86-L88 HydrophobicContact CD2-CD2 4.24Å; L86-L88 HydrophobicContact CD2-CG 3.98Å; L86-L88 HydrophobicContact CG-CD1 4.38Å; L86-L88 HydrophobicContact CG-CD2 4.14Å; L86-L88 HydrophobicContact CG-CG 3.95Å; L86-W103 HydrophobicContact CB-CH2 3.8Å; L86-W103 HydrophobicContact CB-CZ2 3.83Å; L86-W103 HydrophobicContact CD2-CH2 4.07Å; L86-W103 HydrophobicContact CD2-CZ3 4.36Å; L86-W103 HydrophobicContact CG-CH2 4.05Å; L86-W103 WeakPolarHBondContact O-CH2 3.38Å; L86-L106 HydrophobicContact CD2-CB 4.33Å; L86-L107 HydrophobicContact CB-CD2 3.7Å; L86-L107 HydrophobicContact CD2-CD2 4.28Å; L86-F110 HydrophobicContact CD1-CB 4.32Å; L86-F110 HydrophobicContact CD2-CB 4.28Å; L86-T111 HydrophobicContact CB-CG2 4.25Å
87	E	97.3	Very high	96.8	Very high	35 Å²	35	45.8 Å²	45.8	16%	0.164	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	124	174.3	-63.9	178.5	-147.1	0	0	109.9	W80 L81 C82 R128 R162	W80-E87 HydrophobicContact CE3-CB 4.34Å; W80-E87 HydrophobicContact CZ3-CB 4.48Å; L81-E87 CarbonylContact O-C 3.45Å; L81-E87 WeakPolarHBondContact O-CA 3.5Å; C82-E87 HydrophobicContact CB-CG 4.36Å; E87-R128 IonicContact OE2-CZ 2.75Å; E87-R128 VanDerWaalsContact OE2-CZ 3.28Å; E87-R128 IonicContact OE2-NH1 3.69Å; E87-R128 PolarHBondContact OE2-NH1 3.22Å; E87-R128 IonicContact OE2-NH2 2.96Å; E87-R128 PolarHBondContact OE2-NH2 3.48Å; E87-R162 VanDerWaalsContact CD-NH1 3.34Å; E87-R162 IonicContact OE1-CZ 2.96Å; E87-R162 VanDerWaalsContact OE1-CZ 3.25Å; E87-R162 IonicContact OE1-NH1 3.26Å; E87-R162 PolarHBondContact OE1-NH1 3Å; E87-R162 IonicContact OE1-NH2 2.78Å; E87-R162 PolarHBondContact OE1-NH2 3.21Å; E87-R162 IonicContact OE2-NH1 3.89Å; E87-R162 PolarHBondContact OE2-NH1 3.3Å
88	L	97.1	Very high	96.7	Very high	32 Å²	32	50.2 Å²	50.2	17%	0.168	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	119.2	-177	-62.4	178.9	0	0	0	112	W80 L81 L86 L90 W103 L106 L362	W80-L88 CarbonylContact C-O 3.53Å; W80-L88 VanDerWaalsContact CA-O 3.24Å; W80-L88 WeakPolarHBondContact CA-O 3.38Å; L81-L88 PolarHBondContact N-O 3.11Å; L81-L88 PolarHBondContact O-N 2.94Å; L86-L88 HydrophobicContact CD1-CD2 4.15Å; L86-L88 HydrophobicContact CD2-CD1 3.84Å; L86-L88 HydrophobicContact CD2-CD2 4.24Å; L86-L88 HydrophobicContact CD2-CG 3.98Å; L86-L88 HydrophobicContact CG-CD1 4.38Å; L86-L88 HydrophobicContact CG-CD2 4.14Å; L86-L88 HydrophobicContact CG-CG 3.95Å; L88-L90 PolarHBondContact O-N 3.23Å; L88-W103 HydrophobicContact CD1-CZ3 4.11Å; L88-L106 HydrophobicContact CD1-CD1 4.08Å; L88-L362 HydrophobicContact CD2-CD1 3.95Å
89	Q	97.6	Very high	96.6	Very high	41 Å²	41	51.2 Å²	51.2	19%	0.192	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	129.8	169.8	-166.6	171.4	-65.5	0	0	110.1	A78 W80 N130	A78-Q89 HydrophobicContact CB-CG 3.85Å; W80-Q89 HydrophobicContact CD2-CB 3.61Å; W80-Q89 HydrophobicContact CD2-CG 4.06Å; W80-Q89 VanDerWaalsContact CE2-CB 3.47Å; W80-Q89 VanDerWaalsContact CE2-OE1 3.25Å; W80-Q89 HydrophobicContact CE3-CB 3.85Å; W80-Q89 HydrophobicContact CG-CB 4.28Å; W80-Q89 HydrophobicContact CG-CG 4.37Å; W80-Q89 HydrophobicContact CH2-CB 3.92Å; W80-Q89 HydrophobicContact CZ2-CB 3.68Å; W80-Q89 HydrophobicContact CZ2-CG 4.03Å; W80-Q89 HydrophobicContact CZ3-CB 3.98Å; Q89-N130 PolarHBondContact NE2-OD1 3.36Å
90	L	97.5	Very high	96.5	Very high	10 Å²	10	53.2 Å²	53.2	5%	0.052	26%	0.262	C	S	.	.	P	Polyproline II helix	trans	-86.8	148.9	179.7	-52.5	-172.3	0	0	0	111.6	V56 F79 L81 L88 H94 P96 L99 L125	V56-L90 HydrophobicContact CG2-CB 3.66Å; V56-L90 HydrophobicContact CG2-CD1 3.78Å; V56-L90 HydrophobicContact CG2-CG 4.41Å; F79-L90 HydrophobicContact CB-CB 4.4Å; F79-L90 HydrophobicContact CB-CD1 4.23Å; F79-L90 HydrophobicContact CB-CG 4.47Å; F79-L90 PolarHBondContact O-N 3.39Å; L81-L90 HydrophobicContact CD1-CD2 4.16Å; L81-L90 HydrophobicContact CG-CD1 4.15Å; L81-L90 HydrophobicContact CG-CD2 4.04Å; L81-L90 HydrophobicContact CG-CG 4.43Å; L88-L90 PolarHBondContact O-N 3.23Å; L90-H94 HydrophobicContact CB-CB 4.37Å; L90-P96 HydrophobicContact CD1-CB 4.08Å; L90-P96 HydrophobicContact CD1-CG 3.92Å; L90-L99 HydrophobicContact CD2-CD1 3.55Å; L90-L125 HydrophobicContact CD1-CD1 3.95Å
91	K	95.6	Very high	96.3	Very high	129 Å²	129	62.1 Å²	62.1	56%	0.561	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-89.4	154.4	173.7	-65	175.6	177.2	164.2	0	109.9	V56 R93 H94	V56-K91 WeakPolarHBondContact CB-O 3.28Å; K91-R93 PolarHBondContact O-N 3.18Å; K91-H94 PolarHBondContact N-ND1 3.35Å; K91-H94 VanDerWaalsContact N-ND1 3.19Å; K91-H94 VanDerWaalsContact O-CB 3.29Å; K91-H94 WeakPolarHBondContact O-CB 3.32Å; K91-H94 PolarHBondContact O-N 2.8Å
92	A	94.8	Very high	96.3	Very high	56 Å²	56	66.7 Å²	66.7	46%	0.463	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49	-38.1	-177.2	0	0	0	0	0	114.6	V56 Q57	V56-A92 PolarHBondContact N-O 3.05Å; Q57-A92 HydrophobicContact CB-CB 4.29Å; Q57-A92 PolarHBondContact N-O 3.23Å
93	R	96.4	Very high	96.3	Very high	204 Å²	204	66.9 Å²	66.9	77%	0.77	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-7.6	179.9	68.5	179.1	177.7	-128.7	2.7	115.2	K91	K91-R93 PolarHBondContact O-N 3.18Å
94	H	97.6	Very high	96.3	Very high	56 Å²	56	71 Å²	71	26%	0.259	34%	0.336	S	S	.	.			trans	-66.9	151	178.4	-71.7	176.9	0	0	0	110.2	S55 V56 L90 K91 L99	S55-H94 CarbonylContact C-O 3.56Å; S55-H94 VanDerWaalsContact CA-O 3.3Å; S55-H94 WeakPolarHBondContact CA-O 3.32Å; V56-H94 HydrophobicContact CG2-CB 4.13Å; V56-H94 WeakPolarHBondContact CG2-O 3.49Å; V56-H94 PolarHBondContact N-O 3.33Å; L90-H94 HydrophobicContact CB-CB 4.37Å; K91-H94 PolarHBondContact N-ND1 3.35Å; K91-H94 VanDerWaalsContact N-ND1 3.19Å; K91-H94 VanDerWaalsContact O-CB 3.29Å; K91-H94 WeakPolarHBondContact O-CB 3.32Å; K91-H94 PolarHBondContact O-N 2.8Å; H94-L99 HydrophobicContact CB-CD1 3.83Å
95	Q	97.1	Very high	96.5	Very high	56 Å²	56	70.5 Å²	70.5	26%	0.262	33%	0.326	S	S	.	.			trans	-109.8	103.7	174.9	-71.2	171.2	-35.2	0	0	107.6	S53 V54 Y97 K98 L99	S53-Q95 PolarHBondContact O-NE2 3.23Å; V54-Q95 WeakPolarHBondContact O-CA 3.48Å; Q95-Y97 VanDerWaalsContact C-N 3.3Å; Q95-Y97 PolarHBondContact O-N 2.9Å; Q95-K98 HydrophobicContact CB-CB 4.29Å; Q95-K98 HydrophobicContact CB-CD 4.26Å; Q95-K98 HydrophobicContact CB-CG 4.16Å; Q95-K98 PolarHBondContact O-N 2.95Å; Q95-L99 PolarHBondContact O-N 3.12Å
96	P	96.1	Very high	96.5	Very high	11 Å²	11	70 Å²	70	7%	0.071	32%	0.323	C	S	.	.	H	α-helix	trans	-53.4	-45.5	-170.6	-28.4	35.7	0	0	0	113	V54 V56 L59 L90 K98 L99 C100 L125	V54-P96 WeakPolarHBondContact O-CD 3.4Å; V56-P96 HydrophobicContact CG2-CG 3.81Å; L59-P96 HydrophobicContact CD2-CG 4.27Å; L90-P96 HydrophobicContact CD1-CB 4.08Å; L90-P96 HydrophobicContact CD1-CG 3.92Å; P96-K98 VanDerWaalsContact C-N 3.29Å; P96-K98 PolarHBondContact O-N 3.21Å; P96-L99 PolarHBondContact O-N 2.75Å; P96-C100 PolarHBondContact O-N 3.11Å; P96-C100 PolarHBondContact O-SG 3.38Å; P96-C100 VanDerWaalsContact O-SG 3.33Å; P96-L125 HydrophobicContact CB-CD1 4.16Å; P96-L125 HydrophobicContact CB-CD2 4.22Å; P96-L125 HydrophobicContact CG-CD1 4.49Å; P96-L125 HydrophobicContact CG-CD2 4.43Å
97	Y	93.9	Very high	96.5	Very high	113 Å²	113	69.7 Å²	69.7	44%	0.443	32%	0.322	S	S	.	.	H	α-helix	trans	-57.4	-39.1	179.7	-174.5	-94.9	0	0	0	113.3	Q95 C100 R101	Q95-Y97 VanDerWaalsContact C-N 3.3Å; Q95-Y97 PolarHBondContact O-N 2.9Å; Y97-C100 PolarHBondContact O-N 3.43Å; Y97-R101 HydrophobicContact CE1-CG 4.37Å; Y97-R101 PolarHBondContact O-N 3.38Å
98	K	95	Very high	96.4	Very high	104 Å²	104	73 Å²	73	45%	0.452	33%	0.334	S	S	.	.	H	α-helix	trans	-69.1	-37	177.7	-67.8	-168.5	-176.2	169.1	0	112.2	Q95 P96 R101 Q102	Q95-K98 HydrophobicContact CB-CB 4.29Å; Q95-K98 HydrophobicContact CB-CD 4.26Å; Q95-K98 HydrophobicContact CB-CG 4.16Å; Q95-K98 PolarHBondContact O-N 2.95Å; P96-K98 VanDerWaalsContact C-N 3.29Å; P96-K98 PolarHBondContact O-N 3.21Å; K98-R101 PolarHBondContact O-N 2.98Å; K98-Q102 PolarHBondContact O-N 2.78Å
99	L	96	Very high	96.3	Very high	32 Å²	32	78.1 Å²	78.1	17%	0.168	35%	0.351	C	S	.	.	H	α-helix	trans	-70.1	-37.6	177.1	-69.7	173.9	0	0	0	111.7	L81 L90 H94 Q95 P96 R101 Q102 W103	L81-L99 HydrophobicContact CD1-CB 3.59Å; L90-L99 HydrophobicContact CD2-CD1 3.55Å; H94-L99 HydrophobicContact CB-CD1 3.83Å; Q95-L99 PolarHBondContact O-N 3.12Å; P96-L99 PolarHBondContact O-N 2.75Å; L99-R101 PolarHBondContact O-N 2.82Å; L99-Q102 CarbonylContact O-C 3.5Å; L99-Q102 WeakPolarHBondContact O-CA 3.42Å; L99-Q102 PolarHBondContact O-N 3.1Å; L99-W103 PolarHBondContact O-N 3.49Å
100	C	95.6	Very high	96.2	Very high	46 Å²	46	76.8 Å²	76.8	31%	0.311	34%	0.344	S	S	.	.	H	α-helix	trans	-57.3	-39.4	172.1	-64.2	0	0	0	0	111.7	L81 P96 Y97 Q102 W103 P123	L81-C100 VanDerWaalsContact CD2-SG 3.6Å; P96-C100 PolarHBondContact O-N 3.11Å; P96-C100 PolarHBondContact O-SG 3.38Å; P96-C100 VanDerWaalsContact O-SG 3.33Å; Y97-C100 PolarHBondContact O-N 3.43Å; C100-Q102 PolarHBondContact O-N 3.31Å; C100-W103 WeakPolarHBondContact O-CB 3.24Å; C100-W103 PolarHBondContact O-N 2.8Å; C100-W103 VanDerWaalsContact O-N 3.15Å; C100-P123 HydrophobicContact CB-CG 4.2Å
101	R	94.9	Very high	96.1	Very high	197 Å²	197	76.8 Å²	76.8	74%	0.743	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-19.7	176.1	-70.1	-172.1	63.9	-166.9	-2	114.3	Y97 K98 L99	Y97-R101 HydrophobicContact CE1-CG 4.37Å; Y97-R101 PolarHBondContact O-N 3.38Å; K98-R101 PolarHBondContact O-N 2.98Å; L99-R101 PolarHBondContact O-N 2.82Å
102	Q	96.8	Very high	95.9	Very high	98 Å²	98	76.4 Å²	76.4	46%	0.458	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	9.8	177.2	-65.6	177.1	-21.8	0	0	111.6	K98 L99 C100 Q104 D105 L106	K98-Q102 PolarHBondContact O-N 2.78Å; L99-Q102 CarbonylContact O-C 3.5Å; L99-Q102 WeakPolarHBondContact O-CA 3.42Å; L99-Q102 PolarHBondContact O-N 3.1Å; C100-Q102 PolarHBondContact O-N 3.31Å; Q102-Q104 PolarHBondContact O-N 2.74Å; Q102-D105 WeakPolarHBondContact O-CB 3.43Å; Q102-D105 PolarHBondContact O-N 2.88Å; Q102-L106 WeakPolarHBondContact O-CG 3.38Å; Q102-L106 PolarHBondContact O-N 2.87Å
103	W	97.8	Very high	96	Very high	4 Å²	4	74.9 Å²	74.9	2%	0.015	34%	0.337	C	S	.	.	H	α-helix	trans	-60.3	-46.1	-170.4	-171.7	-113.9	0	0	0	112.7	L81 S83 L86 L88 L99 C100 D105 L106 L107 D121 P123	L81-W103 HydrophobicContact CB-CH2 4.28Å; L81-W103 HydrophobicContact CB-CZ3 3.81Å; L81-W103 HydrophobicContact CD1-CE3 4.4Å; L81-W103 HydrophobicContact CD1-CZ3 4.34Å; S83-W103 WeakPolarHBondContact OG-CZ2 3.28Å; L86-W103 HydrophobicContact CB-CH2 3.8Å; L86-W103 HydrophobicContact CB-CZ2 3.83Å; L86-W103 HydrophobicContact CD2-CH2 4.07Å; L86-W103 HydrophobicContact CD2-CZ3 4.36Å; L86-W103 HydrophobicContact CG-CH2 4.05Å; L86-W103 WeakPolarHBondContact O-CH2 3.38Å; L88-W103 HydrophobicContact CD1-CZ3 4.11Å; L99-W103 PolarHBondContact O-N 3.49Å; C100-W103 WeakPolarHBondContact O-CB 3.24Å; C100-W103 PolarHBondContact O-N 2.8Å; C100-W103 VanDerWaalsContact O-N 3.15Å; W103-D105 VanDerWaalsContact C-N 3.34Å; W103-D105 PolarHBondContact O-N 3.43Å; W103-L106 HydrophobicContact CE3-CD1 4.04Å; W103-L106 HydrophobicContact CZ3-CD1 4.41Å; W103-L106 WeakPolarHBondContact O-CA 3.38Å; W103-L106 WeakPolarHBondContact O-CB 3.34Å; W103-L106 PolarHBondContact O-N 3.34Å; W103-L106 VanDerWaalsContact O-N 3.07Å; W103-L107 HydrophobicContact CD2-CG 4.5Å; W103-L107 HydrophobicContact CG-CD1 4.49Å; W103-L107 HydrophobicContact CG-CG 4.46Å; W103-L107 HydrophobicContact CZ2-CD2 3.99Å; W103-L107 WeakPolarHBondContact O-CG 3.34Å; W103-L107 PolarHBondContact O-N 3.48Å; W103-D121 PolarHBondContact NE1-OD2 3.41Å; W103-P123 HydrophobicContact CB-CG 3.85Å; W103-P123 VanDerWaalsContact CD1-CD 3.44Å; W103-P123 HydrophobicContact CD2-CB 3.58Å; W103-P123 HydrophobicContact CD2-CG 3.57Å; W103-P123 HydrophobicContact CE3-CB 3.85Å; W103-P123 HydrophobicContact CE3-CG 3.99Å; W103-P123 HydrophobicContact CG-CB 4.01Å; W103-P123 HydrophobicContact CG-CG 3.5Å; W103-P123 VanDerWaalsContact CG-CG 3.5Å; W103-P123 HydrophobicContact CH2-CB 4.21Å; W103-P123 HydrophobicContact CZ2-CB 3.97Å; W103-P123 HydrophobicContact CZ3-CB 4.16Å
104	Q	97.7	Very high	95.9	Very high	96 Å²	96	67.7 Å²	67.7	45%	0.449	32%	0.317	S	S	.	.	H	α-helix	trans	-58.6	-45.3	177.4	-66.6	179.3	3.3	0	0	111.5	Q102 L106 L107 Y108 I118	Q102-Q104 PolarHBondContact O-N 2.74Å; Q104-L106 VanDerWaalsContact C-N 3.27Å; Q104-L106 PolarHBondContact O-N 2.97Å; Q104-L107 WeakPolarHBondContact O-CB 3.26Å; Q104-L107 PolarHBondContact O-N 2.95Å; Q104-L107 VanDerWaalsContact O-N 3.09Å; Q104-Y108 HydrophobicContact CB-CD2 4.44Å; Q104-Y108 HydrophobicContact CB-CE2 4.22Å; Q104-Y108 WeakPolarHBondContact O-CD2 3.44Å; Q104-Y108 PolarHBondContact O-N 2.92Å; Q104-I118 HydrophobicContact CB-CG2 4.07Å; Q104-I118 HydrophobicContact CG-CG2 4.17Å
105	D	97.6	Very high	95.9	Very high	111 Å²	111	71.8 Å²	71.8	59%	0.594	34%	0.337	S	S	*	.	H	α-helix	trans	-58.8	-39.1	175.7	-62.7	-31	0	0	0	112.2	Q102 W103 R109	Q102-D105 WeakPolarHBondContact O-CB 3.43Å; Q102-D105 PolarHBondContact O-N 2.88Å; W103-D105 VanDerWaalsContact C-N 3.34Å; W103-D105 PolarHBondContact O-N 3.43Å; D105-R109 WeakPolarHBondContact O-CB 3.35Å; D105-R109 PolarHBondContact O-N 3.5Å; D105-R109 VanDerWaalsContact O-N 3.12Å
106	L	97.4	Very high	95.9	Very high	32 Å²	32	75.1 Å²	75.1	17%	0.168	36%	0.356	C	S	.	.	H	α-helix	trans	-66.2	-42.1	175.4	-66.7	169.4	0	0	0	111.2	L86 L88 Q102 W103 Q104 R109 F110	L86-L106 HydrophobicContact CD2-CB 4.33Å; L88-L106 HydrophobicContact CD1-CD1 4.08Å; Q102-L106 WeakPolarHBondContact O-CG 3.38Å; Q102-L106 PolarHBondContact O-N 2.87Å; W103-L106 HydrophobicContact CE3-CD1 4.04Å; W103-L106 HydrophobicContact CZ3-CD1 4.41Å; W103-L106 WeakPolarHBondContact O-CA 3.38Å; W103-L106 WeakPolarHBondContact O-CB 3.34Å; W103-L106 PolarHBondContact O-N 3.34Å; W103-L106 VanDerWaalsContact O-N 3.07Å; Q104-L106 VanDerWaalsContact C-N 3.27Å; Q104-L106 PolarHBondContact O-N 2.97Å; L106-R109 PolarHBondContact O-N 3.38Å; L106-F110 HydrophobicContact CD2-CD2 4.32Å; L106-F110 HydrophobicContact CD2-CE2 3.96Å; L106-F110 WeakPolarHBondContact O-CB 3.27Å; L106-F110 VanDerWaalsContact O-CD2 3.27Å; L106-F110 WeakPolarHBondContact O-CD2 3.5Å; L106-F110 PolarHBondContact O-N 2.58Å
107	L	97.5	Very high	96	Very high	0 Å²	0	78.9 Å²	78.9	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.9	-44.7	177.2	-66.8	178.4	0	0	0	112.1	L85 L86 W103 Q104 R109 F110 T111 I118 D121	L85-L107 HydrophobicContact CB-CD2 3.69Å; L85-L107 HydrophobicContact CD1-CD1 4.02Å; L85-L107 HydrophobicContact CD1-CD2 4.28Å; L86-L107 HydrophobicContact CB-CD2 3.7Å; L86-L107 HydrophobicContact CD2-CD2 4.28Å; W103-L107 HydrophobicContact CD2-CG 4.5Å; W103-L107 HydrophobicContact CG-CD1 4.49Å; W103-L107 HydrophobicContact CG-CG 4.46Å; W103-L107 HydrophobicContact CZ2-CD2 3.99Å; W103-L107 WeakPolarHBondContact O-CG 3.34Å; W103-L107 PolarHBondContact O-N 3.48Å; Q104-L107 WeakPolarHBondContact O-CB 3.26Å; Q104-L107 PolarHBondContact O-N 2.95Å; Q104-L107 VanDerWaalsContact O-N 3.09Å; L107-R109 PolarHBondContact O-N 3.13Å; L107-F110 PolarHBondContact O-N 2.97Å; L107-T111 HydrophobicContact CD2-CG2 3.95Å; L107-T111 WeakPolarHBondContact O-CA 3.4Å; L107-T111 WeakPolarHBondContact O-CB 3.14Å; L107-T111 PolarHBondContact O-N 3.28Å; L107-T111 PolarHBondContact O-OG1 3.5Å; L107-I118 HydrophobicContact CB-CD1 4.26Å; L107-I118 HydrophobicContact CB-CG1 3.98Å; L107-I118 HydrophobicContact CB-CG2 4.04Å; L107-I118 HydrophobicContact CD1-CB 4.39Å; L107-I118 HydrophobicContact CD1-CG1 4.35Å; L107-I118 HydrophobicContact CD1-CG2 4.06Å; L107-D121 HydrophobicContact CD1-CB 3.8Å; L107-D121 WeakPolarHBondContact CD1-OD2 3.46Å
108	Y	95.5	Very high	96.1	Very high	106 Å²	106	73.6 Å²	73.6	42%	0.416	36%	0.355	S	S	.	.	H	α-helix	trans	-57.1	-40.9	174.7	-78.7	-64.9	0	0	0	111.6	Q104 E115 I118	Q104-Y108 HydrophobicContact CB-CD2 4.44Å; Q104-Y108 HydrophobicContact CB-CE2 4.22Å; Q104-Y108 WeakPolarHBondContact O-CD2 3.44Å; Q104-Y108 PolarHBondContact O-N 2.92Å; Y108-E115 HydrophobicContact CE1-CG 4.28Å; Y108-I118 HydrophobicContact CD1-CD1 3.61Å; Y108-I118 HydrophobicContact CD2-CG2 4.1Å; Y108-I118 HydrophobicContact CE1-CD1 3.75Å; Y108-I118 HydrophobicContact CE1-CG2 4.3Å; Y108-I118 HydrophobicContact CE2-CG2 3.69Å; Y108-I118 HydrophobicContact CG-CD1 4.09Å
109	R	94.4	Very high	96.2	Very high	138 Å²	138	71.2 Å²	71.2	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-74.1	-38.8	-178.8	-175.9	172.9	173.9	171.5	-2.1	113.2	D105 L106 L107 E361	D105-R109 WeakPolarHBondContact O-CB 3.35Å; D105-R109 PolarHBondContact O-N 3.5Å; D105-R109 VanDerWaalsContact O-N 3.12Å; L106-R109 PolarHBondContact O-N 3.38Å; L107-R109 PolarHBondContact O-N 3.13Å; R109-E361 IonicContact CZ-OE2 3.9Å; R109-E361 IonicContact NE-OE2 2.7Å; R109-E361 IonicContact NH2-OE1 3.83Å; R109-E361 IonicContact NH2-OE2 3.25Å; R109-E361 PolarHBondContact NH2-OE2 2.91Å
110	F	96	Very high	96.2	Very high	13 Å²	13	77.2 Å²	77.2	6%	0.057	38%	0.379	C	S	.	.	H	α-helix	trans	-115.7	4	-165.6	-62.1	-59.8	0	0	0	114.9	L86 L106 L107 Q359 L362	L86-F110 HydrophobicContact CD1-CB 4.32Å; L86-F110 HydrophobicContact CD2-CB 4.28Å; L106-F110 HydrophobicContact CD2-CD2 4.32Å; L106-F110 HydrophobicContact CD2-CE2 3.96Å; L106-F110 WeakPolarHBondContact O-CB 3.27Å; L106-F110 VanDerWaalsContact O-CD2 3.27Å; L106-F110 WeakPolarHBondContact O-CD2 3.5Å; L106-F110 PolarHBondContact O-N 2.58Å; L107-F110 PolarHBondContact O-N 2.97Å; F110-Q359 HydrophobicContact CB-CG 4.37Å; F110-Q359 WeakPolarHBondContact O-CG 3.07Å; F110-Q359 PolarHBondContact O-NE2 3.21Å; F110-L362 HydrophobicContact CB-CD1 4.15Å; F110-L362 HydrophobicContact CD1-CD1 3.61Å; F110-L362 HydrophobicContact CD1-CD2 4.36Å; F110-L362 HydrophobicContact CD1-CG 3.7Å; F110-L362 HydrophobicContact CD2-CD1 4.01Å; F110-L362 HydrophobicContact CE1-CD1 3.92Å; F110-L362 HydrophobicContact CE1-CD2 3.78Å; F110-L362 HydrophobicContact CE1-CG 3.56Å; F110-L362 HydrophobicContact CE2-CD1 4.29Å; F110-L362 HydrophobicContact CE2-CD2 4.23Å; F110-L362 HydrophobicContact CG-CD1 3.66Å; F110-L362 HydrophobicContact CG-CG 4.25Å; F110-L362 HydrophobicContact CZ-CD1 4.24Å; F110-L362 HydrophobicContact CZ-CD2 3.7Å; F110-L362 HydrophobicContact CZ-CG 3.98Å
111	T	95.1	Very high	96.3	Very high	11 Å²	11	76 Å²	76	7%	0.067	37%	0.369	C	S	.	.			trans	-136.4	155.5	179.4	79.5	0	0	0	0	112.2	L85 L86 L107 A113 K358	L85-T111 HydrophobicContact CB-CG2 4.45Å; L86-T111 HydrophobicContact CB-CG2 4.25Å; L107-T111 HydrophobicContact CD2-CG2 3.95Å; L107-T111 WeakPolarHBondContact O-CA 3.4Å; L107-T111 WeakPolarHBondContact O-CB 3.14Å; L107-T111 PolarHBondContact O-N 3.28Å; L107-T111 PolarHBondContact O-OG1 3.5Å; T111-A113 VanDerWaalsContact C-N 3.3Å; T111-A113 PolarHBondContact OG1-N 3.34Å; T111-K358 VanDerWaalsContact C-CD 3.43Å; T111-K358 WeakPolarHBondContact O-CD 3.33Å; T111-K358 PolarHBondContact O-NZ 3.47Å
112	D	91.8	Very high	96.4	Very high	121 Å²	121	74.4 Å²	74.4	65%	0.647	37%	0.37	S	S	*	.			trans	-96.8	22.4	171.5	-69.5	-55.9	0	0	0	111.8	K358	D112-K358 WeakPolarHBondContact OD1-CD 3.3Å; D112-K358 WeakPolarHBondContact OD1-CE 3.24Å; D112-K358 IonicContact OD1-NZ 2.72Å; D112-K358 PolarHBondContact OD1-NZ 3.03Å
113	A	95	Very high	96.4	Very high	24 Å²	24	71.1 Å²	71.1	20%	0.198	36%	0.357	C	S	.	.			trans	-66.1	153	176.8	0	0	0	0	0	111.2	L85 T111 D117 I118	L85-A113 HydrophobicContact CD1-CB 3.73Å; L85-A113 HydrophobicContact CD2-CB 3.99Å; L85-A113 HydrophobicContact CG-CB 4.44Å; T111-A113 VanDerWaalsContact C-N 3.3Å; T111-A113 PolarHBondContact OG1-N 3.34Å; A113-D117 HydrophobicContact CB-CB 4.23Å; A113-I118 HydrophobicContact CB-CD1 4.33Å; A113-I118 HydrophobicContact CB-CG1 3.88Å
114	S	96.1	Very high	96.3	Very high	52 Å²	52	75.4 Å²	75.4	36%	0.364	37%	0.374	S	S	.	.			trans	-69.3	158.3	176.5	70.3	0	0	0	0	111.2	D116 D117 I118	S114-D116 PolarHBondContact O-N 3.41Å; S114-D117 PolarHBondContact O-N 3.23Å; S114-D117 WeakPolarHBondContact OG-CB 3.27Å; S114-D117 PolarHBondContact OG-N 3.2Å; S114-D117 VanDerWaalsContact OG-N 3.11Å; S114-D117 PolarHBondContact OG-OD2 3.44Å; S114-I118 VanDerWaalsContact O-CG1 3.31Å; S114-I118 WeakPolarHBondContact O-CG1 3.41Å; S114-I118 PolarHBondContact O-N 3.34Å
115	E	96.4	Very high	96.3	Very high	143 Å²	143	71.6 Å²	71.6	67%	0.668	36%	0.357	S	S	*	.	H	α-helix	trans	-58.3	-37.2	175.5	-61.9	-171.3	164.9	0	0	111.7	Y108 I118 S119	Y108-E115 HydrophobicContact CE1-CG 4.28Å; E115-I118 PolarHBondContact O-N 3.07Å; E115-S119 WeakPolarHBondContact O-CB 3.46Å; E115-S119 PolarHBondContact O-N 3.47Å
116	D	97.3	Very high	96.4	Very high	125 Å²	125	66.9 Å²	66.9	67%	0.668	33%	0.331	S	S	*	.	H	α-helix	trans	-61.4	-50.7	175.3	-68.8	-29.2	0	0	0	110.8	S114 I118 S119 Q120	S114-D116 PolarHBondContact O-N 3.41Å; D116-I118 VanDerWaalsContact C-N 3.34Å; D116-I118 PolarHBondContact O-N 3.05Å; D116-S119 PolarHBondContact O-N 3.16Å; D116-S119 PolarHBondContact O-OG 3Å; D116-Q120 WeakPolarHBondContact O-CG 3.45Å; D116-Q120 PolarHBondContact O-N 3.28Å
117	D	97.5	Very high	96.4	Very high	90 Å²	90	65.7 Å²	65.7	48%	0.481	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-43.8	177.8	-64.2	-44.4	0	0	0	111.4	L85 A113 S114 S119 Q120 D121	L85-D117 HydrophobicContact CD1-CB 4.36Å; A113-D117 HydrophobicContact CB-CB 4.23Å; S114-D117 PolarHBondContact O-N 3.23Å; S114-D117 WeakPolarHBondContact OG-CB 3.27Å; S114-D117 PolarHBondContact OG-N 3.2Å; S114-D117 VanDerWaalsContact OG-N 3.11Å; S114-D117 PolarHBondContact OG-OD2 3.44Å; D117-S119 VanDerWaalsContact C-N 3.32Å; D117-S119 PolarHBondContact O-N 2.81Å; D117-Q120 PolarHBondContact O-N 3.41Å; D117-D121 WeakPolarHBondContact O-CB 3.3Å; D117-D121 PolarHBondContact O-N 3.41Å; D117-D121 VanDerWaalsContact O-N 3.1Å
118	I	97.6	Very high	96.3	Very high	3 Å²	3	66.3 Å²	66.3	2%	0.015	33%	0.327	C	S	.	.	H	α-helix	trans	-62.6	-39.6	178.6	-68.6	174.1	0	0	0	111.3	Q104 L107 Y108 A113 S114 E115 D116 Q120 D121	Q104-I118 HydrophobicContact CB-CG2 4.07Å; Q104-I118 HydrophobicContact CG-CG2 4.17Å; L107-I118 HydrophobicContact CB-CD1 4.26Å; L107-I118 HydrophobicContact CB-CG1 3.98Å; L107-I118 HydrophobicContact CB-CG2 4.04Å; L107-I118 HydrophobicContact CD1-CB 4.39Å; L107-I118 HydrophobicContact CD1-CG1 4.35Å; L107-I118 HydrophobicContact CD1-CG2 4.06Å; Y108-I118 HydrophobicContact CD1-CD1 3.61Å; Y108-I118 HydrophobicContact CD2-CG2 4.1Å; Y108-I118 HydrophobicContact CE1-CD1 3.75Å; Y108-I118 HydrophobicContact CE1-CG2 4.3Å; Y108-I118 HydrophobicContact CE2-CG2 3.69Å; Y108-I118 HydrophobicContact CG-CD1 4.09Å; A113-I118 HydrophobicContact CB-CD1 4.33Å; A113-I118 HydrophobicContact CB-CG1 3.88Å; S114-I118 VanDerWaalsContact O-CG1 3.31Å; S114-I118 WeakPolarHBondContact O-CG1 3.41Å; S114-I118 PolarHBondContact O-N 3.34Å; E115-I118 PolarHBondContact O-N 3.07Å; D116-I118 VanDerWaalsContact C-N 3.34Å; D116-I118 PolarHBondContact O-N 3.05Å; I118-Q120 VanDerWaalsContact C-N 3.26Å; I118-Q120 PolarHBondContact O-N 3.11Å; I118-D121 PolarHBondContact O-N 3.27Å
119	S	96.3	Very high	96.4	Very high	54 Å²	54	61.8 Å²	61.8	38%	0.378	31%	0.309	S	S	.	.	H	α-helix	trans	-66.4	-28.5	-179	78.1	0	0	0	0	113.3	E115 D116 D117	E115-S119 WeakPolarHBondContact O-CB 3.46Å; E115-S119 PolarHBondContact O-N 3.47Å; D116-S119 PolarHBondContact O-N 3.16Å; D116-S119 PolarHBondContact O-OG 3Å; D117-S119 VanDerWaalsContact C-N 3.32Å; D117-S119 PolarHBondContact O-N 2.81Å
120	Q	96.6	Very high	96.6	Very high	157 Å²	157	56.3 Å²	56.3	73%	0.734	29%	0.29	S	S	*	.	H	α-helix	trans	-97	-11.5	-177.7	-59.4	-52.5	-63.4	0	0	113.3	D116 D117 I118	D116-Q120 WeakPolarHBondContact O-CG 3.45Å; D116-Q120 PolarHBondContact O-N 3.28Å; D117-Q120 PolarHBondContact O-N 3.41Å; I118-Q120 VanDerWaalsContact C-N 3.26Å; I118-Q120 PolarHBondContact O-N 3.11Å
121	D	97.7	Very high	96.6	Very high	20 Å²	20	55.9 Å²	55.9	11%	0.107	29%	0.288	C	S	.	.			trans	-83.3	124.2	-176.1	-167.8	76	0	0	0	111.6	S83 P84 L85 W103 L107 D117 I118	S83-D121 WeakPolarHBondContact CB-OD1 3.34Å; S83-D121 WeakPolarHBondContact CB-OD2 3.36Å; S83-D121 VanDerWaalsContact OG-CG 3.26Å; S83-D121 PolarHBondContact OG-OD1 3Å; S83-D121 PolarHBondContact OG-OD2 3.48Å; P84-D121 WeakPolarHBondContact CD-OD1 3.37Å; L85-D121 HydrophobicContact CD1-CB 3.73Å; L85-D121 HydrophobicContact CG-CB 4.41Å; W103-D121 PolarHBondContact NE1-OD2 3.41Å; L107-D121 HydrophobicContact CD1-CB 3.8Å; L107-D121 WeakPolarHBondContact CD1-OD2 3.46Å; D117-D121 WeakPolarHBondContact O-CB 3.3Å; D117-D121 PolarHBondContact O-N 3.41Å; D117-D121 VanDerWaalsContact O-N 3.1Å; I118-D121 PolarHBondContact O-N 3.27Å
122	E	95.8	Very high	96.6	Very high	164 Å²	164	57.8 Å²	57.8	77%	0.766	30%	0.296	S	S	*	.			trans	-119.8	133.1	176.7	-66.2	-171.9	163.5	0	0	110.4
123	P	97.4	Very high	96.7	Very high	29 Å²	29	53.2 Å²	53.2	19%	0.188	27%	0.27	C	S	.	.			trans	-81.6	144.7	178.2	33.2	-30.6	0	0	0	110.6	L81 C82 C100 W103	L81-P123 HydrophobicContact CB-CB 4.31Å; L81-P123 HydrophobicContact CD2-CB 4.34Å; C82-P123 WeakPolarHBondContact O-CA 3.47Å; C100-P123 HydrophobicContact CB-CG 4.2Å; W103-P123 HydrophobicContact CB-CG 3.85Å; W103-P123 VanDerWaalsContact CD1-CD 3.44Å; W103-P123 HydrophobicContact CD2-CB 3.58Å; W103-P123 HydrophobicContact CD2-CG 3.57Å; W103-P123 HydrophobicContact CE3-CB 3.85Å; W103-P123 HydrophobicContact CE3-CG 3.99Å; W103-P123 HydrophobicContact CG-CB 4.01Å; W103-P123 HydrophobicContact CG-CG 3.5Å; W103-P123 VanDerWaalsContact CG-CG 3.5Å; W103-P123 HydrophobicContact CH2-CB 4.21Å; W103-P123 HydrophobicContact CZ2-CB 3.97Å; W103-P123 HydrophobicContact CZ3-CB 4.16Å
124	Y	96.7	Very high	96.7	Very high	94 Å²	94	53.9 Å²	53.9	37%	0.369	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	155.2	164.8	66	-87.3	0	0	0	110.9	Y37 C82 Q126	Y37-Y124 AromaticContact CD2-CD2 3.7Å; Y37-Y124 HydrophobicContact CD2-CD2 3.7Å; Y37-Y124 HydrophobicContact CD2-CG 4.16Å; Y37-Y124 HydrophobicContact CE2-CD2 4.44Å; Y37-Y124 HydrophobicContact CE2-CG 4.48Å; Y37-Y124 HydrophobicContact CG-CD2 4.02Å; C82-Y124 HydrophobicContact CB-CD1 4.37Å; C82-Y124 HydrophobicContact CB-CD2 4.4Å; C82-Y124 HydrophobicContact CB-CE1 3.79Å; C82-Y124 HydrophobicContact CB-CE2 3.83Å; C82-Y124 VanDerWaalsContact CB-CZ 3.48Å; C82-Y124 PolarHBondContact N-O 2.79Å; C82-Y124 WeakPolarHBondContact O-CD1 3.47Å; C82-Y124 VanDerWaalsContact O-CE1 3.3Å; C82-Y124 WeakPolarHBondContact O-CE1 3.38Å; C82-Y124 PolarHBondContact O-N 3.33Å; Y124-Q126 HydrophobicContact CD2-CB 4.23Å; Y124-Q126 HydrophobicContact CE2-CB 3.88Å; Y124-Q126 HydrophobicContact CE2-CG 4.34Å
125	L	97.6	Very high	96.5	Very high	16 Å²	16	54.4 Å²	54.4	8%	0.084	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	119.5	178.4	-169.8	65.3	0	0	0	109.9	V36 Y37 L59 F79 L81 L90 P96	V36-L125 HydrophobicContact CG2-CD2 4.22Å; Y37-L125 PolarHBondContact N-O 3.37Å; L59-L125 HydrophobicContact CD2-CD2 3.47Å; L59-L125 VanDerWaalsContact CD2-CD2 3.47Å; F79-L125 HydrophobicContact CB-CD1 4.09Å; F79-L125 HydrophobicContact CD1-CD1 3.97Å; F79-L125 HydrophobicContact CD1-CD2 3.87Å; F79-L125 HydrophobicContact CD1-CG 3.86Å; F79-L125 HydrophobicContact CE1-CD2 4.22Å; F79-L125 HydrophobicContact CG-CD1 4.49Å; L81-L125 HydrophobicContact CD2-CD1 3.9Å; L90-L125 HydrophobicContact CD1-CD1 3.95Å; P96-L125 HydrophobicContact CB-CD1 4.16Å; P96-L125 HydrophobicContact CB-CD2 4.22Å; P96-L125 HydrophobicContact CG-CD1 4.49Å; P96-L125 HydrophobicContact CG-CD2 4.43Å
