A0A077ZB75_TRITR Loading...

CDC50 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZB75, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 375 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	44	Very low	51.4	Low	248 Å²	248	156.4 Å²	156.4	100%	1.222	82%	0.817	S	S	*	*				0	130.7	0	-79	174.1	-179.5	0	0	108.2
2	V	42.9	Very low	53.5	Low	147 Å²	147	156.6 Å²	156.6	89%	0.891	80%	0.801	S	S	*	*			trans	-75.2	147.2	-167.6	173.7	0	0	0	0	111.8
3	K	43.8	Very low	55.5	Low	204 Å²	204	147.9 Å²	147.9	89%	0.887	76%	0.763	S	S	*	*			trans	-32	142.3	175.7	-71.9	174.2	171	178.9	0	116.3
4	G	46.4	Very low	57.5	Low	76 Å²	76	147.9 Å²	147.9	78%	0.784	75%	0.754	S	S	*	*			trans	-157.5	66.6	157.6	0	0	0	0	0	110.6	Y6	G4-Y6 PolarHBondContact O-N 3Å
5	E	50.2	Low	59.5	Low	178 Å²	178	148.1 Å²	148.1	83%	0.832	75%	0.749	S	S	*	*			trans	-63.2	103.4	163	-90.5	-177.7	142.6	0	0	107.9	Q7	E5-Q7 VanDerWaalsContact C-N 3.28Å; E5-Q7 PolarHBondContact O-N 2.93Å
6	Y	45.7	Very low	60.8	Low	211 Å²	211	151.4 Å²	151.4	83%	0.827	75%	0.749	S	S	*	*			trans	-72.6	85.6	175	-155.9	-96.9	0	0	0	108.4	G4 V8	G4-Y6 PolarHBondContact O-N 3Å; Y6-V8 VanDerWaalsContact C-N 3.32Å; Y6-V8 HydrophobicContact CD1-CG2 3.61Å; Y6-V8 HydrophobicContact CE1-CG2 3.93Å; Y6-V8 PolarHBondContact O-N 2.93Å
7	Q	48.8	Very low	62.4	Low	161 Å²	161	147.6 Å²	147.6	75%	0.752	73%	0.729	S	S	*	*			trans	-66.7	91.9	168.9	-79.6	-75.1	-20.2	0	0	108.4	E5 S9	E5-Q7 VanDerWaalsContact C-N 3.28Å; E5-Q7 PolarHBondContact O-N 2.93Å; Q7-S9 PolarHBondContact O-N 3.49Å
8	V	59.3	Low	63.7	Low	101 Å²	101	149.6 Å²	149.6	61%	0.612	74%	0.736	S	S	*	*			trans	-65.3	88.1	165.5	-177.1	0	0	0	0	107	Y6 K10	Y6-V8 VanDerWaalsContact C-N 3.32Å; Y6-V8 HydrophobicContact CD1-CG2 3.61Å; Y6-V8 HydrophobicContact CE1-CG2 3.93Å; Y6-V8 PolarHBondContact O-N 2.93Å; V8-K10 PolarHBondContact O-N 2.81Å
9	S	54.8	Low	65	Low	101 Å²	101	148.7 Å²	148.7	71%	0.706	73%	0.728	S	S	*	*			trans	-62.9	87.4	168.6	170.6	0	0	0	0	107.9	Q7 T11	Q7-S9 PolarHBondContact O-N 3.49Å; S9-T11 PolarHBondContact O-N 2.88Å
10	K	63.4	Low	66.2	Low	178 Å²	178	146.4 Å²	146.4	77%	0.774	72%	0.718	S	S	*	*			trans	-56.7	103.1	169.4	-85.1	-178.9	176.9	174.1	0	106.9	V8 Y12	V8-K10 PolarHBondContact O-N 2.81Å; K10-Y12 PolarHBondContact O-N 2.77Å
11	T	66.5	Low	67.3	Low	115 Å²	115	149.8 Å²	149.8	71%	0.706	73%	0.729	S	S	*	*			trans	-54.8	108.1	179.2	-32.8	0	0	0	0	108.2	S9 S13	S9-T11 PolarHBondContact O-N 2.88Å; T11-S13 PolarHBondContact O-N 2.91Å
12	Y	76.2	Confident	69.5	Low	159 Å²	159	141.6 Å²	141.6	62%	0.624	70%	0.701	S	S	*	*			trans	-70.9	100.9	-176.7	-170.2	-91.3	0	0	0	108.3	K10 Q17	K10-Y12 PolarHBondContact O-N 2.77Å; Y12-Q17 HydrophobicContact CD2-CG 4.1Å; Y12-Q17 HydrophobicContact CE2-CG 3.83Å
13	S	79.9	Confident	71.8	Confident	44 Å²	44	145.1 Å²	145.1	31%	0.308	70%	0.698	S	S	.	*			trans	-117.9	138	172.5	95.6	0	0	0	0	110.1	T11 F15 R16 Q17	T11-S13 PolarHBondContact O-N 2.91Å; S13-F15 PolarHBondContact O-N 3.1Å; S13-F15 VanDerWaalsContact O-N 3.12Å; S13-R16 PolarHBondContact O-N 2.97Å; S13-R16 PolarHBondContact OG-N 2.82Å; S13-Q17 WeakPolarHBondContact O-CG 3.49Å; S13-Q17 PolarHBondContact O-N 2.99Å; S13-Q17 VanDerWaalsContact O-N 3.16Å
14	K	83.3	Confident	73.9	Confident	147 Å²	147	143.5 Å²	143.5	64%	0.639	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.1	-30.3	178.1	-72.2	-175.6	179.4	178.5	0	112.3	Q18 K19 L20	K14-Q18 PolarHBondContact O-N 2.81Å; K14-K19 CarbonylContact O-C 3.59Å; K14-K19 PolarHBondContact O-N 3.16Å; K14-L20 HydrophobicContact CB-CD2 4.47Å; K14-L20 PolarHBondContact O-N 3.18Å
15	F	87.1	Confident	75.7	Confident	152 Å²	152	143.1 Å²	143.1	67%	0.667	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-50.9	174.3	-175.9	-95.9	0	0	0	112.2	S13 Q17 Q18 L20	S13-F15 PolarHBondContact O-N 3.1Å; S13-F15 VanDerWaalsContact O-N 3.12Å; F15-Q17 PolarHBondContact O-N 3.3Å; F15-Q18 PolarHBondContact O-N 3.23Å; F15-L20 HydrophobicContact CB-CD2 4.16Å; F15-L20 HydrophobicContact CD2-CD1 3.77Å; F15-L20 HydrophobicContact CD2-CD2 4.34Å; F15-L20 HydrophobicContact CD2-CG 4.44Å; F15-L20 HydrophobicContact CE2-CD1 4.34Å
16	R	81.1	Confident	77.5	Confident	201 Å²	201	141.4 Å²	141.4	76%	0.758	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-22.1	-178.5	-71.9	-169.9	177.9	-142.6	1.6	113.7	S13	S13-R16 PolarHBondContact O-N 2.97Å; S13-R16 PolarHBondContact OG-N 2.82Å
17	Q	87.8	Confident	79.4	Confident	86 Å²	86	138.2 Å²	138.2	40%	0.402	67%	0.669	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.4	4.6	177.8	-58.3	-59.5	-29	0	0	113.1	Y12 S13 F15 K19	Y12-Q17 HydrophobicContact CD2-CG 4.1Å; Y12-Q17 HydrophobicContact CE2-CG 3.83Å; S13-Q17 WeakPolarHBondContact O-CG 3.49Å; S13-Q17 PolarHBondContact O-N 2.99Å; S13-Q17 VanDerWaalsContact O-N 3.16Å; F15-Q17 PolarHBondContact O-N 3.3Å; Q17-K19 HydrophobicContact CB-CD 4.43Å; Q17-K19 HydrophobicContact CB-CG 4.3Å; Q17-K19 PolarHBondContact O-N 3.05Å; Q17-K19 VanDerWaalsContact O-N 3.12Å
18	Q	84.8	Confident	81.1	Confident	184 Å²	184	134.2 Å²	134.2	86%	0.86	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.3	29.4	-174.1	-59.8	-179	-10.6	0	0	113.5	K14 F15	K14-Q18 PolarHBondContact O-N 2.81Å; F15-Q18 PolarHBondContact O-N 3.23Å
19	K	88.3	Confident	82.3	Confident	132 Å²	132	131 Å²	131	57%	0.574	64%	0.639	S	S	*	*			trans	-105.8	35.7	177.5	-67.4	-177.6	-176.6	-179.9	0	111.3	K14 Q17	K14-K19 CarbonylContact O-C 3.59Å; K14-K19 PolarHBondContact O-N 3.16Å; Q17-K19 HydrophobicContact CB-CD 4.43Å; Q17-K19 HydrophobicContact CB-CG 4.3Å; Q17-K19 PolarHBondContact O-N 3.05Å; Q17-K19 VanDerWaalsContact O-N 3.12Å
20	L	89.5	Confident	83.5	Confident	102 Å²	102	128.8 Å²	128.8	53%	0.534	63%	0.633	S	S	.	*			trans	-64.4	147.9	171.5	-68.2	172.6	0	0	0	109.3	K14 F15 A22	K14-L20 HydrophobicContact CB-CD2 4.47Å; K14-L20 PolarHBondContact O-N 3.18Å; F15-L20 HydrophobicContact CB-CD2 4.16Å; F15-L20 HydrophobicContact CD2-CD1 3.77Å; F15-L20 HydrophobicContact CD2-CD2 4.34Å; F15-L20 HydrophobicContact CD2-CG 4.44Å; F15-L20 HydrophobicContact CE2-CD1 4.34Å; L20-A22 PolarHBondContact O-N 3.12Å
21	K	90.3	Very high	84.5	Confident	218 Å²	218	122.8 Å²	122.8	95%	0.948	61%	0.614	S	S	*	*			trans	-65.2	112.7	171.9	-168.8	178.6	-178.7	-176.9	0	107.2
22	A	89.4	Confident	85.6	Confident	76 Å²	76	119 Å²	119	63%	0.628	59%	0.59	S	S	*	*			trans	-120.8	148.3	177.7	0	0	0	0	0	109.3	L20	L20-A22 PolarHBondContact O-N 3.12Å
23	W	91.2	Very high	86.3	Confident	222 Å²	222	112.3 Å²	112.3	84%	0.841	57%	0.565	S	S	*	*			trans	-97.3	126.6	167.6	178.4	56.4	0	0	0	108.2	P25	W23-P25 HydrophobicContact CD2-CB 4.4Å; W23-P25 HydrophobicContact CD2-CG 4.21Å; W23-P25 HydrophobicContact CE3-CG 3.99Å; W23-P25 HydrophobicContact CH2-CB 3.79Å; W23-P25 HydrophobicContact CH2-CG 3.92Å; W23-P25 HydrophobicContact CZ2-CB 3.63Å; W23-P25 HydrophobicContact CZ2-CG 4.13Å; W23-P25 HydrophobicContact CZ3-CB 4.23Å; W23-P25 HydrophobicContact CZ3-CG 3.83Å; W23-P25 WeakPolarHBondContact O-CD 3.02Å
24	Q	87.9	Confident	87	Confident	169 Å²	169	113.9 Å²	113.9	79%	0.79	57%	0.574	S	S	*	*			trans	-118.7	82.7	-178.3	-67.8	-179.4	-42.3	0	0	108.9	I26	Q24-I26 PolarHBondContact O-N 2.86Å
25	P	85.4	Confident	87.5	Confident	68 Å²	68	110.5 Å²	110.5	44%	0.442	57%	0.566	S	S	.	*			trans	-67	115.7	178.9	25.1	-30.7	0	0	0	110.2	W23 L27	W23-P25 HydrophobicContact CD2-CB 4.4Å; W23-P25 HydrophobicContact CD2-CG 4.21Å; W23-P25 HydrophobicContact CE3-CG 3.99Å; W23-P25 HydrophobicContact CH2-CB 3.79Å; W23-P25 HydrophobicContact CH2-CG 3.92Å; W23-P25 HydrophobicContact CZ2-CB 3.63Å; W23-P25 HydrophobicContact CZ2-CG 4.13Å; W23-P25 HydrophobicContact CZ3-CB 4.23Å; W23-P25 HydrophobicContact CZ3-CG 3.83Å; W23-P25 WeakPolarHBondContact O-CD 3.02Å; P25-L27 PolarHBondContact O-N 3.5Å
26	I	86.2	Confident	87.8	Confident	143 Å²	143	105.9 Å²	105.9	73%	0.733	55%	0.546	S	S	*	.			trans	-86.9	108.5	170	-56.2	172.7	0	0	0	106.6	Q24 T28	Q24-I26 PolarHBondContact O-N 2.86Å; I26-T28 VanDerWaalsContact C-N 3.35Å; I26-T28 HydrophobicContact CG2-CG2 4.01Å; I26-T28 PolarHBondContact O-N 3.12Å
27	L	86.1	Confident	88.6	Confident	144 Å²	144	98.9 Å²	98.9	75%	0.754	52%	0.521	S	S	*	.			trans	-71.6	89.5	179.6	-66.4	172.8	0	0	0	109.5	P25 V32	P25-L27 PolarHBondContact O-N 3.5Å; L27-V32 HydrophobicContact CB-CG2 3.87Å; L27-V32 HydrophobicContact CD2-CG2 3.92Å; L27-V32 HydrophobicContact CG-CG2 4.44Å
28	T	85.7	Confident	89	Confident	76 Å²	76	100.4 Å²	100.4	47%	0.466	53%	0.531	S	S	.	.			trans	-92	157.7	173.5	63.9	0	0	0	0	110.4	I26 G30 S31 V32	I26-T28 VanDerWaalsContact C-N 3.35Å; I26-T28 HydrophobicContact CG2-CG2 4.01Å; I26-T28 PolarHBondContact O-N 3.12Å; T28-G30 PolarHBondContact O-N 2.93Å; T28-S31 PolarHBondContact N-OG 3.33Å; T28-S31 VanDerWaalsContact N-OG 3.11Å; T28-S31 PolarHBondContact O-N 3.11Å; T28-S31 PolarHBondContact O-OG 3.49Å; T28-S31 PolarHBondContact OG1-N 3.07Å; T28-S31 PolarHBondContact OG1-OG 3.17Å; T28-V32 WeakPolarHBondContact O-CG2 3.49Å; T28-V32 PolarHBondContact O-N 3.46Å
29	A	82.7	Confident	89.5	Confident	33 Å²	33	94.3 Å²	94.3	27%	0.273	50%	0.504	S	S	.	.	H	α-helix	trans	-52.4	-39	174.7	0	0	0	0	0	111.8	S31 V32 L33 H369	A29-S31 VanDerWaalsContact C-N 3.31Å; A29-S31 PolarHBondContact O-N 3.18Å; A29-V32 PolarHBondContact O-N 3.4Å; A29-L33 HydrophobicContact CB-CD1 4.08Å; A29-L33 VanDerWaalsContact O-CB 3.25Å; A29-L33 WeakPolarHBondContact O-CB 3.49Å; A29-L33 WeakPolarHBondContact O-CG 3.48Å; A29-L33 PolarHBondContact O-N 2.88Å; A29-H369 HydrophobicContact CB-CB 4.37Å