126	Q	98	Very high	96.3	Very high	12 Å²	12	51.5 Å²	51.5	6%	0.056	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.8	179.9	-169.2	172.6	63.1	0	0	110.9	Y37 F79 W80 Y124	Y37-Q126 CarbonylContact O-C 3.5Å; Y37-Q126 VanDerWaalsContact O-CA 3.29Å; Y37-Q126 WeakPolarHBondContact O-CA 3.34Å; F79-Q126 CarbonylContact C-O 3.51Å; F79-Q126 WeakPolarHBondContact CA-O 3.32Å; W80-Q126 PolarHBondContact N-O 2.84Å; W80-Q126 PolarHBondContact O-N 2.94Å; Y124-Q126 HydrophobicContact CD2-CB 4.23Å; Y124-Q126 HydrophobicContact CE2-CB 3.88Å; Y124-Q126 HydrophobicContact CE2-CG 4.34Å
127	Y	97.8	Very high	96.2	Very high	8 Å²	8	51.4 Å²	51.4	3%	0.031	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	115.4	172	-169.3	-109.2	0	0	0	109.3	Y37 L38 V63 R64 L67 I69 F77 F79	Y37-Y127 PolarHBondContact O-N 2.85Å; L38-Y127 HydrophobicContact CD2-CD1 4.2Å; V63-Y127 HydrophobicContact CG1-CD1 3.75Å; V63-Y127 HydrophobicContact CG1-CD2 4.18Å; V63-Y127 HydrophobicContact CG1-CE1 3.78Å; V63-Y127 HydrophobicContact CG1-CE2 4.23Å; V63-Y127 HydrophobicContact CG1-CG 3.93Å; R64-Y127 WeakPolarHBondContact CG-OH 3.36Å; L67-Y127 HydrophobicContact CD1-CD1 4.14Å; L67-Y127 HydrophobicContact CD1-CE1 4.16Å; I69-Y127 HydrophobicContact CD1-CE1 3.87Å; F77-Y127 HydrophobicContact CB-CD1 3.93Å; F77-Y127 HydrophobicContact CB-CD2 4.34Å; F77-Y127 HydrophobicContact CB-CE1 3.34Å; F77-Y127 HydrophobicContact CB-CE2 3.82Å; F77-Y127 HydrophobicContact CB-CG 4.4Å; F77-Y127 AromaticContact CD2-CE1 3.89Å; F77-Y127 HydrophobicContact CD2-CE1 3.89Å; F77-Y127 HydrophobicContact CG-CD1 4.28Å; F77-Y127 AromaticContact CG-CE1 3.71Å; F77-Y127 HydrophobicContact CG-CE1 3.71Å; F79-Y127 HydrophobicContact CD1-CD2 4.1Å; F79-Y127 AromaticContact CD2-CD2 3.86Å; F79-Y127 HydrophobicContact CD2-CD2 3.86Å; F79-Y127 HydrophobicContact CD2-CE2 4.04Å; F79-Y127 AromaticContact CE1-CD2 3.89Å; F79-Y127 HydrophobicContact CE1-CD2 3.89Å; F79-Y127 AromaticContact CE2-CD2 3.65Å; F79-Y127 HydrophobicContact CE2-CD2 3.65Å; F79-Y127 AromaticContact CE2-CE2 3.61Å; F79-Y127 HydrophobicContact CE2-CE2 3.61Å; F79-Y127 HydrophobicContact CG-CD2 4.11Å; F79-Y127 AromaticContact CZ-CD2 3.68Å; F79-Y127 HydrophobicContact CZ-CD2 3.68Å; F79-Y127 AromaticContact CZ-CE2 3.93Å; F79-Y127 HydrophobicContact CZ-CE2 3.93Å
128	R	96.6	Very high	96	Very high	12 Å²	12	47.3 Å²	47.3	5%	0.045	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	175.9	-171.6	67.3	171.6	-176.1	-166.3	17.2	111.6	F39 F77 A78 W80 E87 N130 E153	F39-R128 HydrophobicContact CD2-CB 3.86Å; F39-R128 HydrophobicContact CE2-CB 3.59Å; F39-R128 HydrophobicContact CE2-CG 4.24Å; F77-R128 CarbonylContact C-O 3.52Å; F77-R128 WeakPolarHBondContact CA-O 3.39Å; F77-R128 WeakPolarHBondContact CB-O 3.32Å; A78-R128 PolarHBondContact N-O 3.28Å; A78-R128 PolarHBondContact O-N 3.4Å; A78-R128 VanDerWaalsContact O-O 3.13Å; W80-R128 HydrophobicContact CD2-CG 4.46Å; W80-R128 VanDerWaalsContact CD2-NH2 3.3Å; W80-R128 HydrophobicContact CG-CG 3.92Å; W80-R128 VanDerWaalsContact CG-NE 3.28Å; E87-R128 IonicContact OE2-CZ 2.75Å; E87-R128 VanDerWaalsContact OE2-CZ 3.28Å; E87-R128 IonicContact OE2-NH1 3.69Å; E87-R128 PolarHBondContact OE2-NH1 3.22Å; E87-R128 IonicContact OE2-NH2 2.96Å; E87-R128 PolarHBondContact OE2-NH2 3.48Å; R128-N130 PolarHBondContact O-N 3.38Å; R128-E153 WeakPolarHBondContact CB-OE2 3.42Å
129	R	97.2	Very high	95.9	Very high	12 Å²	12	51.7 Å²	51.7	5%	0.045	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-47.7	131.2	-178.5	-173.9	-174.8	-177.8	-71.7	-11.5	110.7	V131 Y133 E138 L150 E153 G268	R129-V131 PolarHBondContact O-N 2.97Å; R129-Y133 PolarHBondContact NH2-O 2.84Å; R129-E138 IonicContact CZ-OE2 3.37Å; R129-E138 VanDerWaalsContact CZ-OE2 3.24Å; R129-E138 IonicContact NE-OE2 2.64Å; R129-E138 PolarHBondContact NE-OE2 3.44Å; R129-E138 IonicContact NH2-OE2 3.37Å; R129-E138 PolarHBondContact NH2-OE2 3.02Å; R129-L150 HydrophobicContact CB-CD2 4.14Å; R129-L150 HydrophobicContact CG-CD2 3.95Å; R129-E153 WeakPolarHBondContact CB-OE2 3.31Å; R129-E153 PolarHBondContact N-OE2 3.03Å; R129-G268 PolarHBondContact NH1-O 2.86Å
130	N	97.4	Very high	95.8	Very high	23 Å²	23	56 Å²	56	12%	0.123	27%	0.272	C	S	.	.			trans	-71.6	120.4	171.5	176.2	6.7	0	0	0	108.3	D75 T76 A78 Q89 R128 F132 Y133	D75-N130 VanDerWaalsContact O-CB 3.24Å; D75-N130 WeakPolarHBondContact O-CB 3.43Å; D75-N130 PolarHBondContact O-ND2 3.35Å; T76-N130 PolarHBondContact O-N 3.41Å; A78-N130 HydrophobicContact CB-CB 3.82Å; Q89-N130 PolarHBondContact NE2-OD1 3.36Å; R128-N130 PolarHBondContact O-N 3.38Å; N130-F132 PolarHBondContact O-N 2.87Å; N130-F132 VanDerWaalsContact O-N 3.09Å; N130-F132 PolarHBondContact OD1-N 3.28Å; N130-Y133 VanDerWaalsContact O-CB 3.28Å; N130-Y133 WeakPolarHBondContact O-CB 3.24Å; N130-Y133 PolarHBondContact O-N 2.88Å
131	V	96.5	Very high	95.7	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.018	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.1	-180	67.5	0	0	0	0	112.9	W80 R129 G268 A270 F366	W80-V131 HydrophobicContact CZ2-CB 4.23Å; R129-V131 PolarHBondContact O-N 2.97Å; V131-G268 WeakPolarHBondContact CG2-O 3.42Å; V131-A270 HydrophobicContact CG2-CB 4.06Å; V131-F366 HydrophobicContact CB-CZ 4.04Å; V131-F366 HydrophobicContact CG1-CE1 4.35Å; V131-F366 HydrophobicContact CG1-CE2 4.11Å; V131-F366 HydrophobicContact CG1-CZ 3.41Å; V131-F366 VanDerWaalsContact CG1-CZ 3.41Å; V131-F366 HydrophobicContact CG2-CE1 4.19Å; V131-F366 HydrophobicContact CG2-CE2 4.48Å; V131-F366 HydrophobicContact CG2-CZ 3.52Å
132	F	95.1	Very high	95.5	Very high	51 Å²	51	55.8 Å²	55.8	22%	0.224	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	5	178	-52.5	-60.9	0	0	0	113.5	N130 P134 L298 F366 F369	N130-F132 PolarHBondContact O-N 2.87Å; N130-F132 VanDerWaalsContact O-N 3.09Å; N130-F132 PolarHBondContact OD1-N 3.28Å; F132-P134 WeakPolarHBondContact O-CD 3.18Å; F132-L298 HydrophobicContact CD1-CD2 4.01Å; F132-F366 HydrophobicContact CD1-CE1 4.39Å; F132-F366 HydrophobicContact CE1-CD1 4.17Å; F132-F366 AromaticContact CE1-CE1 3.42Å; F132-F366 HydrophobicContact CE1-CE1 3.42Å; F132-F366 VanDerWaalsContact CE1-CE1 3.42Å; F132-F366 AromaticContact CE1-CZ 3.68Å; F132-F366 HydrophobicContact CE1-CZ 3.68Å; F132-F366 HydrophobicContact CZ-CD1 4.47Å; F132-F366 AromaticContact CZ-CE1 3.83Å; F132-F366 HydrophobicContact CZ-CE1 3.83Å; F132-F366 HydrophobicContact CZ-CE2 4.21Å; F132-F366 AromaticContact CZ-CZ 3.69Å; F132-F366 HydrophobicContact CZ-CZ 3.69Å; F132-F369 AromaticContact CD1-CD1 3.99Å; F132-F369 HydrophobicContact CD1-CD1 3.99Å; F132-F369 AromaticContact CD1-CE1 3.73Å; F132-F369 HydrophobicContact CD1-CE1 3.73Å; F132-F369 HydrophobicContact CD2-CE1 4.16Å; F132-F369 AromaticContact CE1-CD1 3.36Å; F132-F369 HydrophobicContact CE1-CD1 3.36Å; F132-F369 AromaticContact CE1-CE1 3.52Å; F132-F369 HydrophobicContact CE1-CE1 3.52Å; F132-F369 HydrophobicContact CE2-CD1 4.33Å; F132-F369 AromaticContact CE2-CE1 3.96Å; F132-F369 HydrophobicContact CE2-CE1 3.96Å; F132-F369 HydrophobicContact CG-CE1 4.06Å; F132-F369 AromaticContact CZ-CD1 3.56Å; F132-F369 HydrophobicContact CZ-CD1 3.56Å; F132-F369 AromaticContact CZ-CE1 3.64Å; F132-F369 HydrophobicContact CZ-CE1 3.64Å
133	Y	95.1	Very high	95.5	Very high	25 Å²	25	50.5 Å²	50.5	10%	0.098	25%	0.245	C	C	.	.	S	Bend	trans	-77.3	120.3	173.9	-167.5	-108.7	0	0	0	109.9	D75 T76 R129 N130 K135 K137 E138 I141	D75-Y133 WeakPolarHBondContact O-CD2 3.14Å; T76-Y133 HydrophobicContact CG2-CD1 4.16Å; T76-Y133 HydrophobicContact CG2-CE1 4.02Å; R129-Y133 PolarHBondContact NH2-O 2.84Å; N130-Y133 VanDerWaalsContact O-CB 3.28Å; N130-Y133 WeakPolarHBondContact O-CB 3.24Å; N130-Y133 PolarHBondContact O-N 2.88Å; Y133-K135 PolarHBondContact O-N 2.94Å; Y133-K137 HydrophobicContact CE1-CB 4.07Å; Y133-K137 HydrophobicContact CE2-CB 4.32Å; Y133-K137 HydrophobicContact CE2-CD 4.47Å; Y133-E138 HydrophobicContact CD1-CB 4.06Å; Y133-E138 HydrophobicContact CD1-CG 4.36Å; Y133-E138 HydrophobicContact CE1-CB 3.78Å; Y133-E138 HydrophobicContact CE1-CG 4.18Å; Y133-I141 HydrophobicContact CE1-CD1 3.95Å
134	P	93.2	Very high	95.4	Very high	39 Å²	39	53.8 Å²	53.8	25%	0.253	26%	0.258	S	S	.	.			trans	-65.9	130.7	-177.8	-21.8	33.7	0	0	0	111.7	F132 S136 K137 E138 L298	F132-P134 WeakPolarHBondContact O-CD 3.18Å; P134-S136 PolarHBondContact O-N 2.82Å; P134-K137 HydrophobicContact CB-CG 4.28Å; P134-K137 HydrophobicContact CG-CD 4.23Å; P134-K137 HydrophobicContact CG-CG 4.46Å; P134-K137 WeakPolarHBondContact O-CB 3.36Å; P134-K137 PolarHBondContact O-N 3.02Å; P134-E138 PolarHBondContact O-N 2.82Å; P134-E138 VanDerWaalsContact O-N 3.08Å; P134-L298 HydrophobicContact CB-CD1 4.45Å; P134-L298 HydrophobicContact CG-CD1 4.26Å
135	K	92.8	Very high	95.3	Very high	62 Å²	62	52 Å²	52	27%	0.27	26%	0.257	S	S	.	.	H	α-helix	trans	-57.6	-32.8	175.6	-176.6	179.7	172.5	-168.8	0	112.9	Y133 K137 E138 L139 H262	Y133-K135 PolarHBondContact O-N 2.94Å; K135-K137 VanDerWaalsContact C-N 3.29Å; K135-K137 PolarHBondContact O-N 2.88Å; K135-E138 WeakPolarHBondContact O-CB 3.45Å; K135-E138 PolarHBondContact O-N 2.71Å; K135-E138 VanDerWaalsContact O-N 3.16Å; K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.33Å; K135-H262 WeakPolarHBondContact CE-O 3.41Å; K135-H262 PolarHBondContact NZ-O 2.78Å
136	S	92.5	Very high	95.2	Very high	82 Å²	82	51.2 Å²	51.2	57%	0.573	25%	0.253	S	S	*	.	H	α-helix	trans	-60.7	-35.4	174.1	55.9	0	0	0	0	113.2	P134	P134-S136 PolarHBondContact O-N 2.82Å
137	K	94	Very high	95.2	Very high	124 Å²	124	50.8 Å²	50.8	54%	0.539	25%	0.251	S	S	.	.	H	α-helix	trans	-76.2	-36.7	173.1	-66.4	-172.3	177.7	-179.1	0	111.4	Y133 P134 K135 L139 Q140	Y133-K137 HydrophobicContact CE1-CB 4.07Å; Y133-K137 HydrophobicContact CE2-CB 4.32Å; Y133-K137 HydrophobicContact CE2-CD 4.47Å; P134-K137 HydrophobicContact CB-CG 4.28Å; P134-K137 HydrophobicContact CG-CD 4.23Å; P134-K137 HydrophobicContact CG-CG 4.46Å; P134-K137 WeakPolarHBondContact O-CB 3.36Å; P134-K137 PolarHBondContact O-N 3.02Å; K135-K137 VanDerWaalsContact C-N 3.29Å; K135-K137 PolarHBondContact O-N 2.88Å; K137-L139 VanDerWaalsContact C-N 3.32Å; K137-L139 PolarHBondContact O-N 2.77Å; K137-Q140 WeakPolarHBondContact O-CB 3.32Å; K137-Q140 PolarHBondContact O-N 3.07Å; K137-Q140 VanDerWaalsContact O-N 3.09Å
138	E	95.1	Very high	95.1	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.019	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-40.4	176.9	-157.4	-176.3	124.2	0	0	112.9	R129 Y133 P134 K135 Q140 I141 L150 H262 Y267	R129-E138 IonicContact CZ-OE2 3.37Å; R129-E138 VanDerWaalsContact CZ-OE2 3.24Å; R129-E138 IonicContact NE-OE2 2.64Å; R129-E138 PolarHBondContact NE-OE2 3.44Å; R129-E138 IonicContact NH2-OE2 3.37Å; R129-E138 PolarHBondContact NH2-OE2 3.02Å; Y133-E138 HydrophobicContact CD1-CB 4.06Å; Y133-E138 HydrophobicContact CD1-CG 4.36Å; Y133-E138 HydrophobicContact CE1-CB 3.78Å; Y133-E138 HydrophobicContact CE1-CG 4.18Å; P134-E138 PolarHBondContact O-N 2.82Å; P134-E138 VanDerWaalsContact O-N 3.08Å; K135-E138 WeakPolarHBondContact O-CB 3.45Å; K135-E138 PolarHBondContact O-N 2.71Å; K135-E138 VanDerWaalsContact O-N 3.16Å; E138-Q140 PolarHBondContact O-N 2.94Å; E138-Q140 VanDerWaalsContact O-N 3.1Å; E138-I141 HydrophobicContact CB-CD1 4.36Å; E138-I141 HydrophobicContact CG-CD1 3.88Å; E138-I141 WeakPolarHBondContact O-CB 3.05Å; E138-I141 WeakPolarHBondContact O-CG1 3.38Å; E138-I141 PolarHBondContact O-N 2.96Å; E138-L150 HydrophobicContact CG-CD1 3.66Å; E138-H262 IonicContact OE1-CD2 2.68Å; E138-H262 IonicContact OE1-CE1 2.75Å; E138-H262 IonicContact OE1-NE2 3.24Å; E138-H262 PolarHBondContact OE1-NE2 3.36Å; E138-Y267 VanDerWaalsContact OE1-CE1 3.28Å; E138-Y267 WeakPolarHBondContact OE1-CE1 3.27Å; E138-Y267 PolarHBondContact OE1-OH 3.38Å
139	L	94.4	Very high	95.2	Very high	95 Å²	95	55.1 Å²	55.1	50%	0.497	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.9	175.1	-73.3	168.3	0	0	0	114	K135 K137 H262	K135-L139 WeakPolarHBondContact O-CG 3.4Å; K135-L139 PolarHBondContact O-N 3.33Å; K137-L139 VanDerWaalsContact C-N 3.32Å; K137-L139 PolarHBondContact O-N 2.77Å; L139-H262 VanDerWaalsContact CD2-ND1 3.26Å; L139-H262 WeakPolarHBondContact CD2-ND1 3.45Å
140	Q	94.4	Very high	95.2	Very high	145 Å²	145	54.6 Å²	54.6	68%	0.678	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-5.3	179.2	-55.5	-60.7	-23.2	0	0	113.1	K137 E138 K142	K137-Q140 WeakPolarHBondContact O-CB 3.32Å; K137-Q140 PolarHBondContact O-N 3.07Å; K137-Q140 VanDerWaalsContact O-N 3.09Å; E138-Q140 PolarHBondContact O-N 2.94Å; E138-Q140 VanDerWaalsContact O-N 3.1Å; Q140-K142 PolarHBondContact O-N 3.48Å
141	I	94.6	Very high	95.2	Very high	14 Å²	14	53.5 Å²	53.5	7%	0.072	26%	0.261	C	S	.	.			trans	-69	128.8	-179.4	-65	172	0	0	0	109	T76 Y133 E138 V146 L147 L150 H255	T76-I141 HydrophobicContact CG2-CD1 3.93Å; Y133-I141 HydrophobicContact CE1-CD1 3.95Å; E138-I141 HydrophobicContact CB-CD1 4.36Å; E138-I141 HydrophobicContact CG-CD1 3.88Å; E138-I141 WeakPolarHBondContact O-CB 3.05Å; E138-I141 WeakPolarHBondContact O-CG1 3.38Å; E138-I141 PolarHBondContact O-N 2.96Å; I141-V146 HydrophobicContact CD1-CG1 3.79Å; I141-V146 HydrophobicContact CG2-CB 3.87Å; I141-V146 HydrophobicContact CG2-CG1 3.68Å; I141-L147 HydrophobicContact CB-CD2 4.38Å; I141-L147 HydrophobicContact CG2-CD2 4.08Å; I141-L147 HydrophobicContact CG2-CG 4Å; I141-L150 HydrophobicContact CD1-CD1 3.93Å; I141-H255 PolarHBondContact O-CE1 2.9Å
142	K	93.9	Very high	95.3	Very high	157 Å²	157	54.9 Å²	54.9	68%	0.683	27%	0.268	S	S	*	.			trans	-115.7	-11.9	175.2	-61.5	-177.3	-178.9	-178.7	0	113.2	Q140 E144 Q251	Q140-K142 PolarHBondContact O-N 3.48Å; K142-E144 PolarHBondContact O-N 3.09Å; K142-Q251 VanDerWaalsContact O-CD 3.24Å; K142-Q251 PolarHBondContact O-NE2 3.37Å
143	D	95.1	Very high	95.4	Very high	54 Å²	54	53.1 Å²	53.1	29%	0.289	26%	0.26	S	S	.	.			trans	-69.6	122.6	-177.6	-178	-92.2	0	0	0	110.4	P70 T145 V146 L147	P70-D143 HydrophobicContact CG-CB 4.04Å; D143-T145 VanDerWaalsContact C-N 3.33Å; D143-T145 PolarHBondContact O-N 2.74Å; D143-T145 WeakPolarHBondContact OD1-CB 3.47Å; D143-T145 PolarHBondContact OD1-N 3.39Å; D143-T145 VanDerWaalsContact OD1-N 3.14Å; D143-V146 HydrophobicContact CB-CB 4.24Å; D143-V146 HydrophobicContact CB-CG2 4.14Å; D143-V146 PolarHBondContact O-N 3.34Å; D143-V146 WeakPolarHBondContact OD1-CG2 3.32Å; D143-V146 PolarHBondContact OD1-N 3.43Å; D143-L147 WeakPolarHBondContact O-CB 3.31Å; D143-L147 VanDerWaalsContact O-CG 3.23Å; D143-L147 WeakPolarHBondContact O-CG 3.25Å; D143-L147 PolarHBondContact O-N 3.05Å
144	E	94.9	Very high	95.6	Very high	98 Å²	98	51.9 Å²	51.9	46%	0.458	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-38.7	-174.8	-172.1	179.3	153.5	0	0	112.2	K142 L147 R148 L254	K142-E144 PolarHBondContact O-N 3.09Å; E144-L147 PolarHBondContact O-N 3.34Å; E144-R148 WeakPolarHBondContact O-CB 3.49Å; E144-R148 PolarHBondContact O-N 3.31Å; E144-L254 HydrophobicContact CG-CD1 3.97Å
145	T	94.4	Very high	95.8	Very high	55 Å²	55	52 Å²	52	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-46.4	179.7	-58	0	0	0	0	111	L67 D143 R148 L149	L67-T145 WeakPolarHBondContact O-CG2 3.31Å; D143-T145 VanDerWaalsContact C-N 3.33Å; D143-T145 PolarHBondContact O-N 2.74Å; D143-T145 WeakPolarHBondContact OD1-CB 3.47Å; D143-T145 PolarHBondContact OD1-N 3.39Å; D143-T145 VanDerWaalsContact OD1-N 3.14Å; T145-R148 PolarHBondContact O-N 3.47Å; T145-L149 WeakPolarHBondContact O-CG 3.22Å; T145-L149 PolarHBondContact O-N 2.95Å; T145-L149 VanDerWaalsContact O-N 3.1Å
146	V	96.8	Very high	96	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-43.9	176.2	178.8	0	0	0	0	111	I69 P70 T76 F77 I141 D143 R148 L149 L150	I69-V146 HydrophobicContact CG2-CG2 4.1Å; P70-V146 HydrophobicContact CG-CG2 4.27Å; T76-V146 HydrophobicContact CG2-CG1 3.84Å; F77-V146 HydrophobicContact CE2-CB 4.45Å; F77-V146 HydrophobicContact CE2-CG1 3.86Å; F77-V146 HydrophobicContact CE2-CG2 4.38Å; F77-V146 HydrophobicContact CZ-CG1 3.9Å; I141-V146 HydrophobicContact CD1-CG1 3.79Å; I141-V146 HydrophobicContact CG2-CB 3.87Å; I141-V146 HydrophobicContact CG2-CG1 3.68Å; D143-V146 HydrophobicContact CB-CB 4.24Å; D143-V146 HydrophobicContact CB-CG2 4.14Å; D143-V146 PolarHBondContact O-N 3.34Å; D143-V146 WeakPolarHBondContact OD1-CG2 3.32Å; D143-V146 PolarHBondContact OD1-N 3.43Å; V146-R148 VanDerWaalsContact C-N 3.31Å; V146-R148 PolarHBondContact O-N 3.28Å; V146-L149 PolarHBondContact O-N 3.46Å; V146-L150 HydrophobicContact CG1-CD1 4.15Å; V146-L150 WeakPolarHBondContact O-CG 3.09Å; V146-L150 PolarHBondContact O-N 3.49Å; V146-L150 VanDerWaalsContact O-N 3.11Å
147	L	97.2	Very high	96.2	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-61.4	-39.6	176.5	-70	167.4	0	0	0	111.8	I141 D143 E144 L150 Y151 Q251 L254 H255 L258	I141-L147 HydrophobicContact CB-CD2 4.38Å; I141-L147 HydrophobicContact CG2-CD2 4.08Å; I141-L147 HydrophobicContact CG2-CG 4Å; D143-L147 WeakPolarHBondContact O-CB 3.31Å; D143-L147 VanDerWaalsContact O-CG 3.23Å; D143-L147 WeakPolarHBondContact O-CG 3.25Å; D143-L147 PolarHBondContact O-N 3.05Å; E144-L147 PolarHBondContact O-N 3.34Å; L147-L150 PolarHBondContact O-N 2.96Å; L147-Y151 VanDerWaalsContact O-CB 3.27Å; L147-Y151 WeakPolarHBondContact O-CB 3.49Å; L147-Y151 PolarHBondContact O-N 2.91Å; L147-Q251 HydrophobicContact CD1-CG 3.72Å; L147-L254 HydrophobicContact CB-CB 4.18Å; L147-L254 HydrophobicContact CB-CD1 3.96Å; L147-H255 WeakPolarHBondContact CD1-NE2 3.43Å; L147-L258 HydrophobicContact CB-CD1 4.4Å; L147-L258 HydrophobicContact CD2-CD1 3.69Å
148	R	96.5	Very high	96.3	Very high	84 Å²	84	41.9 Å²	41.9	32%	0.317	20%	0.202	S	C	.	.	H	α-helix	trans	-63.5	-45.6	178.6	-173.6	68.3	-172.3	-155.9	2.1	111.4	E144 T145 V146 Y151 E152 L254	E144-R148 WeakPolarHBondContact O-CB 3.49Å; E144-R148 PolarHBondContact O-N 3.31Å; T145-R148 PolarHBondContact O-N 3.47Å; V146-R148 VanDerWaalsContact C-N 3.31Å; V146-R148 PolarHBondContact O-N 3.28Å; R148-Y151 WeakPolarHBondContact O-CB 3.33Å; R148-Y151 PolarHBondContact O-N 3.24Å; R148-E152 IonicContact CZ-OE1 3.84Å; R148-E152 IonicContact NE-OE1 2.71Å; R148-E152 PolarHBondContact NE-OE1 3.05Å; R148-E152 IonicContact NH2-OE1 2.75Å; R148-E152 PolarHBondContact NH2-OE1 3.44Å; R148-E152 WeakPolarHBondContact O-CG 3.39Å; R148-E152 PolarHBondContact O-N 3.38Å; R148-L254 HydrophobicContact CB-CD1 4.35Å
149	L	97.1	Very high	96.3	Very high	28 Å²	28	42.8 Å²	42.8	15%	0.147	21%	0.207	C	C	.	.	H	α-helix	trans	-62.3	-43.7	177.5	-68.7	171.4	0	0	0	112.1	L38 L67 I69 F77 T145 V146 Y151 E152 E153	L38-L149 HydrophobicContact CD1-CD2 3.99Å; L38-L149 HydrophobicContact CD2-CD2 4.48Å; L67-L149 HydrophobicContact CD1-CD1 4.11Å; I69-L149 HydrophobicContact CD1-CD1 3.91Å; I69-L149 HydrophobicContact CG1-CD1 4.36Å; F77-L149 HydrophobicContact CE1-CB 3.66Å; F77-L149 HydrophobicContact CE1-CD1 4.39Å; F77-L149 HydrophobicContact CE2-CB 4.35Å; F77-L149 HydrophobicContact CE2-CD1 3.84Å; F77-L149 HydrophobicContact CZ-CB 3.45Å; F77-L149 VanDerWaalsContact CZ-CB 3.45Å; F77-L149 HydrophobicContact CZ-CD1 3.79Å; F77-L149 HydrophobicContact CZ-CG 4.28Å; T145-L149 WeakPolarHBondContact O-CG 3.22Å; T145-L149 PolarHBondContact O-N 2.95Å; T145-L149 VanDerWaalsContact O-N 3.1Å; V146-L149 PolarHBondContact O-N 3.46Å; L149-Y151 VanDerWaalsContact C-N 3.32Å; L149-Y151 PolarHBondContact O-N 2.77Å; L149-E152 PolarHBondContact O-N 3.17Å; L149-E153 PolarHBondContact O-N 2.76Å
150	L	98	Very high	96.2	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-40.1	174.8	-70.4	168.4	0	0	0	111.8	T76 F77 R129 E138 I141 V146 L147 A154 L258	T76-L150 HydrophobicContact CG2-CD1 4.36Å; T76-L150 HydrophobicContact CG2-CD2 4.36Å; F77-L150 HydrophobicContact CE1-CD2 3.98Å; F77-L150 HydrophobicContact CE1-CG 4.09Å; F77-L150 HydrophobicContact CZ-CD2 4.41Å; F77-L150 HydrophobicContact CZ-CG 4.11Å; R129-L150 HydrophobicContact CB-CD2 4.14Å; R129-L150 HydrophobicContact CG-CD2 3.95Å; E138-L150 HydrophobicContact CG-CD1 3.66Å; I141-L150 HydrophobicContact CD1-CD1 3.93Å; V146-L150 HydrophobicContact CG1-CD1 4.15Å; V146-L150 WeakPolarHBondContact O-CG 3.09Å; V146-L150 PolarHBondContact O-N 3.49Å; V146-L150 VanDerWaalsContact O-N 3.11Å; L147-L150 PolarHBondContact O-N 2.96Å; L150-A154 VanDerWaalsContact O-CB 3.32Å; L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 2.56Å; L150-L258 HydrophobicContact CB-CD1 4.1Å; L150-L258 HydrophobicContact CB-CD2 3.99Å
151	Y	98.1	Very high	96.2	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-63.7	-47	176.9	158.2	-97.7	0	0	0	112	L147 R148 L149 E153 A154 R155 S177 L180 L254 Y257	L147-Y151 VanDerWaalsContact O-CB 3.27Å; L147-Y151 WeakPolarHBondContact O-CB 3.49Å; L147-Y151 PolarHBondContact O-N 2.91Å; R148-Y151 WeakPolarHBondContact O-CB 3.33Å; R148-Y151 PolarHBondContact O-N 3.24Å; L149-Y151 VanDerWaalsContact C-N 3.32Å; L149-Y151 PolarHBondContact O-N 2.77Å; Y151-E153 VanDerWaalsContact C-N 3.29Å; Y151-E153 PolarHBondContact O-N 2.74Å; Y151-A154 PolarHBondContact O-N 3.35Å; Y151-R155 HydrophobicContact CE2-CB 4.31Å; Y151-R155 VanDerWaalsContact O-CB 3.27Å; Y151-R155 WeakPolarHBondContact O-CB 3.49Å; Y151-R155 PolarHBondContact O-N 3.22Å; Y151-R155 WeakPolarHBondContact OH-CD 3.46Å; Y151-S177 WeakPolarHBondContact OH-CA 3.46Å; Y151-L180 HydrophobicContact CD2-CD1 3.9Å; Y151-L180 HydrophobicContact CE1-CD1 4.09Å; Y151-L180 HydrophobicContact CE2-CD1 3.39Å; Y151-L180 HydrophobicContact CG-CD1 4.43Å; Y151-L180 VanDerWaalsContact CZ-CD1 3.48Å; Y151-L254 HydrophobicContact CD1-CD2 3.76Å; Y151-L254 HydrophobicContact CD2-CD2 4.11Å; Y151-L254 HydrophobicContact CG-CD2 3.5Å; Y151-Y257 AromaticContact CD2-CD1 3.53Å; Y151-Y257 HydrophobicContact CD2-CD1 3.53Å; Y151-Y257 HydrophobicContact CD2-CD2 4.06Å; Y151-Y257 AromaticContact CD2-CE1 4Å; Y151-Y257 HydrophobicContact CD2-CE1 4Å; Y151-Y257 HydrophobicContact CD2-CE2 4.46Å; Y151-Y257 AromaticContact CD2-CG 3.58Å; Y151-Y257 HydrophobicContact CD2-CG 3.58Å; Y151-Y257 AromaticContact CE2-CD1 3.91Å; Y151-Y257 HydrophobicContact CE2-CD1 3.91Å; Y151-Y257 AromaticContact CE2-CD2 3.62Å; Y151-Y257 HydrophobicContact CE2-CD2 3.62Å; Y151-Y257 HydrophobicContact CE2-CE1 4.13Å; Y151-Y257 AromaticContact CE2-CE2 3.85Å; Y151-Y257 HydrophobicContact CE2-CE2 3.85Å; Y151-Y257 AromaticContact CE2-CG 3.66Å; Y151-Y257 HydrophobicContact CE2-CG 3.66Å
152	E	97.9	Very high	96.2	Very high	33 Å²	33	37 Å²	37	15%	0.154	18%	0.182	C	C	.	.	H	α-helix	trans	-61.6	-39.8	-179	-69.2	-62.5	167.7	0	0	111.4	F39 R148 L149 S156	F39-E152 HydrophobicContact CB-CB 4.09Å; R148-E152 IonicContact CZ-OE1 3.84Å; R148-E152 IonicContact NE-OE1 2.71Å; R148-E152 PolarHBondContact NE-OE1 3.05Å; R148-E152 IonicContact NH2-OE1 2.75Å; R148-E152 PolarHBondContact NH2-OE1 3.44Å; R148-E152 WeakPolarHBondContact O-CG 3.39Å; R148-E152 PolarHBondContact O-N 3.38Å; L149-E152 PolarHBondContact O-N 3.17Å; E152-S156 WeakPolarHBondContact O-CB 3.39Å; E152-S156 PolarHBondContact O-N 3.49Å
153	E	98	Very high	96.2	Very high	13 Å²	13	29.6 Å²	29.6	6%	0.061	15%	0.149	C	C	.	.	H	α-helix	trans	-63.7	-49.8	172.1	175	168.6	179.6	0	0	112.2	F39 R128 R129 L149 Y151 R155 S156 N157	F39-E153 HydrophobicContact CB-CB 4.13Å; F39-E153 HydrophobicContact CD1-CB 4.43Å; F39-E153 HydrophobicContact CD2-CB 3.46Å; F39-E153 VanDerWaalsContact CD2-CB 3.46Å; F39-E153 HydrophobicContact CD2-CG 3.62Å; F39-E153 HydrophobicContact CE1-CG 4.42Å; F39-E153 HydrophobicContact CE2-CB 3.86Å; F39-E153 HydrophobicContact CE2-CG 3.43Å; F39-E153 VanDerWaalsContact CE2-CG 3.43Å; F39-E153 VanDerWaalsContact CG-CA 3.49Å; F39-E153 HydrophobicContact CG-CB 3.77Å; F39-E153 HydrophobicContact CG-CG 4.19Å; F39-E153 HydrophobicContact CZ-CB 4.5Å; F39-E153 HydrophobicContact CZ-CG 3.87Å; R128-E153 WeakPolarHBondContact CB-OE2 3.42Å; R129-E153 WeakPolarHBondContact CB-OE2 3.31Å; R129-E153 PolarHBondContact N-OE2 3.03Å; L149-E153 PolarHBondContact O-N 2.76Å; Y151-E153 VanDerWaalsContact C-N 3.29Å; Y151-E153 PolarHBondContact O-N 2.74Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 3.35Å; E153-S156 PolarHBondContact O-N 3.48Å; E153-N157 WeakPolarHBondContact CG-ND2 3.43Å; E153-N157 WeakPolarHBondContact O-CB 3.35Å; E153-N157 PolarHBondContact O-N 3.01Å; E153-N157 PolarHBondContact O-ND2 2.72Å; E153-N157 VanDerWaalsContact O-ND2 3.07Å
154	A	98	Very high	96.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-58.4	-44.8	179.4	0	0	0	0	0	111.4	L150 Y151 N157 I158 Y257 L258 C261 Y267	L150-A154 VanDerWaalsContact O-CB 3.32Å; L150-A154 WeakPolarHBondContact O-CB 3.41Å; L150-A154 PolarHBondContact O-N 2.56Å; Y151-A154 PolarHBondContact O-N 3.35Å; A154-N157 PolarHBondContact O-N 3.1Å; A154-I158 VanDerWaalsContact O-CG1 3.3Å; A154-I158 WeakPolarHBondContact O-CG1 3.38Å; A154-I158 PolarHBondContact O-N 3.1Å; A154-Y257 HydrophobicContact CB-CE1 4.11Å; A154-L258 HydrophobicContact CB-CD2 4.1Å; A154-C261 HydrophobicContact CB-CB 4.4Å; A154-Y267 HydrophobicContact CB-CE2 3.98Å
155	R	97.6	Very high	95.7	Very high	41 Å²	41	23.4 Å²	23.4	16%	0.155	12%	0.121	C	C	.	.	H	α-helix	trans	-61.1	-48.8	176.9	177.8	173	178	-86.3	6.7	111.8	Y151 E153 N157 I158 L159 E181 S202 Y257	Y151-R155 HydrophobicContact CE2-CB 4.31Å; Y151-R155 VanDerWaalsContact O-CB 3.27Å; Y151-R155 WeakPolarHBondContact O-CB 3.49Å; Y151-R155 PolarHBondContact O-N 3.22Å; Y151-R155 WeakPolarHBondContact OH-CD 3.46Å; E153-R155 VanDerWaalsContact C-N 3.31Å; E153-R155 PolarHBondContact O-N 3.35Å; R155-N157 VanDerWaalsContact C-N 3.28Å; R155-N157 PolarHBondContact O-N 3.36Å; R155-I158 PolarHBondContact O-N 3.2Å; R155-L159 HydrophobicContact CG-CD1 3.81Å; R155-L159 HydrophobicContact CG-CG 4.22Å; R155-L159 WeakPolarHBondContact O-CB 3.47Å; R155-L159 VanDerWaalsContact O-CG 3.28Å; R155-L159 WeakPolarHBondContact O-CG 3.5Å; R155-L159 PolarHBondContact O-N 3.3Å; R155-E181 IonicContact CZ-OE1 3.83Å; R155-E181 IonicContact NE-OE1 2.85Å; R155-E181 IonicContact NH2-OE1 3.28Å; R155-E181 PolarHBondContact NH2-OE1 2.82Å; R155-S202 PolarHBondContact NH2-O 2.91Å; R155-S202 VanDerWaalsContact NH2-O 3.11Å; R155-Y257 VanDerWaalsContact CA-OH 3.3Å; R155-Y257 WeakPolarHBondContact CA-OH 3.26Å; R155-Y257 HydrophobicContact CB-CE1 4.31Å
156	S	96.6	Very high	95.4	Very high	46 Å²	46	25 Å²	25	32%	0.322	13%	0.127	S	C	.	.	H	α-helix	trans	-58.3	-42.3	176.7	-173.6	0	0	0	0	112.2	F39 E152 E153 L159 S160	F39-S156 VanDerWaalsContact CD1-CB 3.42Å; E152-S156 WeakPolarHBondContact O-CB 3.39Å; E152-S156 PolarHBondContact O-N 3.49Å; E153-S156 PolarHBondContact O-N 3.48Å; S156-L159 PolarHBondContact O-N 3.09Å; S156-S160 WeakPolarHBondContact O-CB 3.24Å; S156-S160 PolarHBondContact O-N 3.49Å; S156-S160 PolarHBondContact O-OG 2.97Å
157	N	96.9	Very high	94.8	Very high	6 Å²	6	29 Å²	29	3%	0.032	15%	0.153	C	C	.	.	H	α-helix	trans	-67.9	-36.8	178.5	-72.2	-38	0	0	0	113	E153 A154 R155 S160 G161 R162 Y163	E153-N157 WeakPolarHBondContact CG-ND2 3.43Å; E153-N157 WeakPolarHBondContact O-CB 3.35Å; E153-N157 PolarHBondContact O-N 3.01Å; E153-N157 PolarHBondContact O-ND2 2.72Å; E153-N157 VanDerWaalsContact O-ND2 3.07Å; A154-N157 PolarHBondContact O-N 3.1Å; R155-N157 VanDerWaalsContact C-N 3.28Å; R155-N157 PolarHBondContact O-N 3.36Å; N157-S160 PolarHBondContact O-OG 3.32Å; N157-G161 PolarHBondContact O-N 2.9Å; N157-R162 HydrophobicContact CB-CB 4.32Å; N157-R162 WeakPolarHBondContact O-CA 3.48Å; N157-R162 PolarHBondContact O-N 3.25Å; N157-R162 WeakPolarHBondContact OD1-CD 3.36Å; N157-Y163 HydrophobicContact CB-CD1 4.07Å; N157-Y163 HydrophobicContact CB-CD2 3.4Å; N157-Y163 HydrophobicContact CB-CE1 4.1Å; N157-Y163 HydrophobicContact CB-CE2 3.42Å; N157-Y163 VanDerWaalsContact CB-CE2 3.42Å; N157-Y163 HydrophobicContact CB-CG 3.72Å; N157-Y163 PolarHBondContact ND2-OH 2.72Å; N157-Y163 PolarHBondContact O-N 3.5Å
158	I	96.6	Very high	94.4	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.015	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-50.6	172.6	-68.7	-73.4	0	0	0	110.7	A154 R155 S160 G161 Y163 C165 L173 P205 L264	A154-I158 VanDerWaalsContact O-CG1 3.3Å; A154-I158 WeakPolarHBondContact O-CG1 3.38Å; A154-I158 PolarHBondContact O-N 3.1Å; R155-I158 PolarHBondContact O-N 3.2Å; I158-S160 PolarHBondContact O-N 3.35Å; I158-G161 WeakPolarHBondContact O-CA 3.46Å; I158-G161 PolarHBondContact O-N 2.67Å; I158-Y163 HydrophobicContact CD1-CD2 4.33Å; I158-Y163 HydrophobicContact CG1-CD2 4.3Å; I158-C165 HydrophobicContact CD1-CB 4.16Å; I158-L173 HydrophobicContact CD1-CD1 3.99Å; I158-L173 HydrophobicContact CG1-CD1 4.27Å; I158-L173 HydrophobicContact CG2-CD1 4.06Å; I158-P205 HydrophobicContact CG2-CG 4.16Å; I158-L264 HydrophobicContact CD1-CD1 3.98Å
159	L	95.1	Very high	94.1	Very high	23 Å²	23	34.4 Å²	34.4	12%	0.12	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-39.1	-174.9	-67.5	179.6	0	0	0	112.4	R155 S156 G161 S202 P205 A206	R155-L159 HydrophobicContact CG-CD1 3.81Å; R155-L159 HydrophobicContact CG-CG 4.22Å; R155-L159 WeakPolarHBondContact O-CB 3.47Å; R155-L159 VanDerWaalsContact O-CG 3.28Å; R155-L159 WeakPolarHBondContact O-CG 3.5Å; R155-L159 PolarHBondContact O-N 3.3Å; S156-L159 PolarHBondContact O-N 3.09Å; L159-G161 PolarHBondContact O-N 3.32Å; L159-S202 WeakPolarHBondContact CD1-O 3.3Å; L159-P205 WeakPolarHBondContact O-CA 3.38Å; L159-A206 PolarHBondContact O-N 3.24Å
160	S	93.3	Very high	94	Very high	58 Å²	58	34.3 Å²	34.3	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-11.6	173.8	61.9	0	0	0	0	113.6	S156 N157 I158 R162	S156-S160 WeakPolarHBondContact O-CB 3.24Å; S156-S160 PolarHBondContact O-N 3.49Å; S156-S160 PolarHBondContact O-OG 2.97Å; N157-S160 PolarHBondContact O-OG 3.32Å; I158-S160 PolarHBondContact O-N 3.35Å; S160-R162 PolarHBondContact O-N 2.94Å; S160-R162 PolarHBondContact OG-N 2.91Å
161	G	93.1	Very high	93.8	Very high	3 Å²	3	34.8 Å²	34.8	3%	0.031	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	16.8	-172.4	0	0	0	0	0	113.5	N157 I158 L159 Y163 K309	N157-G161 PolarHBondContact O-N 2.9Å; I158-G161 WeakPolarHBondContact O-CA 3.46Å; I158-G161 PolarHBondContact O-N 2.67Å; L159-G161 PolarHBondContact O-N 3.32Å; G161-Y163 VanDerWaalsContact C-N 3.26Å; G161-K309 WeakPolarHBondContact O-CD 3.38Å
162	R	94.4	Very high	93.7	Very high	72 Å²	72	35.3 Å²	35.3	27%	0.272	19%	0.189	S	C	.	.	S	Bend	trans	-66.6	-32.6	169.9	-175.3	175.7	-67.1	-145.5	-1.6	111.2	E87 N157 S160 P164 F271	E87-R162 VanDerWaalsContact CD-NH1 3.34Å; E87-R162 IonicContact OE1-CZ 2.96Å; E87-R162 VanDerWaalsContact OE1-CZ 3.25Å; E87-R162 IonicContact OE1-NH1 3.26Å; E87-R162 PolarHBondContact OE1-NH1 3Å; E87-R162 IonicContact OE1-NH2 2.78Å; E87-R162 PolarHBondContact OE1-NH2 3.21Å; E87-R162 IonicContact OE2-NH1 3.89Å; E87-R162 PolarHBondContact OE2-NH1 3.3Å; N157-R162 HydrophobicContact CB-CB 4.32Å; N157-R162 WeakPolarHBondContact O-CA 3.48Å; N157-R162 PolarHBondContact O-N 3.25Å; N157-R162 WeakPolarHBondContact OD1-CD 3.36Å; S160-R162 PolarHBondContact O-N 2.94Å; S160-R162 PolarHBondContact OG-N 2.91Å; R162-P164 WeakPolarHBondContact O-CD 3.37Å; R162-F271 HydrophobicContact CG-CD1 4.09Å; R162-F271 HydrophobicContact CG-CD2 4.04Å; R162-F271 HydrophobicContact CG-CE1 3.83Å; R162-F271 HydrophobicContact CG-CE2 3.81Å; R162-F271 HydrophobicContact CG-CG 4.16Å; R162-F271 HydrophobicContact CG-CZ 3.71Å
163	Y	95.3	Very high	93.6	Very high	2 Å²	2	34 Å²	34	1%	0.008	18%	0.183	C	C	.	.	S	Bend	trans	-98.8	96.3	162.2	-65.8	-17.3	0	0	0	108.6	N157 I158 G161 C165 L264 Y266 Y267 G268 F271	N157-Y163 HydrophobicContact CB-CD1 4.07Å; N157-Y163 HydrophobicContact CB-CD2 3.4Å; N157-Y163 HydrophobicContact CB-CE1 4.1Å; N157-Y163 HydrophobicContact CB-CE2 3.42Å; N157-Y163 VanDerWaalsContact CB-CE2 3.42Å; N157-Y163 HydrophobicContact CB-CG 3.72Å; N157-Y163 PolarHBondContact ND2-OH 2.72Å; N157-Y163 PolarHBondContact O-N 3.5Å; I158-Y163 HydrophobicContact CD1-CD2 4.33Å; I158-Y163 HydrophobicContact CG1-CD2 4.3Å; G161-Y163 VanDerWaalsContact C-N 3.26Å; Y163-C165 PolarHBondContact O-N 3.31Å; Y163-L264 HydrophobicContact CG-CD1 4.45Å; Y163-Y266 AromaticContact CD1-CD2 3.94Å; Y163-Y266 HydrophobicContact CD1-CD2 3.94Å; Y163-Y266 HydrophobicContact CD1-CE2 4.44Å; Y163-Y266 WeakPolarHBondContact CE1-O 3.32Å; Y163-Y266 HydrophobicContact CG-CD2 4.46Å; Y163-Y267 HydrophobicContact CD2-CD2 4.47Å; Y163-Y267 AromaticContact CE2-CD2 3.73Å; Y163-Y267 HydrophobicContact CE2-CD2 3.73Å; Y163-Y267 HydrophobicContact CE2-CE2 4.16Å; Y163-G268 PolarHBondContact OH-N 2.92Å; Y163-F271 HydrophobicContact CD1-CE2 4.4Å; Y163-F271 AromaticContact CD1-CZ 3.86Å; Y163-F271 HydrophobicContact CD1-CZ 3.86Å; Y163-F271 AromaticContact CE1-CE2 3.74Å; Y163-F271 HydrophobicContact CE1-CE2 3.74Å; Y163-F271 AromaticContact CE1-CZ 3.59Å; Y163-F271 HydrophobicContact CE1-CZ 3.59Å
164	P	91.8	Very high	93.5	Very high	7 Å²	7	33.4 Å²	33.4	5%	0.045	18%	0.18	C	C	.	.			trans	-44.7	142.9	159.9	-30.5	37.8	0	0	0	110	R162 Y266 M304 K309 V311	R162-P164 WeakPolarHBondContact O-CD 3.37Å; P164-Y266 HydrophobicContact CB-CE2 4.42Å; P164-Y266 WeakPolarHBondContact O-CE2 3.42Å; P164-Y266 PolarHBondContact O-OH 3.21Å; P164-M304 HydrophobicContact CG-CB 4.49Å; P164-M304 HydrophobicContact CG-CG 4.13Å; P164-M304 HydrophobicContact CG-SD 4.2Å; P164-K309 VanDerWaalsContact CB-O 3.28Å; P164-K309 WeakPolarHBondContact CB-O 3.47Å; P164-V311 HydrophobicContact CB-CG2 4.29Å; P164-V311 HydrophobicContact CG-CG2 4.44Å
165	C	88.1	Confident	93.4	Very high	14 Å²	14	33.4 Å²	33.4	10%	0.095	18%	0.18	C	C	.	.			trans	-152	149.2	172.5	49.9	0	0	0	0	108.7	I158 Y163 W170 L264	I158-C165 HydrophobicContact CD1-CB 4.16Å; Y163-C165 PolarHBondContact O-N 3.31Å; C165-W170 PolarHBondContact O-NE1 2.97Å; C165-W170 PolarHBondContact SG-NE1 3.24Å; C165-W170 VanDerWaalsContact SG-NE1 3.36Å; C165-L264 HydrophobicContact CB-CD2 4.49Å
166	D	86.4	Confident	93.4	Very high	90 Å²	90	31.8 Å²	31.8	48%	0.481	17%	0.174	S	C	.	.			trans	-66.7	149.1	-176.7	-64.7	-50.5	0	0	0	111.8	E168 H169 W170	D166-E168 HydrophobicContact CB-CG 3.85Å; D166-E168 PolarHBondContact O-N 3.46Å; D166-H169 PolarHBondContact O-N 3.33Å; D166-W170 PolarHBondContact O-NE1 3.23Å
167	P	85.9	Confident	93.4	Very high	82 Å²	82	29.6 Å²	29.6	53%	0.532	16%	0.159	S	C	.	.	H	α-helix	trans	-54.1	-29.6	-178	-27	34.4	0	0	0	115.1	H169 W170	P167-H169 PolarHBondContact O-N 2.9Å; P167-W170 HydrophobicContact CB-CD2 4.35Å; P167-W170 HydrophobicContact CB-CE3 4.01Å; P167-W170 HydrophobicContact CB-CH2 3.84Å; P167-W170 HydrophobicContact CB-CZ2 4.15Å; P167-W170 HydrophobicContact CB-CZ3 3.75Å; P167-W170 HydrophobicContact CG-CH2 3.67Å; P167-W170 HydrophobicContact CG-CZ2 3.87Å; P167-W170 HydrophobicContact CG-CZ3 4.11Å
168	E	88	Confident	93.3	Very high	148 Å²	148	29.3 Å²	29.3	69%	0.692	16%	0.157	S	C	*	.	H	α-helix	trans	-63	-25.5	176	59.1	-145	-136.1	0	0	114	D166	D166-E168 HydrophobicContact CB-CG 3.85Å; D166-E168 PolarHBondContact O-N 3.46Å
169	H	90.8	Very high	93.2	Very high	54 Å²	54	29.2 Å²	29.2	25%	0.25	16%	0.157	C	C	.	.	H	α-helix	trans	-92.8	-18.9	-176.7	-62	127.5	0	0	0	113.8	D166 P167 A171 G172 L173 M260	D166-H169 PolarHBondContact O-N 3.33Å; P167-H169 PolarHBondContact O-N 2.9Å; H169-A171 PolarHBondContact O-N 3.36Å; H169-G172 PolarHBondContact O-N 3.03Å; H169-L173 HydrophobicContact CB-CD1 4.42Å; H169-L173 WeakPolarHBondContact O-CG 3.29Å; H169-L173 PolarHBondContact O-N 2.92Å; H169-M260 HydrophobicContact CB-CE 3.89Å
170	W	93.4	Very high	93.2	Very high	25 Å²	25	29.2 Å²	29.2	10%	0.095	16%	0.157	C	C	.	.	H	α-helix	trans	-60.2	-48	-172.5	-60.5	-18.9	0	0	0	113.2	C165 D166 P167 G174 P205 V208 L229	C165-W170 PolarHBondContact O-NE1 2.97Å; C165-W170 PolarHBondContact SG-NE1 3.24Å; C165-W170 VanDerWaalsContact SG-NE1 3.36Å; D166-W170 PolarHBondContact O-NE1 3.23Å; P167-W170 HydrophobicContact CB-CD2 4.35Å; P167-W170 HydrophobicContact CB-CE3 4.01Å; P167-W170 HydrophobicContact CB-CH2 3.84Å; P167-W170 HydrophobicContact CB-CZ2 4.15Å; P167-W170 HydrophobicContact CB-CZ3 3.75Å; P167-W170 HydrophobicContact CG-CH2 3.67Å; P167-W170 HydrophobicContact CG-CZ2 3.87Å; P167-W170 HydrophobicContact CG-CZ3 4.11Å; W170-G174 PolarHBondContact O-N 2.98Å; W170-P205 HydrophobicContact CG-CG 4.37Å; W170-V208 HydrophobicContact CD2-CG1 4.18Å; W170-V208 HydrophobicContact CD2-CG2 3.89Å; W170-V208 HydrophobicContact CE3-CB 4.25Å; W170-V208 HydrophobicContact CE3-CG1 3.44Å; W170-V208 VanDerWaalsContact CE3-CG1 3.44Å; W170-V208 HydrophobicContact CE3-CG2 3.86Å; W170-V208 HydrophobicContact CH2-CB 4.34Å; W170-V208 HydrophobicContact CH2-CG1 3.99Å; W170-V208 HydrophobicContact CH2-CG2 3.38Å; W170-V208 HydrophobicContact CZ2-CG2 3.43Å; W170-V208 VanDerWaalsContact CZ2-CG2 3.43Å; W170-V208 HydrophobicContact CZ3-CB 4.12Å; W170-V208 HydrophobicContact CZ3-CG1 3.33Å; W170-V208 HydrophobicContact CZ3-CG2 3.61Å; W170-L229 HydrophobicContact CE3-CD2 4.3Å
171	A	94.1	Very high	93.2	Very high	10 Å²	10	29.4 Å²	29.4	8%	0.083	15%	0.152	C	C	.	.	H	α-helix	trans	-67.6	-39.2	-178.7	0	0	0	0	0	111.8	H169 G174 A175 K232 E236	H169-A171 PolarHBondContact O-N 3.36Å; A171-G174 PolarHBondContact O-N 2.94Å; A171-A175 VanDerWaalsContact O-CB 3.26Å; A171-A175 WeakPolarHBondContact O-CB 3.22Å; A171-A175 PolarHBondContact O-N 2.82Å; A171-K232 HydrophobicContact CB-CB 3.81Å; A171-E236 HydrophobicContact CB-CG 3.93Å
172	G	95.6	Very high	93.1	Very high	11 Å²	11	32.1 Å²	32.1	11%	0.113	16%	0.164	C	C	.	.	H	α-helix	trans	-64.4	-47	178	0	0	0	0	0	112.5	H169 G174 A175 L176	H169-G172 PolarHBondContact O-N 3.03Å; G172-G174 PolarHBondContact O-N 3.37Å; G172-A175 PolarHBondContact O-N 2.64Å; G172-L176 WeakPolarHBondContact O-CG 3.43Å; G172-L176 PolarHBondContact O-N 3.27Å
173	L	97	Very high	92.8	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-41.8	175.1	-69	171.7	0	0	0	111.7	I158 H169 L176 S177 Y257 M260	I158-L173 HydrophobicContact CD1-CD1 3.99Å; I158-L173 HydrophobicContact CG1-CD1 4.27Å; I158-L173 HydrophobicContact CG2-CD1 4.06Å; H169-L173 HydrophobicContact CB-CD1 4.42Å; H169-L173 WeakPolarHBondContact O-CG 3.29Å; H169-L173 PolarHBondContact O-N 2.92Å; L173-L176 PolarHBondContact O-N 2.95Å; L173-S177 PolarHBondContact O-N 3.09Å; L173-S177 PolarHBondContact O-OG 3.06Å; L173-Y257 HydrophobicContact CB-CD2 4.46Å; L173-Y257 HydrophobicContact CB-CE2 3.8Å; L173-Y257 HydrophobicContact CD2-CD1 4.19Å; L173-Y257 HydrophobicContact CD2-CD2 3.77Å; L173-Y257 HydrophobicContact CD2-CE1 4.07Å; L173-Y257 HydrophobicContact CD2-CE2 3.63Å; L173-Y257 HydrophobicContact CD2-CG 4.04Å; L173-Y257 HydrophobicContact CG-CE2 4.31Å; L173-Y257 VanDerWaalsContact O-CE2 3.31Å; L173-Y257 WeakPolarHBondContact O-CE2 3.1Å; L173-M260 HydrophobicContact CD2-CB 3.78Å; L173-M260 HydrophobicContact CD2-CE 4.01Å; L173-M260 HydrophobicContact CD2-CG 4.4Å; L173-M260 HydrophobicContact CD2-SD 3.78Å; L173-M260 HydrophobicContact CG-CE 3.8Å; L173-M260 HydrophobicContact CG-SD 4.18Å
174	G	96.6	Very high	92.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-42	176.2	0	0	0	0	0	112.9	W170 A171 G172 S177 L178 F203	W170-G174 PolarHBondContact O-N 2.98Å; A171-G174 PolarHBondContact O-N 2.94Å; G172-G174 PolarHBondContact O-N 3.37Å; G174-S177 WeakPolarHBondContact O-CB 3.4Å; G174-S177 PolarHBondContact O-N 3.18Å; G174-L178 PolarHBondContact O-N 3.24Å; G174-F203 WeakPolarHBondContact CA-O 3.14Å
175	A	96	Very high	91.8	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-43	176.7	0	0	0	0	0	112.5	A171 G172 S177 L178 A179 E236 I240	A171-A175 VanDerWaalsContact O-CB 3.26Å; A171-A175 WeakPolarHBondContact O-CB 3.22Å; A171-A175 PolarHBondContact O-N 2.82Å; G172-A175 PolarHBondContact O-N 2.64Å; A175-S177 VanDerWaalsContact C-N 3.33Å; A175-S177 PolarHBondContact O-N 3.19Å; A175-L178 PolarHBondContact O-N 3.19Å; A175-A179 WeakPolarHBondContact O-CB 3.29Å; A175-A179 PolarHBondContact O-N 3.05Å; A175-E236 HydrophobicContact CB-CB 3.64Å; A175-I240 HydrophobicContact CB-CD1 3.92Å
176	L	96.8	Very high	91.9	Very high	7 Å²	7	35 Å²	35	4%	0.037	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-42.2	173.2	-75.5	166.7	0	0	0	111.5	G172 L173 A179 L180 I240 L253 Q256 Y257 M260	G172-L176 WeakPolarHBondContact O-CG 3.43Å; G172-L176 PolarHBondContact O-N 3.27Å; L173-L176 PolarHBondContact O-N 2.95Å; L176-A179 PolarHBondContact O-N 3.49Å; L176-L180 WeakPolarHBondContact O-CB 3.29Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.17Å; L176-I240 HydrophobicContact CD2-CD1 3.83Å; L176-I240 HydrophobicContact CD2-CG1 4.48Å; L176-I240 HydrophobicContact CG-CD1 4Å; L176-L253 HydrophobicContact CD2-CD2 3.95Å; L176-Q256 HydrophobicContact CD1-CB 4.14Å; L176-Q256 HydrophobicContact CD2-CB 3.88Å; L176-Y257 HydrophobicContact CB-CD2 3.85Å; L176-Y257 HydrophobicContact CD1-CD2 4.33Å; L176-M260 HydrophobicContact CD1-SD 3.77Å
177	S	96.1	Very high	92.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-44.7	176.4	-54.8	0	0	0	0	111.5	Y151 L173 G174 A175 A179 L180 E181 Y257	Y151-S177 WeakPolarHBondContact OH-CA 3.46Å; L173-S177 PolarHBondContact O-N 3.09Å; L173-S177 PolarHBondContact O-OG 3.06Å; G174-S177 WeakPolarHBondContact O-CB 3.4Å; G174-S177 PolarHBondContact O-N 3.18Å; A175-S177 VanDerWaalsContact C-N 3.33Å; A175-S177 PolarHBondContact O-N 3.19Å; S177-A179 PolarHBondContact O-N 3.14Å; S177-L180 PolarHBondContact O-N 2.8Å; S177-E181 WeakPolarHBondContact O-CG 3.24Å; S177-E181 PolarHBondContact O-N 3.29Å; S177-E181 VanDerWaalsContact O-N 3.09Å; S177-Y257 WeakPolarHBondContact OG-CE2 3.33Å
178	L	95.4	Very high	92.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.8	-42	176.7	-178.1	63.4	0	0	0	111.7	G174 A175 L180 E181 E182 I191 K194 F203 L233 Y237	G174-L178 PolarHBondContact O-N 3.24Å; A175-L178 PolarHBondContact O-N 3.19Å; L178-L180 VanDerWaalsContact C-N 3.35Å; L178-E181 PolarHBondContact O-N 3.48Å; L178-E182 HydrophobicContact CD1-CG 3.69Å; L178-E182 PolarHBondContact O-N 2.84Å; L178-I191 HydrophobicContact CD2-CG1 4.4Å; L178-I191 HydrophobicContact CD2-CG2 3.9Å; L178-K194 HydrophobicContact CD1-CB 4.17Å; L178-F203 HydrophobicContact CB-CD1 4.25Å; L178-F203 HydrophobicContact CB-CE1 4.02Å; L178-F203 HydrophobicContact CD1-CE1 3.85Å; L178-F203 HydrophobicContact CD1-CZ 3.92Å; L178-L233 HydrophobicContact CD2-CD2 3.93Å; L178-Y237 HydrophobicContact CB-CD2 4.18Å; L178-Y237 HydrophobicContact CB-CE2 4.42Å; L178-Y237 HydrophobicContact CD2-CD2 3.88Å; L178-Y237 HydrophobicContact CD2-CE2 4.17Å; L178-Y237 HydrophobicContact CD2-CG 4.44Å; L178-Y237 HydrophobicContact CG-CD2 4.03Å; L178-Y237 HydrophobicContact CG-CE2 4Å
179	A	94.8	Very high	92.3	Very high	2 Å²	2	34.8 Å²	34.8	2%	0.017	21%	0.206	C	C	.	.	H	α-helix	trans	-66.1	-35	176.7	0	0	0	0	0	112.8	A175 L176 S177 E181 G183 Y237 I240 L253	A175-A179 WeakPolarHBondContact O-CB 3.29Å; A175-A179 PolarHBondContact O-N 3.05Å; L176-A179 PolarHBondContact O-N 3.49Å; S177-A179 PolarHBondContact O-N 3.14Å; A179-E181 VanDerWaalsContact C-N 3.31Å; A179-G183 CarbonylContact O-C 3.58Å; A179-G183 WeakPolarHBondContact O-CA 3.49Å; A179-G183 PolarHBondContact O-N 3.26Å; A179-Y237 HydrophobicContact CB-CD2 4.15Å; A179-Y237 HydrophobicContact CB-CE2 3.8Å; A179-I240 HydrophobicContact CB-CD1 4.47Å; A179-I240 HydrophobicContact CB-CG2 4.35Å; A179-L253 HydrophobicContact CB-CD1 3.95Å
180	L	94.5	Very high	92.4	Very high	23 Å²	23	36.3 Å²	36.3	12%	0.12	21%	0.213	C	C	.	.	H	α-helix	trans	-70.1	-26	174.3	-78.6	166.1	0	0	0	113.4	Y151 L176 S177 L178 L253 L254	Y151-L180 HydrophobicContact CD2-CD1 3.9Å; Y151-L180 HydrophobicContact CE1-CD1 4.09Å; Y151-L180 HydrophobicContact CE2-CD1 3.39Å; Y151-L180 HydrophobicContact CG-CD1 4.43Å; Y151-L180 VanDerWaalsContact CZ-CD1 3.48Å; L176-L180 WeakPolarHBondContact O-CB 3.29Å; L176-L180 WeakPolarHBondContact O-CG 3.45Å; L176-L180 PolarHBondContact O-N 3.17Å; S177-L180 PolarHBondContact O-N 2.8Å; L178-L180 VanDerWaalsContact C-N 3.35Å; L180-L253 HydrophobicContact CD1-CB 4.42Å; L180-L253 HydrophobicContact CD2-CB 3.59Å; L180-L253 HydrophobicContact CD2-CD1 4.26Å; L180-L253 HydrophobicContact CG-CB 3.82Å; L180-L253 HydrophobicContact CG-CD1 4.36Å; L180-L254 HydrophobicContact CD1-CD2 3.94Å; L180-L254 HydrophobicContact CD2-CD2 3.92Å; L180-L254 HydrophobicContact CD2-CG 3.83Å
181	E	92.4	Very high	92.4	Very high	61 Å²	61	35.4 Å²	35.4	29%	0.285	21%	0.21	S	C	.	.	H	α-helix	trans	-91.5	-43.3	-178.7	-72.7	172.8	-157.4	0	0	112.8	R155 S177 L178 A179 K198	R155-E181 IonicContact CZ-OE1 3.83Å; R155-E181 IonicContact NE-OE1 2.85Å; R155-E181 IonicContact NH2-OE1 3.28Å; R155-E181 PolarHBondContact NH2-OE1 2.82Å; S177-E181 WeakPolarHBondContact O-CG 3.24Å; S177-E181 PolarHBondContact O-N 3.29Å; S177-E181 VanDerWaalsContact O-N 3.09Å; L178-E181 PolarHBondContact O-N 3.48Å; A179-E181 VanDerWaalsContact C-N 3.31Å; E181-K198 WeakPolarHBondContact OE2-CE 3.45Å; E181-K198 IonicContact OE2-NZ 2.76Å; E181-K198 PolarHBondContact OE2-NZ 2.9Å
182	E	91.7	Very high	92.2	Very high	60 Å²	60	37 Å²	37	28%	0.28	22%	0.219	S	C	.	.	H	α-helix	trans	-107.6	-5.3	-172.9	-54.2	-67	150.8	0	0	113.1	L178 L186 K194 K198	L178-E182 HydrophobicContact CD1-CG 3.69Å; L178-E182 PolarHBondContact O-N 2.84Å; E182-L186 HydrophobicContact CB-CD1 3.76Å; E182-L186 HydrophobicContact CB-CG 4.4Å; E182-L186 HydrophobicContact CG-CD1 4.16Å; E182-K194 HydrophobicContact CG-CD 4.27Å; E182-K194 HydrophobicContact CG-CG 4.4Å; E182-K194 IonicContact OE1-NZ 2.67Å; E182-K194 WeakPolarHBondContact OE2-CE 3.46Å; E182-K194 IonicContact OE2-NZ 3.67Å; E182-K194 PolarHBondContact OE2-NZ 2.88Å; E182-K198 IonicContact OE1-NZ 3.01Å; E182-K198 PolarHBondContact OE1-NZ 2.85Å
183	G	88.1	Confident	92.2	Very high	26 Å²	26	39 Å²	39	27%	0.268	23%	0.229	S	C	.	.			trans	79.9	166.5	-168.2	0	0	0	0	0	112.4	A179 Y237	A179-G183 CarbonylContact O-C 3.58Å; A179-G183 WeakPolarHBondContact O-CA 3.49Å; A179-G183 PolarHBondContact O-N 3.26Å; G183-Y237 PolarHBondContact O-OH 3.01Å
184	P	82.4	Confident	92	Very high	36 Å²	36	41.4 Å²	41.4	23%	0.234	24%	0.239	C	C	.	.	S	Bend	trans	-81.5	144.2	170.6	34.4	-34.1	0	0	0	110.4	Y237 S247 P248	P184-Y237 WeakPolarHBondContact CA-OH 3.42Å; P184-S247 WeakPolarHBondContact CG-OG 3.27Å; P184-P248 HydrophobicContact CB-CG 3.9Å; P184-P248 HydrophobicContact CG-CG 3.87Å
185	G	84.8	Confident	91.8	Very high	58 Å²	58	41.4 Å²	41.4	60%	0.598	24%	0.239	S	C	*	.			trans	116.1	8.8	175.3	0	0	0	0	0	116.2	Y237 S241	G185-Y237 PolarHBondContact N-OH 3.4Å; G185-Y237 VanDerWaalsContact N-OH 3.07Å; G185-S241 PolarHBondContact N-OG 3.19Å
186	L	89.7	Confident	91.5	Very high	35 Å²	35	49.9 Å²	49.9	18%	0.183	27%	0.271	C	S	.	.			trans	-65.9	140.2	168.1	-61.9	-178.5	0	0	0	111.3	E182 Q190 I191 K194 Y237	E182-L186 HydrophobicContact CB-CD1 3.76Å; E182-L186 HydrophobicContact CB-CG 4.4Å; E182-L186 HydrophobicContact CG-CD1 4.16Å; L186-Q190 HydrophobicContact CB-CB 4.1Å; L186-Q190 HydrophobicContact CD2-CB 4.12Å; L186-I191 HydrophobicContact CB-CD1 4.45Å; L186-I191 HydrophobicContact CB-CG1 3.73Å; L186-I191 HydrophobicContact CD1-CG1 4.37Å; L186-K194 HydrophobicContact CD1-CG 4.18Å; L186-Y237 HydrophobicContact CB-CE1 3.84Å; L186-Y237 WeakPolarHBondContact CB-OH 3.26Å; L186-Y237 WeakPolarHBondContact CG-OH 3.26Å; L186-Y237 PolarHBondContact N-OH 3.28Å
187	D	89.8	Confident	91.3	Very high	81 Å²	81	55.4 Å²	55.4	43%	0.433	30%	0.297	S	S	.	.			trans	-77.2	169.7	168.3	73.3	45.6	0	0	0	112.1	Q189 Q190 I191	D187-Q189 VanDerWaalsContact C-N 3.25Å; D187-Q189 PolarHBondContact O-N 2.94Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.36Å; D187-Q189 WeakPolarHBondContact OD1-CB 3.24Å; D187-Q189 PolarHBondContact OD1-N 3.36Å; D187-Q190 PolarHBondContact O-N 2.98Å; D187-Q190 WeakPolarHBondContact OD1-CG 3.49Å; D187-Q190 PolarHBondContact OD1-N 2.86Å; D187-I191 WeakPolarHBondContact O-CD1 3.21Å; D187-I191 VanDerWaalsContact O-CG1 3.24Å; D187-I191 WeakPolarHBondContact O-CG1 3.33Å; D187-I191 PolarHBondContact O-N 3.34Å
188	S	88.7	Confident	91.1	Very high	83 Å²	83	58.7 Å²	58.7	58%	0.58	31%	0.311	S	S	*	.	H	α-helix	trans	-59.9	-32.1	-177.3	-170.7	0	0	0	0	114	T192	S188-T192 PolarHBondContact O-N 3.38Å; S188-T192 PolarHBondContact O-OG1 2.99Å
189	Q	90.3	Very high	90.8	Very high	153 Å²	153	65.8 Å²	65.8	72%	0.715	34%	0.342	S	S	*	.	H	α-helix	trans	-76.8	-40.8	-179.8	-174.3	178.9	-4.4	0	0	110.5	D187 T192 T193	D187-Q189 VanDerWaalsContact C-N 3.25Å; D187-Q189 PolarHBondContact O-N 2.94Å; D187-Q189 WeakPolarHBondContact OD1-CA 3.36Å; D187-Q189 WeakPolarHBondContact OD1-CB 3.24Å; D187-Q189 PolarHBondContact OD1-N 3.36Å; Q189-T192 PolarHBondContact O-N 3.07Å; Q189-T193 WeakPolarHBondContact O-CB 3.18Å; Q189-T193 PolarHBondContact O-N 3.37Å; Q189-T193 PolarHBondContact O-OG1 3.14Å
190	Q	93.4	Very high	90.6	Very high	86 Å²	86	66.1 Å²	66.1	40%	0.402	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-45.6	174.5	-68.7	173.7	-28	0	0	111.2	L186 D187 T192 T193 K194	L186-Q190 HydrophobicContact CB-CB 4.1Å; L186-Q190 HydrophobicContact CD2-CB 4.12Å; D187-Q190 PolarHBondContact O-N 2.98Å; D187-Q190 WeakPolarHBondContact OD1-CG 3.49Å; D187-Q190 PolarHBondContact OD1-N 2.86Å; Q190-T192 PolarHBondContact O-N 3.43Å; Q190-T193 WeakPolarHBondContact O-CB 3.41Å; Q190-T193 PolarHBondContact O-N 3.02Å; Q190-T193 VanDerWaalsContact O-N 3.14Å; Q190-K194 WeakPolarHBondContact O-CG 3.44Å; Q190-K194 PolarHBondContact O-N 2.88Å
191	I	92.2	Very high	90.4	Very high	5 Å²	5	67.7 Å²	67.7	3%	0.026	36%	0.355	C	S	.	.	H	α-helix	trans	-56	-51.1	175.1	-66.9	162.9	0	0	0	110.6	L178 L186 D187 T193 K194 I195 L233 S234 Y237	L178-I191 HydrophobicContact CD2-CG1 4.4Å; L178-I191 HydrophobicContact CD2-CG2 3.9Å; L186-I191 HydrophobicContact CB-CD1 4.45Å; L186-I191 HydrophobicContact CB-CG1 3.73Å; L186-I191 HydrophobicContact CD1-CG1 4.37Å; D187-I191 WeakPolarHBondContact O-CD1 3.21Å; D187-I191 VanDerWaalsContact O-CG1 3.24Å; D187-I191 WeakPolarHBondContact O-CG1 3.33Å; D187-I191 PolarHBondContact O-N 3.34Å; I191-T193 PolarHBondContact O-N 3.49Å; I191-K194 PolarHBondContact O-N 3.13Å; I191-I195 HydrophobicContact CG2-CD1 3.69Å; I191-I195 HydrophobicContact CG2-CG1 4.34Å; I191-I195 WeakPolarHBondContact O-CG1 3.42Å; I191-I195 PolarHBondContact O-N 3.14Å; I191-L233 HydrophobicContact CG2-CD2 4.42Å; I191-S234 WeakPolarHBondContact CG2-OG 3.44Å; I191-Y237 HydrophobicContact CD1-CD1 3.33Å; I191-Y237 HydrophobicContact CD1-CE1 3.82Å; I191-Y237 HydrophobicContact CD1-CG 4.01Å; I191-Y237 HydrophobicContact CG1-CD1 3.96Å; I191-Y237 HydrophobicContact CG1-CE1 4.12Å; I191-Y237 HydrophobicContact CG1-CG 4.44Å
192	T	91	Very high	90.5	Very high	44 Å²	44	66.8 Å²	66.8	27%	0.27	36%	0.355	S	S	.	.	H	α-helix	trans	-59.9	-36	179.5	-54.4	0	0	0	0	112	S188 Q189 Q190 R196	S188-T192 PolarHBondContact O-N 3.38Å; S188-T192 PolarHBondContact O-OG1 2.99Å; Q189-T192 PolarHBondContact O-N 3.07Å; Q190-T192 PolarHBondContact O-N 3.43Å; T192-R196 WeakPolarHBondContact O-CB 3.32Å; T192-R196 PolarHBondContact O-N 3.47Å
193	T	93.8	Very high	90.6	Very high	53 Å²	53	64 Å²	64	33%	0.325	34%	0.342	S	S	.	.	H	α-helix	trans	-67.6	-47.2	177.7	-57.5	0	0	0	0	110.6	Q189 Q190 I191 I195 R196 E197	Q189-T193 WeakPolarHBondContact O-CB 3.18Å; Q189-T193 PolarHBondContact O-N 3.37Å; Q189-T193 PolarHBondContact O-OG1 3.14Å; Q190-T193 WeakPolarHBondContact O-CB 3.41Å; Q190-T193 PolarHBondContact O-N 3.02Å; Q190-T193 VanDerWaalsContact O-N 3.14Å; I191-T193 PolarHBondContact O-N 3.49Å; T193-I195 PolarHBondContact O-N 3.37Å; T193-R196 WeakPolarHBondContact O-CB 3.3Å; T193-R196 PolarHBondContact O-N 2.82Å; T193-R196 VanDerWaalsContact O-N 3.14Å; T193-E197 WeakPolarHBondContact O-CG 3.17Å; T193-E197 PolarHBondContact O-N 3.34Å
194	K	94.2	Very high	90.8	Very high	56 Å²	56	62.9 Å²	62.9	24%	0.243	33%	0.33	C	S	.	.	H	α-helix	trans	-63.2	-41.6	178.7	-68	-68.9	178	164.8	0	113	L178 E182 L186 Q190 I191 R196 E197 K198	L178-K194 HydrophobicContact CD1-CB 4.17Å; E182-K194 HydrophobicContact CG-CD 4.27Å; E182-K194 HydrophobicContact CG-CG 4.4Å; E182-K194 IonicContact OE1-NZ 2.67Å; E182-K194 WeakPolarHBondContact OE2-CE 3.46Å; E182-K194 IonicContact OE2-NZ 3.67Å; E182-K194 PolarHBondContact OE2-NZ 2.88Å; L186-K194 HydrophobicContact CD1-CG 4.18Å; Q190-K194 WeakPolarHBondContact O-CG 3.44Å; Q190-K194 PolarHBondContact O-N 2.88Å; I191-K194 PolarHBondContact O-N 3.13Å; K194-R196 VanDerWaalsContact C-N 3.26Å; K194-R196 PolarHBondContact O-N 3.05Å; K194-E197 PolarHBondContact O-N 3.13Å; K194-K198 PolarHBondContact O-N 3.33Å
195	I	91	Very high	91.3	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-38.8	175.2	-64.1	165.8	0	0	0	110.9	I191 T193 K199 L200 F203 E230 L233	I191-I195 HydrophobicContact CG2-CD1 3.69Å; I191-I195 HydrophobicContact CG2-CG1 4.34Å; I191-I195 WeakPolarHBondContact O-CG1 3.42Å; I191-I195 PolarHBondContact O-N 3.14Å; T193-I195 PolarHBondContact O-N 3.37Å; I195-K199 CarbonylContact O-C 3.52Å; I195-K199 VanDerWaalsContact O-C 3.29Å; I195-K199 WeakPolarHBondContact O-CA 3.45Å; I195-K199 PolarHBondContact O-N 2.93Å; I195-L200 HydrophobicContact CG2-CB 4.41Å; I195-L200 HydrophobicContact CG2-CD1 4.12Å; I195-F203 HydrophobicContact CG1-CE2 4.41Å; I195-E230 HydrophobicContact CG2-CG 4.02Å; I195-L233 HydrophobicContact CD1-CD1 4.36Å; I195-L233 HydrophobicContact CD1-CD2 3.9Å; I195-L233 HydrophobicContact CG1-CD2 4.47Å
196	R	89.7	Confident	91.5	Very high	177 Å²	177	60.6 Å²	60.6	67%	0.668	31%	0.308	S	S	*	.	H	α-helix	trans	-70	-42.3	178.9	-166.4	-171.1	-37.1	-141.8	-0.4	112.6	T192 T193 K194	T192-R196 WeakPolarHBondContact O-CB 3.32Å; T192-R196 PolarHBondContact O-N 3.47Å; T193-R196 WeakPolarHBondContact O-CB 3.3Å; T193-R196 PolarHBondContact O-N 2.82Å; T193-R196 VanDerWaalsContact O-N 3.14Å; K194-R196 VanDerWaalsContact C-N 3.26Å; K194-R196 PolarHBondContact O-N 3.05Å
197	E	93.4	Very high	91.3	Very high	124 Å²	124	61.7 Å²	61.7	58%	0.579	31%	0.312	S	S	*	.	H	α-helix	trans	-60.7	-50.4	176.8	-73.8	173.3	178.9	0	0	111.2	T193 K194	T193-E197 WeakPolarHBondContact O-CG 3.17Å; T193-E197 PolarHBondContact O-N 3.34Å; K194-E197 PolarHBondContact O-N 3.13Å