30	G	81.7	Confident	90	Very high	56 Å²	56	88 Å²	88	58%	0.577	48%	0.476	S	S	*	.	H	α-helix	trans	-62.7	-30.8	176.8	0	0	0	0	0	114.5	T28 P34	T28-G30 PolarHBondContact O-N 2.93Å; G30-P34 VanDerWaalsContact O-CD 3.24Å; G30-P34 WeakPolarHBondContact O-CD 3.27Å; G30-P34 WeakPolarHBondContact O-CG 3.21Å
31	S	84.7	Confident	90.3	Very high	52 Å²	52	87.8 Å²	87.8	36%	0.364	48%	0.479	S	S	.	.	H	α-helix	trans	-85.6	-36.1	173.5	60.8	0	0	0	0	113.6	T28 A29 T35	T28-S31 PolarHBondContact N-OG 3.33Å; T28-S31 VanDerWaalsContact N-OG 3.11Å; T28-S31 PolarHBondContact O-N 3.11Å; T28-S31 PolarHBondContact O-OG 3.49Å; T28-S31 PolarHBondContact OG1-N 3.07Å; T28-S31 PolarHBondContact OG1-OG 3.17Å; A29-S31 VanDerWaalsContact C-N 3.31Å; A29-S31 PolarHBondContact O-N 3.18Å; S31-T35 PolarHBondContact O-OG1 3.46Å
32	V	89.6	Confident	90.7	Very high	35 Å²	35	80.9 Å²	80.9	21%	0.212	46%	0.455	C	S	.	.	H	α-helix	trans	-85.4	-40.3	-168.8	173.6	0	0	0	0	111.9	L27 T28 A29 T35 F36	L27-V32 HydrophobicContact CB-CG2 3.87Å; L27-V32 HydrophobicContact CD2-CG2 3.92Å; L27-V32 HydrophobicContact CG-CG2 4.44Å; T28-V32 WeakPolarHBondContact O-CG2 3.49Å; T28-V32 PolarHBondContact O-N 3.46Å; A29-V32 PolarHBondContact O-N 3.4Å; V32-T35 WeakPolarHBondContact O-CB 3.34Å; V32-T35 PolarHBondContact O-N 3.45Å; V32-F36 HydrophobicContact CG1-CD2 3.57Å; V32-F36 HydrophobicContact CG1-CE2 3.38Å; V32-F36 WeakPolarHBondContact O-CD2 3.38Å; V32-F36 PolarHBondContact O-N 3.48Å; V32-F36 VanDerWaalsContact O-N 3.16Å
33	L	91	Very high	91.1	Very high	18 Å²	18	80.4 Å²	80.4	9%	0.094	44%	0.439	C	S	.	.	H	α-helix	trans	-58.5	-49.4	-178.6	-75.2	167.8	0	0	0	112.7	A29 T35 F36 F37 G362 F365 L366 H369	A29-L33 HydrophobicContact CB-CD1 4.08Å; A29-L33 VanDerWaalsContact O-CB 3.25Å; A29-L33 WeakPolarHBondContact O-CB 3.49Å; A29-L33 WeakPolarHBondContact O-CG 3.48Å; A29-L33 PolarHBondContact O-N 2.88Å; L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 2.96Å; L33-F36 PolarHBondContact O-N 2.8Å; L33-F37 VanDerWaalsContact O-CD2 3.26Å; L33-F37 WeakPolarHBondContact O-CD2 3.39Å; L33-F37 PolarHBondContact O-N 3.33Å; L33-G362 WeakPolarHBondContact CD2-O 3.23Å; L33-F365 HydrophobicContact CD2-CB 3.59Å; L33-L366 HydrophobicContact CD2-CB 4.07Å; L33-H369 HydrophobicContact CD1-CB 4.35Å
34	P	93.4	Very high	91.4	Very high	77 Å²	77	71.8 Å²	71.8	50%	0.5	41%	0.411	S	S	.	.	H	α-helix	trans	-60.5	-36.2	177.9	-23.2	35.1	0	0	0	112.5	G30 F37 L38	G30-P34 VanDerWaalsContact O-CD 3.24Å; G30-P34 WeakPolarHBondContact O-CD 3.27Å; G30-P34 WeakPolarHBondContact O-CG 3.21Å; P34-F37 PolarHBondContact O-N 2.83Å; P34-L38 VanDerWaalsContact O-CB 3.25Å; P34-L38 WeakPolarHBondContact O-CB 3.24Å; P34-L38 PolarHBondContact O-N 3.5Å
35	T	93.2	Very high	91.8	Very high	76 Å²	76	67.1 Å²	67.1	47%	0.466	40%	0.395	S	S	.	.	H	α-helix	trans	-63.7	-43.3	179	-50.8	0	0	0	0	112	S31 V32 L33 L38 I39	S31-T35 PolarHBondContact O-OG1 3.46Å; V32-T35 WeakPolarHBondContact O-CB 3.34Å; V32-T35 PolarHBondContact O-N 3.45Å; L33-T35 VanDerWaalsContact C-N 3.26Å; L33-T35 PolarHBondContact O-N 2.96Å; T35-L38 PolarHBondContact O-N 3.24Å; T35-I39 HydrophobicContact CG2-CD1 3.88Å; T35-I39 HydrophobicContact CG2-CG1 4.43Å; T35-I39 VanDerWaalsContact O-CG1 3.3Å; T35-I39 WeakPolarHBondContact O-CG1 3.25Å; T35-I39 PolarHBondContact O-N 3.36Å
36	F	95.1	Very high	92.3	Very high	55 Å²	55	66.7 Å²	66.7	24%	0.241	39%	0.391	C	S	.	.	H	α-helix	trans	-61.3	-46.6	177.4	-88	-75.6	0	0	0	112.4	V32 L33 G40 C358 M361 F365	V32-F36 HydrophobicContact CG1-CD2 3.57Å; V32-F36 HydrophobicContact CG1-CE2 3.38Å; V32-F36 WeakPolarHBondContact O-CD2 3.38Å; V32-F36 PolarHBondContact O-N 3.48Å; V32-F36 VanDerWaalsContact O-N 3.16Å; L33-F36 PolarHBondContact O-N 2.8Å; F36-G40 PolarHBondContact O-N 2.95Å; F36-C358 HydrophobicContact CD1-CB 4.09Å; F36-M361 HydrophobicContact CD1-CB 4.4Å; F36-M361 HydrophobicContact CE1-CB 4.3Å; F36-F365 HydrophobicContact CD2-CD2 4.4Å; F36-F365 HydrophobicContact CE2-CD2 4.14Å; F36-F365 AromaticContact CE2-CE2 3.89Å; F36-F365 HydrophobicContact CE2-CE2 3.89Å; F36-F365 HydrophobicContact CZ-CE2 4.14Å
37	F	96.4	Very high	92.7	Very high	55 Å²	55	59.9 Å²	59.9	24%	0.241	36%	0.356	C	S	.	.	H	α-helix	trans	-66.3	-39.7	177.6	-73.4	-68	0	0	0	112.1	L33 P34 G40 V41 I359 G362 L363 L366	L33-F37 VanDerWaalsContact O-CD2 3.26Å; L33-F37 WeakPolarHBondContact O-CD2 3.39Å; L33-F37 PolarHBondContact O-N 3.33Å; P34-F37 PolarHBondContact O-N 2.83Å; F37-G40 PolarHBondContact O-N 2.94Å; F37-V41 WeakPolarHBondContact O-CB 3.4Å; F37-V41 VanDerWaalsContact O-CG2 3.27Å; F37-V41 WeakPolarHBondContact O-CG2 3.32Å; F37-V41 PolarHBondContact O-N 3.33Å; F37-I359 HydrophobicContact CE1-CG2 4.32Å; F37-G362 VanDerWaalsContact CZ-C 3.46Å; F37-L363 HydrophobicContact CE1-CD2 4.06Å; F37-L363 HydrophobicContact CE1-CG 4.08Å; F37-L363 HydrophobicContact CZ-CD2 3.98Å; F37-L363 HydrophobicContact CZ-CG 4.16Å; F37-L366 HydrophobicContact CE2-CD1 4.26Å
38	L	96.4	Very high	93.1	Very high	117 Å²	117	56.3 Å²	56.3	61%	0.613	34%	0.34	S	S	*	.	H	α-helix	trans	-62.9	-48.3	178.1	-170.4	155.7	0	0	0	111.3	P34 T35 G40 V41 V42	P34-L38 VanDerWaalsContact O-CB 3.25Å; P34-L38 WeakPolarHBondContact O-CB 3.24Å; P34-L38 PolarHBondContact O-N 3.5Å; T35-L38 PolarHBondContact O-N 3.24Å; L38-G40 VanDerWaalsContact C-N 3.3Å; L38-G40 PolarHBondContact O-N 2.94Å; L38-V41 PolarHBondContact O-N 3.03Å; L38-V42 HydrophobicContact CD2-CG2 4.29Å; L38-V42 WeakPolarHBondContact O-CB 3.46Å; L38-V42 VanDerWaalsContact O-CG2 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.48Å; L38-V42 PolarHBondContact O-N 3.24Å
39	I	96.5	Very high	93.3	Very high	56 Å²	56	57.2 Å²	57.2	29%	0.287	35%	0.345	S	S	.	.	H	α-helix	trans	-58.1	-46.8	175.8	-68.2	168.8	0	0	0	109.9	T35 V42 F43 C358	T35-I39 HydrophobicContact CG2-CD1 3.88Å; T35-I39 HydrophobicContact CG2-CG1 4.43Å; T35-I39 VanDerWaalsContact O-CG1 3.3Å; T35-I39 WeakPolarHBondContact O-CG1 3.25Å; T35-I39 PolarHBondContact O-N 3.36Å; I39-V42 PolarHBondContact O-N 2.94Å; I39-F43 HydrophobicContact CG2-CD1 4.18Å; I39-F43 HydrophobicContact CG2-CD2 4.05Å; I39-F43 HydrophobicContact CG2-CE1 4.26Å; I39-F43 HydrophobicContact CG2-CE2 4.11Å; I39-F43 HydrophobicContact CG2-CG 4.09Å; I39-F43 HydrophobicContact CG2-CZ 4.22Å; I39-F43 VanDerWaalsContact O-CB 3.24Å; I39-F43 WeakPolarHBondContact O-CB 3.38Å; I39-F43 WeakPolarHBondContact O-CD1 3.26Å; I39-F43 WeakPolarHBondContact O-CG 3.25Å; I39-F43 PolarHBondContact O-N 2.91Å; I39-C358 HydrophobicContact CG2-CB 4.41Å
40	G	96.9	Very high	93.6	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-59.2	-51.4	179.3	0	0	0	0	0	114.1	F36 F37 L38 V42 F43 V44 G355	F36-G40 PolarHBondContact O-N 2.95Å; F37-G40 PolarHBondContact O-N 2.94Å; L38-G40 VanDerWaalsContact C-N 3.3Å; L38-G40 PolarHBondContact O-N 2.94Å; G40-V42 VanDerWaalsContact C-N 3.26Å; G40-V42 PolarHBondContact O-N 3.41Å; G40-F43 PolarHBondContact O-N 2.97Å; G40-V44 WeakPolarHBondContact O-CG2 3.37Å; G40-V44 PolarHBondContact O-N 2.92Å; G40-V44 VanDerWaalsContact O-N 3.08Å; G40-G355 WeakPolarHBondContact CA-O 3.23Å
41	V	96.9	Very high	93.9	Very high	98 Å²	98	56.5 Å²	56.5	59%	0.594	32%	0.323	S	S	*	.	H	α-helix	trans	-65.3	-28.3	-178.9	170.4	0	0	0	0	112.1	F37 L38 P45	F37-V41 WeakPolarHBondContact O-CB 3.4Å; F37-V41 VanDerWaalsContact O-CG2 3.27Å; F37-V41 WeakPolarHBondContact O-CG2 3.32Å; F37-V41 PolarHBondContact O-N 3.33Å; L38-V41 PolarHBondContact O-N 3.03Å; V41-P45 WeakPolarHBondContact O-CD 3.43Å; V41-P45 WeakPolarHBondContact O-CG 3.35Å
42	V	97.8	Very high	93.9	Very high	73 Å²	73	58.3 Å²	58.3	44%	0.442	33%	0.332	S	S	.	.	H	α-helix	trans	-82.5	-44.1	174.8	174.4	0	0	0	0	111.5	L38 I39 G40 P45 V46	L38-V42 HydrophobicContact CD2-CG2 4.29Å; L38-V42 WeakPolarHBondContact O-CB 3.46Å; L38-V42 VanDerWaalsContact O-CG2 3.31Å; L38-V42 WeakPolarHBondContact O-CG2 3.48Å; L38-V42 PolarHBondContact O-N 3.24Å; I39-V42 PolarHBondContact O-N 2.94Å; G40-V42 VanDerWaalsContact C-N 3.26Å; G40-V42 PolarHBondContact O-N 3.41Å; V42-P45 WeakPolarHBondContact O-CD 3.38Å; V42-V46 HydrophobicContact CG1-CG2 4.43Å; V42-V46 VanDerWaalsContact O-CG2 3.24Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.27Å
43	F	98.1	Very high	93.5	Very high	66 Å²	66	58.1 Å²	58.1	29%	0.289	33%	0.334	S	S	.	.	H	α-helix	trans	-71.9	-35.4	-172.3	-83.3	27.4	0	0	0	112.8	I39 G40 G47 Y351 V354	I39-F43 HydrophobicContact CG2-CD1 4.18Å; I39-F43 HydrophobicContact CG2-CD2 4.05Å; I39-F43 HydrophobicContact CG2-CE1 4.26Å; I39-F43 HydrophobicContact CG2-CE2 4.11Å; I39-F43 HydrophobicContact CG2-CG 4.09Å; I39-F43 HydrophobicContact CG2-CZ 4.22Å; I39-F43 VanDerWaalsContact O-CB 3.24Å; I39-F43 WeakPolarHBondContact O-CB 3.38Å; I39-F43 WeakPolarHBondContact O-CD1 3.26Å; I39-F43 WeakPolarHBondContact O-CG 3.25Å; I39-F43 PolarHBondContact O-N 2.91Å; G40-F43 PolarHBondContact O-N 2.97Å; F43-G47 PolarHBondContact O-N 3.27Å; F43-Y351 HydrophobicContact CB-CD1 4.06Å; F43-Y351 HydrophobicContact CD1-CD1 4.17Å; F43-Y351 HydrophobicContact CD1-CE1 4.17Å; F43-Y351 AromaticContact CD2-CD1 3.85Å; F43-Y351 HydrophobicContact CD2-CD1 3.85Å; F43-Y351 HydrophobicContact CD2-CE1 4.19Å; F43-Y351 HydrophobicContact CE1-CE1 4.17Å; F43-Y351 HydrophobicContact CE2-CD1 4.3Å; F43-Y351 HydrophobicContact CE2-CE1 4.2Å; F43-Y351 AromaticContact CG-CD1 3.77Å; F43-Y351 HydrophobicContact CG-CD1 3.77Å; F43-Y351 HydrophobicContact CG-CE1 4.17Å; F43-Y351 HydrophobicContact CZ-CE1 4.18Å; F43-V354 HydrophobicContact CD2-CB 4.46Å; F43-V354 HydrophobicContact CD2-CG1 4.08Å; F43-V354 HydrophobicContact CE2-CG1 4.23Å
44	V	97.8	Very high	92.8	Very high	40 Å²	40	57.6 Å²	57.6	24%	0.242	33%	0.332	C	S	.	.	H	α-helix	trans	-63.8	-52.6	-179.5	171.5	0	0	0	0	111.8	G40 V46 G47 V48 I359	G40-V44 WeakPolarHBondContact O-CG2 3.37Å; G40-V44 PolarHBondContact O-N 2.92Å; G40-V44 VanDerWaalsContact O-N 3.08Å; V44-V46 PolarHBondContact O-N 3.16Å; V44-G47 PolarHBondContact O-N 3.2Å; V44-V48 WeakPolarHBondContact O-CG2 3.3Å; V44-V48 PolarHBondContact O-N 3.32Å; V44-I359 HydrophobicContact CG2-CD1 4.37Å
45	P	96.9	Very high	92	Very high	71 Å²	71	58.6 Å²	58.6	46%	0.461	33%	0.333	S	S	.	.	H	α-helix	trans	-60.6	-42	175.7	-24.7	35	0	0	0	113.3	V41 V42 G47 V48 V49	V41-P45 WeakPolarHBondContact O-CD 3.43Å; V41-P45 WeakPolarHBondContact O-CG 3.35Å; V42-P45 WeakPolarHBondContact O-CD 3.38Å; P45-G47 VanDerWaalsContact C-N 3.31Å; P45-G47 PolarHBondContact O-N 3.3Å; P45-V48 PolarHBondContact O-N 3.46Å; P45-V49 WeakPolarHBondContact O-CG2 3.39Å; P45-V49 PolarHBondContact O-N 2.87Å
46	V	95.2	Very high	90.9	Very high	59 Å²	59	56.5 Å²	56.5	36%	0.358	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-44.3	176.1	170.9	0	0	0	0	110.6	V42 V44 V49 L50 Y351	V42-V46 HydrophobicContact CG1-CG2 4.43Å; V42-V46 VanDerWaalsContact O-CG2 3.24Å; V42-V46 WeakPolarHBondContact O-CG2 3.48Å; V42-V46 PolarHBondContact O-N 3.27Å; V44-V46 PolarHBondContact O-N 3.16Å; V46-V49 PolarHBondContact O-N 3.18Å; V46-L50 HydrophobicContact CG1-CD1 3.89Å; V46-L50 HydrophobicContact CG1-CG 4.44Å; V46-L50 WeakPolarHBondContact O-CB 3.27Å; V46-L50 VanDerWaalsContact O-CG 3.3Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 3.43Å; V46-Y351 HydrophobicContact CB-CD1 4.38Å; V46-Y351 HydrophobicContact CG1-CD1 3.97Å; V46-Y351 HydrophobicContact CG1-CE1 4.03Å
47	G	95.3	Very high	89.6	Confident	0 Å²	0	54 Å²	54	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-62.9	-41	176.9	0	0	0	0	0	113.1	F43 V44 P45 L50 L51 G348 Y351	F43-G47 PolarHBondContact O-N 3.27Å; V44-G47 PolarHBondContact O-N 3.2Å; P45-G47 VanDerWaalsContact C-N 3.31Å; P45-G47 PolarHBondContact O-N 3.3Å; G47-L50 PolarHBondContact O-N 3.24Å; G47-L51 VanDerWaalsContact O-CB 3.3Å; G47-L51 WeakPolarHBondContact O-CB 3.44Å; G47-L51 PolarHBondContact O-N 2.9Å; G47-G348 WeakPolarHBondContact O-CA 3.39Å; G47-Y351 VanDerWaalsContact CA-CB 3.5Å
48	V	93.6	Very high	88.2	Confident	70 Å²	70	53.7 Å²	53.7	42%	0.424	32%	0.316	S	S	.	.	H	α-helix	trans	-62.7	-46.2	174.6	172.2	0	0	0	0	111	V44 P45 L50 L51 V52 I352	V44-V48 WeakPolarHBondContact O-CG2 3.3Å; V44-V48 PolarHBondContact O-N 3.32Å; P45-V48 PolarHBondContact O-N 3.46Å; V48-L50 PolarHBondContact O-N 2.95Å; V48-L51 PolarHBondContact O-N 3.3Å; V48-V52 HydrophobicContact CG1-CG2 4.38Å; V48-V52 WeakPolarHBondContact O-CG2 3.3Å; V48-V52 PolarHBondContact O-N 3.47Å; V48-I352 HydrophobicContact CG2-CD1 4.11Å; V48-I352 HydrophobicContact CG2-CG1 4.37Å
49	V	90.8	Very high	86.9	Confident	95 Å²	95	50.6 Å²	50.6	58%	0.576	30%	0.3	S	S	*	.	H	α-helix	trans	-60.4	-45.5	177.8	171	0	0	0	0	111.1	P45 V46 L51 V52 A53	P45-V49 WeakPolarHBondContact O-CG2 3.39Å; P45-V49 PolarHBondContact O-N 2.87Å; V46-V49 PolarHBondContact O-N 3.18Å; V49-L51 VanDerWaalsContact C-N 3.34Å; V49-L51 PolarHBondContact O-N 2.85Å; V49-V52 PolarHBondContact O-N 2.92Å; V49-A53 WeakPolarHBondContact O-CB 3.44Å; V49-A53 PolarHBondContact O-N 3.37Å
50	L	88.9	Confident	85.7	Confident	31 Å²	31	50.2 Å²	50.2	16%	0.162	30%	0.296	C	S	.	.	H	α-helix	trans	-64.4	-38.2	177.2	-71.8	170.5	0	0	0	112.4	V46 G47 V48 S54 W339 L347 Y351	V46-L50 HydrophobicContact CG1-CD1 3.89Å; V46-L50 HydrophobicContact CG1-CG 4.44Å; V46-L50 WeakPolarHBondContact O-CB 3.27Å; V46-L50 VanDerWaalsContact O-CG 3.3Å; V46-L50 WeakPolarHBondContact O-CG 3.45Å; V46-L50 PolarHBondContact O-N 3.43Å; G47-L50 PolarHBondContact O-N 3.24Å; V48-L50 PolarHBondContact O-N 2.95Å; L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 3.37Å; L50-W339 HydrophobicContact CD2-CH2 4.11Å; L50-L347 HydrophobicContact CD1-CD2 3.72Å; L50-L347 HydrophobicContact CD1-CG 4.05Å; L50-L347 HydrophobicContact CD2-CD2 4.2Å; L50-Y351 HydrophobicContact CD1-CD2 4.1Å; L50-Y351 HydrophobicContact CD1-CE2 4.28Å
51	L	87.7	Confident	84.6	Confident	42 Å²	42	55 Å²	55	22%	0.22	32%	0.319	C	S	.	.	H	α-helix	trans	-67.8	-45.9	178.7	-171.8	61.6	0	0	0	111.1	G47 V48 V49 A53 S54 D55 P345 I349 I352	G47-L51 VanDerWaalsContact O-CB 3.3Å; G47-L51 WeakPolarHBondContact O-CB 3.44Å; G47-L51 PolarHBondContact O-N 2.9Å; V48-L51 PolarHBondContact O-N 3.3Å; V49-L51 VanDerWaalsContact C-N 3.34Å; V49-L51 PolarHBondContact O-N 2.85Å; L51-A53 VanDerWaalsContact C-N 3.33Å; L51-A53 PolarHBondContact O-N 2.89Å; L51-S54 CarbonylContact O-C 3.52Å; L51-S54 WeakPolarHBondContact O-CB 3.31Å; L51-S54 PolarHBondContact O-N 3.02Å; L51-S54 VanDerWaalsContact O-N 3.09Å; L51-D55 PolarHBondContact O-N 3.31Å; L51-P345 HydrophobicContact CD1-CB 3.67Å; L51-I349 HydrophobicContact CD1-CG1 4.07Å; L51-I352 HydrophobicContact CD2-CD1 3.94Å
52	V	84.5	Confident	83.1	Confident	91 Å²	91	52.6 Å²	52.6	55%	0.552	30%	0.302	S	S	*	.	H	α-helix	trans	-61.2	-42.7	175.5	172.5	0	0	0	0	111	V48 V49 S54 D55 S56	V48-V52 HydrophobicContact CG1-CG2 4.38Å; V48-V52 WeakPolarHBondContact O-CG2 3.3Å; V48-V52 PolarHBondContact O-N 3.47Å; V49-V52 PolarHBondContact O-N 2.92Å; V52-S54 VanDerWaalsContact C-N 3.25Å; V52-S54 PolarHBondContact O-N 2.92Å; V52-D55 PolarHBondContact O-N 3.48Å; V52-S56 WeakPolarHBondContact O-CB 3.19Å; V52-S56 PolarHBondContact O-N 3.39Å; V52-S56 PolarHBondContact O-OG 3.33Å
53	A	80.3	Confident	81.4	Confident	30 Å²	30	53.3 Å²	53.3	25%	0.248	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-27.9	175.8	0	0	0	0	0	113.1	V49 L51 S56	V49-A53 WeakPolarHBondContact O-CB 3.44Å; V49-A53 PolarHBondContact O-N 3.37Å; L51-A53 VanDerWaalsContact C-N 3.33Å; L51-A53 PolarHBondContact O-N 2.89Å; A53-S56 WeakPolarHBondContact CA-OG 3.43Å; A53-S56 PolarHBondContact O-OG 2.93Å
54	S	78.1	Confident	79.3	Confident	8 Å²	8	52.5 Å²	52.5	6%	0.056	30%	0.302	C	S	.	.	H	α-helix	trans	-79.4	-35.2	173.1	179.5	0	0	0	0	112.3	L50 L51 V52 V57 N344 P345	L50-S54 WeakPolarHBondContact O-CB 3.44Å; L50-S54 PolarHBondContact O-N 3.37Å; L51-S54 CarbonylContact O-C 3.52Å; L51-S54 WeakPolarHBondContact O-CB 3.31Å; L51-S54 PolarHBondContact O-N 3.02Å; L51-S54 VanDerWaalsContact O-N 3.09Å; V52-S54 VanDerWaalsContact C-N 3.25Å; V52-S54 PolarHBondContact O-N 2.92Å; S54-V57 VanDerWaalsContact O-CB 3.29Å; S54-V57 WeakPolarHBondContact O-CB 3.5Å; S54-V57 VanDerWaalsContact O-CG2 3.3Å; S54-V57 WeakPolarHBondContact O-CG2 3.43Å; S54-V57 PolarHBondContact O-N 2.93Å; S54-N344 PolarHBondContact OG-N 3.29Å; S54-N344 PolarHBondContact OG-O 3.41Å; S54-P345 VanDerWaalsContact OG-N 3.07Å
55	D	76.4	Confident	76.7	Confident	97 Å²	97	59 Å²	59	52%	0.519	32%	0.323	S	S	.	.	H	α-helix	trans	-79.5	-24.4	179.9	-77.6	-15.8	0	0	0	112.5	L51 V52 V57	L51-D55 PolarHBondContact O-N 3.31Å; V52-D55 PolarHBondContact O-N 3.48Å; D55-V57 PolarHBondContact O-N 3.33Å
56	S	70.2	Confident	74.3	Confident	33 Å²	33	60.4 Å²	60.4	23%	0.231	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-2.4	165.4	69.2	0	0	0	0	112.2	V52 A53 S58 L95	V52-S56 WeakPolarHBondContact O-CB 3.19Å; V52-S56 PolarHBondContact O-N 3.39Å; V52-S56 PolarHBondContact O-OG 3.33Å; A53-S56 WeakPolarHBondContact CA-OG 3.43Å; A53-S56 PolarHBondContact O-OG 2.93Å; S56-S58 PolarHBondContact O-N 3.35Å; S56-L95 WeakPolarHBondContact O-CD1 3.24Å; S56-L95 WeakPolarHBondContact O-CG 3.26Å
57	V	67.6	Low	71.6	Confident	3 Å²	3	63 Å²	63	2%	0.018	34%	0.338	C	S	.	.			trans	-82.5	110.5	169.3	-174.5	0	0	0	0	110.7	S54 D55 N59 V96 K343	S54-V57 VanDerWaalsContact O-CB 3.29Å; S54-V57 WeakPolarHBondContact O-CB 3.5Å; S54-V57 VanDerWaalsContact O-CG2 3.3Å; S54-V57 WeakPolarHBondContact O-CG2 3.43Å; S54-V57 PolarHBondContact O-N 2.93Å; D55-V57 PolarHBondContact O-N 3.33Å; V57-N59 WeakPolarHBondContact CG1-OD1 2.92Å; V57-V96 CarbonylContact C-O 3.44Å; V57-V96 VanDerWaalsContact CA-O 3.23Å; V57-V96 WeakPolarHBondContact CA-O 3.3Å; V57-V96 HydrophobicContact CB-CB 4.01Å; V57-V96 HydrophobicContact CG1-CB 3.58Å; V57-V96 HydrophobicContact CG1-CG1 3.71Å; V57-V96 HydrophobicContact CG2-CB 3.56Å; V57-V96 HydrophobicContact CG2-CG1 4.42Å; V57-V96 HydrophobicContact CG2-CG2 3.87Å; V57-K343 HydrophobicContact CB-CB 3.72Å; V57-K343 HydrophobicContact CB-CD 4.21Å; V57-K343 HydrophobicContact CB-CG 4.07Å; V57-K343 HydrophobicContact CG1-CB 3.65Å; V57-K343 HydrophobicContact CG1-CD 4.46Å; V57-K343 HydrophobicContact CG1-CG 4.42Å; V57-K343 HydrophobicContact CG2-CB 4.17Å; V57-K343 PolarHBondContact O-NZ 3.07Å
58	S	65.8	Low	69	Low	48 Å²	48	71 Å²	71	34%	0.336	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	117.4	174.6	-174.9	0	0	0	0	109.8	S56 V96 K97 E98	S56-S58 PolarHBondContact O-N 3.35Å; S58-V96 PolarHBondContact N-O 3.07Å; S58-K97 WeakPolarHBondContact O-CA 3.24Å; S58-E98 PolarHBondContact O-N 2.84Å