198	K	91.3	Very high	91	Very high	69 Å²	69	58.1 Å²	58.1	30%	0.3	29%	0.294	S	S	.	.	H	α-helix	trans	-85.1	-11.7	-177.6	-74.7	175.4	168.8	174	0	113.9	E181 E182 K194 S202 F203	E181-K198 WeakPolarHBondContact OE2-CE 3.45Å; E181-K198 IonicContact OE2-NZ 2.76Å; E181-K198 PolarHBondContact OE2-NZ 2.9Å; E182-K198 IonicContact OE1-NZ 3.01Å; E182-K198 PolarHBondContact OE1-NZ 2.85Å; K194-K198 PolarHBondContact O-N 3.33Å; K198-S202 WeakPolarHBondContact O-CB 3.28Å; K198-S202 PolarHBondContact O-OG 3.31Å; K198-F203 HydrophobicContact CB-CE2 3.66Å; K198-F203 HydrophobicContact CB-CZ 3.78Å; K198-F203 HydrophobicContact CD-CE1 4.44Å; K198-F203 HydrophobicContact CD-CE2 4.41Å; K198-F203 HydrophobicContact CD-CZ 3.64Å; K198-F203 HydrophobicContact CG-CZ 4.33Å
199	K	90.8	Very high	90.6	Very high	148 Å²	148	54.2 Å²	54.2	64%	0.643	27%	0.266	S	S	*	.			trans	64.4	145.6	-171.2	-49.6	174.1	-177.6	171	0	112.8	I195 S202	I195-K199 CarbonylContact O-C 3.52Å; I195-K199 VanDerWaalsContact O-C 3.29Å; I195-K199 WeakPolarHBondContact O-CA 3.45Å; I195-K199 PolarHBondContact O-N 2.93Å; K199-S202 WeakPolarHBondContact O-CB 3.45Å; K199-S202 PolarHBondContact O-N 3.3Å
200	L	88.8	Confident	89.7	Confident	10 Å²	10	51.9 Å²	51.9	5%	0.052	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-53.2	-38.6	179.4	-170.3	63	0	0	0	115.2	I195 S202 F203 V204 A209 Q226 L229 E230	I195-L200 HydrophobicContact CG2-CB 4.41Å; I195-L200 HydrophobicContact CG2-CD1 4.12Å; L200-S202 PolarHBondContact O-N 2.97Å; L200-F203 PolarHBondContact O-N 3.39Å; L200-V204 HydrophobicContact CD1-CG1 4.13Å; L200-V204 HydrophobicContact CD1-CG2 4.23Å; L200-V204 HydrophobicContact CD2-CG2 4.38Å; L200-V204 HydrophobicContact CG-CG2 3.79Å; L200-V204 PolarHBondContact O-N 2.98Å; L200-V204 VanDerWaalsContact O-N 3.12Å; L200-A209 HydrophobicContact CG-CB 4.49Å; L200-Q226 HydrophobicContact CD2-CB 4.21Å; L200-Q226 HydrophobicContact CD2-CG 4.18Å; L200-L229 HydrophobicContact CD2-CB 4.06Å; L200-L229 HydrophobicContact CD2-CD1 4.2Å; L200-E230 HydrophobicContact CD1-CG 4.09Å; L200-E230 HydrophobicContact CD2-CG 4.46Å
201	P	91.7	Very high	88	Confident	56 Å²	56	49 Å²	49	36%	0.364	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-60.3	-14.1	176.6	-20.8	30.7	0	0	0	115.5	F203 A209	P201-F203 VanDerWaalsContact C-N 3.27Å; P201-A209 HydrophobicContact CB-CB 4.03Å; P201-A209 HydrophobicContact CG-CB 3.63Å
202	S	93.1	Very high	86	Confident	41 Å²	41	54 Å²	54	29%	0.287	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-77.3	-14.1	174	-60.2	0	0	0	0	112.8	R155 L159 K198 K199 L200	R155-S202 PolarHBondContact NH2-O 2.91Å; R155-S202 VanDerWaalsContact NH2-O 3.11Å; L159-S202 WeakPolarHBondContact CD1-O 3.3Å; K198-S202 WeakPolarHBondContact O-CB 3.28Å; K198-S202 PolarHBondContact O-OG 3.31Å; K199-S202 WeakPolarHBondContact O-CB 3.45Å; K199-S202 PolarHBondContact O-N 3.3Å; L200-S202 PolarHBondContact O-N 2.97Å
203	F	93.9	Very high	83.8	Confident	3 Å²	3	53.3 Å²	53.3	1%	0.013	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.8	-21.5	-177.1	-55.7	-74	0	0	0	113.7	G174 L178 I195 K198 L200 P201 L233	G174-F203 WeakPolarHBondContact CA-O 3.14Å; L178-F203 HydrophobicContact CB-CD1 4.25Å; L178-F203 HydrophobicContact CB-CE1 4.02Å; L178-F203 HydrophobicContact CD1-CE1 3.85Å; L178-F203 HydrophobicContact CD1-CZ 3.92Å; I195-F203 HydrophobicContact CG1-CE2 4.41Å; K198-F203 HydrophobicContact CB-CE2 3.66Å; K198-F203 HydrophobicContact CB-CZ 3.78Å; K198-F203 HydrophobicContact CD-CE1 4.44Å; K198-F203 HydrophobicContact CD-CE2 4.41Å; K198-F203 HydrophobicContact CD-CZ 3.64Å; K198-F203 HydrophobicContact CG-CZ 4.33Å; L200-F203 PolarHBondContact O-N 3.39Å; P201-F203 VanDerWaalsContact C-N 3.27Å; F203-L233 HydrophobicContact CB-CD1 3.69Å; F203-L233 HydrophobicContact CG-CD1 4.23Å
204	V	93.4	Very high	81.6	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.006	30%	0.304	C	S	.	.	S	Bend	trans	-129.1	156.9	179.2	-50.1	0	0	0	0	110.6	L200 A206 A209	L200-V204 HydrophobicContact CD1-CG1 4.13Å; L200-V204 HydrophobicContact CD1-CG2 4.23Å; L200-V204 HydrophobicContact CD2-CG2 4.38Å; L200-V204 HydrophobicContact CG-CG2 3.79Å; L200-V204 PolarHBondContact O-N 2.98Å; L200-V204 VanDerWaalsContact O-N 3.12Å; V204-A206 PolarHBondContact O-N 2.89Å; V204-A209 HydrophobicContact CG2-CB 3.79Å
205	P	92.9	Very high	79.3	Confident	2 Å²	2	61 Å²	61	1%	0.013	34%	0.338	C	S	.	.			trans	-52.9	134.9	-178.6	-26.3	34.4	0	0	0	113.1	I158 L159 W170 H207 V208 A209	I158-P205 HydrophobicContact CG2-CG 4.16Å; L159-P205 WeakPolarHBondContact O-CA 3.38Å; W170-P205 HydrophobicContact CG-CG 4.37Å; P205-H207 VanDerWaalsContact C-N 3.25Å; P205-H207 WeakPolarHBondContact CB-CE1 3.42Å; P205-H207 PolarHBondContact O-N 2.68Å; P205-H207 VanDerWaalsContact O-N 3.16Å; P205-V208 HydrophobicContact CB-CG2 4Å; P205-V208 HydrophobicContact CG-CG2 4.41Å; P205-V208 WeakPolarHBondContact O-CA 3.43Å; P205-V208 VanDerWaalsContact O-CB 3.3Å; P205-V208 WeakPolarHBondContact O-CB 3.49Å; P205-V208 PolarHBondContact O-N 2.75Å; P205-A209 PolarHBondContact O-N 2.71Å; P205-A209 VanDerWaalsContact O-N 3.09Å
206	A	88.1	Confident	77.2	Confident	44 Å²	44	70.4 Å²	70.4	36%	0.364	38%	0.379	S	S	.	.	H	α-helix	trans	-57.2	-38.1	-171.7	0	0	0	0	0	113	L159 V204 V208 A209 V210	L159-A206 PolarHBondContact O-N 3.24Å; V204-A206 PolarHBondContact O-N 2.89Å; A206-V208 PolarHBondContact O-N 3.36Å; A206-A209 PolarHBondContact O-N 3.04Å; A206-V210 WeakPolarHBondContact O-CG2 3.25Å; A206-V210 PolarHBondContact O-N 3.18Å
207	H	85.1	Confident	75.2	Confident	58 Å²	58	64.2 Å²	64.2	27%	0.269	36%	0.363	S	S	.	.	H	α-helix	trans	-66.1	-23.1	177.8	69.6	-85	0	0	0	113.4	P205 K309	P205-H207 VanDerWaalsContact C-N 3.25Å; P205-H207 WeakPolarHBondContact CB-CE1 3.42Å; P205-H207 PolarHBondContact O-N 2.68Å; P205-H207 VanDerWaalsContact O-N 3.16Å; H207-K309 HydrophobicContact CB-CG 4.21Å
208	V	85.3	Confident	73	Confident	7 Å²	7	63.4 Å²	63.4	4%	0.042	37%	0.367	C	S	.	.	H	α-helix	trans	-83.8	-45.4	175.6	178.8	0	0	0	0	110.3	W170 P205 A206 V210 G211 L229	W170-V208 HydrophobicContact CD2-CG1 4.18Å; W170-V208 HydrophobicContact CD2-CG2 3.89Å; W170-V208 HydrophobicContact CE3-CB 4.25Å; W170-V208 HydrophobicContact CE3-CG1 3.44Å; W170-V208 VanDerWaalsContact CE3-CG1 3.44Å; W170-V208 HydrophobicContact CE3-CG2 3.86Å; W170-V208 HydrophobicContact CH2-CB 4.34Å; W170-V208 HydrophobicContact CH2-CG1 3.99Å; W170-V208 HydrophobicContact CH2-CG2 3.38Å; W170-V208 HydrophobicContact CZ2-CG2 3.43Å; W170-V208 VanDerWaalsContact CZ2-CG2 3.43Å; W170-V208 HydrophobicContact CZ3-CB 4.12Å; W170-V208 HydrophobicContact CZ3-CG1 3.33Å; W170-V208 HydrophobicContact CZ3-CG2 3.61Å; P205-V208 HydrophobicContact CB-CG2 4Å; P205-V208 HydrophobicContact CG-CG2 4.41Å; P205-V208 WeakPolarHBondContact O-CA 3.43Å; P205-V208 VanDerWaalsContact O-CB 3.3Å; P205-V208 WeakPolarHBondContact O-CB 3.49Å; P205-V208 PolarHBondContact O-N 2.75Å; A206-V208 PolarHBondContact O-N 3.36Å; V208-V210 VanDerWaalsContact C-N 3.32Å; V208-V210 PolarHBondContact O-N 3.21Å; V208-G211 PolarHBondContact O-N 2.85Å; V208-L229 HydrophobicContact CG1-CD1 3.69Å; V208-L229 HydrophobicContact CG1-CD2 4.41Å
209	A	79	Confident	71.1	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.008	39%	0.393	C	S	.	.	H	α-helix	trans	-63.7	-34.8	-174.7	0	0	0	0	0	113.2	L200 P201 V204 P205 A206 G211 Q226	L200-A209 HydrophobicContact CG-CB 4.49Å; P201-A209 HydrophobicContact CB-CB 4.03Å; P201-A209 HydrophobicContact CG-CB 3.63Å; V204-A209 HydrophobicContact CG2-CB 3.79Å; P205-A209 PolarHBondContact O-N 2.71Å; P205-A209 VanDerWaalsContact O-N 3.09Å; A206-A209 PolarHBondContact O-N 3.04Å; A209-G211 VanDerWaalsContact C-N 3.33Å; A209-Q226 PolarHBondContact O-NE2 2.93Å
210	V	71.1	Confident	69.2	Low	104 Å²	104	71.8 Å²	71.8	63%	0.63	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-16.1	-178.8	-179.4	0	0	0	0	112.3	A206 V208	A206-V210 WeakPolarHBondContact O-CG2 3.25Å; A206-V210 PolarHBondContact O-N 3.18Å; V208-V210 VanDerWaalsContact C-N 3.32Å; V208-V210 PolarHBondContact O-N 3.21Å
211	G	58.5	Low	67.6	Low	24 Å²	24	73.1 Å²	73.1	25%	0.247	42%	0.42	C	S	.	.			trans	68.3	131.2	-173.5	0	0	0	0	0	111.9	V208 A209 G213	V208-G211 PolarHBondContact O-N 2.85Å; A209-G211 VanDerWaalsContact C-N 3.33Å; G211-G213 PolarHBondContact O-N 3.11Å
212	S	49.3	Very low	65.9	Low	110 Å²	110	74.5 Å²	74.5	77%	0.769	42%	0.42	S	S	*	.	S	Bend	trans	-68.7	67.3	174.1	-42.9	0	0	0	0	111.1
213	G	46.2	Very low	64.5	Low	30 Å²	30	76.1 Å²	76.1	31%	0.309	43%	0.431	S	S	.	.			trans	-112.7	95.6	-175.1	0	0	0	0	0	110.8	G211	G211-G213 PolarHBondContact O-N 3.11Å
214	G	47.4	Very low	63.6	Low	56 Å²	56	79.8 Å²	79.8	58%	0.577	46%	0.457	S	S	*	.			trans	-55.5	169.5	160.7	0	0	0	0	0	111.5	F216 S217	G214-F216 PolarHBondContact O-N 2.67Å; G214-S217 PolarHBondContact O-N 3.34Å
215	F	46.4	Very low	63	Low	216 Å²	216	85.3 Å²	85.3	95%	0.947	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-0.9	-170.9	-69.1	-87	0	0	0	117.4
216	F	45.5	Very low	62.5	Low	197 Å²	197	88.9 Å²	88.9	86%	0.864	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.3	6.1	177.7	-62.5	-75.5	0	0	0	115	G214 T218	G214-F216 PolarHBondContact O-N 2.67Å; F216-T218 PolarHBondContact O-N 3.11Å
217	S	49	Very low	62.4	Low	48 Å²	48	89.3 Å²	89.3	34%	0.336	50%	0.498	S	S	.	.			trans	-72.1	98.6	173.4	179.1	0	0	0	0	109.5	G214 L219 K222	G214-S217 PolarHBondContact O-N 3.34Å; S217-L219 PolarHBondContact O-N 3.43Å; S217-K222 WeakPolarHBondContact OG-CE 3.49Å
218	T	45.8	Very low	62.6	Low	107 Å²	107	90.9 Å²	90.9	66%	0.656	51%	0.506	S	S	*	.			trans	-51	135.4	177.2	50.4	0	0	0	0	110.6	F216 R220 G221	F216-T218 PolarHBondContact O-N 3.11Å; T218-R220 PolarHBondContact O-N 3.02Å; T218-G221 PolarHBondContact O-N 3.01Å; T218-G221 VanDerWaalsContact O-N 3.12Å
219	L	52.3	Low	62.8	Low	162 Å²	162	91.3 Å²	91.3	85%	0.848	51%	0.508	S	S	*	.	H	α-helix	trans	-53.3	-9.2	-175.7	-74.9	160.5	0	0	0	115.2	S217	S217-L219 PolarHBondContact O-N 3.43Å
220	R	51.5	Low	63.3	Low	230 Å²	230	94.1 Å²	94.1	87%	0.868	52%	0.521	S	S	*	.	H	α-helix	trans	-85.4	-20.5	-179.7	-146.1	176.5	-159.8	169.8	5.5	114.4	T218	T218-R220 PolarHBondContact O-N 3.02Å
221	G	53.8	Low	64.3	Low	39 Å²	39	94.7 Å²	94.7	40%	0.402	52%	0.516	S	S	.	.	H	α-helix	trans	-95.8	-25.5	-176.4	0	0	0	0	0	115.1	T218 R225	T218-G221 PolarHBondContact O-N 3.01Å; T218-G221 VanDerWaalsContact O-N 3.12Å; G221-R225 PolarHBondContact O-N 3.4Å
222	K	57.3	Low	66	Low	85 Å²	85	97.8 Å²	97.8	37%	0.37	52%	0.523	S	S	.	.	H	α-helix	trans	-69.6	-41.9	-177.3	-70.1	-178.6	174.5	178.6	0	112.6	S217 S224 Q226	S217-K222 WeakPolarHBondContact OG-CE 3.49Å; K222-S224 VanDerWaalsContact C-N 3.35Å; K222-Q226 PolarHBondContact O-N 2.86Å
223	S	63.4	Low	68.1	Low	74 Å²	74	92.5 Å²	92.5	52%	0.517	49%	0.486	S	S	.	.	H	α-helix	trans	-66.5	-35.5	177.1	53.9	0	0	0	0	112.6	Q226 A227	S223-Q226 PolarHBondContact O-N 3.18Å; S223-A227 VanDerWaalsContact O-CB 3.3Å; S223-A227 WeakPolarHBondContact O-CB 3.42Å; S223-A227 PolarHBondContact O-N 2.97Å
224	S	74.5	Confident	70.3	Confident	80 Å²	80	92 Å²	92	56%	0.559	48%	0.478	S	S	*	.	H	α-helix	trans	-63.4	-45.3	-180	-167.3	0	0	0	0	112.2	K222 A227 E228	K222-S224 VanDerWaalsContact C-N 3.35Å; S224-A227 PolarHBondContact O-N 3.48Å; S224-E228 PolarHBondContact O-N 3.45Å
225	R	79.6	Confident	72.5	Confident	117 Å²	117	93.9 Å²	93.9	44%	0.442	47%	0.472	S	S	.	.	H	α-helix	trans	-70.2	-36.7	-179.8	-167.4	177.3	-176	174	-0.3	112.6	G221 E228 L229	G221-R225 PolarHBondContact O-N 3.4Å; R225-E228 PolarHBondContact O-N 3.34Å; R225-L229 WeakPolarHBondContact O-CG 3.11Å; R225-L229 PolarHBondContact O-N 2.88Å; R225-L229 VanDerWaalsContact O-N 3.11Å
226	Q	83.1	Confident	74.8	Confident	78 Å²	78	86.4 Å²	86.4	36%	0.364	44%	0.439	S	S	.	.	H	α-helix	trans	-65.4	-45.5	173.4	-72.8	-179	-17.5	0	0	110.9	L200 A209 K222 S223 E228 L229 E230	L200-Q226 HydrophobicContact CD2-CB 4.21Å; L200-Q226 HydrophobicContact CD2-CG 4.18Å; A209-Q226 PolarHBondContact O-NE2 2.93Å; K222-Q226 PolarHBondContact O-N 2.86Å; S223-Q226 PolarHBondContact O-N 3.18Å; Q226-E228 VanDerWaalsContact C-N 3.3Å; Q226-E228 PolarHBondContact O-N 2.93Å; Q226-L229 PolarHBondContact O-N 3.37Å; Q226-L229 VanDerWaalsContact O-N 3.12Å; Q226-E230 WeakPolarHBondContact O-CG 3.33Å; Q226-E230 PolarHBondContact O-N 3.4Å
227	A	86.1	Confident	77.1	Confident	53 Å²	53	77 Å²	77	44%	0.438	40%	0.398	S	S	.	.	H	α-helix	trans	-59.9	-39.2	175.7	0	0	0	0	0	112.3	S223 S224 L229 E230 Q231	S223-A227 VanDerWaalsContact O-CB 3.3Å; S223-A227 WeakPolarHBondContact O-CB 3.42Å; S223-A227 PolarHBondContact O-N 2.97Å; S224-A227 PolarHBondContact O-N 3.48Å; A227-L229 PolarHBondContact O-N 3.13Å; A227-E230 PolarHBondContact O-N 3.26Å; A227-Q231 WeakPolarHBondContact O-CB 3.42Å; A227-Q231 PolarHBondContact O-N 3.14Å
228	E	89.1	Confident	79.1	Confident	91 Å²	91	75.7 Å²	75.7	43%	0.425	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-41.2	174.7	-169.3	-167.5	154.6	0	0	112.1	S224 R225 Q226 K232	S224-E228 PolarHBondContact O-N 3.45Å; R225-E228 PolarHBondContact O-N 3.34Å; Q226-E228 VanDerWaalsContact C-N 3.3Å; Q226-E228 PolarHBondContact O-N 2.93Å; E228-K232 HydrophobicContact CG-CD 4.37Å; E228-K232 WeakPolarHBondContact O-CB 3.37Å; E228-K232 WeakPolarHBondContact O-CG 3.32Å; E228-K232 PolarHBondContact O-N 3Å; E228-K232 WeakPolarHBondContact OE1-CE 3.45Å; E228-K232 IonicContact OE1-NZ 3.13Å; E228-K232 PolarHBondContact OE1-NZ 3.43Å
229	L	89.2	Confident	81.3	Confident	15 Å²	15	76 Å²	76	8%	0.079	38%	0.384	C	S	.	.	H	α-helix	trans	-68	-41.7	176.5	-71.3	167.9	0	0	0	112	W170 L200 V208 R225 Q226 A227 Q231 K232 L233	W170-L229 HydrophobicContact CE3-CD2 4.3Å; L200-L229 HydrophobicContact CD2-CB 4.06Å; L200-L229 HydrophobicContact CD2-CD1 4.2Å; V208-L229 HydrophobicContact CG1-CD1 3.69Å; V208-L229 HydrophobicContact CG1-CD2 4.41Å; R225-L229 WeakPolarHBondContact O-CG 3.11Å; R225-L229 PolarHBondContact O-N 2.88Å; R225-L229 VanDerWaalsContact O-N 3.11Å; Q226-L229 PolarHBondContact O-N 3.37Å; Q226-L229 VanDerWaalsContact O-N 3.12Å; A227-L229 PolarHBondContact O-N 3.13Å; L229-Q231 VanDerWaalsContact C-N 3.34Å; L229-K232 PolarHBondContact O-N 3.5Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.5Å; L229-L233 PolarHBondContact O-N 3.42Å
230	E	91.3	Very high	83.1	Confident	61 Å²	61	68.9 Å²	68.9	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-61.6	-42.8	175.2	-71.2	-178.2	-178.4	0	0	111.6	I195 L200 Q226 A227 L233 S234	I195-E230 HydrophobicContact CG2-CG 4.02Å; L200-E230 HydrophobicContact CD1-CG 4.09Å; L200-E230 HydrophobicContact CD2-CG 4.46Å; Q226-E230 WeakPolarHBondContact O-CG 3.33Å; Q226-E230 PolarHBondContact O-N 3.4Å; A227-E230 PolarHBondContact O-N 3.26Å; E230-L233 PolarHBondContact O-N 3.22Å; E230-S234 WeakPolarHBondContact O-CB 3.38Å; E230-S234 PolarHBondContact O-N 2.88Å; E230-S234 PolarHBondContact O-OG 2.85Å
231	Q	91.9	Very high	84.4	Confident	116 Å²	116	60 Å²	60	54%	0.542	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-50.9	175.1	-176.8	-175.1	-17.7	0	0	110.8	A227 L229 L233 S234 E235	A227-Q231 WeakPolarHBondContact O-CB 3.42Å; A227-Q231 PolarHBondContact O-N 3.14Å; L229-Q231 VanDerWaalsContact C-N 3.34Å; Q231-L233 VanDerWaalsContact C-N 3.33Å; Q231-L233 PolarHBondContact O-N 2.81Å; Q231-S234 WeakPolarHBondContact O-CB 3.31Å; Q231-S234 PolarHBondContact O-N 2.78Å; Q231-S234 VanDerWaalsContact O-N 3.13Å; Q231-E235 WeakPolarHBondContact CG-OE1 3.43Å; Q231-E235 PolarHBondContact NE2-OE1 3.26Å; Q231-E235 WeakPolarHBondContact O-CG 3.43Å; Q231-E235 PolarHBondContact O-N 3.45Å
232	K	93.4	Very high	85.6	Confident	88 Å²	88	66.6 Å²	66.6	38%	0.383	34%	0.338	S	S	.	.	H	α-helix	trans	-58.8	-43.3	178.3	-78	173.6	170.6	171.5	0	112.2	A171 E228 L229 S234 E235 E236	A171-K232 HydrophobicContact CB-CB 3.81Å; E228-K232 HydrophobicContact CG-CD 4.37Å; E228-K232 WeakPolarHBondContact O-CB 3.37Å; E228-K232 WeakPolarHBondContact O-CG 3.32Å; E228-K232 PolarHBondContact O-N 3Å; E228-K232 WeakPolarHBondContact OE1-CE 3.45Å; E228-K232 IonicContact OE1-NZ 3.13Å; E228-K232 PolarHBondContact OE1-NZ 3.43Å; L229-K232 PolarHBondContact O-N 3.5Å; K232-S234 VanDerWaalsContact C-N 3.33Å; K232-S234 PolarHBondContact O-N 2.79Å; K232-E235 PolarHBondContact O-N 3.12Å; K232-E236 WeakPolarHBondContact O-CG 3.32Å; K232-E236 PolarHBondContact O-N 3.06Å
233	L	93.6	Very high	86.1	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-60.8	-44.6	175.9	-172.2	165	0	0	0	110.8	L178 I191 I195 F203 L229 E230 Q231 E235 E236 Y237	L178-L233 HydrophobicContact CD2-CD2 3.93Å; I191-L233 HydrophobicContact CG2-CD2 4.42Å; I195-L233 HydrophobicContact CD1-CD1 4.36Å; I195-L233 HydrophobicContact CD1-CD2 3.9Å; I195-L233 HydrophobicContact CG1-CD2 4.47Å; F203-L233 HydrophobicContact CB-CD1 3.69Å; F203-L233 HydrophobicContact CG-CD1 4.23Å; L229-L233 VanDerWaalsContact O-CB 3.31Å; L229-L233 WeakPolarHBondContact O-CB 3.5Å; L229-L233 PolarHBondContact O-N 3.42Å; E230-L233 PolarHBondContact O-N 3.22Å; Q231-L233 VanDerWaalsContact C-N 3.33Å; Q231-L233 PolarHBondContact O-N 2.81Å; L233-E235 VanDerWaalsContact C-N 3.33Å; L233-E235 PolarHBondContact O-N 2.81Å; L233-E236 PolarHBondContact O-N 3.29Å; L233-Y237 WeakPolarHBondContact O-CB 3.37Å; L233-Y237 PolarHBondContact O-N 3.33Å
234	S	93.1	Very high	85.7	Confident	18 Å²	18	66 Å²	66	13%	0.126	34%	0.342	C	S	.	.	H	α-helix	trans	-62.5	-39.6	177	-56.3	0	0	0	0	112.3	I191 E230 Q231 K232 G238	I191-S234 WeakPolarHBondContact CG2-OG 3.44Å; E230-S234 WeakPolarHBondContact O-CB 3.38Å; E230-S234 PolarHBondContact O-N 2.88Å; E230-S234 PolarHBondContact O-OG 2.85Å; Q231-S234 WeakPolarHBondContact O-CB 3.31Å; Q231-S234 PolarHBondContact O-N 2.78Å; Q231-S234 VanDerWaalsContact O-N 3.13Å; K232-S234 VanDerWaalsContact C-N 3.33Å; K232-S234 PolarHBondContact O-N 2.79Å; S234-G238 PolarHBondContact O-N 2.94Å
235	E	93.6	Very high	85	Confident	97 Å²	97	67.1 Å²	67.1	45%	0.453	37%	0.366	S	S	.	.	H	α-helix	trans	-63.7	-47.2	175.2	-72.5	171.9	-171	0	0	111.8	Q231 K232 L233 G238 K239	Q231-E235 WeakPolarHBondContact CG-OE1 3.43Å; Q231-E235 PolarHBondContact NE2-OE1 3.26Å; Q231-E235 WeakPolarHBondContact O-CG 3.43Å; Q231-E235 PolarHBondContact O-N 3.45Å; K232-E235 PolarHBondContact O-N 3.12Å; L233-E235 VanDerWaalsContact C-N 3.33Å; L233-E235 PolarHBondContact O-N 2.81Å; E235-G238 PolarHBondContact O-N 3.25Å; E235-K239 WeakPolarHBondContact O-CG 3.46Å; E235-K239 PolarHBondContact O-N 3.28Å; E235-K239 VanDerWaalsContact O-N 3.16Å
236	E	94.6	Very high	84.4	Confident	58 Å²	58	63.6 Å²	63.6	27%	0.271	37%	0.366	S	S	.	.	H	α-helix	trans	-63	-43	176.6	-69.6	-56	146.3	0	0	112	A171 A175 K232 L233 G238 K239 I240	A171-E236 HydrophobicContact CB-CG 3.93Å; A175-E236 HydrophobicContact CB-CB 3.64Å; K232-E236 WeakPolarHBondContact O-CG 3.32Å; K232-E236 PolarHBondContact O-N 3.06Å; L233-E236 PolarHBondContact O-N 3.29Å; E236-G238 VanDerWaalsContact C-N 3.28Å; E236-G238 PolarHBondContact O-N 3.41Å; E236-K239 VanDerWaalsContact CD-NZ 3.31Å; E236-K239 WeakPolarHBondContact O-CB 3.43Å; E236-K239 PolarHBondContact O-N 3.36Å; E236-K239 IonicContact OE1-NZ 3.52Å; E236-K239 PolarHBondContact OE1-NZ 2.88Å; E236-K239 WeakPolarHBondContact OE2-CD 3.42Å; E236-K239 IonicContact OE2-NZ 2.74Å; E236-K239 PolarHBondContact OE2-NZ 3.09Å; E236-I240 PolarHBondContact O-N 3.01Å
237	Y	93.7	Very high	83.6	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-60.9	-39.6	175.4	-178.4	-81.4	0	0	0	111.8	L178 A179 G183 P184 G185 L186 I191 L233 K239 I240 S241	L178-Y237 HydrophobicContact CB-CD2 4.18Å; L178-Y237 HydrophobicContact CB-CE2 4.42Å; L178-Y237 HydrophobicContact CD2-CD2 3.88Å; L178-Y237 HydrophobicContact CD2-CE2 4.17Å; L178-Y237 HydrophobicContact CD2-CG 4.44Å; L178-Y237 HydrophobicContact CG-CD2 4.03Å; L178-Y237 HydrophobicContact CG-CE2 4Å; A179-Y237 HydrophobicContact CB-CD2 4.15Å; A179-Y237 HydrophobicContact CB-CE2 3.8Å; G183-Y237 PolarHBondContact O-OH 3.01Å; P184-Y237 WeakPolarHBondContact CA-OH 3.42Å; G185-Y237 PolarHBondContact N-OH 3.4Å; G185-Y237 VanDerWaalsContact N-OH 3.07Å; L186-Y237 HydrophobicContact CB-CE1 3.84Å; L186-Y237 WeakPolarHBondContact CB-OH 3.26Å; L186-Y237 WeakPolarHBondContact CG-OH 3.26Å; L186-Y237 PolarHBondContact N-OH 3.28Å; I191-Y237 HydrophobicContact CD1-CD1 3.33Å; I191-Y237 HydrophobicContact CD1-CE1 3.82Å; I191-Y237 HydrophobicContact CD1-CG 4.01Å; I191-Y237 HydrophobicContact CG1-CD1 3.96Å; I191-Y237 HydrophobicContact CG1-CE1 4.12Å; I191-Y237 HydrophobicContact CG1-CG 4.44Å; L233-Y237 WeakPolarHBondContact O-CB 3.37Å; L233-Y237 PolarHBondContact O-N 3.33Å; Y237-K239 VanDerWaalsContact C-N 3.25Å; Y237-K239 PolarHBondContact O-N 3.48Å; Y237-I240 WeakPolarHBondContact O-CB 3.3Å; Y237-I240 PolarHBondContact O-N 3.01Å; Y237-S241 PolarHBondContact O-N 3.49Å; Y237-S241 PolarHBondContact O-OG 3.41Å
238	G	91.1	Very high	83.2	Confident	20 Å²	20	61.9 Å²	61.9	21%	0.206	36%	0.359	C	S	.	.	H	α-helix	trans	-62.1	-29.6	174.1	0	0	0	0	0	113.5	S234 E235 E236 K242	S234-G238 PolarHBondContact O-N 2.94Å; E235-G238 PolarHBondContact O-N 3.25Å; E236-G238 VanDerWaalsContact C-N 3.28Å; E236-G238 PolarHBondContact O-N 3.41Å; G238-K242 WeakPolarHBondContact O-CD 3.41Å; G238-K242 VanDerWaalsContact O-CG 3.27Å; G238-K242 WeakPolarHBondContact O-CG 3.41Å; G238-K242 PolarHBondContact O-N 2.95Å
239	K	91.6	Very high	83.1	Confident	113 Å²	113	63.1 Å²	63.1	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-71.8	-41.3	174.4	-64.2	172	-165.2	171.1	0	111.6	E235 E236 Y237 S241 K242 S243	E235-K239 WeakPolarHBondContact O-CG 3.46Å; E235-K239 PolarHBondContact O-N 3.28Å; E235-K239 VanDerWaalsContact O-N 3.16Å; E236-K239 VanDerWaalsContact CD-NZ 3.31Å; E236-K239 WeakPolarHBondContact O-CB 3.43Å; E236-K239 PolarHBondContact O-N 3.36Å; E236-K239 IonicContact OE1-NZ 3.52Å; E236-K239 PolarHBondContact OE1-NZ 2.88Å; E236-K239 WeakPolarHBondContact OE2-CD 3.42Å; E236-K239 IonicContact OE2-NZ 2.74Å; E236-K239 PolarHBondContact OE2-NZ 3.09Å; Y237-K239 VanDerWaalsContact C-N 3.25Å; Y237-K239 PolarHBondContact O-N 3.48Å; K239-S241 PolarHBondContact O-N 2.93Å; K239-K242 PolarHBondContact O-N 2.84Å; K239-K242 VanDerWaalsContact O-N 3.11Å; K239-S243 WeakPolarHBondContact O-CB 3.34Å; K239-S243 PolarHBondContact O-N 2.97Å; K239-S243 PolarHBondContact O-OG 2.91Å
240	I	90.3	Very high	83.2	Confident	14 Å²	14	65.6 Å²	65.6	7%	0.072	38%	0.382	C	S	.	.	H	α-helix	trans	-58.3	-40.3	176.9	-63.1	168.5	0	0	0	110.8	A175 L176 A179 E236 Y237 K242 S243 P248 L253	A175-I240 HydrophobicContact CB-CD1 3.92Å; L176-I240 HydrophobicContact CD2-CD1 3.83Å; L176-I240 HydrophobicContact CD2-CG1 4.48Å; L176-I240 HydrophobicContact CG-CD1 4Å; A179-I240 HydrophobicContact CB-CD1 4.47Å; A179-I240 HydrophobicContact CB-CG2 4.35Å; E236-I240 PolarHBondContact O-N 3.01Å; Y237-I240 WeakPolarHBondContact O-CB 3.3Å; Y237-I240 PolarHBondContact O-N 3.01Å; I240-K242 VanDerWaalsContact C-N 3.31Å; I240-K242 PolarHBondContact O-N 3.48Å; I240-S243 PolarHBondContact O-OG 2.85Å; I240-P248 HydrophobicContact CG2-CG 3.96Å; I240-L253 HydrophobicContact CG2-CD2 3.65Å
241	S	78.6	Confident	83.3	Confident	42 Å²	42	65.4 Å²	65.4	29%	0.294	38%	0.381	S	S	.	.	H	α-helix	trans	-73.2	-19.5	-179.7	-57.8	0	0	0	0	113.9	G185 Y237 K239	G185-S241 PolarHBondContact N-OG 3.19Å; Y237-S241 PolarHBondContact O-N 3.49Å; Y237-S241 PolarHBondContact O-OG 3.41Å; K239-S241 PolarHBondContact O-N 2.93Å
242	K	78.9	Confident	83.4	Confident	178 Å²	178	63.8 Å²	63.8	77%	0.774	37%	0.374	S	S	*	.	H	α-helix	trans	-102	-19.5	-176.1	-69.7	172.3	-172.9	175.5	0	113.8	G238 K239 I240 T244	G238-K242 WeakPolarHBondContact O-CD 3.41Å; G238-K242 VanDerWaalsContact O-CG 3.27Å; G238-K242 WeakPolarHBondContact O-CG 3.41Å; G238-K242 PolarHBondContact O-N 2.95Å; K239-K242 PolarHBondContact O-N 2.84Å; K239-K242 VanDerWaalsContact O-N 3.11Å; I240-K242 VanDerWaalsContact C-N 3.31Å; I240-K242 PolarHBondContact O-N 3.48Å; K242-T244 PolarHBondContact O-N 3.46Å
243	S	67.4	Low	83.5	Confident	85 Å²	85	59.7 Å²	59.7	59%	0.594	36%	0.356	S	S	*	.	S	Bend	trans	-74.7	-8.9	-170	57.7	0	0	0	0	114.5	K239 I240	K239-S243 WeakPolarHBondContact O-CB 3.34Å; K239-S243 PolarHBondContact O-N 2.97Å; K239-S243 PolarHBondContact O-OG 2.91Å; I240-S243 PolarHBondContact O-OG 2.85Å
244	T	55.9	Low	83.7	Confident	63 Å²	63	59.8 Å²	59.8	39%	0.387	36%	0.356	S	S	.	.	S	Bend	trans	-137.6	138.1	-177.9	-32.1	0	0	0	0	108.7	K242 G246	K242-T244 PolarHBondContact O-N 3.46Å; T244-G246 WeakPolarHBondContact CB-O 3.34Å; T244-G246 PolarHBondContact O-N 3.39Å
245	G	58.2	Low	83.9	Confident	103 Å²	103	62 Å²	62	100%	1.062	36%	0.364	S	S	*	.	S	Bend	trans	-66.7	22.5	176.9	0	0	0	0	0	114.8
246	G	67.4	Low	84	Confident	43 Å²	43	61.2 Å²	61.2	44%	0.443	36%	0.361	S	S	.	.	S	Bend	trans	-168.3	170.3	-178.6	0	0	0	0	0	110.3	T244	T244-G246 WeakPolarHBondContact CB-O 3.34Å; T244-G246 PolarHBondContact O-N 3.39Å
247	S	67.1	Low	84.2	Confident	89 Å²	89	58.5 Å²	58.5	62%	0.622	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-62.5	123.2	174.3	168.6	0	0	0	0	110.1	P184 E249	P184-S247 WeakPolarHBondContact CG-OG 3.27Å; S247-E249 PolarHBondContact O-N 3.35Å
248	P	77.9	Confident	84.4	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.039	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-57.2	137.7	173.5	21.6	-33.3	0	0	0	111.1	P184 I240 L253	P184-P248 HydrophobicContact CB-CG 3.9Å; P184-P248 HydrophobicContact CG-CG 3.87Å; I240-P248 HydrophobicContact CG2-CG 3.96Å; P248-L253 HydrophobicContact CB-CD2 3.94Å; P248-L253 HydrophobicContact CB-CG 4.15Å; P248-L253 HydrophobicContact CG-CD1 4.42Å; P248-L253 HydrophobicContact CG-CD2 3.92Å; P248-L253 HydrophobicContact CG-CG 4.35Å
249	E	87	Confident	84.6	Confident	116 Å²	116	61 Å²	61	54%	0.542	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-70.1	146.2	176.7	-68.7	-177.7	157.4	0	0	110.5	S247 Q251 Q252 L253	S247-E249 PolarHBondContact O-N 3.35Å; E249-Q251 PolarHBondContact O-N 2.74Å; E249-Q251 VanDerWaalsContact O-N 3.16Å; E249-Q252 HydrophobicContact CB-CG 4.27Å; E249-Q252 WeakPolarHBondContact O-CB 3.33Å; E249-Q252 PolarHBondContact O-N 2.87Å; E249-L253 PolarHBondContact O-N 2.85Å
250	P	91.4	Very high	84.8	Confident	68 Å²	68	57.8 Å²	57.8	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-51.3	-41.3	178.8	-28.4	35.3	0	0	0	113.1	Q252 L253 L254	P250-Q252 VanDerWaalsContact C-N 3.31Å; P250-Q252 PolarHBondContact O-N 2.79Å; P250-L253 PolarHBondContact O-N 2.76Å; P250-L254 WeakPolarHBondContact O-CG 3.45Å; P250-L254 PolarHBondContact O-N 2.95Å
251	Q	93.6	Very high	85.1	Confident	57 Å²	57	57.2 Å²	57.2	27%	0.266	35%	0.347	S	S	.	.	H	α-helix	trans	-57.9	-40.5	176.7	-167.6	-172	-30.9	0	0	112.8	K142 L147 E249 L254 H255	K142-Q251 VanDerWaalsContact O-CD 3.24Å; K142-Q251 PolarHBondContact O-NE2 3.37Å; L147-Q251 HydrophobicContact CD1-CG 3.72Å; E249-Q251 PolarHBondContact O-N 2.74Å; E249-Q251 VanDerWaalsContact O-N 3.16Å; Q251-L254 PolarHBondContact O-N 2.99Å; Q251-H255 PolarHBondContact O-CD2 3.21Å; Q251-H255 PolarHBondContact O-N 2.85Å