59	N	70.2	Confident	66.3	Low	52 Å²	52	79.4 Å²	79.4	28%	0.278	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.5	175.5	-74.4	1.8	0	0	0	110	V57 E98 K343	V57-N59 WeakPolarHBondContact CG1-OD1 2.92Å; N59-E98 CarbonylContact C-O 3.53Å; N59-E98 VanDerWaalsContact CA-O 3.27Å; N59-E98 WeakPolarHBondContact CA-O 3.4Å; N59-K343 WeakPolarHBondContact ND2-CD 3.44Å
60	Q	70.7	Confident	63.9	Low	47 Å²	47	84.9 Å²	84.9	22%	0.22	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	109.7	169.5	-171.9	-178.1	-1.7	0	0	108.4	E98 F99 E100 E135	Q60-E98 PolarHBondContact N-O 3.44Å; Q60-F99 HydrophobicContact CB-CD2 3.96Å; Q60-F99 HydrophobicContact CG-CD2 3.9Å; Q60-F99 HydrophobicContact CG-CE2 4.29Å; Q60-F99 CarbonylContact O-C 3.54Å; Q60-F99 WeakPolarHBondContact O-CA 3.23Å; Q60-E100 PolarHBondContact O-N 3.29Å; Q60-E135 PolarHBondContact NE2-O 2.86Å; Q60-E135 PolarHBondContact OE1-O 3.25Å
61	H	73.8	Confident	61.4	Low	101 Å²	101	95.4 Å²	95.4	47%	0.468	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.6	177.2	-66.9	-80	0	0	0	110.2	E100	H61-E100 IonicContact CE1-OE2 3.03Å; H61-E100 PolarHBondContact CE1-OE2 3.46Å; H61-E100 IonicContact ND1-OE1 2.7Å; H61-E100 IonicContact ND1-OE2 2.75Å
62	L	66.3	Low	58.9	Low	48 Å²	48	100 Å²	100	25%	0.251	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	104.6	172.7	-153.3	141	0	0	0	108.8	N64 F99 E100 L101 D102 F134	L62-N64 VanDerWaalsContact CD2-OD1 3.23Å; L62-N64 WeakPolarHBondContact CD2-OD1 3.45Å; L62-F99 HydrophobicContact CB-CE2 4.3Å; L62-F99 HydrophobicContact CB-CZ 4.33Å; L62-E100 PolarHBondContact N-O 2.83Å; L62-L101 HydrophobicContact CB-CD1 4Å; L62-L101 HydrophobicContact CD2-CD1 3.55Å; L62-L101 HydrophobicContact CG-CD1 4.35Å; L62-D102 PolarHBondContact O-N 3.43Å; L62-D102 VanDerWaalsContact O-N 3.12Å; L62-F134 HydrophobicContact CD1-CB 4.26Å
63	I	61.3	Low	56.6	Low	87 Å²	87	101.7 Å²	101.7	45%	0.446	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	101.8	174.6	-51.9	174.5	0	0	0	107.3	Y65	I63-Y65 VanDerWaalsContact C-N 3.29Å; I63-Y65 HydrophobicContact CB-CD2 4.14Å; I63-Y65 HydrophobicContact CB-CE2 3.82Å; I63-Y65 HydrophobicContact CD1-CE2 4.35Å; I63-Y65 HydrophobicContact CG2-CD1 4.5Å; I63-Y65 HydrophobicContact CG2-CD2 3.64Å; I63-Y65 HydrophobicContact CG2-CE1 4.2Å; I63-Y65 HydrophobicContact CG2-CE2 3.29Å; I63-Y65 HydrophobicContact CG2-CG 4.24Å; I63-Y65 PolarHBondContact O-N 3.07Å
64	N	53.4	Low	54.9	Low	50 Å²	50	106.3 Å²	106.3	27%	0.267	51%	0.511	S	S	.	.			trans	-72.8	87	171.6	-82.6	-31.5	0	0	0	109.4	L62 Y66	L62-N64 VanDerWaalsContact CD2-OD1 3.23Å; L62-N64 WeakPolarHBondContact CD2-OD1 3.45Å; N64-Y66 PolarHBondContact O-N 3.34Å
65	Y	44	Very low	52.8	Low	175 Å²	175	111.2 Å²	111.2	69%	0.686	55%	0.545	S	S	*	.			trans	-73.4	101.4	161.1	-69.3	-78.2	0	0	0	107.9	I63 P67	I63-Y65 VanDerWaalsContact C-N 3.29Å; I63-Y65 HydrophobicContact CB-CD2 4.14Å; I63-Y65 HydrophobicContact CB-CE2 3.82Å; I63-Y65 HydrophobicContact CD1-CE2 4.35Å; I63-Y65 HydrophobicContact CG2-CD1 4.5Å; I63-Y65 HydrophobicContact CG2-CD2 3.64Å; I63-Y65 HydrophobicContact CG2-CE1 4.2Å; I63-Y65 HydrophobicContact CG2-CE2 3.29Å; I63-Y65 HydrophobicContact CG2-CG 4.24Å; I63-Y65 PolarHBondContact O-N 3.07Å; Y65-P67 WeakPolarHBondContact O-CD 3.34Å
66	Y	45.7	Very low	51.3	Low	102 Å²	102	112.3 Å²	112.3	40%	0.4	56%	0.559	S	S	.	*			trans	-64	121.5	158.6	-80.8	-93.6	0	0	0	107.1	N64 M68 D105 T107	N64-Y66 PolarHBondContact O-N 3.34Å; Y66-M68 PolarHBondContact O-N 3.41Å; Y66-D105 WeakPolarHBondContact CD2-O 3.3Å; Y66-D105 WeakPolarHBondContact CE2-O 3.48Å; Y66-T107 HydrophobicContact CD1-CG2 4.04Å; Y66-T107 HydrophobicContact CE1-CG2 3.78Å; Y66-T107 WeakPolarHBondContact CE1-OG1 3.43Å; Y66-T107 HydrophobicContact CE2-CG2 4.37Å; Y66-T107 HydrophobicContact CG-CG2 4.4Å; Y66-T107 PolarHBondContact OH-OG1 3.38Å
67	P	40.2	Very low	49.7	Very low	114 Å²	114	120.1 Å²	120.1	74%	0.74	59%	0.589	S	S	*	*			trans	-68.5	104.3	179.8	26.4	-31.6	0	0	0	108.2	Y65 R69	Y65-P67 WeakPolarHBondContact O-CD 3.34Å; P67-R69 PolarHBondContact O-N 3.45Å
68	M	39.5	Very low	48.2	Very low	167 Å²	167	128.8 Å²	128.8	82%	0.823	63%	0.629	S	S	*	*			trans	-58.3	108.8	157.9	-166.5	-179	-108.2	0	0	105.4	Y66 R70	Y66-M68 PolarHBondContact O-N 3.41Å; M68-R70 PolarHBondContact O-N 3.08Å
69	R	37.1	Very low	46.9	Very low	247 Å²	247	133.1 Å²	133.1	93%	0.932	65%	0.647	S	S	*	*			trans	-60	87.2	178.2	-86.5	-172.8	-175.3	-173	2.5	109.5	P67	P67-R69 PolarHBondContact O-N 3.45Å
70	R	40.5	Very low	45.2	Very low	209 Å²	209	136.4 Å²	136.4	79%	0.789	67%	0.671	S	S	*	*			trans	-115.4	110.6	151.1	-76.4	-168.9	-173.6	-173.7	3.4	106.8	M68 L72	M68-R70 PolarHBondContact O-N 3.08Å; R70-L72 PolarHBondContact O-N 3.49Å; R70-L72 VanDerWaalsContact O-N 3.11Å
71	R	35.6	Very low	43.7	Very low	253 Å²	253	141.6 Å²	141.6	96%	0.955	70%	0.699	S	S	*	*			trans	-58.8	110.7	167.4	-74.2	-176.1	-176.1	-175.8	1.4	107.8
72	L	36.9	Very low	41.7	Very low	139 Å²	139	143.7 Å²	143.7	73%	0.728	71%	0.713	S	S	*	*			trans	-137.3	119.9	158.6	-95.6	155.1	0	0	0	106.5	R70 V74	R70-L72 PolarHBondContact O-N 3.49Å; R70-L72 VanDerWaalsContact O-N 3.11Å; L72-V74 PolarHBondContact O-N 2.87Å
73	P	34.6	Very low	40.4	Very low	126 Å²	126	148.6 Å²	148.6	82%	0.818	74%	0.74	S	S	*	*			trans	-82.1	111.8	173.4	32.1	-25.9	0	0	0	107.4
74	V	44.6	Very low	39.3	Very low	126 Å²	126	154.6 Å²	154.6	76%	0.764	76%	0.757	S	S	*	*			trans	-127.2	106.8	163.2	-98.1	0	0	0	0	107.7	L72 C76	L72-V74 PolarHBondContact O-N 2.87Å; V74-C76 PolarHBondContact O-N 3.46Å
75	S	35.4	Very low	38.4	Very low	112 Å²	112	161 Å²	161	78%	0.783	79%	0.786	S	S	*	*			trans	-67.9	114.3	165.7	52.7	0	0	0	0	108.6
76	C	44.3	Very low	38	Very low	119 Å²	119	159.4 Å²	159.4	80%	0.804	79%	0.788	S	S	*	*			trans	-105	121.7	161.4	-72.8	0	0	0	0	108.4	V74 H78	V74-C76 PolarHBondContact O-N 3.46Å; C76-H78 PolarHBondContact O-N 2.93Å
77	F	36	Very low	37.3	Very low	197 Å²	197	163.9 Å²	163.9	86%	0.864	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-58.5	129.5	170.1	-92.6	-102.2	0	0	0	109.9	I79	F77-I79 PolarHBondContact O-N 3.35Å
78	H	37.3	Very low	36.8	Very low	186 Å²	186	166.9 Å²	166.9	86%	0.861	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75	119.8	165.4	-106.1	-63.8	0	0	0	109.1	C76	C76-H78 PolarHBondContact O-N 2.93Å
79	I	37.3	Very low	36.7	Very low	139 Å²	139	164.3 Å²	164.3	71%	0.713	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-87	130.5	159.3	-60.5	169.1	0	0	0	106.2	F77 I81	F77-I79 PolarHBondContact O-N 3.35Å; I79-I81 PolarHBondContact O-N 2.72Å
80	P	34.3	Very low	36.6	Very low	121 Å²	121	157.7 Å²	157.7	79%	0.786	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-74	122.4	172.4	30	-30.2	0	0	0	108.8
81	I	39	Very low	36.7	Very low	155 Å²	155	155.9 Å²	155.9	80%	0.795	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-86.7	116.5	168.4	-60.4	175	0	0	0	106.4	I79 D83	I79-I81 PolarHBondContact O-N 2.72Å; I81-D83 PolarHBondContact O-N 2.87Å
82	D	33.5	Very low	37.2	Very low	145 Å²	145	149.8 Å²	149.8	78%	0.775	78%	0.781	S	S	*	*			trans	-69.5	107.5	171.4	-179.7	25.5	0	0	0	108.9	R84	D82-R84 VanDerWaalsContact C-N 3.34Å; D82-R84 PolarHBondContact O-N 3.33Å
83	D	37.7	Very low	37.7	Very low	152 Å²	152	148.7 Å²	148.7	81%	0.813	78%	0.775	S	S	*	*			trans	-78	89.5	176.8	-123.7	-9.6	0	0	0	108.3	I81 Q85	I81-D83 PolarHBondContact O-N 2.87Å; D83-Q85 PolarHBondContact O-N 3.23Å
84	R	39.6	Very low	38.9	Very low	213 Å²	213	148.3 Å²	148.3	80%	0.804	76%	0.761	S	S	*	*			trans	-59.7	112.3	173.2	-170.3	-179.7	-102.9	-128.1	-0.4	108.2	D82 L86	D82-R84 VanDerWaalsContact C-N 3.34Å; D82-R84 PolarHBondContact O-N 3.33Å; R84-L86 PolarHBondContact O-N 2.83Å
85	Q	32.5	Very low	39.9	Very low	185 Å²	185	146.5 Å²	146.5	86%	0.864	75%	0.746	S	S	*	*			trans	-49.9	100.8	171.4	-75	-178.9	-25.3	0	0	110.5	D83	D83-Q85 PolarHBondContact O-N 3.23Å
86	L	36.1	Very low	41.8	Very low	140 Å²	140	141.2 Å²	141.2	73%	0.733	71%	0.709	S	S	*	*			trans	-81.9	121.2	162.6	-100	145.8	0	0	0	107	R84 H88	R84-L86 PolarHBondContact O-N 2.83Å; L86-H88 VanDerWaalsContact C-N 3.34Å; L86-H88 PolarHBondContact O-CD2 2.94Å; L86-H88 VanDerWaalsContact O-CD2 3.26Å; L86-H88 PolarHBondContact O-N 3.44Å
87	F	30.7	Very low	43.7	Very low	197 Å²	197	136.8 Å²	136.8	86%	0.864	68%	0.677	S	S	*	*			trans	-53	97.7	170.2	-96	-101.6	0	0	0	109.1	I89	F87-I89 PolarHBondContact O-N 3.44Å
88	H	30.5	Very low	46.2	Very low	177 Å²	177	128.4 Å²	128.4	82%	0.819	64%	0.64	S	S	*	*			trans	-72.6	97.1	168.3	-78.3	-84.4	0	0	0	107.7	L86 S90	L86-H88 VanDerWaalsContact C-N 3.34Å; L86-H88 PolarHBondContact O-CD2 2.94Å; L86-H88 VanDerWaalsContact O-CD2 3.26Å; L86-H88 PolarHBondContact O-N 3.44Å; H88-S90 PolarHBondContact O-N 3.41Å
89	I	36.4	Very low	48.9	Very low	113 Å²	113	119.8 Å²	119.8	58%	0.579	60%	0.6	S	S	*	*			trans	-71.2	93.8	159.2	-48.8	174	0	0	0	105.8	F87 Y91	F87-I89 PolarHBondContact O-N 3.44Å; I89-Y91 VanDerWaalsContact C-N 3.33Å; I89-Y91 HydrophobicContact CB-CD2 4.31Å; I89-Y91 HydrophobicContact CB-CE2 3.75Å; I89-Y91 HydrophobicContact CG2-CD1 4.27Å; I89-Y91 HydrophobicContact CG2-CD2 3.91Å; I89-Y91 HydrophobicContact CG2-CE1 3.7Å; I89-Y91 HydrophobicContact CG2-CE2 3.29Å; I89-Y91 HydrophobicContact CG2-CG 4.38Å; I89-Y91 WeakPolarHBondContact CG2-OH 3.33Å; I89-Y91 PolarHBondContact O-N 2.87Å
90	S	35.5	Very low	51.5	Low	108 Å²	108	114.9 Å²	114.9	76%	0.755	57%	0.574	S	S	*	*			trans	-70.4	91.5	176.7	-175	0	0	0	0	108.6	H88	H88-S90 PolarHBondContact O-N 3.41Å
91	Y	42.6	Very low	54.4	Low	171 Å²	171	109.1 Å²	109.1	67%	0.671	54%	0.537	S	S	*	.			trans	-87.6	123.6	159.7	-55.4	-72.3	0	0	0	107.1	I89 L93	I89-Y91 VanDerWaalsContact C-N 3.33Å; I89-Y91 HydrophobicContact CB-CD2 4.31Å; I89-Y91 HydrophobicContact CB-CE2 3.75Å; I89-Y91 HydrophobicContact CG2-CD1 4.27Å; I89-Y91 HydrophobicContact CG2-CD2 3.91Å; I89-Y91 HydrophobicContact CG2-CE1 3.7Å; I89-Y91 HydrophobicContact CG2-CE2 3.29Å; I89-Y91 HydrophobicContact CG2-CG 4.38Å; I89-Y91 WeakPolarHBondContact CG2-OH 3.33Å; I89-Y91 PolarHBondContact O-N 2.87Å; Y91-L93 PolarHBondContact O-N 3.26Å
92	P	45.9	Very low	57.1	Low	124 Å²	124	102.3 Å²	102.3	81%	0.805	50%	0.502	S	S	*	.			trans	-74.6	13.3	-174.5	31.5	-35.5	0	0	0	113.4	F94	P92-F94 PolarHBondContact O-N 3.07Å
93	L	49.2	Very low	60.1	Low	117 Å²	117	95.5 Å²	95.5	61%	0.613	47%	0.466	S	S	*	.	S	Bend	trans	-99.3	101.1	-172.1	-86	153.6	0	0	0	108.3	Y91	Y91-L93 PolarHBondContact O-N 3.26Å
94	F	59.2	Low	62.9	Low	118 Å²	118	88.3 Å²	88.3	52%	0.518	43%	0.427	S	S	.	.			trans	86.7	47.9	159.4	-38.9	-66.1	0	0	0	117.7	P92 V96	P92-F94 PolarHBondContact O-N 3.07Å; F94-V96 PolarHBondContact O-N 3.36Å
95	L	65.7	Low	65.5	Low	87 Å²	87	80.7 Å²	80.7	46%	0.455	40%	0.402	S	S	.	.			trans	-75.5	108.3	168.4	-150.8	91.4	0	0	0	110.3	S56 K97 N336	S56-L95 WeakPolarHBondContact O-CD1 3.24Å; S56-L95 WeakPolarHBondContact O-CG 3.26Å; L95-K97 HydrophobicContact CD2-CD 4.28Å; L95-K97 HydrophobicContact CD2-CG 3.99Å; L95-N336 PolarHBondContact O-ND2 3.45Å
96	V	75.6	Confident	68.4	Low	1 Å²	1	72 Å²	72	1%	0.006	36%	0.362	C	S	.	.			trans	-74.3	137	164.2	-178.1	0	0	0	0	107.5	V57 S58 F94 N336 S338 G341	V57-V96 CarbonylContact C-O 3.44Å; V57-V96 VanDerWaalsContact CA-O 3.23Å; V57-V96 WeakPolarHBondContact CA-O 3.3Å; V57-V96 HydrophobicContact CB-CB 4.01Å; V57-V96 HydrophobicContact CG1-CB 3.58Å; V57-V96 HydrophobicContact CG1-CG1 3.71Å; V57-V96 HydrophobicContact CG2-CB 3.56Å; V57-V96 HydrophobicContact CG2-CG1 4.42Å; V57-V96 HydrophobicContact CG2-CG2 3.87Å; S58-V96 PolarHBondContact N-O 3.07Å; F94-V96 PolarHBondContact O-N 3.36Å; V96-N336 WeakPolarHBondContact CA-OD1 3.46Å; V96-N336 WeakPolarHBondContact CG1-OD1 3.38Å; V96-S338 VanDerWaalsContact CG2-OG 3.24Å; V96-S338 WeakPolarHBondContact CG2-OG 3.39Å; V96-G341 WeakPolarHBondContact CG2-O 3.25Å
97	K	84.3	Confident	71.1	Confident	27 Å²	27	67 Å²	67	12%	0.117	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	133.9	167.9	-67.2	-176.3	-179.8	-179.9	0	107.8	S58 L95 D138 N139 V140 S335 N336	S58-K97 WeakPolarHBondContact O-CA 3.24Å; L95-K97 HydrophobicContact CD2-CD 4.28Å; L95-K97 HydrophobicContact CD2-CG 3.99Å; K97-D138 HydrophobicContact CD-CB 3.87Å; K97-D138 VanDerWaalsContact NZ-CB 3.28Å; K97-D138 IonicContact NZ-OD1 3.65Å; K97-D138 PolarHBondContact NZ-OD1 3.32Å; K97-N139 WeakPolarHBondContact CD-O 3.44Å; K97-N139 WeakPolarHBondContact CE-O 3.49Å; K97-N139 PolarHBondContact NZ-O 3.11Å; K97-V140 HydrophobicContact CB-CG1 4.37Å; K97-V140 HydrophobicContact CB-CG2 4.33Å; K97-S335 VanDerWaalsContact O-CA 3.23Å; K97-S335 WeakPolarHBondContact O-CA 3.13Å; K97-S335 PolarHBondContact O-OG 2.98Å; K97-N336 PolarHBondContact N-OD1 3.07Å; K97-N336 PolarHBondContact O-N 3.26Å; K97-N336 PolarHBondContact O-OD1 3.01Å
98	E	88.5	Confident	74	Confident	21 Å²	21	61.4 Å²	61.4	10%	0.098	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	120.3	178.1	-172.1	164.4	141.8	0	0	108.9	S58 N59 Q60 R291 I333 I334	S58-E98 PolarHBondContact O-N 2.84Å; N59-E98 CarbonylContact C-O 3.53Å; N59-E98 VanDerWaalsContact CA-O 3.27Å; N59-E98 WeakPolarHBondContact CA-O 3.4Å; Q60-E98 PolarHBondContact N-O 3.44Å; E98-R291 IonicContact OE1-NH1 2.85Å; E98-R291 PolarHBondContact OE1-NH1 2.63Å; E98-R291 IonicContact OE2-CZ 3.67Å; E98-R291 IonicContact OE2-NH1 3.59Å; E98-R291 PolarHBondContact OE2-NH1 2.85Å; E98-R291 IonicContact OE2-NH2 3.48Å; E98-I333 HydrophobicContact CG-CG2 3.85Å; E98-I334 CarbonylContact C-O 3.56Å; E98-I334 WeakPolarHBondContact CA-O 3.15Å
99	F	92.1	Very high	76.7	Confident	4 Å²	4	56.3 Å²	56.3	2%	0.018	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	130	170.3	170.5	-92.4	0	0	0	108.1	Q60 L62 L101 F134 L136 I333 I334	Q60-F99 HydrophobicContact CB-CD2 3.96Å; Q60-F99 HydrophobicContact CG-CD2 3.9Å; Q60-F99 HydrophobicContact CG-CE2 4.29Å; Q60-F99 CarbonylContact O-C 3.54Å; Q60-F99 WeakPolarHBondContact O-CA 3.23Å; L62-F99 HydrophobicContact CB-CE2 4.3Å; L62-F99 HydrophobicContact CB-CZ 4.33Å; F99-L101 HydrophobicContact CE1-CB 3.7Å; F99-L101 HydrophobicContact CZ-CB 3.97Å; F99-F134 HydrophobicContact CD1-CD2 4.14Å; F99-F134 AromaticContact CD1-CE2 3.92Å; F99-F134 HydrophobicContact CD1-CE2 3.92Å; F99-F134 HydrophobicContact CD2-CD2 4.41Å; F99-F134 HydrophobicContact CE1-CB 4.46Å; F99-F134 HydrophobicContact CE1-CD1 4.22Å; F99-F134 AromaticContact CE1-CD2 3.4Å; F99-F134 HydrophobicContact CE1-CD2 3.4Å; F99-F134 HydrophobicContact CE1-CE1 4.29Å; F99-F134 AromaticContact CE1-CE2 3.47Å; F99-F134 HydrophobicContact CE1-CE2 3.47Å; F99-F134 VanDerWaalsContact CE1-CE2 3.47Å; F99-F134 AromaticContact CE1-CG 3.79Å; F99-F134 HydrophobicContact CE1-CG 3.79Å; F99-F134 AromaticContact CE1-CZ 3.92Å; F99-F134 HydrophobicContact CE1-CZ 3.92Å; F99-F134 HydrophobicContact CE2-CB 4.18Å; F99-F134 AromaticContact CE2-CD2 3.73Å; F99-F134 HydrophobicContact CE2-CD2 3.73Å; F99-F134 HydrophobicContact CE2-CE2 4.45Å; F99-F134 HydrophobicContact CE2-CG 4.21Å; F99-F134 HydrophobicContact CZ-CB 3.6Å; F99-F134 HydrophobicContact CZ-CD1 4.17Å; F99-F134 AromaticContact CZ-CD2 3.18Å; F99-F134 HydrophobicContact CZ-CD2 3.18Å; F99-F134 AromaticContact CZ-CE2 3.8Å; F99-F134 HydrophobicContact CZ-CE2 3.8Å; F99-F134 AromaticContact CZ-CG 3.39Å; F99-F134 HydrophobicContact CZ-CG 3.39Å; F99-F134 HydrophobicContact CZ-CZ 4.49Å; F99-L136 HydrophobicContact CB-CD2 3.68Å; F99-L136 HydrophobicContact CD1-CD2 4.13Å; F99-L136 HydrophobicContact CD2-CD2 3.66Å; F99-L136 HydrophobicContact CE2-CD2 4.37Å; F99-L136 HydrophobicContact CG-CD2 3.53Å; F99-I333 CarbonylContact O-C 3.58Å; F99-I333 WeakPolarHBondContact O-CA 3.3Å; F99-I333 WeakPolarHBondContact O-CG2 3.28Å; F99-I334 HydrophobicContact CB-CB 4.28Å; F99-I334 HydrophobicContact CD1-CD1 4.18Å; F99-I334 HydrophobicContact CD1-CG1 4.16Å; F99-I334 PolarHBondContact N-O 2.96Å; F99-I334 PolarHBondContact O-N 3.44Å
100	E	93.7	Very high	79.1	Confident	37 Å²	37	60.3 Å²	60.3	17%	0.173	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	124.3	-179.8	178.5	179.4	137.3	0	0	110.2	Q60 H61 L62 R331 I333	Q60-E100 PolarHBondContact O-N 3.29Å; H61-E100 IonicContact CE1-OE2 3.03Å; H61-E100 PolarHBondContact CE1-OE2 3.46Å; H61-E100 IonicContact ND1-OE1 2.7Å; H61-E100 IonicContact ND1-OE2 2.75Å; L62-E100 PolarHBondContact N-O 2.83Å; E100-R331 HydrophobicContact CG-CB 4.29Å; E100-R331 HydrophobicContact CG-CG 4.4Å; E100-R331 WeakPolarHBondContact OE1-CD 3.34Å; E100-R331 IonicContact OE1-CZ 2.71Å; E100-R331 IonicContact OE1-NE 2.63Å; E100-R331 IonicContact OE1-NH1 3.22Å; E100-I333 HydrophobicContact CB-CG1 4.29Å; E100-I333 HydrophobicContact CG-CG1 4.02Å
101	L	94.6	Very high	81.6	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	116.2	177.7	176.5	67.2	0	0	0	109.8	L62 F99 L132 F134 V315 R331 F332	L62-L101 HydrophobicContact CB-CD1 4Å; L62-L101 HydrophobicContact CD2-CD1 3.55Å; L62-L101 HydrophobicContact CG-CD1 4.35Å; F99-L101 HydrophobicContact CE1-CB 3.7Å; F99-L101 HydrophobicContact CZ-CB 3.97Å; L101-L132 HydrophobicContact CD1-CD1 4.47Å; L101-L132 HydrophobicContact CD2-CB 4.01Å; L101-L132 HydrophobicContact CD2-CD1 3.8Å; L101-L132 HydrophobicContact CG-CD1 4.2Å; L101-F134 HydrophobicContact CD2-CD1 4.07Å; L101-F134 HydrophobicContact CD2-CE1 4.41Å; L101-V315 HydrophobicContact CD2-CG1 3.73Å; L101-R331 CarbonylContact O-C 3.58Å; L101-R331 VanDerWaalsContact O-CA 3.25Å; L101-R331 WeakPolarHBondContact O-CA 3.36Å; L101-F332 HydrophobicContact CB-CB 4.48Å; L101-F332 PolarHBondContact N-O 3.29Å; L101-F332 PolarHBondContact O-N 3.22Å
102	D	95.8	Very high	84	Confident	12 Å²	12	52.8 Å²	52.8	6%	0.064	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	121.6	168.8	-168	-40.7	0	0	0	109.8	L62 T104 R329 R331	L62-D102 PolarHBondContact O-N 3.43Å; L62-D102 VanDerWaalsContact O-N 3.12Å; D102-T104 WeakPolarHBondContact OD1-CB 3.36Å; D102-T104 PolarHBondContact OD1-N 3.24Å; D102-T104 PolarHBondContact OD1-OG1 2.91Å; D102-R329 IonicContact OD1-NH2 3.72Å; D102-R329 IonicContact OD2-CZ 2.7Å; D102-R329 IonicContact OD2-NE 3.91Å; D102-R329 PolarHBondContact OD2-NE 2.8Å; D102-R329 IonicContact OD2-NH2 3.45Å; D102-R329 PolarHBondContact OD2-NH2 3.49Å; D102-R331 HydrophobicContact CB-CG 4.35Å