252	Q	93.6	Very high	85.9	Confident	81 Å²	81	55.9 Å²	55.9	38%	0.379	34%	0.336	S	S	.	.	H	α-helix	trans	-67.9	-39.4	178.7	-63.2	176.9	8.8	0	0	111.4	E249 P250 H255 Q256	E249-Q252 HydrophobicContact CB-CG 4.27Å; E249-Q252 WeakPolarHBondContact O-CB 3.33Å; E249-Q252 PolarHBondContact O-N 2.87Å; P250-Q252 VanDerWaalsContact C-N 3.31Å; P250-Q252 PolarHBondContact O-N 2.79Å; Q252-H255 PolarHBondContact O-N 2.84Å; Q252-Q256 VanDerWaalsContact O-CG 3.31Å; Q252-Q256 WeakPolarHBondContact O-CG 3.36Å; Q252-Q256 PolarHBondContact O-N 3.45Å
253	L	95.6	Very high	86.6	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-65.9	-41.4	176.1	-62.8	176	0	0	0	111.6	L176 A179 L180 I240 P248 E249 P250 H255 Q256 Y257	L176-L253 HydrophobicContact CD2-CD2 3.95Å; A179-L253 HydrophobicContact CB-CD1 3.95Å; L180-L253 HydrophobicContact CD1-CB 4.42Å; L180-L253 HydrophobicContact CD2-CB 3.59Å; L180-L253 HydrophobicContact CD2-CD1 4.26Å; L180-L253 HydrophobicContact CG-CB 3.82Å; L180-L253 HydrophobicContact CG-CD1 4.36Å; I240-L253 HydrophobicContact CG2-CD2 3.65Å; P248-L253 HydrophobicContact CB-CD2 3.94Å; P248-L253 HydrophobicContact CB-CG 4.15Å; P248-L253 HydrophobicContact CG-CD1 4.42Å; P248-L253 HydrophobicContact CG-CD2 3.92Å; P248-L253 HydrophobicContact CG-CG 4.35Å; E249-L253 PolarHBondContact O-N 2.85Å; P250-L253 PolarHBondContact O-N 2.76Å; L253-H255 PolarHBondContact O-N 2.85Å; L253-Q256 PolarHBondContact O-N 2.81Å; L253-Y257 PolarHBondContact O-N 2.97Å
254	L	97.5	Very high	87.8	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-58.9	-46.6	173.5	-70.3	170.4	0	0	0	111.1	E144 L147 R148 Y151 L180 P250 Q251 Q256 Y257 L258	E144-L254 HydrophobicContact CG-CD1 3.97Å; L147-L254 HydrophobicContact CB-CB 4.18Å; L147-L254 HydrophobicContact CB-CD1 3.96Å; R148-L254 HydrophobicContact CB-CD1 4.35Å; Y151-L254 HydrophobicContact CD1-CD2 3.76Å; Y151-L254 HydrophobicContact CD2-CD2 4.11Å; Y151-L254 HydrophobicContact CG-CD2 3.5Å; L180-L254 HydrophobicContact CD1-CD2 3.94Å; L180-L254 HydrophobicContact CD2-CD2 3.92Å; L180-L254 HydrophobicContact CD2-CG 3.83Å; P250-L254 WeakPolarHBondContact O-CG 3.45Å; P250-L254 PolarHBondContact O-N 2.95Å; Q251-L254 PolarHBondContact O-N 2.99Å; L254-Q256 PolarHBondContact O-N 2.87Å; L254-Y257 PolarHBondContact O-N 3.42Å; L254-L258 WeakPolarHBondContact O-CB 3.28Å; L254-L258 WeakPolarHBondContact O-CG 3.39Å; L254-L258 PolarHBondContact O-N 3.5Å
255	H	96.8	Very high	89.5	Confident	64 Å²	64	47.1 Å²	47.1	30%	0.296	29%	0.294	S	S	.	.	H	α-helix	trans	-60.9	-43	175.8	-83.3	-62.2	0	0	0	113	I141 L147 Q251 Q252 L253 L258 S259	I141-H255 PolarHBondContact O-CE1 2.9Å; L147-H255 WeakPolarHBondContact CD1-NE2 3.43Å; Q251-H255 PolarHBondContact O-CD2 3.21Å; Q251-H255 PolarHBondContact O-N 2.85Å; Q252-H255 PolarHBondContact O-N 2.84Å; L253-H255 PolarHBondContact O-N 2.85Å; H255-L258 PolarHBondContact O-N 2.91Å; H255-S259 WeakPolarHBondContact O-CB 3.14Å; H255-S259 PolarHBondContact O-N 2.99Å
256	Q	95.9	Very high	91.2	Very high	81 Å²	81	43 Å²	43	38%	0.379	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-44.9	177.5	-73.7	173.5	33.5	0	0	111.2	L176 Q252 L253 L254 S259 M260	L176-Q256 HydrophobicContact CD1-CB 4.14Å; L176-Q256 HydrophobicContact CD2-CB 3.88Å; Q252-Q256 VanDerWaalsContact O-CG 3.31Å; Q252-Q256 WeakPolarHBondContact O-CG 3.36Å; Q252-Q256 PolarHBondContact O-N 3.45Å; L253-Q256 PolarHBondContact O-N 2.81Å; L254-Q256 PolarHBondContact O-N 2.87Å; Q256-S259 PolarHBondContact O-N 2.64Å; Q256-M260 WeakPolarHBondContact O-CG 3.5Å; Q256-M260 PolarHBondContact O-N 3.35Å; Q256-M260 VanDerWaalsContact O-N 3.13Å
257	Y	97.8	Very high	92.6	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-61.5	-51.9	177.5	-167.8	-76.7	0	0	0	111.4	Y151 A154 R155 L173 L176 S177 L253 L254 S259 M260 C261	Y151-Y257 AromaticContact CD2-CD1 3.53Å; Y151-Y257 HydrophobicContact CD2-CD1 3.53Å; Y151-Y257 HydrophobicContact CD2-CD2 4.06Å; Y151-Y257 AromaticContact CD2-CE1 4Å; Y151-Y257 HydrophobicContact CD2-CE1 4Å; Y151-Y257 HydrophobicContact CD2-CE2 4.46Å; Y151-Y257 AromaticContact CD2-CG 3.58Å; Y151-Y257 HydrophobicContact CD2-CG 3.58Å; Y151-Y257 AromaticContact CE2-CD1 3.91Å; Y151-Y257 HydrophobicContact CE2-CD1 3.91Å; Y151-Y257 AromaticContact CE2-CD2 3.62Å; Y151-Y257 HydrophobicContact CE2-CD2 3.62Å; Y151-Y257 HydrophobicContact CE2-CE1 4.13Å; Y151-Y257 AromaticContact CE2-CE2 3.85Å; Y151-Y257 HydrophobicContact CE2-CE2 3.85Å; Y151-Y257 AromaticContact CE2-CG 3.66Å; Y151-Y257 HydrophobicContact CE2-CG 3.66Å; A154-Y257 HydrophobicContact CB-CE1 4.11Å; R155-Y257 VanDerWaalsContact CA-OH 3.3Å; R155-Y257 WeakPolarHBondContact CA-OH 3.26Å; R155-Y257 HydrophobicContact CB-CE1 4.31Å; L173-Y257 HydrophobicContact CB-CD2 4.46Å; L173-Y257 HydrophobicContact CB-CE2 3.8Å; L173-Y257 HydrophobicContact CD2-CD1 4.19Å; L173-Y257 HydrophobicContact CD2-CD2 3.77Å; L173-Y257 HydrophobicContact CD2-CE1 4.07Å; L173-Y257 HydrophobicContact CD2-CE2 3.63Å; L173-Y257 HydrophobicContact CD2-CG 4.04Å; L173-Y257 HydrophobicContact CG-CE2 4.31Å; L173-Y257 VanDerWaalsContact O-CE2 3.31Å; L173-Y257 WeakPolarHBondContact O-CE2 3.1Å; L176-Y257 HydrophobicContact CB-CD2 3.85Å; L176-Y257 HydrophobicContact CD1-CD2 4.33Å; S177-Y257 WeakPolarHBondContact OG-CE2 3.33Å; L253-Y257 PolarHBondContact O-N 2.97Å; L254-Y257 PolarHBondContact O-N 3.42Å; Y257-S259 VanDerWaalsContact C-N 3.32Å; Y257-S259 PolarHBondContact O-N 3.47Å; Y257-M260 WeakPolarHBondContact O-CB 3.33Å; Y257-M260 PolarHBondContact O-N 3.44Å; Y257-C261 WeakPolarHBondContact CE1-SG 3.35Å; Y257-C261 PolarHBondContact O-N 2.97Å; Y257-C261 VanDerWaalsContact O-N 3.1Å
258	L	97.9	Very high	94	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-39.2	179.8	-72.8	171	0	0	0	111.6	L147 L150 A154 L254 H255 M260 C261 H262	L147-L258 HydrophobicContact CB-CD1 4.4Å; L147-L258 HydrophobicContact CD2-CD1 3.69Å; L150-L258 HydrophobicContact CB-CD1 4.1Å; L150-L258 HydrophobicContact CB-CD2 3.99Å; A154-L258 HydrophobicContact CB-CD2 4.1Å; L254-L258 WeakPolarHBondContact O-CB 3.28Å; L254-L258 WeakPolarHBondContact O-CG 3.39Å; L254-L258 PolarHBondContact O-N 3.5Å; H255-L258 PolarHBondContact O-N 2.91Å; L258-M260 VanDerWaalsContact C-N 3.29Å; L258-M260 PolarHBondContact O-N 3Å; L258-C261 CarbonylContact O-C 3.57Å; L258-C261 WeakPolarHBondContact O-CB 3.49Å; L258-C261 PolarHBondContact O-N 3.37Å; L258-C261 VanDerWaalsContact O-N 3.1Å; L258-H262 WeakPolarHBondContact O-CB 3.04Å; L258-H262 PolarHBondContact O-CD2 2.93Å; L258-H262 PolarHBondContact O-N 3.05Å; L258-H262 PolarHBondContact O-ND1 2.87Å
259	S	96.3	Very high	94.9	Very high	68 Å²	68	37.5 Å²	37.5	48%	0.476	20%	0.2	S	C	.	.	H	α-helix	trans	-60.9	-38.1	176.8	-176.2	0	0	0	0	112	H255 Q256 Y257 H262 T263	H255-S259 WeakPolarHBondContact O-CB 3.14Å; H255-S259 PolarHBondContact O-N 2.99Å; Q256-S259 PolarHBondContact O-N 2.64Å; Y257-S259 VanDerWaalsContact C-N 3.32Å; Y257-S259 PolarHBondContact O-N 3.47Å; S259-H262 PolarHBondContact O-N 3.04Å; S259-T263 WeakPolarHBondContact O-CG2 3.38Å; S259-T263 PolarHBondContact O-N 3.44Å
260	M	95.9	Very high	95.4	Very high	47 Å²	47	32 Å²	32	23%	0.232	18%	0.175	C	C	.	.	H	α-helix	trans	-64.4	-47.8	172.6	-69.4	178.7	72.2	0	0	110.6	H169 L173 L176 Q256 Y257 L258 H262 T263	H169-M260 HydrophobicContact CB-CE 3.89Å; L173-M260 HydrophobicContact CD2-CB 3.78Å; L173-M260 HydrophobicContact CD2-CE 4.01Å; L173-M260 HydrophobicContact CD2-CG 4.4Å; L173-M260 HydrophobicContact CD2-SD 3.78Å; L173-M260 HydrophobicContact CG-CE 3.8Å; L173-M260 HydrophobicContact CG-SD 4.18Å; L176-M260 HydrophobicContact CD1-SD 3.77Å; Q256-M260 WeakPolarHBondContact O-CG 3.5Å; Q256-M260 PolarHBondContact O-N 3.35Å; Q256-M260 VanDerWaalsContact O-N 3.13Å; Y257-M260 WeakPolarHBondContact O-CB 3.33Å; Y257-M260 PolarHBondContact O-N 3.44Å; L258-M260 VanDerWaalsContact C-N 3.29Å; L258-M260 PolarHBondContact O-N 3Å; M260-H262 VanDerWaalsContact C-N 3.28Å; M260-H262 PolarHBondContact O-N 2.62Å; M260-T263 WeakPolarHBondContact O-CB 3.42Å; M260-T263 PolarHBondContact O-N 3.12Å; M260-T263 PolarHBondContact O-OG1 2.96Å
261	C	96.8	Very high	95.7	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.007	16%	0.157	C	C	.	.	H	α-helix	trans	-61.5	-35.2	176.8	-65.9	0	0	0	0	112.9	A154 Y257 L258 T263 L264 Y267	A154-C261 HydrophobicContact CB-CB 4.4Å; Y257-C261 WeakPolarHBondContact CE1-SG 3.35Å; Y257-C261 PolarHBondContact O-N 2.97Å; Y257-C261 VanDerWaalsContact O-N 3.1Å; L258-C261 CarbonylContact O-C 3.57Å; L258-C261 WeakPolarHBondContact O-CB 3.49Å; L258-C261 PolarHBondContact O-N 3.37Å; L258-C261 VanDerWaalsContact O-N 3.1Å; C261-T263 PolarHBondContact O-N 3.35Å; C261-L264 VanDerWaalsContact O-CB 3.25Å; C261-L264 WeakPolarHBondContact O-CB 3.37Å; C261-L264 VanDerWaalsContact O-CG 3.31Å; C261-L264 WeakPolarHBondContact O-CG 3.35Å; C261-L264 PolarHBondContact O-N 2.96Å; C261-Y267 HydrophobicContact CB-CD2 3.73Å; C261-Y267 HydrophobicContact CB-CE2 3.84Å; C261-Y267 WeakPolarHBondContact O-CB 3.35Å
262	H	95.5	Very high	95.9	Very high	15 Å²	15	27.5 Å²	27.5	7%	0.069	15%	0.147	C	C	.	.	H	α-helix	trans	-65.2	-17.4	175.8	-69.7	167.3	0	0	0	112.3	K135 E138 L139 L258 S259 M260 L264 Y267	K135-H262 WeakPolarHBondContact CE-O 3.41Å; K135-H262 PolarHBondContact NZ-O 2.78Å; E138-H262 IonicContact OE1-CD2 2.68Å; E138-H262 IonicContact OE1-CE1 2.75Å; E138-H262 IonicContact OE1-NE2 3.24Å; E138-H262 PolarHBondContact OE1-NE2 3.36Å; L139-H262 VanDerWaalsContact CD2-ND1 3.26Å; L139-H262 WeakPolarHBondContact CD2-ND1 3.45Å; L258-H262 WeakPolarHBondContact O-CB 3.04Å; L258-H262 PolarHBondContact O-CD2 2.93Å; L258-H262 PolarHBondContact O-N 3.05Å; L258-H262 PolarHBondContact O-ND1 2.87Å; S259-H262 PolarHBondContact O-N 3.04Å; M260-H262 VanDerWaalsContact C-N 3.28Å; M260-H262 PolarHBondContact O-N 2.62Å; H262-L264 PolarHBondContact O-N 2.99Å; H262-Y267 AromaticContact CD2-CD1 3.59Å; H262-Y267 AromaticContact CD2-CE1 3.36Å; H262-Y267 WeakPolarHBondContact CD2-CE1 3.39Å; H262-Y267 AromaticContact CD2-CZ 3.7Å; H262-Y267 AromaticContact NE2-CE1 3.5Å; H262-Y267 AromaticContact NE2-CZ 3.72Å
263	T	92.9	Very high	96.1	Very high	90 Å²	90	27.5 Å²	27.5	55%	0.552	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-18.4	171.6	68.3	0	0	0	0	112.9	S259 M260 C261 P265	S259-T263 WeakPolarHBondContact O-CG2 3.38Å; S259-T263 PolarHBondContact O-N 3.44Å; M260-T263 WeakPolarHBondContact O-CB 3.42Å; M260-T263 PolarHBondContact O-N 3.12Å; M260-T263 PolarHBondContact O-OG1 2.96Å; C261-T263 PolarHBondContact O-N 3.35Å; T263-P265 WeakPolarHBondContact O-CD 3.38Å
264	L	93.2	Very high	96.1	Very high	11 Å²	11	27.8 Å²	27.8	6%	0.058	16%	0.159	C	C	.	.	S	Bend	trans	-78.6	123.6	-178.7	-50.5	176.8	0	0	0	110	I158 Y163 C165 C261 H262 Y266 Y267	I158-L264 HydrophobicContact CD1-CD1 3.98Å; Y163-L264 HydrophobicContact CG-CD1 4.45Å; C165-L264 HydrophobicContact CB-CD2 4.49Å; C261-L264 VanDerWaalsContact O-CB 3.25Å; C261-L264 WeakPolarHBondContact O-CB 3.37Å; C261-L264 VanDerWaalsContact O-CG 3.31Å; C261-L264 WeakPolarHBondContact O-CG 3.35Å; C261-L264 PolarHBondContact O-N 2.96Å; H262-L264 PolarHBondContact O-N 2.99Å; L264-Y266 HydrophobicContact CB-CD2 4.26Å; L264-Y266 HydrophobicContact CB-CE1 4.39Å; L264-Y266 HydrophobicContact CB-CE2 3.87Å; L264-Y266 HydrophobicContact CD1-CE2 4.02Å; L264-Y266 HydrophobicContact CD2-CE2 4.49Å; L264-Y266 HydrophobicContact CG-CE2 4.34Å; L264-Y266 PolarHBondContact O-N 3.37Å; L264-Y267 WeakPolarHBondContact O-CB 3.48Å; L264-Y267 PolarHBondContact O-N 3.47Å; L264-Y267 VanDerWaalsContact O-N 3.13Å
265	P	91.8	Very high	96	Very high	41 Å²	41	31.4 Å²	31.4	27%	0.266	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-28.4	-180	-27.4	36.4	0	0	0	114.4	T263 Y302 V416	T263-P265 WeakPolarHBondContact O-CD 3.38Å; P265-Y302 HydrophobicContact CB-CD1 4.12Å; P265-Y302 HydrophobicContact CB-CE1 3.29Å; P265-Y302 WeakPolarHBondContact CB-OH 3.35Å; P265-Y302 HydrophobicContact CG-CE1 4.49Å; P265-Y302 WeakPolarHBondContact O-CE2 3.47Å; P265-Y302 PolarHBondContact O-OH 2.94Å; P265-Y302 VanDerWaalsContact O-OH 3.05Å; P265-V416 HydrophobicContact CB-CG1 4.02Å; P265-V416 HydrophobicContact CG-CG1 3.65Å
266	Y	93.5	Very high	95.9	Very high	16 Å²	16	28.4 Å²	28.4	6%	0.063	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	9.8	-179.2	42.1	-87.5	0	0	0	113.4	Y163 P164 L264 G268 C269 Y302 M304 V311	Y163-Y266 AromaticContact CD1-CD2 3.94Å; Y163-Y266 HydrophobicContact CD1-CD2 3.94Å; Y163-Y266 HydrophobicContact CD1-CE2 4.44Å; Y163-Y266 WeakPolarHBondContact CE1-O 3.32Å; Y163-Y266 HydrophobicContact CG-CD2 4.46Å; P164-Y266 HydrophobicContact CB-CE2 4.42Å; P164-Y266 WeakPolarHBondContact O-CE2 3.42Å; P164-Y266 PolarHBondContact O-OH 3.21Å; L264-Y266 HydrophobicContact CB-CD2 4.26Å; L264-Y266 HydrophobicContact CB-CE1 4.39Å; L264-Y266 HydrophobicContact CB-CE2 3.87Å; L264-Y266 HydrophobicContact CD1-CE2 4.02Å; L264-Y266 HydrophobicContact CD2-CE2 4.49Å; L264-Y266 HydrophobicContact CG-CE2 4.34Å; L264-Y266 PolarHBondContact O-N 3.37Å; Y266-G268 PolarHBondContact O-N 3.14Å; Y266-C269 VanDerWaalsContact CA-SG 3.53Å; Y266-C269 PolarHBondContact O-N 3.06Å; Y266-C269 PolarHBondContact O-SG 2.89Å; Y266-C269 VanDerWaalsContact O-SG 3.34Å; Y266-Y302 HydrophobicContact CD1-CD1 4.43Å; Y266-M304 HydrophobicContact CD2-SD 4.27Å; Y266-M304 HydrophobicContact CG-SD 4.15Å; Y266-V311 HydrophobicContact CD1-CG2 3.92Å; Y266-V311 HydrophobicContact CE1-CG2 3.31Å
267	Y	96.3	Very high	95.7	Very high	11 Å²	11	26.4 Å²	26.4	4%	0.043	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	128.2	172.3	176.3	-94.2	0	0	0	110.5	E138 A154 Y163 C261 H262 L264 C269	E138-Y267 VanDerWaalsContact OE1-CE1 3.28Å; E138-Y267 WeakPolarHBondContact OE1-CE1 3.27Å; E138-Y267 PolarHBondContact OE1-OH 3.38Å; A154-Y267 HydrophobicContact CB-CE2 3.98Å; Y163-Y267 HydrophobicContact CD2-CD2 4.47Å; Y163-Y267 AromaticContact CE2-CD2 3.73Å; Y163-Y267 HydrophobicContact CE2-CD2 3.73Å; Y163-Y267 HydrophobicContact CE2-CE2 4.16Å; C261-Y267 HydrophobicContact CB-CD2 3.73Å; C261-Y267 HydrophobicContact CB-CE2 3.84Å; C261-Y267 WeakPolarHBondContact O-CB 3.35Å; H262-Y267 AromaticContact CD2-CD1 3.59Å; H262-Y267 AromaticContact CD2-CE1 3.36Å; H262-Y267 WeakPolarHBondContact CD2-CE1 3.39Å; H262-Y267 AromaticContact CD2-CZ 3.7Å; H262-Y267 AromaticContact NE2-CE1 3.5Å; H262-Y267 AromaticContact NE2-CZ 3.72Å; L264-Y267 WeakPolarHBondContact O-CB 3.48Å; L264-Y267 PolarHBondContact O-N 3.47Å; L264-Y267 VanDerWaalsContact O-N 3.13Å; Y267-C269 VanDerWaalsContact C-N 3.35Å
268	G	96.1	Very high	95.2	Very high	4 Å²	4	30.5 Å²	30.5	4%	0.041	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.8	15.7	176.8	0	0	0	0	0	114.7	R129 V131 Y163 Y266	R129-G268 PolarHBondContact NH1-O 2.86Å; V131-G268 WeakPolarHBondContact CG2-O 3.42Å; Y163-G268 PolarHBondContact OH-N 2.92Å; Y266-G268 PolarHBondContact O-N 3.14Å
269	C	97.6	Very high	94.3	Very high	8 Å²	8	32.7 Å²	32.7	5%	0.054	19%	0.186	C	C	.	.			trans	-67	147.8	173.9	-74.4	0	0	0	0	113.3	Y266 Y267 F271 I296 C297	Y266-C269 VanDerWaalsContact CA-SG 3.53Å; Y266-C269 PolarHBondContact O-N 3.06Å; Y266-C269 PolarHBondContact O-SG 2.89Å; Y266-C269 VanDerWaalsContact O-SG 3.34Å; Y267-C269 VanDerWaalsContact C-N 3.35Å; C269-F271 HydrophobicContact CB-CD2 4.25Å; C269-F271 HydrophobicContact CB-CE2 3.79Å; C269-F271 HydrophobicContact CB-CZ 3.94Å; C269-F271 WeakPolarHBondContact O-CD2 3.49Å; C269-F271 VanDerWaalsContact O-CE2 3.24Å; C269-F271 WeakPolarHBondContact O-CE2 3.19Å; C269-I296 CarbonylContact C-O 3.56Å; C269-I296 WeakPolarHBondContact CA-O 3.46Å; C269-C297 HydrophobicContact CB-CB 4.46Å
270	A	97.8	Very high	92.9	Very high	1 Å²	1	35 Å²	35	1%	0.008	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	135.8	152	0	0	0	0	0	108.7	W80 V131 F272 G295 I296 F366	W80-A270 HydrophobicContact CH2-CB 3.7Å; W80-A270 HydrophobicContact CZ3-CB 4.38Å; V131-A270 HydrophobicContact CG2-CB 4.06Å; A270-F272 HydrophobicContact CB-CE2 3.86Å; A270-F272 HydrophobicContact CB-CZ 4.24Å; A270-G295 CarbonylContact O-C 3.59Å; A270-G295 VanDerWaalsContact O-CA 3.3Å; A270-G295 WeakPolarHBondContact O-CA 3.19Å; A270-I296 PolarHBondContact N-O 2.75Å; A270-I296 PolarHBondContact O-N 2.8Å; A270-F366 HydrophobicContact CB-CD2 4.36Å; A270-F366 HydrophobicContact CB-CE2 3.5Å; A270-F366 VanDerWaalsContact CB-CE2 3.5Å; A270-F366 HydrophobicContact CB-CZ 3.84Å
271	F	97.6	Very high	91.1	Very high	17 Å²	17	40.1 Å²	40.1	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	133.4	-178	-70	-94	0	0	0	111.4	R162 Y163 C269 S293 V294 M304	R162-F271 HydrophobicContact CG-CD1 4.09Å; R162-F271 HydrophobicContact CG-CD2 4.04Å; R162-F271 HydrophobicContact CG-CE1 3.83Å; R162-F271 HydrophobicContact CG-CE2 3.81Å; R162-F271 HydrophobicContact CG-CG 4.16Å; R162-F271 HydrophobicContact CG-CZ 3.71Å; Y163-F271 HydrophobicContact CD1-CE2 4.4Å; Y163-F271 AromaticContact CD1-CZ 3.86Å; Y163-F271 HydrophobicContact CD1-CZ 3.86Å; Y163-F271 AromaticContact CE1-CE2 3.74Å; Y163-F271 HydrophobicContact CE1-CE2 3.74Å; Y163-F271 AromaticContact CE1-CZ 3.59Å; Y163-F271 HydrophobicContact CE1-CZ 3.59Å; C269-F271 HydrophobicContact CB-CD2 4.25Å; C269-F271 HydrophobicContact CB-CE2 3.79Å; C269-F271 HydrophobicContact CB-CZ 3.94Å; C269-F271 WeakPolarHBondContact O-CD2 3.49Å; C269-F271 VanDerWaalsContact O-CE2 3.24Å; C269-F271 WeakPolarHBondContact O-CE2 3.19Å; F271-S293 WeakPolarHBondContact CD1-OG 3.37Å; F271-V294 CarbonylContact C-O 3.53Å; F271-V294 WeakPolarHBondContact CA-O 3.27Å; F271-M304 HydrophobicContact CD1-CE 3.89Å; F271-M304 HydrophobicContact CE1-CE 3.41Å; F271-M304 VanDerWaalsContact CE1-CE 3.41Å; F271-M304 HydrophobicContact CE1-SD 3.99Å; F271-M304 HydrophobicContact CZ-CE 4.49Å
272	F	98.1	Very high	89.1	Confident	12 Å²	12	42.8 Å²	42.8	5%	0.053	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.6	178.2	-59.2	-89.4	0	0	0	110.1	A270 S293 V294 I296 Q359 L362 M363 F366	A270-F272 HydrophobicContact CB-CE2 3.86Å; A270-F272 HydrophobicContact CB-CZ 4.24Å; F272-S293 WeakPolarHBondContact O-CA 3.37Å; F272-V294 HydrophobicContact CB-CB 4.34Å; F272-V294 PolarHBondContact N-O 3.28Å; F272-V294 PolarHBondContact O-N 2.99Å; F272-I296 HydrophobicContact CD2-CD1 3.88Å; F272-I296 HydrophobicContact CD2-CG1 4.18Å; F272-I296 HydrophobicContact CE2-CB 4.34Å; F272-I296 HydrophobicContact CE2-CD1 3.77Å; F272-I296 HydrophobicContact CE2-CG1 4.14Å; F272-Q359 VanDerWaalsContact CA-OE1 3.28Å; F272-Q359 VanDerWaalsContact CB-OE1 3.27Å; F272-Q359 HydrophobicContact CD1-CB 4.07Å; F272-L362 HydrophobicContact CE1-CB 4.04Å; F272-M363 HydrophobicContact CB-CG 3.83Å; F272-M363 HydrophobicContact CB-SD 3.62Å; F272-M363 HydrophobicContact CD1-CG 3.81Å; F272-M363 HydrophobicContact CD2-CG 3.74Å; F272-M363 HydrophobicContact CD2-SD 4.34Å; F272-M363 HydrophobicContact CE1-CG 4.32Å; F272-M363 HydrophobicContact CE2-CG 4.26Å; F272-M363 HydrophobicContact CG-CG 3.5Å; F272-M363 VanDerWaalsContact CG-CG 3.5Å; F272-M363 HydrophobicContact CG-SD 3.99Å; F272-F366 HydrophobicContact CE2-CD2 4.18Å; F272-F366 AromaticContact CZ-CD2 3.8Å; F272-F366 HydrophobicContact CZ-CD2 3.8Å; F272-F366 HydrophobicContact CZ-CE2 4.35Å
273	C	96.8	Very high	87.2	Confident	81 Å²	81	50.5 Å²	50.5	55%	0.547	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	140.1	175.6	-67.4	0	0	0	0	109.9	S357	C273-S357 VanDerWaalsContact O-CB 3.25Å; C273-S357 WeakPolarHBondContact O-CB 3.35Å; C273-S357 PolarHBondContact O-OG 3.11Å
274	G	96.3	Very high	85.4	Confident	9 Å²	9	54 Å²	54	9%	0.093	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	178.2	171.3	0	0	0	0	0	112.6	V292 Y356	G274-V292 PolarHBondContact N-O 3.39Å; G274-V292 WeakPolarHBondContact O-CG2 3.49Å; G274-V292 PolarHBondContact O-N 3.4Å; G274-Y356 CarbonylContact C-O 3.59Å; G274-Y356 VanDerWaalsContact CA-O 3.25Å; G274-Y356 WeakPolarHBondContact CA-O 3.41Å
275	E	96.1	Very high	83.5	Confident	78 Å²	78	59.3 Å²	59.3	36%	0.364	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	151.1	173.6	-52.3	-169.1	131.5	0	0	111.2	R289 K290 I355 Y356	E275-R289 HydrophobicContact CB-CB 4.03Å; E275-R289 WeakPolarHBondContact OE2-CB 3.39Å; E275-R289 WeakPolarHBondContact OE2-CD 3.36Å; E275-R289 IonicContact OE2-NH1 2.72Å; E275-K290 CarbonylContact C-O 3.52Å; E275-K290 VanDerWaalsContact CA-O 3.23Å; E275-K290 WeakPolarHBondContact CA-O 3.45Å; E275-I355 CarbonylContact O-C 3.51Å; E275-I355 WeakPolarHBondContact O-CA 3.32Å; E275-Y356 PolarHBondContact N-O 3.1Å; E275-Y356 WeakPolarHBondContact O-CD2 3.46Å; E275-Y356 PolarHBondContact O-N 3.45Å
276	I	94.9	Very high	81.7	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.005	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	154.3	171.7	69.4	177.6	0	0	0	111	K278 R289 K290 V292 L312 L353 K354 I355 L423	I276-K278 PolarHBondContact O-N 2.67Å; I276-R289 CarbonylContact O-C 3.5Å; I276-R289 WeakPolarHBondContact O-CA 3.02Å; I276-K290 VanDerWaalsContact CD1-CE 3.4Å; I276-K290 HydrophobicContact CD1-CG 4.43Å; I276-K290 HydrophobicContact CG1-CD 4.16Å; I276-K290 HydrophobicContact CG1-CG 3.59Å; I276-K290 PolarHBondContact N-O 3.38Å; I276-K290 PolarHBondContact O-N 2.94Å; I276-V292 HydrophobicContact CD1-CG1 3.94Å; I276-V292 HydrophobicContact CG1-CG1 3.81Å; I276-V292 HydrophobicContact CG2-CG1 4.28Å; I276-V292 HydrophobicContact CG2-CG2 3.93Å; I276-L312 HydrophobicContact CD1-CD1 4.09Å; I276-L353 HydrophobicContact CB-CD1 4.46Å; I276-L353 HydrophobicContact CD1-CD1 4.42Å; I276-L353 HydrophobicContact CG2-CD1 4.27Å; I276-K354 WeakPolarHBondContact CG2-O 3.38Å; I276-I355 HydrophobicContact CG2-CB 4.45Å; I276-I355 HydrophobicContact CG2-CG1 3.9Å; I276-L423 HydrophobicContact CD1-CD2 3.56Å
277	D	91.6	Very high	80	Confident	39 Å²	39	71 Å²	71	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	134.1	176.2	-68.5	-45.6	0	0	0	110.9	Y356 N424	D277-Y356 WeakPolarHBondContact OD2-CE2 3.47Å; D277-Y356 PolarHBondContact OD2-OH 3.05Å; D277-N424 HydrophobicContact CB-CB 4Å; D277-N424 VanDerWaalsContact O-CB 3.25Å; D277-N424 WeakPolarHBondContact O-CB 3.46Å
278	K	87.3	Confident	79.3	Confident	88 Å²	88	79 Å²	79	38%	0.383	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-68.8	147.5	170.9	-72.8	175.3	-170.9	178.3	0	110.5	I276 R288 R289 K290 N424	I276-K278 PolarHBondContact O-N 2.67Å; K278-R288 WeakPolarHBondContact CB-O 3.48Å; K278-R288 HydrophobicContact CD-CB 4.11Å; K278-R288 WeakPolarHBondContact CD-O 3.49Å; K278-R288 WeakPolarHBondContact CG-O 3.3Å; K278-R288 PolarHBondContact N-O 3.21Å; K278-R288 VanDerWaalsContact N-O 3.12Å; K278-R289 WeakPolarHBondContact CE-O 3.46Å; K278-K290 HydrophobicContact CG-CB 4.03Å; K278-K290 HydrophobicContact CG-CD 4.35Å; K278-K290 HydrophobicContact CG-CG 4.27Å; K278-N424 PolarHBondContact O-ND2 2.71Å
279	P	78.1	Confident	79	Confident	49 Å²	49	83.4 Å²	83.4	32%	0.318	43%	0.432	S	S	.	.	P	Polyproline II helix	trans	-61.3	144.2	170.7	27.6	-34.7	0	0	0	110	Q281 S422	P279-Q281 PolarHBondContact O-N 2.9Å; P279-S422 WeakPolarHBondContact CG-O 3.49Å
280	V	66.4	Low	78.7	Confident	117 Å²	117	84.5 Å²	84.5	71%	0.709	44%	0.436	S	S	*	.			trans	-73.2	96.7	-178.6	-171.1	0	0	0	0	109.3
281	Q	58.2	Low	78.6	Confident	153 Å²	153	86.7 Å²	86.7	72%	0.715	46%	0.455	S	S	*	.			trans	-101.3	100.1	172	-69.4	-173.1	-12.5	0	0	110.2	P279 Q285	P279-Q281 PolarHBondContact O-N 2.9Å; Q281-Q285 WeakPolarHBondContact O-CB 3.3Å; Q281-Q285 WeakPolarHBondContact O-CG 3.05Å
282	G	55.6	Low	78.5	Confident	57 Å²	57	86 Å²	86	59%	0.588	45%	0.452	S	S	*	.	S	Bend	trans	90.4	169.8	169.4	0	0	0	0	0	116.7	L284	G282-L284 VanDerWaalsContact C-N 3.34Å; G282-L284 PolarHBondContact O-N 3.5Å
283	I	55.1	Low	78.5	Confident	178 Å²	178	86.8 Å²	86.8	91%	0.913	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-19.9	-171.5	-65.8	167.9	0	0	0	113.1
284	L	55.8	Low	78.5	Confident	163 Å²	163	82.9 Å²	82.9	85%	0.853	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-3.8	-174.5	-90.4	119.5	0	0	0	115.5	G282 R286	G282-L284 VanDerWaalsContact C-N 3.34Å; G282-L284 PolarHBondContact O-N 3.5Å; L284-R286 PolarHBondContact O-N 3.08Å
285	Q	53.1	Low	78.6	Confident	123 Å²	123	82.5 Å²	82.5	58%	0.575	43%	0.428	S	S	*	.			trans	-98.6	87.7	-178	-64	-67.3	-17	0	0	110.2	Q281 G287	Q281-Q285 WeakPolarHBondContact O-CB 3.3Å; Q281-Q285 WeakPolarHBondContact O-CG 3.05Å; Q285-G287 PolarHBondContact O-N 3.2Å
286	R	54.3	Low	78.7	Confident	236 Å²	236	78.8 Å²	78.8	89%	0.891	41%	0.41	S	S	*	.			trans	-60.8	130.1	164.1	-77.8	-174.9	176.4	-177	-0.8	108.4	L284 R288	L284-R286 PolarHBondContact O-N 3.08Å; R286-R288 PolarHBondContact O-N 3.15Å; R286-R288 VanDerWaalsContact O-N 3.1Å
287	G	57.9	Low	78.7	Confident	67 Å²	67	79 Å²	79	69%	0.691	41%	0.412	S	S	*	.			trans	-46.1	112.7	-170.5	0	0	0	0	0	112.9	Q285	Q285-G287 PolarHBondContact O-N 3.2Å
288	R	80.6	Confident	78.8	Confident	179 Å²	179	78 Å²	78	68%	0.675	41%	0.407	S	S	*	.			trans	-91.2	140.3	164	-67.3	-171.7	-178.2	-160.3	0.9	107.8	K278 R286	K278-R288 WeakPolarHBondContact CB-O 3.48Å; K278-R288 HydrophobicContact CD-CB 4.11Å; K278-R288 WeakPolarHBondContact CD-O 3.49Å; K278-R288 WeakPolarHBondContact CG-O 3.3Å; K278-R288 PolarHBondContact N-O 3.21Å; K278-R288 VanDerWaalsContact N-O 3.12Å; R286-R288 PolarHBondContact O-N 3.15Å; R286-R288 VanDerWaalsContact O-N 3.1Å
289	R	89.8	Confident	79	Confident	96 Å²	96	77.5 Å²	77.5	36%	0.362	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	157.2	166.2	-66.9	179.2	-178.9	170.2	-1.3	109.9	E275 I276 K278 S333 Y356	E275-R289 HydrophobicContact CB-CB 4.03Å; E275-R289 WeakPolarHBondContact OE2-CB 3.39Å; E275-R289 WeakPolarHBondContact OE2-CD 3.36Å; E275-R289 IonicContact OE2-NH1 2.72Å; I276-R289 CarbonylContact O-C 3.5Å; I276-R289 WeakPolarHBondContact O-CA 3.02Å; K278-R289 WeakPolarHBondContact CE-O 3.46Å; R289-S333 PolarHBondContact NH1-OG 3.12Å; R289-Y356 HydrophobicContact CG-CD2 4.4Å; R289-Y356 HydrophobicContact CG-CE2 4.46Å; R289-Y356 VanDerWaalsContact NH2-CE1 3.29Å
290	K	91.5	Very high	79.8	Confident	30 Å²	30	75.1 Å²	75.1	13%	0.13	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	135.9	169.7	66.2	175.5	-165.2	158.9	0	109.7	E275 I276 K278 V292 D305	E275-K290 CarbonylContact C-O 3.52Å; E275-K290 VanDerWaalsContact CA-O 3.23Å; E275-K290 WeakPolarHBondContact CA-O 3.45Å; I276-K290 VanDerWaalsContact CD1-CE 3.4Å; I276-K290 HydrophobicContact CD1-CG 4.43Å; I276-K290 HydrophobicContact CG1-CD 4.16Å; I276-K290 HydrophobicContact CG1-CG 3.59Å; I276-K290 PolarHBondContact N-O 3.38Å; I276-K290 PolarHBondContact O-N 2.94Å; K278-K290 HydrophobicContact CG-CB 4.03Å; K278-K290 HydrophobicContact CG-CD 4.35Å; K278-K290 HydrophobicContact CG-CG 4.27Å; K290-V292 HydrophobicContact CG-CG1 4.4Å; K290-D305 IonicContact NZ-OD2 3.07Å; K290-D305 PolarHBondContact NZ-OD2 3.17Å
291	A	94.9	Very high	81.3	Confident	48 Å²	48	69.6 Å²	69.6	40%	0.397	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	132.4	174.6	0	0	0	0	0	110.4	V306	A291-V306 HydrophobicContact CB-CB 4.24Å; A291-V306 HydrophobicContact CB-CG2 4.27Å; A291-V306 PolarHBondContact O-N 3.03Å