103	Y	96.2	Very high	86.4	Confident	2 Å²	2	46.9 Å²	46.9	1%	0.008	25%	0.253	C	S	.	.			trans	-117.8	12.1	179.6	71.7	-91.5	0	0	0	112.8	D105 C106 L132 F202 D204 F206 I317 Y319 K330 F332	Y103-D105 PolarHBondContact O-N 2.95Å; Y103-C106 WeakPolarHBondContact O-CB 3.47Å; Y103-C106 PolarHBondContact O-N 3.34Å; Y103-C106 VanDerWaalsContact O-N 3.12Å; Y103-C106 PolarHBondContact O-SG 2.88Å; Y103-L132 VanDerWaalsContact CB-CD1 3.5Å; Y103-F202 WeakPolarHBondContact OH-CZ 3.4Å; Y103-D204 VanDerWaalsContact CE2-OD2 3.31Å; Y103-D204 WeakPolarHBondContact CE2-OD2 3.25Å; Y103-D204 PolarHBondContact OH-OD2 2.95Å; Y103-F206 HydrophobicContact CD1-CE1 4.48Å; Y103-F206 AromaticContact CE1-CE1 3.75Å; Y103-F206 HydrophobicContact CE1-CE1 3.75Å; Y103-F206 AromaticContact CE1-CZ 3.97Å; Y103-F206 HydrophobicContact CE1-CZ 3.97Å; Y103-F206 HydrophobicContact CE2-CE1 4.41Å; Y103-F206 AromaticContact CZ-CE1 3.73Å; Y103-F206 AromaticContact CZ-CZ 3.88Å; Y103-F206 WeakPolarHBondContact OH-CZ 3.35Å; Y103-I317 HydrophobicContact CD1-CD1 4.05Å; Y103-I317 HydrophobicContact CD2-CD1 3.71Å; Y103-I317 HydrophobicContact CD2-CG2 4.02Å; Y103-I317 HydrophobicContact CE2-CD1 4.39Å; Y103-I317 HydrophobicContact CE2-CG2 3.85Å; Y103-I317 HydrophobicContact CG-CD1 3.52Å; Y103-Y319 AromaticContact CD2-CD2 4Å; Y103-Y319 HydrophobicContact CD2-CD2 4Å; Y103-Y319 HydrophobicContact CD2-CE2 4.07Å; Y103-Y319 HydrophobicContact CE2-CD2 4.09Å; Y103-Y319 HydrophobicContact CE2-CE2 4.24Å; Y103-K330 HydrophobicContact CD1-CB 4.36Å; Y103-K330 HydrophobicContact CD2-CB 4.39Å; Y103-K330 HydrophobicContact CE1-CB 3.8Å; Y103-K330 HydrophobicContact CE2-CB 3.83Å; Y103-K330 HydrophobicContact CE2-CD 4.1Å; Y103-K330 VanDerWaalsContact CZ-CB 3.48Å; Y103-K330 PolarHBondContact N-O 3.12Å; Y103-K330 VanDerWaalsContact N-O 3.16Å; Y103-F332 HydrophobicContact CD1-CB 3.99Å; Y103-F332 HydrophobicContact CE1-CB 4.16Å
104	T	95.6	Very high	88.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-44.6	-174.9	-53.6	0	0	0	0	112.5	D102 K114 Y319 V323 R329 K330	D102-T104 WeakPolarHBondContact OD1-CB 3.36Å; D102-T104 PolarHBondContact OD1-N 3.24Å; D102-T104 PolarHBondContact OD1-OG1 2.91Å; T104-K114 HydrophobicContact CG2-CD 4.35Å; T104-Y319 WeakPolarHBondContact O-CE2 3.22Å; T104-Y319 PolarHBondContact O-OH 3.07Å; T104-V323 HydrophobicContact CG2-CG2 4.02Å; T104-R329 HydrophobicContact CG2-CB 4.46Å; T104-R329 HydrophobicContact CG2-CG 4.49Å; T104-R329 WeakPolarHBondContact OG1-CA 3.46Å; T104-R329 WeakPolarHBondContact OG1-CB 3.43Å; T104-K330 PolarHBondContact OG1-N 2.04Å; T104-K330 PolarHBondContact OG1-O 3.18Å
105	D	94.2	Very high	90.1	Very high	54 Å²	54	43 Å²	43	29%	0.289	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	27	-173.6	-52.2	-58.3	0	0	0	111.5	Y66 Y103 K114	Y66-D105 WeakPolarHBondContact CD2-O 3.3Å; Y66-D105 WeakPolarHBondContact CE2-O 3.48Å; Y103-D105 PolarHBondContact O-N 2.95Å; D105-K114 WeakPolarHBondContact OD1-CD 3.4Å; D105-K114 IonicContact OD1-NZ 2.65Å; D105-K114 PolarHBondContact OD1-NZ 3.22Å
106	C	93.6	Very high	91.4	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.014	22%	0.223	C	C	.	.			trans	-64.1	149	177.2	78.4	0	0	0	0	112.2	Y103 C113 C130 L132 Y319	Y103-C106 WeakPolarHBondContact O-CB 3.47Å; Y103-C106 PolarHBondContact O-N 3.34Å; Y103-C106 VanDerWaalsContact O-N 3.12Å; Y103-C106 PolarHBondContact O-SG 2.88Å; C106-C113 WeakPolarHBondContact O-CB 3.34Å; C106-C113 PolarHBondContact O-N 3.28Å; C106-C130 HydrophobicContact CB-CB 3.59Å; C106-C130 WeakPolarHBondContact CB-SG 3.48Å; C106-C130 WeakPolarHBondContact SG-CB 3.3Å; C106-C130 CovalentContact SG-SG 2.04Å; C106-C130 PolarHBondContact SG-SG 3.48Å; C106-L132 HydrophobicContact CB-CD1 4.33Å; C106-L132 HydrophobicContact CB-CD2 4.27Å; C106-Y319 VanDerWaalsContact SG-CD2 3.51Å
107	T	93.8	Very high	92.2	Very high	34 Å²	34	40.5 Å²	40.5	21%	0.209	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	150.6	-175.7	67.3	0	0	0	0	112.6	Y66 G109 N111 C130	Y66-T107 HydrophobicContact CD1-CG2 4.04Å; Y66-T107 HydrophobicContact CE1-CG2 3.78Å; Y66-T107 WeakPolarHBondContact CE1-OG1 3.43Å; Y66-T107 HydrophobicContact CE2-CG2 4.37Å; Y66-T107 HydrophobicContact CG-CG2 4.4Å; Y66-T107 PolarHBondContact OH-OG1 3.38Å; T107-G109 PolarHBondContact OG1-O 2.94Å; T107-N111 CarbonylContact C-O 3.53Å; T107-N111 VanDerWaalsContact CA-O 3.23Å; T107-N111 WeakPolarHBondContact CA-O 3.34Å; T107-N111 WeakPolarHBondContact CB-O 3.2Å; T107-C130 WeakPolarHBondContact O-CB 3.31Å
108	M	90.3	Very high	92.5	Very high	81 Å²	81	40.9 Å²	40.9	40%	0.399	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	96.9	165.7	-173.8	178.1	73.8	0	0	107.7	Q110 N111 R129	M108-Q110 PolarHBondContact O-N 3.25Å; M108-N111 PolarHBondContact N-O 3.43Å; M108-N111 PolarHBondContact O-N 3.3Å; M108-R129 VanDerWaalsContact CB-O 3.26Å; M108-R129 WeakPolarHBondContact CB-O 3.48Å; M108-R129 WeakPolarHBondContact CG-O 3.49Å; M108-R129 HydrophobicContact SD-CB 4.49Å; M108-R129 PolarHBondContact SD-N 3.05Å
109	G	87.7	Confident	92.6	Very high	70 Å²	70	43.8 Å²	43.8	72%	0.722	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.4	-120.4	-168.4	0	0	0	0	0	111.1	T107	T107-G109 PolarHBondContact OG1-O 2.94Å
110	Q	86.5	Confident	92.2	Very high	197 Å²	197	53.3 Å²	53.3	92%	0.921	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-12.6	177.9	-66.8	-172.9	-13.9	0	0	113.8	M108	M108-Q110 PolarHBondContact O-N 3.25Å
111	N	89.3	Confident	91.9	Very high	95 Å²	95	56.7 Å²	56.7	51%	0.508	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	129.2	-174.1	-65.5	-26.6	0	0	0	110.9	T107 M108 C113 V116	T107-N111 CarbonylContact C-O 3.53Å; T107-N111 VanDerWaalsContact CA-O 3.23Å; T107-N111 WeakPolarHBondContact CA-O 3.34Å; T107-N111 WeakPolarHBondContact CB-O 3.2Å; M108-N111 PolarHBondContact N-O 3.43Å; M108-N111 PolarHBondContact O-N 3.3Å; N111-C113 PolarHBondContact O-N 2.95Å; N111-V116 HydrophobicContact CB-CG2 3.86Å
112	S	93.3	Very high	91.5	Very high	25 Å²	25	60.7 Å²	60.7	18%	0.175	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	121.9	168.1	161.9	0	0	0	0	109.7	K114 D115 V116	S112-K114 PolarHBondContact O-N 3.48Å; S112-D115 WeakPolarHBondContact CB-OD2 3.33Å; S112-D115 PolarHBondContact O-N 3.21Å; S112-D115 VanDerWaalsContact O-N 3.08Å; S112-D115 PolarHBondContact OG-N 3.48Å; S112-D115 PolarHBondContact OG-OD2 2.96Å; S112-V116 WeakPolarHBondContact O-CG2 3.43Å; S112-V116 PolarHBondContact O-N 3.09Å
113	C	94.9	Very high	91	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-31.9	178.7	-76	0	0	0	0	112	C106 N111 D115 V116 I117 C128 Y319	C106-C113 WeakPolarHBondContact O-CB 3.34Å; C106-C113 PolarHBondContact O-N 3.28Å; N111-C113 PolarHBondContact O-N 2.95Å; C113-D115 VanDerWaalsContact C-N 3.31Å; C113-D115 PolarHBondContact O-N 3.44Å; C113-V116 PolarHBondContact O-N 3.49Å; C113-I117 WeakPolarHBondContact O-CB 3.45Å; C113-I117 VanDerWaalsContact O-CG1 3.27Å; C113-I117 WeakPolarHBondContact O-CG1 3.49Å; C113-I117 PolarHBondContact O-N 2.97Å; C113-C128 WeakPolarHBondContact CA-SG 3.33Å; C113-C128 HydrophobicContact CB-CB 3.69Å; C113-C128 WeakPolarHBondContact CB-SG 3.4Å; C113-C128 WeakPolarHBondContact SG-CB 3.29Å; C113-C128 CovalentContact SG-SG 2.04Å; C113-C128 PolarHBondContact SG-SG 3.16Å; C113-Y319 HydrophobicContact CB-CD1 4.07Å; C113-Y319 HydrophobicContact CB-CD2 3.81Å; C113-Y319 HydrophobicContact CB-CE2 4.28Å; C113-Y319 HydrophobicContact CB-CG 3.67Å
114	K	93.6	Very high	90.2	Very high	50 Å²	50	74.2 Å²	74.2	22%	0.217	40%	0.404	C	S	.	.	H	α-helix	trans	-58.9	-42.2	173.5	-177.1	-179.2	-176.6	180	0	112	T104 D105 S112 A118 A324	T104-K114 HydrophobicContact CG2-CD 4.35Å; D105-K114 WeakPolarHBondContact OD1-CD 3.4Å; D105-K114 IonicContact OD1-NZ 2.65Å; D105-K114 PolarHBondContact OD1-NZ 3.22Å; S112-K114 PolarHBondContact O-N 3.48Å; K114-A118 WeakPolarHBondContact O-CB 3.31Å; K114-A118 PolarHBondContact O-N 3.28Å; K114-A324 HydrophobicContact CG-CB 3.93Å
115	D	92.2	Very high	89.4	Confident	103 Å²	103	77.9 Å²	77.9	55%	0.551	44%	0.442	S	S	*	.	H	α-helix	trans	-78.1	-39.3	-178.5	-59.8	-33.7	0	0	0	111.5	S112 C113 I117 A118 N119	S112-D115 WeakPolarHBondContact CB-OD2 3.33Å; S112-D115 PolarHBondContact O-N 3.21Å; S112-D115 VanDerWaalsContact O-N 3.08Å; S112-D115 PolarHBondContact OG-N 3.48Å; S112-D115 PolarHBondContact OG-OD2 2.96Å; C113-D115 VanDerWaalsContact C-N 3.31Å; C113-D115 PolarHBondContact O-N 3.44Å; D115-I117 VanDerWaalsContact C-N 3.3Å; D115-I117 PolarHBondContact O-N 2.84Å; D115-A118 PolarHBondContact O-N 3.25Å; D115-N119 PolarHBondContact O-N 2.62Å; D115-N119 VanDerWaalsContact O-N 3.07Å
116	V	93.3	Very high	88.9	Confident	31 Å²	31	77.5 Å²	77.5	19%	0.188	44%	0.441	C	S	.	.	H	α-helix	trans	-57.1	-46.2	173.4	171.9	0	0	0	0	110.6	N111 S112 C113 N119 R122 T126 C128	N111-V116 HydrophobicContact CB-CG2 3.86Å; S112-V116 WeakPolarHBondContact O-CG2 3.43Å; S112-V116 PolarHBondContact O-N 3.09Å; C113-V116 PolarHBondContact O-N 3.49Å; V116-N119 PolarHBondContact O-N 3.37Å; V116-R122 WeakPolarHBondContact O-CD 3.42Å; V116-T126 HydrophobicContact CG1-CG2 3.93Å; V116-C128 HydrophobicContact CG1-CB 4.35Å