292	V	96.6	Very high	83.1	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.018	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.9	175.8	-63.4	0	0	0	0	109.8	G274 I276 K290 V294 V303 M304 V306 L312	G274-V292 PolarHBondContact N-O 3.39Å; G274-V292 WeakPolarHBondContact O-CG2 3.49Å; G274-V292 PolarHBondContact O-N 3.4Å; I276-V292 HydrophobicContact CD1-CG1 3.94Å; I276-V292 HydrophobicContact CG1-CG1 3.81Å; I276-V292 HydrophobicContact CG2-CG1 4.28Å; I276-V292 HydrophobicContact CG2-CG2 3.93Å; K290-V292 HydrophobicContact CG-CG1 4.4Å; V292-V294 HydrophobicContact CG2-CG2 4.35Å; V292-V303 HydrophobicContact CB-CG1 3.83Å; V292-V303 HydrophobicContact CG1-CG1 4.01Å; V292-V303 HydrophobicContact CG2-CG1 3.97Å; V292-M304 CarbonylContact C-O 3.6Å; V292-M304 WeakPolarHBondContact CA-O 3.32Å; V292-M304 WeakPolarHBondContact CB-O 3.48Å; V292-V306 VanDerWaalsContact C-CG2 3.43Å; V292-L312 HydrophobicContact CG1-CD1 3.77Å
293	S	97.1	Very high	85	Confident	27 Å²	27	60 Å²	60	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.4	165.7	-167.6	0	0	0	0	108.5	F271 F272 M304	F271-S293 WeakPolarHBondContact CD1-OG 3.37Å; F272-S293 WeakPolarHBondContact O-CA 3.37Å; S293-M304 PolarHBondContact N-O 3.05Å; S293-M304 PolarHBondContact O-N 3.2Å
294	V	98.2	Very high	86.9	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	107.6	179.3	-174.6	0	0	0	0	108.1	F271 F272 V292 I296 V301 Y302 I355 M363	F271-V294 CarbonylContact C-O 3.53Å; F271-V294 WeakPolarHBondContact CA-O 3.27Å; F272-V294 HydrophobicContact CB-CB 4.34Å; F272-V294 PolarHBondContact N-O 3.28Å; F272-V294 PolarHBondContact O-N 2.99Å; V292-V294 HydrophobicContact CG2-CG2 4.35Å; V294-I296 HydrophobicContact CG1-CD1 4.47Å; V294-I296 HydrophobicContact CG1-CG1 4.22Å; V294-V301 HydrophobicContact CG1-CG1 3.86Å; V294-Y302 CarbonylContact C-O 3.54Å; V294-Y302 WeakPolarHBondContact CA-O 3.4Å; V294-I355 HydrophobicContact CG2-CD1 4.16Å; V294-I355 HydrophobicContact CG2-CG2 3.98Å; V294-M363 HydrophobicContact CB-SD 3.91Å; V294-M363 HydrophobicContact CG1-SD 3.86Å; V294-M363 HydrophobicContact CG2-SD 4.18Å
295	G	98	Very high	88.7	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	131.4	173.8	0	0	0	0	0	111	A270 V301 Y302	A270-G295 CarbonylContact O-C 3.59Å; A270-G295 VanDerWaalsContact O-CA 3.3Å; A270-G295 WeakPolarHBondContact O-CA 3.19Å; G295-V301 CarbonylContact O-C 3.45Å; G295-V301 WeakPolarHBondContact O-CA 3.35Å; G295-Y302 PolarHBondContact N-O 3.33Å; G295-Y302 PolarHBondContact O-N 2.75Å
296	I	98.2	Very high	90.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	126.6	175.6	-51.5	177.5	0	0	0	108.6	C269 A270 F272 V294 V301 M363 F366 I367	C269-I296 CarbonylContact C-O 3.56Å; C269-I296 WeakPolarHBondContact CA-O 3.46Å; A270-I296 PolarHBondContact N-O 2.75Å; A270-I296 PolarHBondContact O-N 2.8Å; F272-I296 HydrophobicContact CD2-CD1 3.88Å; F272-I296 HydrophobicContact CD2-CG1 4.18Å; F272-I296 HydrophobicContact CE2-CB 4.34Å; F272-I296 HydrophobicContact CE2-CD1 3.77Å; F272-I296 HydrophobicContact CE2-CG1 4.14Å; V294-I296 HydrophobicContact CG1-CD1 4.47Å; V294-I296 HydrophobicContact CG1-CG1 4.22Å; I296-V301 HydrophobicContact CG1-CG1 4.43Å; I296-V301 HydrophobicContact CG1-CG2 4.4Å; I296-M363 HydrophobicContact CD1-CB 3.8Å; I296-M363 HydrophobicContact CD1-CG 3.89Å; I296-F366 HydrophobicContact CB-CD1 4.4Å; I296-F366 HydrophobicContact CG2-CD1 3.67Å; I296-F366 HydrophobicContact CG2-CE1 4.08Å; I296-F366 HydrophobicContact CG2-CG 4.25Å; I296-I367 HydrophobicContact CD1-CD1 4.29Å; I296-I367 HydrophobicContact CD1-CG1 3.99Å; I296-I367 HydrophobicContact CG2-CG1 4.09Å
297	C	95.5	Very high	92.3	Very high	5 Å²	5	38.4 Å²	38.4	3%	0.034	20%	0.202	C	C	.	.			trans	-133.8	-165.6	173.6	66.8	0	0	0	0	110.6	C269 D299 G300 F317 C370	C269-C297 HydrophobicContact CB-CB 4.46Å; C297-D299 PolarHBondContact O-N 3.48Å; C297-D299 PolarHBondContact SG-N 3Å; C297-G300 PolarHBondContact N-O 3.23Å; C297-G300 VanDerWaalsContact N-O 3.14Å; C297-F317 VanDerWaalsContact O-CZ 3.26Å; C297-F317 WeakPolarHBondContact O-CZ 3.4Å; C297-C370 PolarHBondContact O-SG 2.83Å; C297-C370 VanDerWaalsContact O-SG 3.36Å
298	L	93.9	Very high	93.7	Very high	19 Å²	19	40.1 Å²	40.1	10%	0.099	19%	0.192	C	C	.	.	S	Bend	trans	-68.7	-19.3	176.9	-68.1	178.6	0	0	0	114.1	F132 P134 F317 L373	F132-L298 HydrophobicContact CD1-CD2 4.01Å; P134-L298 HydrophobicContact CB-CD1 4.45Å; P134-L298 HydrophobicContact CG-CD1 4.26Å; L298-F317 VanDerWaalsContact O-CE2 3.24Å; L298-F317 WeakPolarHBondContact O-CE2 3.48Å; L298-L373 HydrophobicContact CD2-CD2 3.78Å
299	D	91.4	Very high	94.1	Very high	77 Å²	77	34.2 Å²	34.2	41%	0.412	17%	0.171	S	C	.	.	S	Bend	trans	-92.2	-32.5	-176.2	-62.2	-35.3	0	0	0	112.4	C297 R316 F317	C297-D299 PolarHBondContact O-N 3.48Å; C297-D299 PolarHBondContact SG-N 3Å; D299-R316 WeakPolarHBondContact O-CA 3.39Å; D299-F317 PolarHBondContact O-N 2.85Å
300	G	94.3	Very high	94	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-162.6	-172.5	0	0	0	0	0	116	C297 L315	C297-G300 PolarHBondContact N-O 3.23Å; C297-G300 VanDerWaalsContact N-O 3.14Å; G300-L315 CarbonylContact C-O 3.29Å; G300-L315 WeakPolarHBondContact CA-O 3.29Å
301	V	96.9	Very high	94	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	133.9	-178.6	-177.1	0	0	0	0	109.9	V294 G295 I296 G314 L315 F317 L320 L338 I367	V294-V301 HydrophobicContact CG1-CG1 3.86Å; G295-V301 CarbonylContact O-C 3.45Å; G295-V301 WeakPolarHBondContact O-CA 3.35Å; I296-V301 HydrophobicContact CG1-CG1 4.43Å; I296-V301 HydrophobicContact CG1-CG2 4.4Å; V301-G314 WeakPolarHBondContact O-CA 3.42Å; V301-L315 PolarHBondContact N-O 3.16Å; V301-L315 PolarHBondContact O-N 3.35Å; V301-F317 HydrophobicContact CG2-CE1 4.08Å; V301-L320 HydrophobicContact CB-CD2 4.13Å; V301-L320 HydrophobicContact CG2-CD2 3.88Å; V301-L338 HydrophobicContact CG1-CD1 3.95Å; V301-I367 HydrophobicContact CG2-CD1 3.76Å; V301-I367 HydrophobicContact CG2-CG1 3.88Å
302	Y	96.3	Very high	93.8	Very high	7 Å²	7	28.9 Å²	28.9	3%	0.027	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	129.4	-177.5	-53.7	-82.8	0	0	0	110.4	P265 Y266 V294 G295 L313	P265-Y302 HydrophobicContact CB-CD1 4.12Å; P265-Y302 HydrophobicContact CB-CE1 3.29Å; P265-Y302 WeakPolarHBondContact CB-OH 3.35Å; P265-Y302 HydrophobicContact CG-CE1 4.49Å; P265-Y302 WeakPolarHBondContact O-CE2 3.47Å; P265-Y302 PolarHBondContact O-OH 2.94Å; P265-Y302 VanDerWaalsContact O-OH 3.05Å; Y266-Y302 HydrophobicContact CD1-CD1 4.43Å; V294-Y302 CarbonylContact C-O 3.54Å; V294-Y302 WeakPolarHBondContact CA-O 3.4Å; G295-Y302 PolarHBondContact N-O 3.33Å; G295-Y302 PolarHBondContact O-N 2.75Å; Y302-L313 CarbonylContact C-O 3.57Å; Y302-L313 WeakPolarHBondContact CA-O 3.2Å
303	V	96.3	Very high	93.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.4	178.3	-171.6	0	0	0	0	108.5	V292 L312 L313 L338 L353 I355	V292-V303 HydrophobicContact CB-CG1 3.83Å; V292-V303 HydrophobicContact CG1-CG1 4.01Å; V292-V303 HydrophobicContact CG2-CG1 3.97Å; V303-L312 HydrophobicContact CG1-CD1 4.29Å; V303-L312 WeakPolarHBondContact O-CA 3.36Å; V303-L312 WeakPolarHBondContact O-CB 3.39Å; V303-L312 PolarHBondContact O-N 2.85Å; V303-L313 HydrophobicContact CB-CB 4.13Å; V303-L313 HydrophobicContact CG2-CB 4.28Å; V303-L313 HydrophobicContact CG2-CD2 4.4Å; V303-L313 PolarHBondContact N-O 2.56Å; V303-L313 PolarHBondContact O-N 2.86Å; V303-L338 HydrophobicContact CG2-CD1 4.39Å; V303-L353 HydrophobicContact CG2-CD2 4.26Å; V303-I355 HydrophobicContact CG2-CD1 3.96Å
304	M	94.8	Very high	93.5	Very high	5 Å²	5	27.5 Å²	27.5	3%	0.025	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142.8	-174.7	-67.8	153	-73	0	0	111.2	P164 Y266 F271 V292 S293 V306 H310 V311	P164-M304 HydrophobicContact CG-CB 4.49Å; P164-M304 HydrophobicContact CG-CG 4.13Å; P164-M304 HydrophobicContact CG-SD 4.2Å; Y266-M304 HydrophobicContact CD2-SD 4.27Å; Y266-M304 HydrophobicContact CG-SD 4.15Å; F271-M304 HydrophobicContact CD1-CE 3.89Å; F271-M304 HydrophobicContact CE1-CE 3.41Å; F271-M304 VanDerWaalsContact CE1-CE 3.41Å; F271-M304 HydrophobicContact CE1-SD 3.99Å; F271-M304 HydrophobicContact CZ-CE 4.49Å; V292-M304 CarbonylContact C-O 3.6Å; V292-M304 WeakPolarHBondContact CA-O 3.32Å; V292-M304 WeakPolarHBondContact CB-O 3.48Å; S293-M304 PolarHBondContact N-O 3.05Å; S293-M304 PolarHBondContact O-N 3.2Å; M304-V306 PolarHBondContact O-N 2.81Å; M304-H310 WeakPolarHBondContact CA-O 3.3Å; M304-V311 HydrophobicContact CG-CG2 4.14Å
305	D	92.6	Very high	93.2	Very high	16 Å²	16	27.5 Å²	27.5	9%	0.086	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.7	176.1	-161.7	-68.1	0	0	0	110.5	K290 K307 E308 K309 H310 L312	K290-D305 IonicContact NZ-OD2 3.07Å; K290-D305 PolarHBondContact NZ-OD2 3.17Å; D305-K307 VanDerWaalsContact C-N 3.28Å; D305-K307 PolarHBondContact O-N 3.48Å; D305-K307 PolarHBondContact OD1-N 2.88Å; D305-E308 HydrophobicContact CB-CB 4.17Å; D305-E308 PolarHBondContact OD1-N 2.7Å; D305-K309 WeakPolarHBondContact O-CA 3.49Å; D305-K309 PolarHBondContact O-N 2.88Å; D305-H310 PolarHBondContact N-O 3.07Å; D305-L312 HydrophobicContact CB-CD1 4.06Å; D305-L312 HydrophobicContact CB-CD2 4.27Å; D305-L312 HydrophobicContact CB-CG 4.17Å
306	V	92.8	Very high	92.9	Very high	60 Å²	60	32.6 Å²	32.6	36%	0.364	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-32.8	-176.1	171.5	0	0	0	0	111.9	A291 V292 M304 K309	A291-V306 HydrophobicContact CB-CB 4.24Å; A291-V306 HydrophobicContact CB-CG2 4.27Å; A291-V306 PolarHBondContact O-N 3.03Å; V292-V306 VanDerWaalsContact C-CG2 3.43Å; M304-V306 PolarHBondContact O-N 2.81Å; V306-K309 VanDerWaalsContact O-CD 3.23Å; V306-K309 WeakPolarHBondContact O-CD 3.4Å; V306-K309 WeakPolarHBondContact O-CE 3.47Å; V306-K309 PolarHBondContact O-NZ 2.88Å
307	K	89.9	Confident	92.6	Very high	167 Å²	167	34.1 Å²	34.1	73%	0.726	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-49.7	-175.9	-176.1	-173.6	174.3	-162.7	0	111	D305 K309	D305-K307 VanDerWaalsContact C-N 3.28Å; D305-K307 PolarHBondContact O-N 3.48Å; D305-K307 PolarHBondContact OD1-N 2.88Å; K307-K309 VanDerWaalsContact C-N 3.31Å
308	E	87.4	Confident	92.2	Very high	102 Å²	102	36.5 Å²	36.5	48%	0.477	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.9	-174.1	-56.6	-59.3	143.8	0	0	113	D305 H310	D305-E308 HydrophobicContact CB-CB 4.17Å; D305-E308 PolarHBondContact OD1-N 2.7Å; E308-H310 VanDerWaalsContact C-N 3.31Å; E308-H310 WeakPolarHBondContact CB-CE1 3.15Å; E308-H310 VanDerWaalsContact CB-ND1 3.3Å; E308-H310 WeakPolarHBondContact CB-ND1 3.45Å; E308-H310 PolarHBondContact O-N 3.15Å; E308-H310 PolarHBondContact O-ND1 2.82Å
309	K	89.6	Confident	91.9	Very high	55 Å²	55	36 Å²	36	24%	0.239	17%	0.174	C	C	.	.			trans	50.9	44.9	173.6	-56.9	-55.6	-166.5	-169.9	0	113.7	G161 P164 H207 D305 V306 K307	G161-K309 WeakPolarHBondContact O-CD 3.38Å; P164-K309 VanDerWaalsContact CB-O 3.28Å; P164-K309 WeakPolarHBondContact CB-O 3.47Å; H207-K309 HydrophobicContact CB-CG 4.21Å; D305-K309 WeakPolarHBondContact O-CA 3.49Å; D305-K309 PolarHBondContact O-N 2.88Å; V306-K309 VanDerWaalsContact O-CD 3.23Å; V306-K309 WeakPolarHBondContact O-CD 3.4Å; V306-K309 WeakPolarHBondContact O-CE 3.47Å; V306-K309 PolarHBondContact O-NZ 2.88Å; K307-K309 VanDerWaalsContact C-N 3.31Å
310	H	87.8	Confident	91.8	Very high	44 Å²	44	32.6 Å²	32.6	20%	0.204	16%	0.156	C	C	.	.			trans	-132.9	157.3	175.1	63.3	-113.1	0	0	0	112	M304 D305 E308 L312 R419	M304-H310 WeakPolarHBondContact CA-O 3.3Å; D305-H310 PolarHBondContact N-O 3.07Å; E308-H310 VanDerWaalsContact C-N 3.31Å; E308-H310 WeakPolarHBondContact CB-CE1 3.15Å; E308-H310 VanDerWaalsContact CB-ND1 3.3Å; E308-H310 WeakPolarHBondContact CB-ND1 3.45Å; E308-H310 PolarHBondContact O-N 3.15Å; E308-H310 PolarHBondContact O-ND1 2.82Å; H310-L312 VanDerWaalsContact NE2-CD2 3.32Å; H310-L312 WeakPolarHBondContact NE2-CD2 3.3Å; H310-R419 PolarHBondContact CD2-NH1 3.31Å; H310-R419 PolarHBondContact CE1-NH1 3.36Å; H310-R419 VanDerWaalsContact CE1-NH1 3.29Å; H310-R419 PolarHBondContact ND1-NH1 3.08Å; H310-R419 PolarHBondContact NE2-NH1 3.06Å; H310-R419 VanDerWaalsContact NE2-NH1 3.2Å
311	V	91.6	Very high	91.7	Very high	17 Å²	17	33.9 Å²	33.9	10%	0.103	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	131.6	175.3	-173.6	0	0	0	0	109.9	P164 Y266 M304 C417	P164-V311 HydrophobicContact CB-CG2 4.29Å; P164-V311 HydrophobicContact CG-CG2 4.44Å; Y266-V311 HydrophobicContact CD1-CG2 3.92Å; Y266-V311 HydrophobicContact CE1-CG2 3.31Å; M304-V311 HydrophobicContact CG-CG2 4.14Å; V311-C417 HydrophobicContact CG1-CB 4.05Å
312	L	91.6	Very high	91.6	Very high	1 Å²	1	35 Å²	35	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-38.6	177.2	-62.2	169.6	0	0	0	111.8	I276 V292 V303 D305 H310 L423	I276-L312 HydrophobicContact CD1-CD1 4.09Å; V292-L312 HydrophobicContact CG1-CD1 3.77Å; V303-L312 HydrophobicContact CG1-CD1 4.29Å; V303-L312 WeakPolarHBondContact O-CA 3.36Å; V303-L312 WeakPolarHBondContact O-CB 3.39Å; V303-L312 PolarHBondContact O-N 2.85Å; D305-L312 HydrophobicContact CB-CD1 4.06Å; D305-L312 HydrophobicContact CB-CD2 4.27Å; D305-L312 HydrophobicContact CB-CG 4.17Å; H310-L312 VanDerWaalsContact NE2-CD2 3.32Å; H310-L312 WeakPolarHBondContact NE2-CD2 3.3Å; L312-L423 HydrophobicContact CB-CD2 4.03Å; L312-L423 HydrophobicContact CD1-CD2 4.49Å
313	L	92.4	Very high	91.5	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	139.8	-176.3	-177.6	62.2	0	0	0	109.3	Y302 V303 L315 F340 L353 V415 V420 L423	Y302-L313 CarbonylContact C-O 3.57Å; Y302-L313 WeakPolarHBondContact CA-O 3.2Å; V303-L313 HydrophobicContact CB-CB 4.13Å; V303-L313 HydrophobicContact CG2-CB 4.28Å; V303-L313 HydrophobicContact CG2-CD2 4.4Å; V303-L313 PolarHBondContact N-O 2.56Å; V303-L313 PolarHBondContact O-N 2.86Å; L313-L315 HydrophobicContact CD1-CD1 4.28Å; L313-L315 HydrophobicContact CD1-CD2 4.06Å; L313-L315 HydrophobicContact CD1-CG 3.96Å; L313-L315 HydrophobicContact CD2-CD1 3.79Å; L313-L315 HydrophobicContact CD2-CG 4.26Å; L313-L315 HydrophobicContact CG-CD1 4.05Å; L313-L315 HydrophobicContact CG-CG 3.94Å; L313-F340 HydrophobicContact CD1-CE1 4.49Å; L313-F340 HydrophobicContact CD1-CE2 4.08Å; L313-F340 HydrophobicContact CD1-CZ 4.05Å; L313-F340 HydrophobicContact CD2-CD1 4.42Å; L313-F340 HydrophobicContact CD2-CE1 3.83Å; L313-F340 HydrophobicContact CD2-CZ 4.05Å; L313-L353 HydrophobicContact CD2-CD2 3.67Å; L313-V415 HydrophobicContact CD1-CG1 3.65Å; L313-V420 HydrophobicContact CD1-CG2 4.11Å; L313-L423 HydrophobicContact CB-CD1 4.07Å; L313-L423 HydrophobicContact CD1-CD1 4.49Å; L313-L423 HydrophobicContact CD2-CD1 4.23Å
314	G	93.4	Very high	91.4	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	128.4	167.5	0	0	0	0	0	109	V301 V415 V416	V301-G314 WeakPolarHBondContact O-CA 3.42Å; G314-V415 WeakPolarHBondContact O-CG1 3.33Å; G314-V416 CarbonylContact C-O 3.59Å; G314-V416 WeakPolarHBondContact CA-O 3.25Å; G314-V416 PolarHBondContact N-O 2.79Å; G314-V416 PolarHBondContact O-N 3.12Å; G314-V416 VanDerWaalsContact O-O 3.12Å
315	L	92.3	Very high	91.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.7	-175.8	-65.2	169.9	0	0	0	109	G300 V301 L313 E319 L320 F340 V415	G300-L315 CarbonylContact C-O 3.29Å; G300-L315 WeakPolarHBondContact CA-O 3.29Å; V301-L315 PolarHBondContact N-O 3.16Å; V301-L315 PolarHBondContact O-N 3.35Å; L313-L315 HydrophobicContact CD1-CD1 4.28Å; L313-L315 HydrophobicContact CD1-CD2 4.06Å; L313-L315 HydrophobicContact CD1-CG 3.96Å; L313-L315 HydrophobicContact CD2-CD1 3.79Å; L313-L315 HydrophobicContact CD2-CG 4.26Å; L313-L315 HydrophobicContact CG-CD1 4.05Å; L313-L315 HydrophobicContact CG-CG 3.94Å; L315-E319 HydrophobicContact CD2-CB 4.27Å; L315-L320 HydrophobicContact CB-CB 4.07Å; L315-L320 HydrophobicContact CB-CD2 3.62Å; L315-L320 HydrophobicContact CB-CG 4.45Å; L315-L320 HydrophobicContact CD1-CB 3.96Å; L315-L320 HydrophobicContact CD1-CD2 4.48Å; L315-F340 HydrophobicContact CD1-CB 3.9Å; L315-F340 HydrophobicContact CD1-CD1 3.69Å; L315-F340 HydrophobicContact CD1-CE1 4.41Å; L315-F340 HydrophobicContact CD1-CG 3.86Å; L315-F340 HydrophobicContact CD2-CB 3.69Å; L315-F340 HydrophobicContact CD2-CD2 4.11Å; L315-F340 HydrophobicContact CD2-CG 3.87Å; L315-F340 HydrophobicContact CG-CB 4.47Å; L315-V415 HydrophobicContact CD2-CB 4.5Å; L315-V415 HydrophobicContact CD2-CG1 3.93Å; L315-V415 HydrophobicContact CD2-CG2 4.04Å
316	R	92.1	Very high	91.1	Very high	107 Å²	107	49.6 Å²	49.6	40%	0.404	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	158.7	166.3	-64.3	-178.4	-68.5	164.8	4	109.8	D299 S318 E319 L320 V416	D299-R316 WeakPolarHBondContact O-CA 3.39Å; R316-S318 PolarHBondContact O-N 2.78Å; R316-S318 VanDerWaalsContact O-N 3.14Å; R316-E319 HydrophobicContact CB-CG 4.15Å; R316-E319 IonicContact CZ-OE1 2.82Å; R316-E319 PolarHBondContact N-OE2 2.82Å; R316-E319 IonicContact NE-OE1 2.99Å; R316-E319 PolarHBondContact NE-OE1 2.81Å; R316-E319 IonicContact NE-OE2 2.74Å; R316-E319 IonicContact NH2-OE1 3.21Å; R316-E319 PolarHBondContact NH2-OE1 2.95Å; R316-E319 WeakPolarHBondContact O-CA 3.42Å; R316-E319 WeakPolarHBondContact O-CB 3.39Å; R316-E319 PolarHBondContact O-N 3.47Å; R316-L320 PolarHBondContact O-N 2.51Å; R316-V416 HydrophobicContact CG-CG2 4.41Å
317	F	90.8	Very high	90.8	Very high	32 Å²	32	49.1 Å²	49.1	14%	0.14	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-62.3	-23.1	178.1	-62.2	-48.2	0	0	0	114	C297 L298 D299 V301 E319 L320 I367 C370 V371	C297-F317 VanDerWaalsContact O-CZ 3.26Å; C297-F317 WeakPolarHBondContact O-CZ 3.4Å; L298-F317 VanDerWaalsContact O-CE2 3.24Å; L298-F317 WeakPolarHBondContact O-CE2 3.48Å; D299-F317 PolarHBondContact O-N 2.85Å; V301-F317 HydrophobicContact CG2-CE1 4.08Å; F317-E319 VanDerWaalsContact C-N 3.26Å; F317-E319 PolarHBondContact O-N 2.83Å; F317-L320 HydrophobicContact CD1-CD2 4.22Å; F317-I367 HydrophobicContact CD1-CG2 3.86Å; F317-I367 HydrophobicContact CE1-CB 4.39Å; F317-I367 HydrophobicContact CE1-CG1 4.45Å; F317-I367 HydrophobicContact CE1-CG2 3.6Å; F317-C370 HydrophobicContact CD2-CB 4.42Å; F317-C370 HydrophobicContact CE2-CB 3.42Å; F317-C370 VanDerWaalsContact CE2-CB 3.42Å; F317-C370 HydrophobicContact CZ-CB 3.51Å; F317-V371 HydrophobicContact CB-CG2 3.8Å; F317-V371 HydrophobicContact CD1-CG2 3.97Å; F317-V371 HydrophobicContact CD2-CG2 4.03Å; F317-V371 HydrophobicContact CG-CG2 3.66Å
318	S	87.9	Confident	90.3	Very high	56 Å²	56	49.9 Å²	49.9	39%	0.392	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-75.8	-13	172.5	65.5	0	0	0	0	113.9	R316 Q412	R316-S318 PolarHBondContact O-N 2.78Å; R316-S318 VanDerWaalsContact O-N 3.14Å; S318-Q412 PolarHBondContact OG-OE1 2.86Å; S318-Q412 VanDerWaalsContact OG-OE1 3.13Å
319	E	87.8	Confident	89.8	Confident	7 Å²	7	52.2 Å²	52.2	3%	0.033	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-105.5	-1.4	-174.7	-62.7	167.2	174	0	0	112.5	L315 R316 F317 F340	L315-E319 HydrophobicContact CD2-CB 4.27Å; R316-E319 HydrophobicContact CB-CG 4.15Å; R316-E319 IonicContact CZ-OE1 2.82Å; R316-E319 PolarHBondContact N-OE2 2.82Å; R316-E319 IonicContact NE-OE1 2.99Å; R316-E319 PolarHBondContact NE-OE1 2.81Å; R316-E319 IonicContact NE-OE2 2.74Å; R316-E319 IonicContact NH2-OE1 3.21Å; R316-E319 PolarHBondContact NH2-OE1 2.95Å; R316-E319 WeakPolarHBondContact O-CA 3.42Å; R316-E319 WeakPolarHBondContact O-CB 3.39Å; R316-E319 PolarHBondContact O-N 3.47Å; F317-E319 VanDerWaalsContact C-N 3.26Å; F317-E319 PolarHBondContact O-N 2.83Å; E319-F340 WeakPolarHBondContact O-CB 3.49Å
320	L	90.1	Very high	88.7	Confident	7 Å²	7	59.6 Å²	59.6	4%	0.037	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	144.9	-173.9	77	92.6	0	0	0	113.4	V301 L315 R316 F317 W322 L338 E339	V301-L320 HydrophobicContact CB-CD2 4.13Å; V301-L320 HydrophobicContact CG2-CD2 3.88Å; L315-L320 HydrophobicContact CB-CB 4.07Å; L315-L320 HydrophobicContact CB-CD2 3.62Å; L315-L320 HydrophobicContact CB-CG 4.45Å; L315-L320 HydrophobicContact CD1-CB 3.96Å; L315-L320 HydrophobicContact CD1-CD2 4.48Å; R316-L320 PolarHBondContact O-N 2.51Å; F317-L320 HydrophobicContact CD1-CD2 4.22Å; L320-W322 HydrophobicContact CD1-CB 4Å; L320-W322 HydrophobicContact CD1-CD2 4.14Å; L320-W322 HydrophobicContact CD1-CE3 3.5Å; L320-W322 HydrophobicContact CD1-CG 4.39Å; L320-W322 HydrophobicContact CD1-CZ3 4.28Å; L320-L338 HydrophobicContact CD1-CD2 4.46Å; L320-E339 CarbonylContact C-O 3.5Å; L320-E339 VanDerWaalsContact CA-O 3.27Å; L320-E339 WeakPolarHBondContact CA-O 3.48Å
321	S	91.3	Very high	87.8	Confident	26 Å²	26	61.1 Å²	61.1	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	148.1	157	-76.4	0	0	0	0	108.2	E339 L409	S321-E339 PolarHBondContact N-O 2.82Å; S321-E339 PolarHBondContact O-N 3.23Å; S321-L409 WeakPolarHBondContact OG-CG 3.49Å
322	W	95.3	Very high	87.1	Confident	25 Å²	25	64.3 Å²	64.3	10%	0.095	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	153.4	179.1	75.8	102	0	0	0	112	L320 W337 L338 S364 I367 E368 V371	L320-W322 HydrophobicContact CD1-CB 4Å; L320-W322 HydrophobicContact CD1-CD2 4.14Å; L320-W322 HydrophobicContact CD1-CE3 3.5Å; L320-W322 HydrophobicContact CD1-CG 4.39Å; L320-W322 HydrophobicContact CD1-CZ3 4.28Å; W322-W337 WeakPolarHBondContact CA-O 3.36Å; W322-W337 WeakPolarHBondContact CB-O 3.37Å; W322-L338 HydrophobicContact CB-CD2 3.93Å; W322-S364 PolarHBondContact NE1-O 2.78Å; W322-S364 PolarHBondContact NE1-OG 2.88Å; W322-I367 HydrophobicContact CD2-CB 4.23Å; W322-I367 HydrophobicContact CD2-CG2 3.49Å; W322-I367 VanDerWaalsContact CD2-CG2 3.49Å; W322-I367 HydrophobicContact CE3-CG2 3.72Å; W322-I367 HydrophobicContact CG-CD1 4.15Å; W322-I367 HydrophobicContact CG-CG2 4.18Å; W322-I367 HydrophobicContact CH2-CB 4.46Å; W322-I367 HydrophobicContact CH2-CG2 3.49Å; W322-I367 VanDerWaalsContact CH2-CG2 3.49Å; W322-I367 HydrophobicContact CZ2-CB 3.75Å; W322-I367 HydrophobicContact CZ2-CG2 3.22Å; W322-I367 HydrophobicContact CZ3-CG2 3.73Å; W322-E368 HydrophobicContact CZ2-CB 4.13Å; W322-V371 HydrophobicContact CH2-CB 4.16Å; W322-V371 HydrophobicContact CH2-CG2 3.66Å; W322-V371 HydrophobicContact CZ3-CG2 4.13Å
323	D	94	Very high	86.8	Confident	104 Å²	104	65.9 Å²	65.9	56%	0.556	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-147.4	168.6	168.4	-162.4	7.4	0	0	0	109.4	W337	D323-W337 PolarHBondContact N-O 3.24Å; D323-W337 WeakPolarHBondContact O-CB 3.45Å; D323-W337 PolarHBondContact O-N 3.32Å
324	H	94.3	Very high	86.9	Confident	51 Å²	51	68 Å²	68	24%	0.236	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	141.1	172.1	76.5	-55.6	0	0	0	111.1	I335 A360	H324-I335 CarbonylContact C-O 3.57Å; H324-I335 WeakPolarHBondContact CA-O 3.49Å; H324-I335 WeakPolarHBondContact CB-O 3.05Å; H324-A360 HydrophobicContact CB-CB 4.24Å
325	S	92.3	Very high	87	Confident	37 Å²	37	68.9 Å²	68.9	26%	0.259	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	142.3	174	58.6	0	0	0	0	110.4	H334 I335 W337	S325-H334 WeakPolarHBondContact O-CA 3.41Å; S325-I335 PolarHBondContact N-O 3.16Å; S325-I335 PolarHBondContact O-N 2.87Å; S325-W337 PolarHBondContact OG-NE1 3.49Å
326	R	88.2	Confident	87.3	Confident	142 Å²	142	68.9 Å²	68.9	54%	0.536	36%	0.357	S	S	.	.			trans	-91.6	155	169.7	-66.6	-179.2	-178.6	-177.3	-1.5	108.8	E328 E361	R326-E328 PolarHBondContact O-N 2.85Å; R326-E361 IonicContact CZ-OE1 3.74Å; R326-E361 IonicContact NH2-OE1 2.8Å; R326-E361 PolarHBondContact NH2-OE1 2.8Å; R326-E361 IonicContact NH2-OE2 2.88Å
327	P	86.9	Confident	87.5	Confident	50 Å²	50	66.3 Å²	66.3	33%	0.325	35%	0.348	S	S	.	.			trans	-59.2	127.9	171.7	25.7	-33.8	0	0	0	109.8	D332 H334	P327-D332 HydrophobicContact CB-CB 3.51Å; P327-D332 WeakPolarHBondContact CB-O 3.32Å; P327-H334 WeakPolarHBondContact CD-CE1 3.36Å; P327-H334 WeakPolarHBondContact CD-NE2 3.19Å
328	E	79.4	Confident	87.7	Confident	184 Å²	184	64.8 Å²	64.8	86%	0.86	34%	0.341	S	S	*	.			trans	-93	-35.7	175.5	-66.8	-175.6	179.7	0	0	110.2	R326 D332	R326-E328 PolarHBondContact O-N 2.85Å; E328-D332 PolarHBondContact N-OD2 2.88Å
329	E	77.2	Confident	87.9	Confident	151 Å²	151	64.1 Å²	64.1	71%	0.706	33%	0.332	S	S	*	.	S	Bend	trans	-115.2	160.2	177.4	-62.6	-175.8	178.9	0	0	112.8	G331 D332	E329-G331 PolarHBondContact O-N 3.47Å; E329-G331 VanDerWaalsContact O-N 3.16Å; E329-D332 PolarHBondContact N-OD2 3.15Å; E329-D332 VanDerWaalsContact N-OD2 3.08Å; E329-D332 WeakPolarHBondContact O-CB 3.27Å; E329-D332 PolarHBondContact O-N 3.09Å
330	E	66.1	Low	87.9	Confident	210 Å²	210	63.8 Å²	63.8	98%	0.981	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	113.4	175.5	-168.7	163.1	-156.2	0	0	110.1
331	G	68.1	Low	87.8	Confident	75 Å²	75	64.9 Å²	64.9	77%	0.773	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.8	-9.9	-174.2	0	0	0	0	0	114.6	E329	E329-G331 PolarHBondContact O-N 3.47Å; E329-G331 VanDerWaalsContact O-N 3.16Å
332	D	78.4	Confident	87.4	Confident	85 Å²	85	64.7 Å²	64.7	46%	0.455	34%	0.338	S	S	.	.			trans	-68.8	155.6	169.3	-79	-26.4	0	0	0	111.5	P327 E328 E329	P327-D332 HydrophobicContact CB-CB 3.51Å; P327-D332 WeakPolarHBondContact CB-O 3.32Å; E328-D332 PolarHBondContact N-OD2 2.88Å; E329-D332 PolarHBondContact N-OD2 3.15Å; E329-D332 VanDerWaalsContact N-OD2 3.08Å; E329-D332 WeakPolarHBondContact O-CB 3.27Å; E329-D332 PolarHBondContact O-N 3.09Å
333	S	85.5	Confident	86.9	Confident	33 Å²	33	69.3 Å²	69.3	23%	0.231	36%	0.361	C	S	.	.			trans	-106	147.1	177.6	-56.7	0	0	0	0	110.1	R289 I335	R289-S333 PolarHBondContact NH1-OG 3.12Å; S333-I335 WeakPolarHBondContact O-CG1 3.25Å; S333-I335 PolarHBondContact O-N 3.37Å
334	H	93.6	Very high	86.2	Confident	46 Å²	46	66.7 Å²	66.7	21%	0.213	35%	0.345	C	S	.	.			trans	-62.9	133	161.2	-66.7	-98.8	0	0	0	109	S325 P327 Y356 S357 A360	S325-H334 WeakPolarHBondContact O-CA 3.41Å; P327-H334 WeakPolarHBondContact CD-CE1 3.36Å; P327-H334 WeakPolarHBondContact CD-NE2 3.19Å; H334-Y356 WeakPolarHBondContact O-CA 3.44Å; H334-S357 WeakPolarHBondContact CB-O 3.25Å; H334-S357 PolarHBondContact O-N 2.99Å; H334-A360 HydrophobicContact CB-CB 4.32Å
335	I	95.8	Very high	85.5	Confident	18 Å²	18	70.3 Å²	70.3	9%	0.092	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	132.7	-175.5	-61.9	162	0	0	0	109.7	H324 S325 S333 W337 K354 I355 Y356	H324-I335 CarbonylContact C-O 3.57Å; H324-I335 WeakPolarHBondContact CA-O 3.49Å; H324-I335 WeakPolarHBondContact CB-O 3.05Å; S325-I335 PolarHBondContact N-O 3.16Å; S325-I335 PolarHBondContact O-N 2.87Å; S333-I335 WeakPolarHBondContact O-CG1 3.25Å; S333-I335 PolarHBondContact O-N 3.37Å; I335-W337 HydrophobicContact CD1-CZ2 4.14Å; I335-W337 HydrophobicContact CG2-CD2 3.86Å; I335-W337 HydrophobicContact CG2-CG 4.08Å; I335-W337 HydrophobicContact CG2-CZ2 4.06Å; I335-K354 HydrophobicContact CG2-CB 4.26Å; I335-I355 CarbonylContact C-O 3.5Å; I335-I355 VanDerWaalsContact CA-O 3.32Å; I335-I355 WeakPolarHBondContact CA-O 3.42Å; I335-Y356 HydrophobicContact CD1-CD1 4.06Å; I335-Y356 HydrophobicContact CD1-CE1 3.87Å; I335-Y356 HydrophobicContact CG1-CD1 3.7Å; I335-Y356 HydrophobicContact CG1-CE1 4.02Å