117	I	92.7	Very high	88.6	Confident	5 Å²	5	80 Å²	80	3%	0.026	46%	0.459	C	S	.	.	H	α-helix	trans	-81	-16.8	-178.7	-61.4	-62.1	0	0	0	112.7	C113 D115 N119 R122 C128 Y319 N320 P322	C113-I117 WeakPolarHBondContact O-CB 3.45Å; C113-I117 VanDerWaalsContact O-CG1 3.27Å; C113-I117 WeakPolarHBondContact O-CG1 3.49Å; C113-I117 PolarHBondContact O-N 2.97Å; D115-I117 VanDerWaalsContact C-N 3.3Å; D115-I117 PolarHBondContact O-N 2.84Å; I117-N119 VanDerWaalsContact C-N 3.35Å; I117-R122 VanDerWaalsContact CA-NH1 3.3Å; I117-R122 PolarHBondContact O-NH1 3.05Å; I117-C128 HydrophobicContact CD1-CB 4.48Å; I117-C128 HydrophobicContact CG1-CB 4.35Å; I117-Y319 HydrophobicContact CB-CD1 4.39Å; I117-Y319 WeakPolarHBondContact CD1-O 3.25Å; I117-Y319 HydrophobicContact CG1-CD1 4Å; I117-Y319 WeakPolarHBondContact CG1-O 3.2Å; I117-N320 WeakPolarHBondContact CG2-O 3.4Å; I117-P322 HydrophobicContact CG2-CB 4.03Å
118	A	90.8	Very high	88.6	Confident	36 Å²	36	78.4 Å²	78.4	30%	0.298	45%	0.449	S	S	.	.	H	α-helix	trans	-78.4	-21.7	169.2	0	0	0	0	0	112.6	K114 D115 F120 A324	K114-A118 WeakPolarHBondContact O-CB 3.31Å; K114-A118 PolarHBondContact O-N 3.28Å; D115-A118 PolarHBondContact O-N 3.25Å; A118-F120 PolarHBondContact O-N 3.14Å; A118-A324 HydrophobicContact CB-CB 3.77Å
119	N	90.8	Very high	88.8	Confident	81 Å²	81	80.7 Å²	80.7	43%	0.433	45%	0.453	S	S	.	.			trans	-73.7	113.8	-178.6	-170.6	-3.1	0	0	0	111.3	D115 V116 I117 S121 R122	D115-N119 PolarHBondContact O-N 2.62Å; D115-N119 VanDerWaalsContact O-N 3.07Å; V116-N119 PolarHBondContact O-N 3.37Å; I117-N119 VanDerWaalsContact C-N 3.35Å; N119-S121 VanDerWaalsContact C-N 3.32Å; N119-S121 WeakPolarHBondContact OD1-CB 3.24Å; N119-S121 PolarHBondContact OD1-N 2.86Å; N119-R122 WeakPolarHBondContact O-CG 3.39Å; N119-R122 PolarHBondContact O-NH1 3.32Å
120	F	83.2	Confident	89.2	Confident	204 Å²	204	77.4 Å²	77.4	90%	0.895	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-23.2	176.8	-68.3	-80.6	0	0	0	113.4	A118 R122	A118-F120 PolarHBondContact O-N 3.14Å; F120-R122 PolarHBondContact O-N 2.66Å
121	S	88	Confident	89.6	Confident	108 Å²	108	71.9 Å²	71.9	76%	0.755	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	7	178.8	-52.2	0	0	0	0	112.9	N119	N119-S121 VanDerWaalsContact C-N 3.32Å; N119-S121 WeakPolarHBondContact OD1-CB 3.24Å; N119-S121 PolarHBondContact OD1-N 2.86Å
122	R	86.2	Confident	89.9	Confident	84 Å²	84	67.8 Å²	67.8	32%	0.317	38%	0.377	S	S	.	.	S	Bend	trans	-68.2	145.6	-179.7	75.6	-179.6	-175.4	-109.8	9.8	110.5	V116 I117 N119 F120	V116-R122 WeakPolarHBondContact O-CD 3.42Å; I117-R122 VanDerWaalsContact CA-NH1 3.3Å; I117-R122 PolarHBondContact O-NH1 3.05Å; N119-R122 WeakPolarHBondContact O-CG 3.39Å; N119-R122 PolarHBondContact O-NH1 3.32Å; F120-R122 PolarHBondContact O-N 2.66Å
123	P	84.8	Confident	89.9	Confident	96 Å²	96	71.8 Å²	71.8	62%	0.623	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-54.1	142.5	171.3	-24.2	32.6	0	0	0	111.6	G125 T126	P123-G125 PolarHBondContact O-N 2.96Å; P123-T126 WeakPolarHBondContact CD-OG1 3.3Å; P123-T126 VanDerWaalsContact O-CB 3.28Å; P123-T126 WeakPolarHBondContact O-CB 3.02Å; P123-T126 PolarHBondContact O-N 2.96Å; P123-T126 VanDerWaalsContact O-N 3.1Å; P123-T126 PolarHBondContact O-OG1 3.26Å
124	E	79.7	Confident	90	Very high	203 Å²	203	72.2 Å²	72.2	95%	0.949	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	138.8	173.1	-161.5	169.3	-163.2	0	0	110	T126	E124-T126 VanDerWaalsContact C-N 3.3Å; E124-T126 PolarHBondContact O-N 3.16Å
125	G	78.2	Confident	90	Very high	77 Å²	77	75 Å²	75	79%	0.794	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	79	2.3	-173.7	0	0	0	0	0	115.7	P123 S127	P123-G125 PolarHBondContact O-N 2.96Å; G125-S127 PolarHBondContact O-N 3.47Å
126	T	84.9	Confident	90.1	Very high	45 Å²	45	70.2 Å²	70.2	28%	0.276	39%	0.386	S	S	.	.			trans	-59.3	111.5	171.3	-60.1	0	0	0	0	110.2	V116 P123 E124	V116-T126 HydrophobicContact CG1-CG2 3.93Å; P123-T126 WeakPolarHBondContact CD-OG1 3.3Å; P123-T126 VanDerWaalsContact O-CB 3.28Å; P123-T126 WeakPolarHBondContact O-CB 3.02Å; P123-T126 PolarHBondContact O-N 2.96Å; P123-T126 VanDerWaalsContact O-N 3.1Å; P123-T126 PolarHBondContact O-OG1 3.26Å; E124-T126 VanDerWaalsContact C-N 3.3Å; E124-T126 PolarHBondContact O-N 3.16Å
127	S	86.2	Confident	90	Very high	55 Å²	55	72.4 Å²	72.4	39%	0.385	40%	0.4	S	S	.	.			trans	-104.3	135.9	173.5	70.3	0	0	0	0	110.5	G125	G125-S127 PolarHBondContact O-N 3.47Å
128	C	94.4	Very high	89.9	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.8	168.9	-160.2	0	0	0	0	109.6	C113 V116 I117 Y319	C113-C128 WeakPolarHBondContact CA-SG 3.33Å; C113-C128 HydrophobicContact CB-CB 3.69Å; C113-C128 WeakPolarHBondContact CB-SG 3.4Å; C113-C128 WeakPolarHBondContact SG-CB 3.29Å; C113-C128 CovalentContact SG-SG 2.04Å; C113-C128 PolarHBondContact SG-SG 3.16Å; V116-C128 HydrophobicContact CG1-CB 4.35Å; I117-C128 HydrophobicContact CD1-CB 4.48Å; I117-C128 HydrophobicContact CG1-CB 4.35Å; C128-Y319 PolarHBondContact O-N 3.12Å
129	R	94.9	Very high	89.9	Confident	129 Å²	129	75.8 Å²	75.8	49%	0.487	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	125	176.7	-61.1	-169.5	-177.8	-160.1	4.8	109.7	M108 E316 I317 V318	M108-R129 VanDerWaalsContact CB-O 3.26Å; M108-R129 WeakPolarHBondContact CB-O 3.48Å; M108-R129 WeakPolarHBondContact CG-O 3.49Å; M108-R129 HydrophobicContact SD-CB 4.49Å; M108-R129 PolarHBondContact SD-N 3.05Å; R129-E316 IonicContact NH1-OE1 3.07Å; R129-E316 PolarHBondContact NH1-OE1 3.3Å; R129-I317 WeakPolarHBondContact CA-O 3.45Å; R129-V318 HydrophobicContact CG-CG2 4.24Å
130	C	94.4	Very high	90	Very high	2 Å²	2	72.1 Å²	72.1	1%	0.014	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	144.3	175.5	66.1	0	0	0	0	110.2	C106 T107 I317	C106-C130 HydrophobicContact CB-CB 3.59Å; C106-C130 WeakPolarHBondContact CB-SG 3.48Å; C106-C130 WeakPolarHBondContact SG-CB 3.3Å; C106-C130 CovalentContact SG-SG 2.04Å; C106-C130 PolarHBondContact SG-SG 3.48Å; T107-C130 WeakPolarHBondContact O-CB 3.31Å; C130-I317 PolarHBondContact N-O 3Å; C130-I317 PolarHBondContact O-N 2.96Å
131	V	95.3	Very high	90.3	Very high	81 Å²	81	66.3 Å²	66.3	49%	0.491	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	119.6	-176.4	-179	0	0	0	0	107.7	T314 E316	V131-T314 HydrophobicContact CG1-CG2 3.23Å; V131-E316 HydrophobicContact CG2-CB 4.36Å; V131-E316 HydrophobicContact CG2-CG 4.25Å
132	L	95.4	Very high	90.4	Very high	8 Å²	8	63.8 Å²	63.8	4%	0.042	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.7	-179.2	-60.7	179	0	0	0	109.8	L101 Y103 C106 T314 V315 I317	L101-L132 HydrophobicContact CD1-CD1 4.47Å; L101-L132 HydrophobicContact CD2-CB 4.01Å; L101-L132 HydrophobicContact CD2-CD1 3.8Å; L101-L132 HydrophobicContact CG-CD1 4.2Å; Y103-L132 VanDerWaalsContact CB-CD1 3.5Å; C106-L132 HydrophobicContact CB-CD1 4.33Å; C106-L132 HydrophobicContact CB-CD2 4.27Å; L132-T314 CarbonylContact O-C 3.57Å; L132-T314 WeakPolarHBondContact O-CA 3.32Å; L132-V315 HydrophobicContact CB-CG1 3.95Å; L132-V315 PolarHBondContact N-O 3.38Å; L132-V315 PolarHBondContact O-N 2.83Å; L132-I317 HydrophobicContact CD1-CD1 3.97Å
133	N	95.2	Very high	90.7	Very high	109 Å²	109	62.5 Å²	62.5	58%	0.583	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	139.6	175.2	-59.7	-40.9	0	0	0	109.4	Y313 T314	N133-Y313 WeakPolarHBondContact CA-O 3.31Å; N133-T314 WeakPolarHBondContact OD1-CB 3.02Å; N133-T314 VanDerWaalsContact OD1-CG2 3.31Å; N133-T314 WeakPolarHBondContact OD1-CG2 3.38Å; N133-T314 PolarHBondContact OD1-OG1 3.43Å
134	F	95.2	Very high	91.1	Very high	10 Å²	10	58 Å²	58	4%	0.044	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	160.6	175	61.9	-87	0	0	0	110.4	L62 F99 L101 L136 L208 Y313 V315 F332 I334	L62-F134 HydrophobicContact CD1-CB 4.26Å; F99-F134 HydrophobicContact CD1-CD2 4.14Å; F99-F134 AromaticContact CD1-CE2 3.92Å; F99-F134 HydrophobicContact CD1-CE2 3.92Å; F99-F134 HydrophobicContact CD2-CD2 4.41Å; F99-F134 HydrophobicContact CE1-CB 4.46Å; F99-F134 HydrophobicContact CE1-CD1 4.22Å; F99-F134 AromaticContact CE1-CD2 3.4Å; F99-F134 HydrophobicContact CE1-CD2 3.4Å; F99-F134 HydrophobicContact CE1-CE1 4.29Å; F99-F134 AromaticContact CE1-CE2 3.47Å; F99-F134 HydrophobicContact CE1-CE2 3.47Å; F99-F134 VanDerWaalsContact CE1-CE2 3.47Å; F99-F134 AromaticContact CE1-CG 3.79Å; F99-F134 HydrophobicContact CE1-CG 3.79Å; F99-F134 AromaticContact CE1-CZ 3.92Å; F99-F134 HydrophobicContact CE1-CZ 3.92Å; F99-F134 HydrophobicContact CE2-CB 4.18Å; F99-F134 AromaticContact CE2-CD2 3.73Å; F99-F134 HydrophobicContact CE2-CD2 3.73Å; F99-F134 HydrophobicContact CE2-CE2 4.45Å; F99-F134 HydrophobicContact CE2-CG 4.21Å; F99-F134 HydrophobicContact CZ-CB 3.6Å; F99-F134 HydrophobicContact CZ-CD1 4.17Å; F99-F134 AromaticContact CZ-CD2 3.18Å; F99-F134 HydrophobicContact CZ-CD2 3.18Å; F99-F134 AromaticContact CZ-CE2 3.8Å; F99-F134 HydrophobicContact CZ-CE2 3.8Å; F99-F134 AromaticContact CZ-CG 3.39Å; F99-F134 HydrophobicContact CZ-CG 3.39Å; F99-F134 HydrophobicContact CZ-CZ 4.49Å; L101-F134 HydrophobicContact CD2-CD1 4.07Å; L101-F134 HydrophobicContact CD2-CE1 4.41Å; F134-L136 HydrophobicContact CD2-CD2 4.17Å; F134-L136 HydrophobicContact CD2-CG 4.4Å; F134-L136 HydrophobicContact CE2-CD2 3.92Å; F134-L136 HydrophobicContact CE2-CG 4.07Å; F134-L208 HydrophobicContact CE1-CD1 4.06Å; F134-L208 HydrophobicContact CZ-CD1 3.65Å; F134-Y313 HydrophobicContact CE2-CD2 4.33Å; F134-Y313 HydrophobicContact CE2-CG 4.07Å; F134-Y313 VanDerWaalsContact CZ-CB 3.47Å; F134-Y313 HydrophobicContact CZ-CG 4.2Å; F134-Y313 PolarHBondContact N-O 2.88Å; F134-Y313 PolarHBondContact O-N 3.2Å; F134-Y313 VanDerWaalsContact O-O 3.05Å; F134-V315 HydrophobicContact CD1-CG1 4.34Å; F134-V315 HydrophobicContact CE1-CB 4.03Å; F134-V315 HydrophobicContact CE1-CG1 3.87Å; F134-F332 HydrophobicContact CZ-CE1 4.23Å; F134-I334 HydrophobicContact CE2-CD1 3.96Å; F134-I334 HydrophobicContact CZ-CD1 3.92Å