336	L	97.7	Very high	85	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	127.1	159.9	178.6	72.8	0	0	0	108.5	L338 I355 A360 M363 I367	L336-L338 HydrophobicContact CD2-CD2 4.18Å; L336-L338 HydrophobicContact CG-CD2 4.21Å; L336-I355 HydrophobicContact CB-CB 4.28Å; L336-I355 HydrophobicContact CD2-CD1 4.27Å; L336-I355 PolarHBondContact N-O 3.35Å; L336-I355 PolarHBondContact O-N 3.07Å; L336-A360 HydrophobicContact CB-CB 4.13Å; L336-M363 HydrophobicContact CB-CE 3.99Å; L336-M363 HydrophobicContact CD1-CB 4.49Å; L336-M363 HydrophobicContact CD2-CB 3.94Å; L336-M363 HydrophobicContact CD2-CE 3.97Å; L336-M363 HydrophobicContact CD2-SD 3.85Å; L336-I367 HydrophobicContact CD1-CD1 4.42Å
337	W	96.3	Very high	84.7	Confident	53 Å²	53	67.7 Å²	67.7	20%	0.201	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.6	177.9	-62.7	94.2	0	0	0	109	W322 D323 S325 I335 L352 K354	W322-W337 WeakPolarHBondContact CA-O 3.36Å; W322-W337 WeakPolarHBondContact CB-O 3.37Å; D323-W337 PolarHBondContact N-O 3.24Å; D323-W337 WeakPolarHBondContact O-CB 3.45Å; D323-W337 PolarHBondContact O-N 3.32Å; S325-W337 PolarHBondContact OG-NE1 3.49Å; I335-W337 HydrophobicContact CD1-CZ2 4.14Å; I335-W337 HydrophobicContact CG2-CD2 3.86Å; I335-W337 HydrophobicContact CG2-CG 4.08Å; I335-W337 HydrophobicContact CG2-CZ2 4.06Å; W337-L352 HydrophobicContact CB-CD1 4.17Å; W337-L352 HydrophobicContact CE3-CD1 3.9Å; W337-L352 HydrophobicContact CE3-CD2 3.53Å; W337-L352 HydrophobicContact CE3-CG 3.6Å; W337-L352 HydrophobicContact CZ3-CD2 3.52Å; W337-L352 HydrophobicContact CZ3-CG 3.95Å; W337-K354 HydrophobicContact CE3-CD 4.46Å; W337-K354 HydrophobicContact CE3-CG 3.83Å; W337-K354 HydrophobicContact CH2-CD 3.54Å; W337-K354 HydrophobicContact CH2-CG 3.84Å; W337-K354 HydrophobicContact CZ2-CD 4.34Å; W337-K354 HydrophobicContact CZ3-CD 3.62Å; W337-K354 HydrophobicContact CZ3-CG 3.37Å
338	L	95	Very high	84.5	Confident	1 Å²	1	68.4 Å²	68.4	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.4	172.2	-58.3	179.9	0	0	0	108.8	V301 V303 L320 W322 L336 L352 L353 I355	V301-L338 HydrophobicContact CG1-CD1 3.95Å; V303-L338 HydrophobicContact CG2-CD1 4.39Å; L320-L338 HydrophobicContact CD1-CD2 4.46Å; W322-L338 HydrophobicContact CB-CD2 3.93Å; L336-L338 HydrophobicContact CD2-CD2 4.18Å; L336-L338 HydrophobicContact CG-CD2 4.21Å; L338-L352 WeakPolarHBondContact O-CA 3.42Å; L338-L353 HydrophobicContact CB-CB 4.45Å; L338-L353 PolarHBondContact N-O 3.11Å; L338-L353 PolarHBondContact O-N 3.48Å; L338-I355 HydrophobicContact CD1-CD1 3.66Å; L338-I355 HydrophobicContact CG-CD1 4.19Å
339	E	92.1	Very high	84.9	Confident	41 Å²	41	59.8 Å²	59.8	19%	0.192	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.5	172.6	-175.7	-170.2	-166.6	0	0	109.3	L320 S321 N350 K351 L352 L409 Y428	L320-E339 CarbonylContact C-O 3.5Å; L320-E339 VanDerWaalsContact CA-O 3.27Å; L320-E339 WeakPolarHBondContact CA-O 3.48Å; S321-E339 PolarHBondContact N-O 2.82Å; S321-E339 PolarHBondContact O-N 3.23Å; E339-N350 HydrophobicContact CG-CB 4.41Å; E339-K351 CarbonylContact C-O 3.56Å; E339-K351 VanDerWaalsContact CA-O 3.29Å; E339-K351 WeakPolarHBondContact CA-O 3.34Å; E339-L352 HydrophobicContact CB-CD1 4Å; E339-L409 HydrophobicContact CB-CD1 4.38Å; E339-L409 HydrophobicContact CG-CD1 3.69Å; E339-Y428 PolarHBondContact OE1-OH 2.94Å
340	F	89.5	Confident	85.3	Confident	1 Å²	1	53.5 Å²	53.5	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	161.7	179.3	57.2	-82.3	0	0	0	110.9	L313 L315 E319 K351 L353 V415 V420 T425	L313-F340 HydrophobicContact CD1-CE1 4.49Å; L313-F340 HydrophobicContact CD1-CE2 4.08Å; L313-F340 HydrophobicContact CD1-CZ 4.05Å; L313-F340 HydrophobicContact CD2-CD1 4.42Å; L313-F340 HydrophobicContact CD2-CE1 3.83Å; L313-F340 HydrophobicContact CD2-CZ 4.05Å; L315-F340 HydrophobicContact CD1-CB 3.9Å; L315-F340 HydrophobicContact CD1-CD1 3.69Å; L315-F340 HydrophobicContact CD1-CE1 4.41Å; L315-F340 HydrophobicContact CD1-CG 3.86Å; L315-F340 HydrophobicContact CD2-CB 3.69Å; L315-F340 HydrophobicContact CD2-CD2 4.11Å; L315-F340 HydrophobicContact CD2-CG 3.87Å; L315-F340 HydrophobicContact CG-CB 4.47Å; E319-F340 WeakPolarHBondContact O-CB 3.49Å; F340-K351 HydrophobicContact CD2-CB 4.27Å; F340-K351 HydrophobicContact CE1-CB 4.19Å; F340-K351 HydrophobicContact CE2-CB 3.85Å; F340-K351 HydrophobicContact CE2-CD 4.23Å; F340-K351 HydrophobicContact CZ-CB 3.81Å; F340-K351 PolarHBondContact N-O 3.09Å; F340-K351 PolarHBondContact O-N 3.4Å; F340-L353 HydrophobicContact CE1-CB 4.1Å; F340-V415 HydrophobicContact CD2-CG2 4.37Å; F340-V420 HydrophobicContact CE2-CG1 3.8Å; F340-V420 HydrophobicContact CE2-CG2 4.25Å; F340-V420 HydrophobicContact CZ-CG1 4.17Å; F340-T425 HydrophobicContact CZ-CG2 4.29Å
341	D	86.6	Confident	86.4	Confident	29 Å²	29	44.5 Å²	44.5	16%	0.155	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	143.2	177	-71.2	-42.3	0	0	0	111.7	R411 Q412	D341-R411 VanDerWaalsContact OD2-CA 3.25Å; D341-R411 WeakPolarHBondContact OD2-CA 2.82Å; D341-Q412 PolarHBondContact OD2-N 2.91Å
342	G	84	Confident	87.6	Confident	22 Å²	22	42.5 Å²	42.5	23%	0.227	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	-173	172	0	0	0	0	0	113	P348 V349	G342-P348 WeakPolarHBondContact O-CA 3.07Å; G342-V349 CarbonylContact C-O 3.53Å; G342-V349 PolarHBondContact N-O 2.71Å; G342-V349 PolarHBondContact O-N 3.32Å
343	E	83.1	Confident	88.3	Confident	122 Å²	122	38.4 Å²	38.4	57%	0.57	22%	0.218	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	144.2	179.6	-163.9	-173	116.3	0	0	110.6	G346 T347 K351	E343-G346 WeakPolarHBondContact OE1-CA 3.08Å; E343-G346 PolarHBondContact OE1-N 3.39Å; E343-G346 VanDerWaalsContact OE1-N 3.15Å; E343-T347 WeakPolarHBondContact CA-O 3.33Å; E343-K351 WeakPolarHBondContact O-CE 3.17Å; E343-K351 PolarHBondContact O-NZ 2.94Å
344	E	80.4	Confident	88.7	Confident	49 Å²	49	39.6 Å²	39.6	23%	0.229	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	120.5	165.7	-73.7	-167.8	162.6	0	0	109.9	G346 T347 V349 S427 L438	E344-G346 VanDerWaalsContact C-N 3.31Å; E344-G346 PolarHBondContact O-N 2.93Å; E344-T347 PolarHBondContact N-O 3.12Å; E344-T347 WeakPolarHBondContact O-CA 3.23Å; E344-T347 VanDerWaalsContact O-CB 3.24Å; E344-T347 WeakPolarHBondContact O-CB 3.22Å; E344-T347 PolarHBondContact O-N 3.34Å; E344-V349 HydrophobicContact CB-CG1 4.29Å; E344-V349 HydrophobicContact CG-CG2 4.08Å; E344-S427 WeakPolarHBondContact OE1-CB 3.06Å; E344-S427 PolarHBondContact OE1-OG 3.21Å; E344-L438 WeakPolarHBondContact OE2-CB 3.48Å
345	D	79.8	Confident	88.9	Confident	128 Å²	128	37.4 Å²	37.4	68%	0.684	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	43.3	179.6	-62.9	-19	0	0	0	113.8	T347 K441	D345-T347 PolarHBondContact O-N 3.32Å; D345-K441 IonicContact OD2-NZ 3.73Å; D345-K441 PolarHBondContact OD2-NZ 3.45Å; D345-K441 VanDerWaalsContact OD2-NZ 3.07Å
346	G	80.9	Confident	88.9	Confident	53 Å²	53	38 Å²	38	55%	0.546	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	-2.3	-176.8	0	0	0	0	0	114.8	E343 E344	E343-G346 WeakPolarHBondContact OE1-CA 3.08Å; E343-G346 PolarHBondContact OE1-N 3.39Å; E343-G346 VanDerWaalsContact OE1-N 3.15Å; E344-G346 VanDerWaalsContact C-N 3.31Å; E344-G346 PolarHBondContact O-N 2.93Å
347	T	82.4	Confident	88.9	Confident	71 Å²	71	38.4 Å²	38.4	44%	0.436	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	122.9	178.2	-53.6	0	0	0	0	109.8	E343 E344 D345 V349	E343-T347 WeakPolarHBondContact CA-O 3.33Å; E344-T347 PolarHBondContact N-O 3.12Å; E344-T347 WeakPolarHBondContact O-CA 3.23Å; E344-T347 VanDerWaalsContact O-CB 3.24Å; E344-T347 WeakPolarHBondContact O-CB 3.22Å; E344-T347 PolarHBondContact O-N 3.34Å; D345-T347 PolarHBondContact O-N 3.32Å; T347-V349 PolarHBondContact O-N 2.87Å
348	P	83.6	Confident	88.8	Confident	64 Å²	64	38.7 Å²	38.7	42%	0.416	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.2	172.1	-22.2	33.7	0	0	0	111.5	G342 R411	G342-P348 WeakPolarHBondContact O-CA 3.07Å; P348-R411 VanDerWaalsContact CB-NH1 3.29Å
349	V	86.4	Confident	88.9	Confident	3 Å²	3	39.1 Å²	39.1	2%	0.018	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	158.1	-177.6	-59.5	0	0	0	0	110.1	G342 E344 T347 K351 V429 L438	G342-V349 CarbonylContact C-O 3.53Å; G342-V349 PolarHBondContact N-O 2.71Å; G342-V349 PolarHBondContact O-N 3.32Å; E344-V349 HydrophobicContact CB-CG1 4.29Å; E344-V349 HydrophobicContact CG-CG2 4.08Å; T347-V349 PolarHBondContact O-N 2.87Å; V349-K351 HydrophobicContact CG2-CG 4.09Å; V349-V429 HydrophobicContact CG1-CG2 4.1Å; V349-L438 HydrophobicContact CG1-CD1 3.38Å
350	N	86.7	Confident	89.2	Confident	20 Å²	20	37.1 Å²	37.1	11%	0.107	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	135.1	162.6	-63.7	-38.1	0	0	0	108.6	E339 S427 Y428	E339-N350 HydrophobicContact CG-CB 4.41Å; N350-S427 WeakPolarHBondContact O-CA 3.43Å; N350-Y428 HydrophobicContact CB-CD1 4.32Å; N350-Y428 HydrophobicContact CB-CD2 4.01Å; N350-Y428 HydrophobicContact CB-CE1 4Å; N350-Y428 HydrophobicContact CB-CE2 3.64Å; N350-Y428 HydrophobicContact CB-CG 4.36Å; N350-Y428 PolarHBondContact N-O 2.89Å; N350-Y428 PolarHBondContact O-N 3.13Å
351	K	89.3	Confident	89.5	Confident	21 Å²	21	39.8 Å²	39.8	9%	0.091	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	134.1	174.8	-65.5	-164.7	179.3	-155.3	0	109.5	E339 F340 E343 V349 V420 T425	E339-K351 CarbonylContact C-O 3.56Å; E339-K351 VanDerWaalsContact CA-O 3.29Å; E339-K351 WeakPolarHBondContact CA-O 3.34Å; F340-K351 HydrophobicContact CD2-CB 4.27Å; F340-K351 HydrophobicContact CE1-CB 4.19Å; F340-K351 HydrophobicContact CE2-CB 3.85Å; F340-K351 HydrophobicContact CE2-CD 4.23Å; F340-K351 HydrophobicContact CZ-CB 3.81Å; F340-K351 PolarHBondContact N-O 3.09Å; F340-K351 PolarHBondContact O-N 3.4Å; E343-K351 WeakPolarHBondContact O-CE 3.17Å; E343-K351 PolarHBondContact O-NZ 2.94Å; V349-K351 HydrophobicContact CG2-CG 4.09Å; K351-V420 HydrophobicContact CD-CG1 3.64Å; K351-T425 HydrophobicContact CB-CG2 4.48Å
352	L	91.9	Very high	89.9	Confident	32 Å²	32	40.6 Å²	40.6	17%	0.168	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.1	177.9	-173.7	67.2	0	0	0	109.7	W337 L338 E339 T425 I426 Y428	W337-L352 HydrophobicContact CB-CD1 4.17Å; W337-L352 HydrophobicContact CE3-CD1 3.9Å; W337-L352 HydrophobicContact CE3-CD2 3.53Å; W337-L352 HydrophobicContact CE3-CG 3.6Å; W337-L352 HydrophobicContact CZ3-CD2 3.52Å; W337-L352 HydrophobicContact CZ3-CG 3.95Å; L338-L352 WeakPolarHBondContact O-CA 3.42Å; E339-L352 HydrophobicContact CB-CD1 4Å; L352-T425 WeakPolarHBondContact O-CA 3.41Å; L352-I426 HydrophobicContact CB-CB 4.22Å; L352-I426 PolarHBondContact N-O 2.88Å; L352-I426 PolarHBondContact O-N 3.31Å; L352-Y428 HydrophobicContact CB-CE1 4.17Å
353	L	93.9	Very high	90.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	133.1	174.4	179.6	66.2	0	0	0	110	I276 V303 L313 L338 F340 I355 T425	I276-L353 HydrophobicContact CB-CD1 4.46Å; I276-L353 HydrophobicContact CD1-CD1 4.42Å; I276-L353 HydrophobicContact CG2-CD1 4.27Å; V303-L353 HydrophobicContact CG2-CD2 4.26Å; L313-L353 HydrophobicContact CD2-CD2 3.67Å; L338-L353 HydrophobicContact CB-CB 4.45Å; L338-L353 PolarHBondContact N-O 3.11Å; L338-L353 PolarHBondContact O-N 3.48Å; F340-L353 HydrophobicContact CE1-CB 4.1Å; L353-I355 HydrophobicContact CD2-CD1 4.2Å; L353-I355 HydrophobicContact CD2-CG1 4.11Å; L353-I355 HydrophobicContact CG-CG1 4.17Å; L353-T425 HydrophobicContact CB-CG2 4.34Å; L353-T425 HydrophobicContact CD1-CG2 4.31Å
354	K	94.8	Very high	91.3	Very high	58 Å²	58	34.3 Å²	34.3	25%	0.252	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	124.7	171.9	-53.3	-163.7	-172.1	-167.5	0	110	I276 I335 W337 Y356 I426	I276-K354 WeakPolarHBondContact CG2-O 3.38Å; I335-K354 HydrophobicContact CG2-CB 4.26Å; W337-K354 HydrophobicContact CE3-CD 4.46Å; W337-K354 HydrophobicContact CE3-CG 3.83Å; W337-K354 HydrophobicContact CH2-CD 3.54Å; W337-K354 HydrophobicContact CH2-CG 3.84Å; W337-K354 HydrophobicContact CZ2-CD 4.34Å; W337-K354 HydrophobicContact CZ3-CD 3.62Å; W337-K354 HydrophobicContact CZ3-CG 3.37Å; K354-Y356 HydrophobicContact CB-CE2 4.41Å; K354-I426 VanDerWaalsContact CE-CD1 3.47Å
355	I	97.1	Very high	92	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	109.7	171.9	-57.2	171.6	0	0	0	108.2	E275 I276 V294 V303 I335 L336 L338 L353	E275-I355 CarbonylContact O-C 3.51Å; E275-I355 WeakPolarHBondContact O-CA 3.32Å; I276-I355 HydrophobicContact CG2-CB 4.45Å; I276-I355 HydrophobicContact CG2-CG1 3.9Å; V294-I355 HydrophobicContact CG2-CD1 4.16Å; V294-I355 HydrophobicContact CG2-CG2 3.98Å; V303-I355 HydrophobicContact CG2-CD1 3.96Å; I335-I355 CarbonylContact C-O 3.5Å; I335-I355 VanDerWaalsContact CA-O 3.32Å; I335-I355 WeakPolarHBondContact CA-O 3.42Å; L336-I355 HydrophobicContact CB-CB 4.28Å; L336-I355 HydrophobicContact CD2-CD1 4.27Å; L336-I355 PolarHBondContact N-O 3.35Å; L336-I355 PolarHBondContact O-N 3.07Å; L338-I355 HydrophobicContact CD1-CD1 3.66Å; L338-I355 HydrophobicContact CG-CD1 4.19Å; L353-I355 HydrophobicContact CD2-CD1 4.2Å; L353-I355 HydrophobicContact CD2-CG1 4.11Å; L353-I355 HydrophobicContact CG-CG1 4.17Å
356	Y	96.3	Very high	92.8	Very high	30 Å²	30	29 Å²	29	12%	0.118	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	120	176.4	-54.2	-82.7	0	0	0	109.2	G274 E275 D277 R289 H334 I335 K354	G274-Y356 CarbonylContact C-O 3.59Å; G274-Y356 VanDerWaalsContact CA-O 3.25Å; G274-Y356 WeakPolarHBondContact CA-O 3.41Å; E275-Y356 PolarHBondContact N-O 3.1Å; E275-Y356 WeakPolarHBondContact O-CD2 3.46Å; E275-Y356 PolarHBondContact O-N 3.45Å; D277-Y356 WeakPolarHBondContact OD2-CE2 3.47Å; D277-Y356 PolarHBondContact OD2-OH 3.05Å; R289-Y356 HydrophobicContact CG-CD2 4.4Å; R289-Y356 HydrophobicContact CG-CE2 4.46Å; R289-Y356 VanDerWaalsContact NH2-CE1 3.29Å; H334-Y356 WeakPolarHBondContact O-CA 3.44Å; I335-Y356 HydrophobicContact CD1-CD1 4.06Å; I335-Y356 HydrophobicContact CD1-CE1 3.87Å; I335-Y356 HydrophobicContact CG1-CD1 3.7Å; I335-Y356 HydrophobicContact CG1-CE1 4.02Å; K354-Y356 HydrophobicContact CB-CE2 4.41Å
357	S	96.4	Very high	93.6	Very high	9 Å²	9	26.4 Å²	26.4	6%	0.063	15%	0.145	C	C	.	.			trans	-169.7	131.1	178.6	179.9	0	0	0	0	111.7	C273 H334 Q359 A360	C273-S357 VanDerWaalsContact O-CB 3.25Å; C273-S357 WeakPolarHBondContact O-CB 3.35Å; C273-S357 PolarHBondContact O-OG 3.11Å; H334-S357 WeakPolarHBondContact CB-O 3.25Å; H334-S357 PolarHBondContact O-N 2.99Å; S357-Q359 PolarHBondContact O-N 2.93Å; S357-Q359 VanDerWaalsContact O-N 3.11Å; S357-Q359 WeakPolarHBondContact OG-CB 3.44Å; S357-Q359 PolarHBondContact OG-N 2.86Å; S357-A360 VanDerWaalsContact O-CB 3.27Å; S357-A360 WeakPolarHBondContact O-CB 3.02Å; S357-A360 PolarHBondContact O-N 3.04Å
358	K	95.7	Very high	94.2	Very high	58 Å²	58	27 Å²	27	25%	0.252	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-15.7	166.2	-86.4	179.6	172.6	156.7	0	114.1	T111 D112 A360	T111-K358 VanDerWaalsContact C-CD 3.43Å; T111-K358 WeakPolarHBondContact O-CD 3.33Å; T111-K358 PolarHBondContact O-NZ 3.47Å; D112-K358 WeakPolarHBondContact OD1-CD 3.3Å; D112-K358 WeakPolarHBondContact OD1-CE 3.24Å; D112-K358 IonicContact OD1-NZ 2.72Å; D112-K358 PolarHBondContact OD1-NZ 3.03Å; K358-A360 VanDerWaalsContact C-N 3.26Å; K358-A360 PolarHBondContact O-N 3.44Å
359	Q	97.1	Very high	94.7	Very high	10 Å²	10	28.4 Å²	28.4	5%	0.047	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.6	4	176.1	-53.8	174.2	6	0	0	112.4	F110 F272 S357 E361 L362 M363	F110-Q359 HydrophobicContact CB-CG 4.37Å; F110-Q359 WeakPolarHBondContact O-CG 3.07Å; F110-Q359 PolarHBondContact O-NE2 3.21Å; F272-Q359 VanDerWaalsContact CA-OE1 3.28Å; F272-Q359 VanDerWaalsContact CB-OE1 3.27Å; F272-Q359 HydrophobicContact CD1-CB 4.07Å; S357-Q359 PolarHBondContact O-N 2.93Å; S357-Q359 VanDerWaalsContact O-N 3.11Å; S357-Q359 WeakPolarHBondContact OG-CB 3.44Å; S357-Q359 PolarHBondContact OG-N 2.86Å; Q359-E361 VanDerWaalsContact C-N 3.29Å; Q359-E361 PolarHBondContact O-N 2.91Å; Q359-L362 WeakPolarHBondContact O-CA 3.31Å; Q359-L362 WeakPolarHBondContact O-CB 3.38Å; Q359-L362 PolarHBondContact O-N 2.87Å; Q359-M363 HydrophobicContact CB-CE 4.45Å; Q359-M363 WeakPolarHBondContact O-CG 3.41Å; Q359-M363 PolarHBondContact O-N 2.87Å
360	A	97.1	Very high	95.1	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-55.7	-38.2	-176.9	0	0	0	0	0	114.1	H324 H334 L336 S357 K358 M363 S364	H324-A360 HydrophobicContact CB-CB 4.24Å; H334-A360 HydrophobicContact CB-CB 4.32Å; L336-A360 HydrophobicContact CB-CB 4.13Å; S357-A360 VanDerWaalsContact O-CB 3.27Å; S357-A360 WeakPolarHBondContact O-CB 3.02Å; S357-A360 PolarHBondContact O-N 3.04Å; K358-A360 VanDerWaalsContact C-N 3.26Å; K358-A360 PolarHBondContact O-N 3.44Å; A360-M363 HydrophobicContact CB-CE 4.35Å; A360-M363 PolarHBondContact O-N 2.64Å; A360-S364 VanDerWaalsContact O-CB 3.3Å; A360-S364 WeakPolarHBondContact O-CB 3.38Å; A360-S364 PolarHBondContact O-N 3.46Å
361	E	95.5	Very high	95.3	Very high	56 Å²	56	29.5 Å²	29.5	26%	0.262	15%	0.15	S	C	.	.	H	α-helix	trans	-65.2	-42.2	174.7	-178.8	176.2	-144.8	0	0	111.7	R109 R326 Q359 S364 G365	R109-E361 IonicContact CZ-OE2 3.9Å; R109-E361 IonicContact NE-OE2 2.7Å; R109-E361 IonicContact NH2-OE1 3.83Å; R109-E361 IonicContact NH2-OE2 3.25Å; R109-E361 PolarHBondContact NH2-OE2 2.91Å; R326-E361 IonicContact CZ-OE1 3.74Å; R326-E361 IonicContact NH2-OE1 2.8Å; R326-E361 PolarHBondContact NH2-OE1 2.8Å; R326-E361 IonicContact NH2-OE2 2.88Å; Q359-E361 VanDerWaalsContact C-N 3.29Å; Q359-E361 PolarHBondContact O-N 2.91Å; E361-S364 PolarHBondContact O-N 3.07Å; E361-G365 PolarHBondContact O-N 3.35Å
362	L	96.5	Very high	95.5	Very high	46 Å²	46	33.4 Å²	33.4	24%	0.241	17%	0.169	C	C	.	.	H	α-helix	trans	-63.6	-46.5	176.3	-64.9	177.9	0	0	0	110.9	L88 F110 F272 Q359 G365 F366	L88-L362 HydrophobicContact CD2-CD1 3.95Å; F110-L362 HydrophobicContact CB-CD1 4.15Å; F110-L362 HydrophobicContact CD1-CD1 3.61Å; F110-L362 HydrophobicContact CD1-CD2 4.36Å; F110-L362 HydrophobicContact CD1-CG 3.7Å; F110-L362 HydrophobicContact CD2-CD1 4.01Å; F110-L362 HydrophobicContact CE1-CD1 3.92Å; F110-L362 HydrophobicContact CE1-CD2 3.78Å; F110-L362 HydrophobicContact CE1-CG 3.56Å; F110-L362 HydrophobicContact CE2-CD1 4.29Å; F110-L362 HydrophobicContact CE2-CD2 4.23Å; F110-L362 HydrophobicContact CG-CD1 3.66Å; F110-L362 HydrophobicContact CG-CG 4.25Å; F110-L362 HydrophobicContact CZ-CD1 4.24Å; F110-L362 HydrophobicContact CZ-CD2 3.7Å; F110-L362 HydrophobicContact CZ-CG 3.98Å; F272-L362 HydrophobicContact CE1-CB 4.04Å; Q359-L362 WeakPolarHBondContact O-CA 3.31Å; Q359-L362 WeakPolarHBondContact O-CB 3.38Å; Q359-L362 PolarHBondContact O-N 2.87Å; L362-G365 PolarHBondContact O-N 2.85Å; L362-F366 VanDerWaalsContact O-CB 3.32Å; L362-F366 WeakPolarHBondContact O-CB 3.45Å; L362-F366 PolarHBondContact O-N 2.97Å
363	M	98.2	Very high	95.4	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-60.1	-48.7	177.4	-68.9	-172.4	-74.4	0	0	111.1	F272 V294 I296 L336 Q359 A360 G365 F366 I367	F272-M363 HydrophobicContact CB-CG 3.83Å; F272-M363 HydrophobicContact CB-SD 3.62Å; F272-M363 HydrophobicContact CD1-CG 3.81Å; F272-M363 HydrophobicContact CD2-CG 3.74Å; F272-M363 HydrophobicContact CD2-SD 4.34Å; F272-M363 HydrophobicContact CE1-CG 4.32Å; F272-M363 HydrophobicContact CE2-CG 4.26Å; F272-M363 HydrophobicContact CG-CG 3.5Å; F272-M363 VanDerWaalsContact CG-CG 3.5Å; F272-M363 HydrophobicContact CG-SD 3.99Å; V294-M363 HydrophobicContact CB-SD 3.91Å; V294-M363 HydrophobicContact CG1-SD 3.86Å; V294-M363 HydrophobicContact CG2-SD 4.18Å; I296-M363 HydrophobicContact CD1-CB 3.8Å; I296-M363 HydrophobicContact CD1-CG 3.89Å; L336-M363 HydrophobicContact CB-CE 3.99Å; L336-M363 HydrophobicContact CD1-CB 4.49Å; L336-M363 HydrophobicContact CD2-CB 3.94Å; L336-M363 HydrophobicContact CD2-CE 3.97Å; L336-M363 HydrophobicContact CD2-SD 3.85Å; Q359-M363 HydrophobicContact CB-CE 4.45Å; Q359-M363 WeakPolarHBondContact O-CG 3.41Å; Q359-M363 PolarHBondContact O-N 2.87Å; A360-M363 HydrophobicContact CB-CE 4.35Å; A360-M363 PolarHBondContact O-N 2.64Å; M363-G365 PolarHBondContact O-N 2.98Å; M363-F366 WeakPolarHBondContact O-CB 3.06Å; M363-F366 PolarHBondContact O-N 2.54Å; M363-I367 VanDerWaalsContact O-CG1 3.26Å; M363-I367 WeakPolarHBondContact O-CG1 3.11Å; M363-I367 PolarHBondContact O-N 2.96Å
364	S	96.8	Very high	94.9	Very high	13 Å²	13	38.4 Å²	38.4	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-59.9	-47.6	179.8	-175.9	0	0	0	0	112.3	W322 A360 E361 F366 I367 E368	W322-S364 PolarHBondContact NE1-O 2.78Å; W322-S364 PolarHBondContact NE1-OG 2.88Å; A360-S364 VanDerWaalsContact O-CB 3.3Å; A360-S364 WeakPolarHBondContact O-CB 3.38Å; A360-S364 PolarHBondContact O-N 3.46Å; E361-S364 PolarHBondContact O-N 3.07Å; S364-F366 VanDerWaalsContact C-N 3.29Å; S364-F366 PolarHBondContact O-N 2.96Å; S364-I367 PolarHBondContact O-N 2.93Å; S364-E368 WeakPolarHBondContact O-CB 3.01Å; S364-E368 PolarHBondContact O-N 3.05Å
365	G	96.3	Very high	94.3	Very high	36 Å²	36	38.9 Å²	38.9	37%	0.371	20%	0.204	S	C	.	.	H	α-helix	trans	-66.1	-30.2	177.1	0	0	0	0	0	113.3	E361 L362 M363 F369	E361-G365 PolarHBondContact O-N 3.35Å; L362-G365 PolarHBondContact O-N 2.85Å; M363-G365 PolarHBondContact O-N 2.98Å; G365-F369 WeakPolarHBondContact O-CB 3.49Å; G365-F369 PolarHBondContact O-N 3.3Å
366	F	96.9	Very high	93.5	Very high	28 Å²	28	43.3 Å²	43.3	12%	0.123	23%	0.232	C	C	.	.	H	α-helix	trans	-67.4	-51.1	173.4	-158.5	-54	0	0	0	111	V131 F132 A270 F272 I296 L362 M363 S364 E368 F369 C370	V131-F366 HydrophobicContact CB-CZ 4.04Å; V131-F366 HydrophobicContact CG1-CE1 4.35Å; V131-F366 HydrophobicContact CG1-CE2 4.11Å; V131-F366 HydrophobicContact CG1-CZ 3.41Å; V131-F366 VanDerWaalsContact CG1-CZ 3.41Å; V131-F366 HydrophobicContact CG2-CE1 4.19Å; V131-F366 HydrophobicContact CG2-CE2 4.48Å; V131-F366 HydrophobicContact CG2-CZ 3.52Å; F132-F366 HydrophobicContact CD1-CE1 4.39Å; F132-F366 HydrophobicContact CE1-CD1 4.17Å; F132-F366 AromaticContact CE1-CE1 3.42Å; F132-F366 HydrophobicContact CE1-CE1 3.42Å; F132-F366 VanDerWaalsContact CE1-CE1 3.42Å; F132-F366 AromaticContact CE1-CZ 3.68Å; F132-F366 HydrophobicContact CE1-CZ 3.68Å; F132-F366 HydrophobicContact CZ-CD1 4.47Å; F132-F366 AromaticContact CZ-CE1 3.83Å; F132-F366 HydrophobicContact CZ-CE1 3.83Å; F132-F366 HydrophobicContact CZ-CE2 4.21Å; F132-F366 AromaticContact CZ-CZ 3.69Å; F132-F366 HydrophobicContact CZ-CZ 3.69Å; A270-F366 HydrophobicContact CB-CD2 4.36Å; A270-F366 HydrophobicContact CB-CE2 3.5Å; A270-F366 VanDerWaalsContact CB-CE2 3.5Å; A270-F366 HydrophobicContact CB-CZ 3.84Å; F272-F366 HydrophobicContact CE2-CD2 4.18Å; F272-F366 AromaticContact CZ-CD2 3.8Å; F272-F366 HydrophobicContact CZ-CD2 3.8Å; F272-F366 HydrophobicContact CZ-CE2 4.35Å; I296-F366 HydrophobicContact CB-CD1 4.4Å; I296-F366 HydrophobicContact CG2-CD1 3.67Å; I296-F366 HydrophobicContact CG2-CE1 4.08Å; I296-F366 HydrophobicContact CG2-CG 4.25Å; L362-F366 VanDerWaalsContact O-CB 3.32Å; L362-F366 WeakPolarHBondContact O-CB 3.45Å; L362-F366 PolarHBondContact O-N 2.97Å; M363-F366 WeakPolarHBondContact O-CB 3.06Å; M363-F366 PolarHBondContact O-N 2.54Å; S364-F366 VanDerWaalsContact C-N 3.29Å; S364-F366 PolarHBondContact O-N 2.96Å; F366-E368 PolarHBondContact O-N 3.38Å; F366-F369 PolarHBondContact O-N 3.26Å; F366-C370 VanDerWaalsContact CD1-SG 3.57Å; F366-C370 WeakPolarHBondContact CE1-SG 3.5Å; F366-C370 PolarHBondContact O-N 3.19Å
367	I	96.8	Very high	92.1	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-43.4	178.6	-61.3	164.9	0	0	0	109.6	I296 V301 F317 W322 L336 M363 S364 F369 C370 V371	I296-I367 HydrophobicContact CD1-CD1 4.29Å; I296-I367 HydrophobicContact CD1-CG1 3.99Å; I296-I367 HydrophobicContact CG2-CG1 4.09Å; V301-I367 HydrophobicContact CG2-CD1 3.76Å; V301-I367 HydrophobicContact CG2-CG1 3.88Å; F317-I367 HydrophobicContact CD1-CG2 3.86Å; F317-I367 HydrophobicContact CE1-CB 4.39Å; F317-I367 HydrophobicContact CE1-CG1 4.45Å; F317-I367 HydrophobicContact CE1-CG2 3.6Å; W322-I367 HydrophobicContact CD2-CB 4.23Å; W322-I367 HydrophobicContact CD2-CG2 3.49Å; W322-I367 VanDerWaalsContact CD2-CG2 3.49Å; W322-I367 HydrophobicContact CE3-CG2 3.72Å; W322-I367 HydrophobicContact CG-CD1 4.15Å; W322-I367 HydrophobicContact CG-CG2 4.18Å; W322-I367 HydrophobicContact CH2-CB 4.46Å; W322-I367 HydrophobicContact CH2-CG2 3.49Å; W322-I367 VanDerWaalsContact CH2-CG2 3.49Å; W322-I367 HydrophobicContact CZ2-CB 3.75Å; W322-I367 HydrophobicContact CZ2-CG2 3.22Å; W322-I367 HydrophobicContact CZ3-CG2 3.73Å; L336-I367 HydrophobicContact CD1-CD1 4.42Å; M363-I367 VanDerWaalsContact O-CG1 3.26Å; M363-I367 WeakPolarHBondContact O-CG1 3.11Å; M363-I367 PolarHBondContact O-N 2.96Å; S364-I367 PolarHBondContact O-N 2.93Å; I367-F369 PolarHBondContact O-N 2.92Å; I367-C370 PolarHBondContact O-N 3.11Å; I367-V371 WeakPolarHBondContact O-CG2 2.94Å; I367-V371 PolarHBondContact O-N 3.08Å
368	E	95.4	Very high	90.3	Very high	83 Å²	83	52.5 Å²	52.5	39%	0.388	29%	0.285	S	S	.	.	H	α-helix	trans	-57.9	-49.9	176.2	178.4	158.4	-117.1	0	0	112.1	W322 S364 F366 C370 V371 E372 R406	W322-E368 HydrophobicContact CZ2-CB 4.13Å; S364-E368 WeakPolarHBondContact O-CB 3.01Å; S364-E368 PolarHBondContact O-N 3.05Å; F366-E368 PolarHBondContact O-N 3.38Å; E368-C370 VanDerWaalsContact C-N 3.34Å; E368-C370 PolarHBondContact O-N 3.19Å; E368-V371 PolarHBondContact O-N 2.66Å; E368-E372 WeakPolarHBondContact O-CG 3.43Å; E368-E372 PolarHBondContact O-N 3.29Å; E368-R406 IonicContact OE1-NH2 2.67Å; E368-R406 PolarHBondContact OE1-NH2 3.34Å
369	F	94.3	Very high	88	Confident	93 Å²	93	51.7 Å²	51.7	41%	0.408	29%	0.293	S	S	.	.	H	α-helix	trans	-60.8	-40.9	177.5	-178.2	-99.2	0	0	0	112.8	F132 G365 F366 I367 E372 L373	F132-F369 AromaticContact CD1-CD1 3.99Å; F132-F369 HydrophobicContact CD1-CD1 3.99Å; F132-F369 AromaticContact CD1-CE1 3.73Å; F132-F369 HydrophobicContact CD1-CE1 3.73Å; F132-F369 HydrophobicContact CD2-CE1 4.16Å; F132-F369 AromaticContact CE1-CD1 3.36Å; F132-F369 HydrophobicContact CE1-CD1 3.36Å; F132-F369 AromaticContact CE1-CE1 3.52Å; F132-F369 HydrophobicContact CE1-CE1 3.52Å; F132-F369 HydrophobicContact CE2-CD1 4.33Å; F132-F369 AromaticContact CE2-CE1 3.96Å; F132-F369 HydrophobicContact CE2-CE1 3.96Å; F132-F369 HydrophobicContact CG-CE1 4.06Å; F132-F369 AromaticContact CZ-CD1 3.56Å; F132-F369 HydrophobicContact CZ-CD1 3.56Å; F132-F369 AromaticContact CZ-CE1 3.64Å; F132-F369 HydrophobicContact CZ-CE1 3.64Å; G365-F369 WeakPolarHBondContact O-CB 3.49Å; G365-F369 PolarHBondContact O-N 3.3Å; F366-F369 PolarHBondContact O-N 3.26Å; I367-F369 PolarHBondContact O-N 2.92Å; F369-E372 PolarHBondContact O-N 3.28Å; F369-L373 HydrophobicContact CE1-CD2 4.43Å; F369-L373 WeakPolarHBondContact O-CB 3.37Å; F369-L373 PolarHBondContact O-N 3.49Å
370	C	94.3	Very high	85.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-45.8	176.1	-75.6	0	0	0	0	112.1	C297 F317 F366 I367 E368 L373 M374	C297-C370 PolarHBondContact O-SG 2.83Å; C297-C370 VanDerWaalsContact O-SG 3.36Å; F317-C370 HydrophobicContact CD2-CB 4.42Å; F317-C370 HydrophobicContact CE2-CB 3.42Å; F317-C370 VanDerWaalsContact CE2-CB 3.42Å; F317-C370 HydrophobicContact CZ-CB 3.51Å; F366-C370 VanDerWaalsContact CD1-SG 3.57Å; F366-C370 WeakPolarHBondContact CE1-SG 3.5Å; F366-C370 PolarHBondContact O-N 3.19Å; I367-C370 PolarHBondContact O-N 3.11Å; E368-C370 VanDerWaalsContact C-N 3.34Å; E368-C370 PolarHBondContact O-N 3.19Å; C370-L373 PolarHBondContact O-N 3.21Å; C370-M374 VanDerWaalsContact O-CG 3.31Å; C370-M374 WeakPolarHBondContact O-CG 3.49Å; C370-M374 PolarHBondContact O-N 3.36Å
371	V	91.8	Very high	82.7	Confident	46 Å²	46	58.6 Å²	58.6	28%	0.279	36%	0.357	S	S	.	.	H	α-helix	trans	-64.8	-42.1	179.7	170.3	0	0	0	0	111.3	F317 W322 I367 E368 M374 S375	F317-V371 HydrophobicContact CB-CG2 3.8Å; F317-V371 HydrophobicContact CD1-CG2 3.97Å; F317-V371 HydrophobicContact CD2-CG2 4.03Å; F317-V371 HydrophobicContact CG-CG2 3.66Å; W322-V371 HydrophobicContact CH2-CB 4.16Å; W322-V371 HydrophobicContact CH2-CG2 3.66Å; W322-V371 HydrophobicContact CZ3-CG2 4.13Å; I367-V371 WeakPolarHBondContact O-CG2 2.94Å; I367-V371 PolarHBondContact O-N 3.08Å; E368-V371 PolarHBondContact O-N 2.66Å; V371-M374 PolarHBondContact O-N 3.2Å; V371-S375 PolarHBondContact O-N 2.81Å
372	E	92.2	Very high	79.8	Confident	104 Å²	104	59.7 Å²	59.7	49%	0.486	38%	0.376	S	S	.	.	H	α-helix	trans	-60	-47.7	174.2	-73.1	179	177.7	0	0	111.3	E368 F369 M374 S375 T376	E368-E372 WeakPolarHBondContact O-CG 3.43Å; E368-E372 PolarHBondContact O-N 3.29Å; F369-E372 PolarHBondContact O-N 3.28Å; E372-M374 VanDerWaalsContact C-N 3.34Å; E372-M374 PolarHBondContact O-N 3.17Å; E372-S375 PolarHBondContact O-N 3.29Å; E372-S375 PolarHBondContact O-OG 2.85Å; E372-T376 WeakPolarHBondContact O-CG2 3.23Å; E372-T376 PolarHBondContact O-N 3.24Å; E372-T376 VanDerWaalsContact O-N 3.11Å
373	L	89.5	Confident	76.9	Confident	64 Å²	64	64.4 Å²	64.4	34%	0.335	40%	0.401	S	S	.	.	H	α-helix	trans	-59.2	-44.5	180	-171.7	67.3	0	0	0	111.8	L298 F369 C370 T376 S377	L298-L373 HydrophobicContact CD2-CD2 3.78Å; F369-L373 HydrophobicContact CE1-CD2 4.43Å; F369-L373 WeakPolarHBondContact O-CB 3.37Å; F369-L373 PolarHBondContact O-N 3.49Å; C370-L373 PolarHBondContact O-N 3.21Å; L373-T376 PolarHBondContact O-N 3.47Å; L373-T376 PolarHBondContact O-OG1 3.44Å; L373-S377 PolarHBondContact O-N 3.23Å
374	M	83.9	Confident	73.5	Confident	72 Å²	72	73 Å²	73	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-64.4	-42.3	178.1	-67.5	-63.1	-77.1	0	0	112	C370 V371 E372 T376 S377 E378	C370-M374 VanDerWaalsContact O-CG 3.31Å; C370-M374 WeakPolarHBondContact O-CG 3.49Å; C370-M374 PolarHBondContact O-N 3.36Å; V371-M374 PolarHBondContact O-N 3.2Å; E372-M374 VanDerWaalsContact C-N 3.34Å; E372-M374 PolarHBondContact O-N 3.17Å; M374-T376 VanDerWaalsContact C-N 3.32Å; M374-T376 PolarHBondContact O-N 2.91Å; M374-S377 PolarHBondContact O-N 3.37Å; M374-E378 PolarHBondContact O-N 3.42Å; M374-E378 VanDerWaalsContact O-N 3.12Å
375	S	83	Confident	70.5	Confident	68 Å²	68	79 Å²	79	48%	0.476	48%	0.48	S	S	.	.	H	α-helix	trans	-62.5	-36.3	178.5	72.7	0	0	0	0	113.2	V371 E372 G379	V371-S375 PolarHBondContact O-N 2.81Å; E372-S375 PolarHBondContact O-N 3.29Å; E372-S375 PolarHBondContact O-OG 2.85Å; S375-G379 PolarHBondContact O-N 2.92Å
376	T	78.8	Confident	67.3	Low	94 Å²	94	80.3 Å²	80.3	58%	0.577	49%	0.494	S	S	*	.	H	α-helix	trans	-71.3	-32.8	176.8	61.2	0	0	0	0	112.8	E372 L373 M374 G380	E372-T376 WeakPolarHBondContact O-CG2 3.23Å; E372-T376 PolarHBondContact O-N 3.24Å; E372-T376 VanDerWaalsContact O-N 3.11Å; L373-T376 PolarHBondContact O-N 3.47Å; L373-T376 PolarHBondContact O-OG1 3.44Å; M374-T376 VanDerWaalsContact C-N 3.32Å; M374-T376 PolarHBondContact O-N 2.91Å; T376-G380 PolarHBondContact O-N 3.42Å
377	S	68.3	Low	64	Low	90 Å²	90	85.5 Å²	85.5	63%	0.629	53%	0.528	S	S	*	.	H	α-helix	trans	-70.5	-35.6	176.7	-170.7	0	0	0	0	112.3	L373 M374	L373-S377 PolarHBondContact O-N 3.23Å; M374-S377 PolarHBondContact O-N 3.37Å
378	E	58.6	Low	60.8	Low	142 Å²	142	91.4 Å²	91.4	66%	0.664	57%	0.566	S	S	*	*	H	α-helix	trans	-78.6	-37.8	177.9	-68.1	-180	168.5	0	0	112.1	M374 G380 A381	M374-E378 PolarHBondContact O-N 3.42Å; M374-E378 VanDerWaalsContact O-N 3.12Å; E378-G380 VanDerWaalsContact C-N 3.31Å; E378-G380 PolarHBondContact O-N 3.29Å; E378-A381 PolarHBondContact O-N 3.31Å
379	G	47.8	Very low	57.7	Low	41 Å²	41	96.7 Å²	96.7	42%	0.423	59%	0.591	S	S	.	*	H	α-helix	trans	-68.7	-24.6	176.7	0	0	0	0	0	114.5	S375 A381	S375-G379 PolarHBondContact O-N 2.92Å; G379-A381 VanDerWaalsContact C-N 3.31Å; G379-A381 PolarHBondContact O-N 2.73Å
380	G	42.2	Very low	54.5	Low	62 Å²	62	101.1 Å²	101.1	64%	0.639	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-19.9	175.5	0	0	0	0	0	114.5	T376 E378	T376-G380 PolarHBondContact O-N 3.42Å; E378-G380 VanDerWaalsContact C-N 3.31Å; E378-G380 PolarHBondContact O-N 3.29Å
381	A	39.2	Very low	51.4	Low	92 Å²	92	107.1 Å²	107.1	76%	0.76	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-8.3	178.4	0	0	0	0	0	113.5	E378 G379	E378-A381 PolarHBondContact O-N 3.31Å; G379-A381 VanDerWaalsContact C-N 3.31Å; G379-A381 PolarHBondContact O-N 2.73Å
382	A	36	Very low	48.5	Very low	79 Å²	79	109.4 Å²	109.4	65%	0.653	68%	0.676	S	S	*	*	S	Bend	trans	-102.7	1.6	-174.4	0	0	0	0	0	114.9	E384	A382-E384 PolarHBondContact O-N 3.31Å
383	N	33.9	Very low	45.5	Very low	145 Å²	145	116.5 Å²	116.5	78%	0.775	70%	0.698	S	S	*	*			trans	-100	81.9	-179	-77.9	-21	0	0	0	112
384	E	28.7	Very low	42.7	Very low	181 Å²	181	122.4 Å²	122.4	85%	0.846	72%	0.724	S	S	*	*			trans	-77.6	143.4	146.2	-75.8	-153	153.9	0	0	109.6	A382 G386	A382-E384 PolarHBondContact O-N 3.31Å; E384-G386 PolarHBondContact O-N 2.78Å
385	P	33.7	Very low	40	Very low	138 Å²	138	128.3 Å²	128.3	90%	0.896	75%	0.751	S	S	*	*			trans	-79.6	112.1	-174.3	30.3	-30.8	0	0	0	111
386	G	27.4	Very low	37.5	Very low	65 Å²	65	130.3 Å²	130.3	67%	0.67	77%	0.771	S	S	*	*			trans	-162.4	105.3	175.8	0	0	0	0	0	115.4	E384	E384-G386 PolarHBondContact O-N 2.78Å
387	V	28.9	Very low	35.1	Very low	136 Å²	136	129.1 Å²	129.1	82%	0.824	78%	0.777	S	S	*	*			trans	84.3	122.3	159.2	-164.1	0	0	0	0	117.4
388	P	29.5	Very low	33.5	Very low	125 Å²	125	131.8 Å²	131.8	81%	0.812	79%	0.79	S	S	*	*			trans	-80.4	126.8	176.8	31	-27.8	0	0	0	111
389	Q	29.4	Very low	32.2	Very low	193 Å²	193	136.4 Å²	136.4	90%	0.902	80%	0.802	S	S	*	*			trans	-104.9	128.9	165.9	-96.5	-178.5	-13.2	0	0	110.6
390	E	27.5	Very low	31.5	Very low	187 Å²	187	143.1 Å²	143.1	87%	0.874	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-62.4	153.6	179.7	-75.3	-176.8	144	0	0	113.5	A392	E390-A392 PolarHBondContact O-N 2.98Å
391	P	30.2	Very low	31	Very low	125 Å²	125	143.3 Å²	143.3	81%	0.812	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-81.8	117.2	-171.4	31.8	-31.8	0	0	0	111.9
392	A	29.6	Very low	30.9	Very low	95 Å²	95	151.9 Å²	151.9	79%	0.785	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-74.7	128.2	164.8	0	0	0	0	0	110.3	E390 Q394	E390-A392 PolarHBondContact O-N 2.98Å; A392-Q394 PolarHBondContact O-N 3.47Å
393	R	28.6	Very low	30.9	Very low	252 Å²	252	151 Å²	151	95%	0.951	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-51.8	123.1	-179	-70.4	173.9	168.1	-179.5	-4.4	112.5
394	Q	31.1	Very low	30.8	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-90.3	121.2	163.7	-79.7	178.2	-10.9	0	0	109.8	A392 A396	A392-Q394 PolarHBondContact O-N 3.47Å; Q394-A396 PolarHBondContact O-N 3.48Å
395	E	28.1	Very low	31.2	Very low	196 Å²	196	150.8 Å²	150.8	92%	0.916	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-70	122.3	165.6	-75	-176.2	154.8	0	0	109.7	G397	E395-G397 PolarHBondContact O-N 2.87Å; E395-G397 VanDerWaalsContact O-N 3.14Å
396	A	31	Very low	31.9	Very low	109 Å²	109	149.2 Å²	149.2	90%	0.901	82%	0.82	S	S	*	*			trans	-75.6	97.1	176.4	0	0	0	0	0	110.1	Q394	Q394-A396 PolarHBondContact O-N 3.48Å
397	G	27.6	Very low	32.8	Very low	69 Å²	69	149.2 Å²	149.2	71%	0.711	82%	0.82	S	S	*	*			trans	-98.4	100.4	164.8	0	0	0	0	0	110.5	E395 R399	E395-G397 PolarHBondContact O-N 2.87Å; E395-G397 VanDerWaalsContact O-N 3.14Å; G397-R399 PolarHBondContact O-N 2.86Å; G397-R399 VanDerWaalsContact O-N 3.12Å
398	T	35.1	Very low	33.5	Very low	147 Å²	147	151.3 Å²	151.3	90%	0.902	82%	0.822	S	S	*	*			trans	-54.9	109.7	170.2	28.3	0	0	0	0	111.4
399	R	31	Very low	34.4	Very low	238 Å²	238	146.8 Å²	146.8	90%	0.898	79%	0.791	S	S	*	*			trans	-132.9	105.4	160.1	-83.6	-174.3	173.1	176.5	-1.9	109.9	G397 G401	G397-R399 PolarHBondContact O-N 2.86Å; G397-R399 VanDerWaalsContact O-N 3.12Å; R399-G401 PolarHBondContact O-N 2.82Å
400	N	33.6	Very low	35.3	Very low	182 Å²	182	144.6 Å²	144.6	97%	0.973	78%	0.781	S	S	*	*			trans	-64	113.2	160.7	-77.9	-24.8	0	0	0	108.3
401	G	30.4	Very low	36.6	Very low	66 Å²	66	143.4 Å²	143.4	68%	0.68	77%	0.768	S	S	*	*			trans	174	90.7	176.5	0	0	0	0	0	108.6	R399 G403	R399-G401 PolarHBondContact O-N 2.82Å; G401-G403 PolarHBondContact O-N 3.26Å
402	R	37.8	Very low	37.7	Very low	272 Å²	272	140.9 Å²	140.9	100%	1.026	75%	0.746	S	S	*	*			trans	-68.7	86.8	170.2	-73.6	-179.4	177.9	176.5	-1.2	108.1
403	G	36.3	Very low	38.5	Very low	60 Å²	60	140.7 Å²	140.7	62%	0.619	75%	0.753	S	S	*	*			trans	-157.1	76.6	173.8	0	0	0	0	0	106.1	G401 R405	G401-G403 PolarHBondContact O-N 3.26Å; G403-R405 PolarHBondContact O-N 2.96Å; G403-R405 VanDerWaalsContact O-N 3.09Å
404	G	32.2	Very low	39.6	Very low	70 Å²	70	131.7 Å²	131.7	72%	0.722	73%	0.729	S	S	*	*			trans	-58.4	115.6	177.2	0	0	0	0	0	108.4	R406	G404-R406 VanDerWaalsContact C-N 3.34Å; G404-R406 PolarHBondContact O-N 3.5Å
405	R	37.2	Very low	40.7	Very low	252 Å²	252	124.7 Å²	124.7	95%	0.951	70%	0.699	S	S	*	*			trans	-56.7	98.7	170.1	-85	176.8	163.6	179.2	-7	108.2	G403	G403-R405 PolarHBondContact O-N 2.96Å; G403-R405 VanDerWaalsContact O-N 3.09Å
406	R	48.2	Very low	42	Very low	106 Å²	106	117.3 Å²	117.3	40%	0.4	67%	0.667	S	S	.	*	P	Polyproline II helix	trans	-74.3	143.6	168.4	-73.6	-172.5	175	124.9	3.8	108.9	E368 G404	E368-R406 IonicContact OE1-NH2 2.67Å; E368-R406 PolarHBondContact OE1-NH2 3.34Å; G404-R406 VanDerWaalsContact C-N 3.34Å; G404-R406 PolarHBondContact O-N 3.5Å
407	G	45	Very low	43.2	Very low	65 Å²	65	114.6 Å²	114.6	67%	0.67	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-55.9	152.1	-174.4	0	0	0	0	0	112.6	L409	G407-L409 PolarHBondContact O-N 2.82Å
408	M	43.8	Very low	44.7	Very low	179 Å²	179	116 Å²	116	88%	0.882	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-53.7	130.8	175	-154.6	167.6	81.6	0	0	109.4	Q410	M408-Q410 PolarHBondContact O-N 2.95Å
409	L	47.8	Very low	46.3	Very low	30 Å²	30	114 Å²	114	16%	0.157	62%	0.616	C	S	.	*			trans	-47	116	173.7	-84.8	159.7	0	0	0	108.7	S321 E339 G407 R411	S321-L409 WeakPolarHBondContact OG-CG 3.49Å; E339-L409 HydrophobicContact CB-CD1 4.38Å; E339-L409 HydrophobicContact CG-CD1 3.69Å; G407-L409 PolarHBondContact O-N 2.82Å; L409-R411 PolarHBondContact O-N 3.43Å
410	Q	49.2	Very low	48.3	Very low	147 Å²	147	103.8 Å²	103.8	69%	0.687	58%	0.58	S	S	*	*			trans	-78.6	123.8	170.2	-71.7	-167.2	-8.2	0	0	106.8	M408 Q412	M408-Q410 PolarHBondContact O-N 2.95Å; Q410-Q412 WeakPolarHBondContact O-CG 3.32Å; Q410-Q412 PolarHBondContact O-N 3.3Å
411	R	55.6	Low	50.1	Low	162 Å²	162	102.5 Å²	102.5	61%	0.611	57%	0.568	S	S	*	*			trans	-58.2	114.5	-178.8	-71.6	-172.2	175.4	-161.4	-3.2	110.2	D341 P348 L409	D341-R411 VanDerWaalsContact OD2-CA 3.25Å; D341-R411 WeakPolarHBondContact OD2-CA 2.82Å; P348-R411 VanDerWaalsContact CB-NH1 3.29Å; L409-R411 PolarHBondContact O-N 3.43Å
412	Q	52.7	Low	52.4	Low	73 Å²	73	101 Å²	101	34%	0.341	55%	0.546	S	S	.	.			trans	-124.5	132.4	-178.4	-73.1	-174	18.4	0	0	111	S318 D341 Q410 S414	S318-Q412 PolarHBondContact OG-OE1 2.86Å; S318-Q412 VanDerWaalsContact OG-OE1 3.13Å; D341-Q412 PolarHBondContact OD2-N 2.91Å; Q410-Q412 WeakPolarHBondContact O-CG 3.32Å; Q410-Q412 PolarHBondContact O-N 3.3Å; Q412-S414 PolarHBondContact O-N 2.71Å; Q412-S414 VanDerWaalsContact O-N 3.11Å
413	G	45.6	Very low	54.6	Low	90 Å²	90	88.5 Å²	88.5	93%	0.928	50%	0.5	S	S	*	.	S	Bend	trans	-84.8	74	-179.2	0	0	0	0	0	112
414	S	51.5	Low	57	Low	64 Å²	64	88.7 Å²	88.7	45%	0.448	49%	0.487	S	S	.	.			trans	-175.4	139.1	148.2	-150.7	0	0	0	0	109.5	Q412	Q412-S414 PolarHBondContact O-N 2.71Å; Q412-S414 VanDerWaalsContact O-N 3.11Å
415	V	55.6	Low	59.6	Low	42 Å²	42	86.6 Å²	86.6	26%	0.255	46%	0.46	S	S	.	.			trans	-112.2	127.2	159.1	170.5	0	0	0	0	104.5	L313 G314 L315 F340 C417 V420	L313-V415 HydrophobicContact CD1-CG1 3.65Å; G314-V415 WeakPolarHBondContact O-CG1 3.33Å; L315-V415 HydrophobicContact CD2-CB 4.5Å; L315-V415 HydrophobicContact CD2-CG1 3.93Å; L315-V415 HydrophobicContact CD2-CG2 4.04Å; F340-V415 HydrophobicContact CD2-CG2 4.37Å; V415-C417 PolarHBondContact O-N 3.07Å; V415-V420 HydrophobicContact CG1-CG2 4.15Å
416	V	55	Low	62	Low	41 Å²	41	76.1 Å²	76.1	25%	0.248	42%	0.423	C	S	.	.	S	Bend	trans	-70.4	97.7	177.5	-179	0	0	0	0	108.2	P265 G314 R316	P265-V416 HydrophobicContact CB-CG1 4.02Å; P265-V416 HydrophobicContact CG-CG1 3.65Å; G314-V416 CarbonylContact C-O 3.59Å; G314-V416 WeakPolarHBondContact CA-O 3.25Å; G314-V416 PolarHBondContact N-O 2.79Å; G314-V416 PolarHBondContact O-N 3.12Å; G314-V416 VanDerWaalsContact O-O 3.12Å; R316-V416 HydrophobicContact CG-CG2 4.41Å
417	C	56.6	Low	63.8	Low	52 Å²	52	71.2 Å²	71.2	35%	0.351	41%	0.405	S	S	.	.	S	Bend	trans	92.7	134.6	178.8	-157.2	0	0	0	0	117.1	V311 V415	V311-C417 HydrophobicContact CG1-CB 4.05Å; V415-C417 PolarHBondContact O-N 3.07Å
418	S	58.2	Low	65.7	Low	99 Å²	99	69.5 Å²	69.5	69%	0.692	38%	0.378	S	S	*	.	S	Bend	trans	-104.5	20.3	-143.8	50.6	0	0	0	0	115.8
419	R	69	Low	67.5	Low	104 Å²	104	62.3 Å²	62.3	39%	0.392	34%	0.344	S	S	.	.			trans	-102.1	21.6	-176.9	-62.6	-172.7	-176.5	-168.4	3.5	114.1	H310 H421 S422	H310-R419 PolarHBondContact CD2-NH1 3.31Å; H310-R419 PolarHBondContact CE1-NH1 3.36Å; H310-R419 VanDerWaalsContact CE1-NH1 3.29Å; H310-R419 PolarHBondContact ND1-NH1 3.08Å; H310-R419 PolarHBondContact NE2-NH1 3.06Å; H310-R419 VanDerWaalsContact NE2-NH1 3.2Å; R419-H421 PolarHBondContact O-N 3.16Å; R419-H421 VanDerWaalsContact O-N 3.08Å; R419-S422 WeakPolarHBondContact O-CB 3.49Å; R419-S422 PolarHBondContact O-N 2.66Å; R419-S422 PolarHBondContact O-OG 3.19Å
420	V	73.3	Confident	68.7	Low	23 Å²	23	64.4 Å²	64.4	14%	0.139	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-52.6	-34.1	177.1	-178.6	0	0	0	0	111.8	L313 F340 K351 V415 S422 L423	L313-V420 HydrophobicContact CD1-CG2 4.11Å; F340-V420 HydrophobicContact CE2-CG1 3.8Å; F340-V420 HydrophobicContact CE2-CG2 4.25Å; F340-V420 HydrophobicContact CZ-CG1 4.17Å; K351-V420 HydrophobicContact CD-CG1 3.64Å; V415-V420 HydrophobicContact CG1-CG2 4.15Å; V420-S422 PolarHBondContact O-N 3.11Å; V420-L423 WeakPolarHBondContact O-CB 3.45Å; V420-L423 PolarHBondContact O-N 3.5Å; V420-L423 VanDerWaalsContact O-N 3.11Å
421	H	72.1	Confident	69.6	Low	156 Å²	156	63 Å²	63	72%	0.722	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-64.1	-17.3	176.3	68.4	74.5	0	0	0	114.4	R419	R419-H421 PolarHBondContact O-N 3.16Å; R419-H421 VanDerWaalsContact O-N 3.08Å
422	S	77.4	Confident	69.9	Low	33 Å²	33	58.7 Å²	58.7	23%	0.231	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-90.8	-5.5	177.5	75.3	0	0	0	0	113.1	P279 R419 V420	P279-S422 WeakPolarHBondContact CG-O 3.49Å; R419-S422 WeakPolarHBondContact O-CB 3.49Å; R419-S422 PolarHBondContact O-N 2.66Å; R419-S422 PolarHBondContact O-OG 3.19Å; V420-S422 PolarHBondContact O-N 3.11Å
423	L	84.8	Confident	69.8	Low	11 Å²	11	65 Å²	65	6%	0.058	39%	0.385	C	S	.	.	S	Bend	trans	-92.5	141.1	-179	-60.3	176.7	0	0	0	111	I276 L312 L313 V420 T425	I276-L423 HydrophobicContact CD1-CD2 3.56Å; L312-L423 HydrophobicContact CB-CD2 4.03Å; L312-L423 HydrophobicContact CD1-CD2 4.49Å; L313-L423 HydrophobicContact CB-CD1 4.07Å; L313-L423 HydrophobicContact CD1-CD1 4.49Å; L313-L423 HydrophobicContact CD2-CD1 4.23Å; V420-L423 WeakPolarHBondContact O-CB 3.45Å; V420-L423 PolarHBondContact O-N 3.5Å; V420-L423 VanDerWaalsContact O-N 3.11Å; L423-T425 HydrophobicContact CB-CG2 3.88Å; L423-T425 PolarHBondContact O-N 3.12Å
424	N	86.8	Confident	70.6	Confident	64 Å²	64	66.1 Å²	66.1	34%	0.342	37%	0.366	S	S	.	.			trans	-81.1	102.9	165.3	-167.3	-5.7	0	0	0	108.4	D277 K278	D277-N424 HydrophobicContact CB-CB 4Å; D277-N424 VanDerWaalsContact O-CB 3.25Å; D277-N424 WeakPolarHBondContact O-CB 3.46Å; K278-N424 PolarHBondContact O-ND2 2.71Å
425	T	87.1	Confident	71.8	Confident	26 Å²	26	68.4 Å²	68.4	16%	0.16	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	155.1	-178.7	50.7	0	0	0	0	110.2	F340 K351 L352 L353 L423	F340-T425 HydrophobicContact CZ-CG2 4.29Å; K351-T425 HydrophobicContact CB-CG2 4.48Å; L352-T425 WeakPolarHBondContact O-CA 3.41Å; L353-T425 HydrophobicContact CB-CG2 4.34Å; L353-T425 HydrophobicContact CD1-CG2 4.31Å; L423-T425 HydrophobicContact CB-CG2 3.88Å; L423-T425 PolarHBondContact O-N 3.12Å
426	I	86.6	Confident	72.7	Confident	32 Å²	32	71.4 Å²	71.4	16%	0.164	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	118.1	168.2	-59.9	169.5	0	0	0	107.5	L352 K354 R437	L352-I426 HydrophobicContact CB-CB 4.22Å; L352-I426 PolarHBondContact N-O 2.88Å; L352-I426 PolarHBondContact O-N 3.31Å; K354-I426 VanDerWaalsContact CE-CD1 3.47Å; I426-R437 HydrophobicContact CG2-CG 4.2Å
427	S	86.5	Confident	73.7	Confident	3 Å²	3	78 Å²	78	2%	0.021	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.9	175.7	-55.5	0	0	0	0	111.1	E344 N350 L438	E344-S427 WeakPolarHBondContact OE1-CB 3.06Å; E344-S427 PolarHBondContact OE1-OG 3.21Å; N350-S427 WeakPolarHBondContact O-CA 3.43Å; S427-L438 PolarHBondContact O-N 2.71Å
428	Y	83.9	Confident	74.4	Confident	28 Å²	28	78.4 Å²	78.4	11%	0.11	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.5	173.4	62.3	-88.1	0	0	0	112.1	E339 N350 L352 D430 I435 K436	E339-Y428 PolarHBondContact OE1-OH 2.94Å; N350-Y428 HydrophobicContact CB-CD1 4.32Å; N350-Y428 HydrophobicContact CB-CD2 4.01Å; N350-Y428 HydrophobicContact CB-CE1 4Å; N350-Y428 HydrophobicContact CB-CE2 3.64Å; N350-Y428 HydrophobicContact CB-CG 4.36Å; N350-Y428 PolarHBondContact N-O 2.89Å; N350-Y428 PolarHBondContact O-N 3.13Å; L352-Y428 HydrophobicContact CB-CE1 4.17Å; Y428-D430 HydrophobicContact CD2-CB 4.43Å; Y428-D430 HydrophobicContact CE2-CB 4.34Å; Y428-I435 HydrophobicContact CD2-CG2 3.65Å; Y428-I435 HydrophobicContact CE2-CG2 4.26Å; Y428-I435 HydrophobicContact CG-CG2 3.97Å; Y428-K436 CarbonylContact C-O 3.56Å; Y428-K436 WeakPolarHBondContact CA-O 3.46Å; Y428-K436 WeakPolarHBondContact CB-O 3.07Å
429	V	83	Confident	74.6	Confident	29 Å²	29	82.5 Å²	82.5	18%	0.176	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	125.2	170.4	-177.1	0	0	0	0	107.7	V349 N431 K436 L438	V349-V429 HydrophobicContact CG1-CG2 4.1Å; V429-N431 WeakPolarHBondContact CG1-OD1 3.18Å; V429-K436 PolarHBondContact N-O 3.15Å; V429-K436 PolarHBondContact O-N 3.01Å; V429-L438 HydrophobicContact CG2-CD1 3.97Å; V429-L438 HydrophobicContact CG2-CG 4.44Å
430	D	72.6	Confident	74	Confident	73 Å²	73	82.6 Å²	82.6	39%	0.39	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	113.2	169	-173.4	0.2	0	0	0	109.4	Y428 G432 I435	Y428-D430 HydrophobicContact CD2-CB 4.43Å; Y428-D430 HydrophobicContact CE2-CB 4.34Å; D430-G432 WeakPolarHBondContact OD1-CA 3.36Å; D430-G432 PolarHBondContact OD1-N 2.99Å; D430-I435 HydrophobicContact CB-CG1 4.42Å
431	N	67.4	Low	72.8	Confident	119 Å²	119	89.5 Å²	89.5	64%	0.636	45%	0.448	S	S	*	.			trans	-97.4	14.8	177.4	-69.9	-19.8	0	0	0	112.4	V429 K433	V429-N431 WeakPolarHBondContact CG1-OD1 3.18Å; N431-K433 PolarHBondContact O-N 3.02Å; N431-K433 VanDerWaalsContact O-N 3.16Å
432	G	61.8	Low	71.4	Confident	70 Å²	70	93.4 Å²	93.4	72%	0.722	46%	0.456	S	S	*	.	S	Bend	trans	72.6	-1.2	-176.2	0	0	0	0	0	114.7	D430	D430-G432 WeakPolarHBondContact OD1-CA 3.36Å; D430-G432 PolarHBondContact OD1-N 2.99Å
433	K	50.1	Low	69.4	Low	207 Å²	207	96.4 Å²	96.4	90%	0.9	48%	0.483	S	S	*	.	S	Bend	trans	-123.1	-28.9	176.9	-67.6	-175.3	179.1	180	0	113.4	N431	N431-K433 PolarHBondContact O-N 3.02Å; N431-K433 VanDerWaalsContact O-N 3.16Å
434	E	64.4	Low	66.9	Low	113 Å²	113	100.2 Å²	100.2	53%	0.528	52%	0.516	S	S	.	.			trans	-158	137.2	-175.6	-167.3	-175.5	169.7	0	0	109.4	K436	E434-K436 HydrophobicContact CG-CG 4.24Å; E434-K436 WeakPolarHBondContact OE1-CE 3.4Å; E434-K436 WeakPolarHBondContact OE2-CE 3.42Å; E434-K436 IonicContact OE2-NZ 3.96Å; E434-K436 PolarHBondContact OE2-NZ 3.16Å
435	I	75.1	Confident	64.3	Low	111 Å²	111	100.7 Å²	100.7	57%	0.569	52%	0.524	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	112.7	172.3	-63.2	174	0	0	0	108	Y428 D430	Y428-I435 HydrophobicContact CD2-CG2 3.65Å; Y428-I435 HydrophobicContact CE2-CG2 4.26Å; Y428-I435 HydrophobicContact CG-CG2 3.97Å; D430-I435 HydrophobicContact CB-CG1 4.42Å
436	K	74.4	Confident	62	Low	106 Å²	106	109.4 Å²	109.4	46%	0.461	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106	109.9	178.3	-68.8	-173.8	-178.7	179.7	0	110.7	Y428 V429 E434 L438	Y428-K436 CarbonylContact C-O 3.56Å; Y428-K436 WeakPolarHBondContact CA-O 3.46Å; Y428-K436 WeakPolarHBondContact CB-O 3.07Å; V429-K436 PolarHBondContact N-O 3.15Å; V429-K436 PolarHBondContact O-N 3.01Å; E434-K436 HydrophobicContact CG-CG 4.24Å; E434-K436 WeakPolarHBondContact OE1-CE 3.4Å; E434-K436 WeakPolarHBondContact OE2-CE 3.42Å; E434-K436 IonicContact OE2-NZ 3.96Å; E434-K436 PolarHBondContact OE2-NZ 3.16Å; K436-L438 PolarHBondContact O-N 3.49Å
437	R	77.1	Confident	59.6	Low	178 Å²	178	117 Å²	117	67%	0.672	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-68	125.4	172	-174.3	176.3	-179.7	177.5	3.4	110.1	I426	I426-R437 HydrophobicContact CG2-CG 4.2Å
438	L	71	Confident	57.2	Low	61 Å²	61	122.5 Å²	122.5	32%	0.319	63%	0.626	S	S	.	*	P	Polyproline II helix	trans	-84.6	129.2	171.8	-65.8	174.6	0	0	0	108.8	E344 V349 S427 V429 K436	E344-L438 WeakPolarHBondContact OE2-CB 3.48Å; V349-L438 HydrophobicContact CG1-CD1 3.38Å; S427-L438 PolarHBondContact O-N 2.71Å; V429-L438 HydrophobicContact CG2-CD1 3.97Å; V429-L438 HydrophobicContact CG2-CG 4.44Å; K436-L438 PolarHBondContact O-N 3.49Å
439	K	63.2	Low	54.8	Low	186 Å²	186	132.8 Å²	132.8	81%	0.809	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-81.9	130	169.9	-71.3	-176.8	179.3	176.4	0	107.1	K441	K439-K441 PolarHBondContact O-N 3.1Å; K439-K441 VanDerWaalsContact O-N 3.13Å
440	P	54.9	Low	52.6	Low	106 Å²	106	140.5 Å²	140.5	69%	0.688	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-57.2	124.3	173.8	21.8	-30.5	0	0	0	108.3	R442	P440-R442 PolarHBondContact O-N 2.97Å; P440-R442 VanDerWaalsContact O-N 3.15Å
441	K	48.5	Very low	50.6	Low	167 Å²	167	141.8 Å²	141.8	73%	0.726	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-59.7	123	171.9	-78.5	178.1	-170.8	151.1	0	106.8	D345 K439 A443	D345-K441 IonicContact OD2-NZ 3.73Å; D345-K441 PolarHBondContact OD2-NZ 3.45Å; D345-K441 VanDerWaalsContact OD2-NZ 3.07Å; K439-K441 PolarHBondContact O-N 3.1Å; K439-K441 VanDerWaalsContact O-N 3.13Å; K441-A443 PolarHBondContact O-N 3.41Å; K441-A443 VanDerWaalsContact O-N 3.16Å
442	R	43.7	Very low	49.3	Very low	239 Å²	239	142.8 Å²	142.8	90%	0.902	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-52.5	127.5	166.8	-75.6	-177.1	-179.1	179.7	0.6	106.4	P440 A444	P440-R442 PolarHBondContact O-N 2.97Å; P440-R442 VanDerWaalsContact O-N 3.15Å; R442-A444 PolarHBondContact O-N 3.12Å
443	A	35.1	Very low	47.8	Very low	95 Å²	95	143.8 Å²	143.8	79%	0.785	73%	0.732	S	S	*	*			trans	-44.1	121.5	166.3	0	0	0	0	0	106.7	K441 S445	K441-A443 PolarHBondContact O-N 3.41Å; K441-A443 VanDerWaalsContact O-N 3.16Å; A443-S445 PolarHBondContact O-N 2.88Å
444	A	31.4	Very low	47.3	Very low	91 Å²	91	139.4 Å²	139.4	75%	0.752	72%	0.724	S	S	*	*			trans	-51.5	113.1	-176.6	0	0	0	0	0	107.1	R442 F446	R442-A444 PolarHBondContact O-N 3.12Å; A444-F446 PolarHBondContact O-N 3.39Å; A444-F446 VanDerWaalsContact O-N 3.12Å
445	S	31.7	Very low	45.7	Very low	74 Å²	74	139.5 Å²	139.5	52%	0.517	73%	0.733	S	S	.	*			trans	-54.1	123.2	173.2	176.1	0	0	0	0	106.6	A443 F447 T448	A443-S445 PolarHBondContact O-N 2.88Å; S445-F447 PolarHBondContact O-N 3.2Å; S445-F447 PolarHBondContact OG-N 3.43Å; S445-T448 PolarHBondContact O-N 2.86Å
446	F	40.3	Very low	43.4	Very low	209 Å²	209	144.7 Å²	144.7	92%	0.917	75%	0.747	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	-6.2	174	-94.7	-93.5	0	0	0	112.9	A444	A444-F446 PolarHBondContact O-N 3.39Å; A444-F446 VanDerWaalsContact O-N 3.12Å
447	F	35.8	Very low	41.2	Very low	192 Å²	192	144.8 Å²	144.8	84%	0.842	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	10.8	177.9	-73.3	-78.7	0	0	0	115.6	S445	S445-F447 PolarHBondContact O-N 3.2Å; S445-F447 PolarHBondContact OG-N 3.43Å
448	T	35.2	Very low	39	Very low	119 Å²	119	141 Å²	141	73%	0.73	77%	0.768	S	S	*	*			trans	-118.1	66.2	174.7	-32.7	0	0	0	0	112	S445	S445-T448 PolarHBondContact O-N 2.86Å
449	R	34.1	Very low	37.1	Very low	243 Å²	243	144.7 Å²	144.7	92%	0.917	79%	0.793	S	S	*	*			trans	-124.3	78.6	151.6	-101.1	-167.8	178.7	-166.6	1.2	109.3
450	Q	37.2	Very low	35.4	Very low	191 Å²	191	143 Å²	143	89%	0.893	79%	0.793	S	S	*	*			trans	-128.7	90.4	141.9	-88.1	-174.8	-19.9	0	0	106.2
451	A	31.1	Very low	34.4	Very low	100 Å²	100	144.2 Å²	144.2	83%	0.826	80%	0.798	S	S	*	*			trans	-105.4	105	161.9	0	0	0	0	0	106.2
452	T	38.8	Very low	33.5	Very low	140 Å²	140	144.7 Å²	144.7	86%	0.859	80%	0.803	S	S	*	*			trans	-64.1	148.4	162.9	36.5	0	0	0	0	110.9
453	A	30.8	Very low	32.9	Very low	92 Å²	92	137.9 Å²	137.9	76%	0.76	79%	0.792	S	S	*	*			trans	176.1	165.6	143	0	0	0	0	0	111
454	P	40	Very low	32.7	Very low	114 Å²	114	140.3 Å²	140.3	74%	0.74	79%	0.791	S	S	*	*				-144.6	168	-60.8	44.7	-27.2	0	0	0	116
455	T	29.6	Very low	32.7	Very low	115 Å²	115	143 Å²	143	71%	0.706	79%	0.788	S	S	*	*			trans	72.6	139.1	146.3	-27.6	0	0	0	0	125.7
456	Y	27	Very low	32.7	Very low	220 Å²	220	148 Å²	148	86%	0.863	80%	0.803	S	S	*	*			trans	105.4	127.2	161.1	-75.5	-85.9	0	0	0	113.9
457	S	29.7	Very low	32.5	Very low	109 Å²	109	145.4 Å²	145.4	76%	0.762	84%	0.835	S	S	*	*			cis	-156.1	154.2	28.6	41.6	0	0	0	0	112.3
458	A	30.1	Very low	32.3	Very low	98 Å²	98	143.1 Å²	143.1	81%	0.81	84%	0.835	S	S	*	*			trans	-68.5	142.2	174.5	0	0	0	0	0	113.4
459	V	30.4	Very low	32.1	Very low	139 Å²	139	144.3 Å²	144.3	84%	0.842	84%	0.84	S	S	*	*			trans	-151.1	123.9	145.6	-176.2	0	0	0	0	110.3
460	N	28	Very low	32	Very low	151 Å²	151	138.8 Å²	138.8	81%	0.807	84%	0.836	S	S	*	*			trans	17.9	131.4	157.9	-81	-8	0	0	0	123.4
461	T	34.7	Very low	31.7	Very low	130 Å²	130	135.8 Å²	135.8	80%	0.798	83%	0.833	S	S	*	*			trans	-70.2	139	146.4	45.4	0	0	0	0	112.1
462	E	29.7	Very low	31.8	Very low	178 Å²	178	138 Å²	138	83%	0.832	83%	0.833	S	S	*	*			trans	-172.7	116.1	142.7	-103.8	-178.6	171.1	0	0	107.5
463	S	30.5	Very low	31.3	Very low	96 Å²	96	137.9 Å²	137.9	67%	0.671	83%	0.831	S	S	*	*				100.1	110.2	102.4	-72.4	0	0	0	0	111.4
464	L	30.8	Very low	31.3	Very low	145 Å²	145	141.1 Å²	141.1	76%	0.759	84%	0.837	S	S	*	*				80	125	109.4	-104.2	89.3	0	0	0	115.6
465	E	31.6	Very low	30.7	Very low	147 Å²	147	143.2 Å²	143.2	69%	0.687	84%	0.844	S	S	*	*			trans	72.3	123.4	139.4	-68.9	-164.9	143.7	0	0	122.7
466	Q	32.4	Very low	30.8	Very low	179 Å²	179	145.6 Å²	145.6	84%	0.836	86%	0.855	S	S	*	*			trans	70.7	127.4	136.2	-65.4	-179.4	16.4	0	0	120.2
467	G	34.6	Very low	31.1	Very low	155 Å²	155	138.8 Å²	138.8	100%	1.598	86%	0.855	S	S	*	*			trans	157.8	0	171.9	0	0	0	0	0	110.8

Retrieved 467 of 467 residues in 286.2 ms (Link to these results)

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