135	E	94.5	Very high	91.8	Very high	107 Å²	107	50.8 Å²	50.8	50%	0.5	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	129.3	176.3	-174.3	177.2	-176.9	0	0	109.1	Q60 G311	Q60-E135 PolarHBondContact NE2-O 2.86Å; Q60-E135 PolarHBondContact OE1-O 3.25Å; E135-G311 CarbonylContact C-O 3.52Å; E135-G311 WeakPolarHBondContact CA-O 3.36Å
136	L	93.8	Very high	92.7	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	117.7	165.3	-64.5	-176.8	0	0	0	108	F99 F134 D138 V140 L308 K310 G311 Y313 I334	F99-L136 HydrophobicContact CB-CD2 3.68Å; F99-L136 HydrophobicContact CD1-CD2 4.13Å; F99-L136 HydrophobicContact CD2-CD2 3.66Å; F99-L136 HydrophobicContact CE2-CD2 4.37Å; F99-L136 HydrophobicContact CG-CD2 3.53Å; F134-L136 HydrophobicContact CD2-CD2 4.17Å; F134-L136 HydrophobicContact CD2-CG 4.4Å; F134-L136 HydrophobicContact CE2-CD2 3.92Å; F134-L136 HydrophobicContact CE2-CG 4.07Å; L136-D138 PolarHBondContact O-N 2.82Å; L136-V140 HydrophobicContact CD1-CG2 4.3Å; L136-L308 HydrophobicContact CD1-CD2 3.73Å; L136-L308 HydrophobicContact CD1-CG 4.16Å; L136-K310 WeakPolarHBondContact O-CA 3.4Å; L136-K310 WeakPolarHBondContact O-CB 3.31Å; L136-G311 PolarHBondContact N-O 3.2Å; L136-G311 PolarHBondContact O-N 2.83Å; L136-Y313 HydrophobicContact CB-CD2 4.32Å; L136-Y313 HydrophobicContact CB-CE2 4.15Å; L136-Y313 HydrophobicContact CD1-CD2 3.85Å; L136-Y313 HydrophobicContact CD1-CE2 3.5Å; L136-Y313 HydrophobicContact CG-CD2 3.77Å; L136-Y313 HydrophobicContact CG-CE2 3.83Å; L136-I334 HydrophobicContact CD1-CD1 4.42Å
137	T	91.7	Very high	93.2	Very high	77 Å²	77	46.9 Å²	46.9	47%	0.472	25%	0.246	S	C	.	.	S	Bend	trans	-65.6	-19.6	178.5	54.6	0	0	0	0	112.6
138	D	89.5	Confident	93.8	Very high	66 Å²	66	44.7 Å²	44.7	35%	0.353	23%	0.229	S	C	.	.	S	Bend	trans	-144.4	143.1	-157.9	-95.1	-65.5	0	0	0	111	K97 L136	K97-D138 HydrophobicContact CD-CB 3.87Å; K97-D138 VanDerWaalsContact NZ-CB 3.28Å; K97-D138 IonicContact NZ-OD1 3.65Å; K97-D138 PolarHBondContact NZ-OD1 3.32Å; L136-D138 PolarHBondContact O-N 2.82Å
139	N	92	Very high	93.9	Very high	46 Å²	46	44.7 Å²	44.7	25%	0.246	23%	0.229	C	C	.	.			trans	-66.2	136.6	171.6	-62.9	-23.3	0	0	0	109.3	K97 K307 L308 K310	K97-N139 WeakPolarHBondContact CD-O 3.44Å; K97-N139 WeakPolarHBondContact CE-O 3.49Å; K97-N139 PolarHBondContact NZ-O 3.11Å; N139-K307 HydrophobicContact CB-CD 4.04Å; N139-L308 CarbonylContact C-O 3.58Å; N139-L308 WeakPolarHBondContact CA-O 3.46Å; N139-K310 PolarHBondContact OD1-N 3.31Å
140	V	91.9	Very high	94.1	Very high	5 Å²	5	38.6 Å²	38.6	3%	0.03	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	107.4	172	-171	0	0	0	0	108.1	K97 L136 V144 K307 L308 N336	K97-V140 HydrophobicContact CB-CG1 4.37Å; K97-V140 HydrophobicContact CB-CG2 4.33Å; L136-V140 HydrophobicContact CD1-CG2 4.3Å; V140-V144 HydrophobicContact CB-CG2 4.22Å; V140-V144 HydrophobicContact CG1-CG1 4.15Å; V140-V144 HydrophobicContact CG1-CG2 3.9Å; V140-V144 VanDerWaalsContact O-CG2 3.28Å; V140-V144 WeakPolarHBondContact O-CG2 3.5Å; V140-K307 CarbonylContact O-C 3.59Å; V140-K307 VanDerWaalsContact O-CA 3.29Å; V140-K307 WeakPolarHBondContact O-CA 3.21Å; V140-K307 WeakPolarHBondContact O-CB 3.29Å; V140-L308 HydrophobicContact CB-CB 4.13Å; V140-L308 PolarHBondContact N-O 2.81Å; V140-L308 PolarHBondContact O-N 3.23Å; V140-N336 HydrophobicContact CG1-CB 3.87Å
141	E	90.4	Very high	94.1	Very high	82 Å²	82	39.2 Å²	39.2	38%	0.383	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	146.4	-175.5	-58.8	-57.7	145.3	0	0	112.1	N336	E141-N336 WeakPolarHBondContact O-CB 3.4Å
142	S	90	Very high	94.1	Very high	55 Å²	55	36.4 Å²	36.4	39%	0.385	20%	0.198	S	C	.	.	S	Bend	trans	-60.8	144.4	175.5	175.6	0	0	0	0	111.8	H299 D306	S142-H299 PolarHBondContact OG-CD2 2.77Å; S142-D306 WeakPolarHBondContact CB-O 3.38Å; S142-D306 PolarHBondContact N-O 2.87Å
143	P	91.7	Very high	94.2	Very high	56 Å²	56	37.1 Å²	37.1	36%	0.364	20%	0.201	S	C	.	.	S	Bend	cis	-82	134.5	-0.2	30.8	-33.4	0	0	0	112.9	Y145 N336 A337	P143-Y145 HydrophobicContact CB-CE2 3.94Å; P143-Y145 HydrophobicContact CG-CE2 3.88Å; P143-Y145 WeakPolarHBondContact O-CE2 3.4Å; P143-N336 VanDerWaalsContact O-CA 3.26Å; P143-N336 WeakPolarHBondContact O-CA 3.45Å; P143-N336 WeakPolarHBondContact O-CB 3.36Å; P143-A337 HydrophobicContact CG-CB 4.26Å; P143-A337 PolarHBondContact O-N 3.36Å
144	V	93.2	Very high	94.3	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	134.3	179	-174.2	0	0	0	0	111.8	V140 V297 H299 L308 I334	V140-V144 HydrophobicContact CB-CG2 4.22Å; V140-V144 HydrophobicContact CG1-CG1 4.15Å; V140-V144 HydrophobicContact CG1-CG2 3.9Å; V140-V144 VanDerWaalsContact O-CG2 3.28Å; V140-V144 WeakPolarHBondContact O-CG2 3.5Å; V144-V297 HydrophobicContact CB-CB 4.02Å; V144-V297 HydrophobicContact CB-CG2 3.86Å; V144-V297 HydrophobicContact CG1-CG2 3.8Å; V144-V297 PolarHBondContact O-N 2.88Å; V144-H299 PolarHBondContact N-NE2 2.96Å; V144-H299 VanDerWaalsContact N-NE2 3.17Å; V144-L308 HydrophobicContact CG1-CB 4.42Å; V144-L308 HydrophobicContact CG1-CD2 4.3Å; V144-L308 HydrophobicContact CG2-CB 4.19Å; V144-I334 HydrophobicContact CG1-CG2 3.68Å
145	Y	94.9	Very high	94.4	Very high	53 Å²	53	38.6 Å²	38.6	21%	0.208	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	144	-178.2	-59.3	-82.6	0	0	0	111	P143 Y147 L293 R296 S335 A337	P143-Y145 HydrophobicContact CB-CE2 3.94Å; P143-Y145 HydrophobicContact CG-CE2 3.88Å; P143-Y145 WeakPolarHBondContact O-CE2 3.4Å; Y145-Y147 VanDerWaalsContact CB-CE2 3.4Å; Y145-Y147 HydrophobicContact CG-CE2 4.4Å; Y145-L293 HydrophobicContact CD1-CD1 3.7Å; Y145-L293 HydrophobicContact CD1-CD2 4.12Å; Y145-L293 HydrophobicContact CG-CD1 4.06Å; Y145-R296 HydrophobicContact CD1-CB 3.9Å; Y145-R296 HydrophobicContact CE1-CB 4.2Å; Y145-S335 WeakPolarHBondContact CA-O 3.19Å; Y145-S335 WeakPolarHBondContact CB-O 3.42Å; Y145-S335 PolarHBondContact N-O 3.49Å; Y145-S335 PolarHBondContact O-N 3.19Å; Y145-A337 HydrophobicContact CD2-CB 4.42Å; Y145-A337 HydrophobicContact CE2-CB 3.64Å
146	L	96.8	Very high	94.4	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.9	171.9	-53.2	-172.3	0	0	0	108.6	L208 I221 L293 H294 S295 V297 F332 I333 I334	L146-L208 HydrophobicContact CD1-CD2 4.44Å; L146-L208 HydrophobicContact CD2-CD2 4.3Å; L146-I221 HydrophobicContact CD1-CG2 3.73Å; L146-L293 WeakPolarHBondContact O-CD1 3.19Å; L146-H294 WeakPolarHBondContact O-CA 3.46Å; L146-H294 VanDerWaalsContact O-CB 3.31Å; L146-H294 WeakPolarHBondContact O-CB 3.19Å; L146-H294 PolarHBondContact O-N 3.03Å; L146-S295 PolarHBondContact N-O 2.71Å; L146-S295 PolarHBondContact O-N 3.11Å; L146-V297 HydrophobicContact CD2-CG2 4.49Å; L146-F332 HydrophobicContact CB-CE2 4.33Å; L146-F332 HydrophobicContact CD1-CE2 4.26Å; L146-F332 HydrophobicContact CD1-CZ 4.2Å; L146-F332 HydrophobicContact CD2-CZ 4.04Å; L146-I333 CarbonylContact C-O 3.59Å; L146-I333 WeakPolarHBondContact CA-O 3.46Å; L146-I334 HydrophobicContact CD2-CB 4.27Å; L146-I334 HydrophobicContact CD2-CD1 4.41Å; L146-I334 HydrophobicContact CD2-CG1 3.79Å; L146-I334 HydrophobicContact CD2-CG2 4.08Å
147	Y	97	Very high	94.6	Very high	38 Å²	38	41.1 Å²	41.1	15%	0.149	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	151.8	176.7	-54.7	-102.8	0	0	0	110.3	Y145 R291 K292 L293 I333	Y145-Y147 VanDerWaalsContact CB-CE2 3.4Å; Y145-Y147 HydrophobicContact CG-CE2 4.4Å; Y147-R291 HydrophobicContact CD1-CG 4.23Å; Y147-K292 VanDerWaalsContact CA-O 3.22Å; Y147-K292 WeakPolarHBondContact CA-O 3.29Å; Y147-K292 VanDerWaalsContact CB-O 3.31Å; Y147-K292 WeakPolarHBondContact CB-O 3.36Å; Y147-L293 HydrophobicContact CD1-CB 4.04Å; Y147-L293 HydrophobicContact CD1-CD1 4.11Å; Y147-L293 HydrophobicContact CE1-CB 3.88Å; Y147-L293 HydrophobicContact CE1-CD1 3.74Å; Y147-L293 HydrophobicContact CE1-CG 4.37Å; Y147-L293 HydrophobicContact CE2-CD1 4.33Å; Y147-I333 HydrophobicContact CD2-CG2 4.44Å; Y147-I333 PolarHBondContact N-O 3.34Å; Y147-I333 PolarHBondContact O-N 3.26Å
148	Y	97.9	Very high	94.8	Very high	10 Å²	10	47.7 Å²	47.7	4%	0.039	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	140.1	158.3	57.8	-93.3	0	0	0	109.5	F202 W281 R291 K292 H294 R331	Y148-F202 AromaticContact CD1-CD1 3.74Å; Y148-F202 HydrophobicContact CD1-CD1 3.74Å; Y148-F202 AromaticContact CD1-CE1 3.65Å; Y148-F202 HydrophobicContact CD1-CE1 3.65Å; Y148-F202 HydrophobicContact CD1-CZ 4.34Å; Y148-F202 AromaticContact CD2-CD1 3.92Å; Y148-F202 HydrophobicContact CD2-CD1 3.92Å; Y148-F202 HydrophobicContact CD2-CD2 4.01Å; Y148-F202 AromaticContact CD2-CE1 3.99Å; Y148-F202 HydrophobicContact CD2-CE1 3.99Å; Y148-F202 HydrophobicContact CD2-CE2 4.07Å; Y148-F202 AromaticContact CD2-CG 3.91Å; Y148-F202 HydrophobicContact CD2-CG 3.91Å; Y148-F202 HydrophobicContact CD2-CZ 4.03Å; Y148-F202 AromaticContact CE1-CD1 3.8Å; Y148-F202 HydrophobicContact CE1-CD1 3.8Å; Y148-F202 HydrophobicContact CE1-CE1 4.2Å; Y148-F202 HydrophobicContact CE1-CG 4.42Å; Y148-F202 HydrophobicContact CE2-CB 3.95Å; Y148-F202 AromaticContact CE2-CD1 3.92Å; Y148-F202 HydrophobicContact CE2-CD1 3.92Å; Y148-F202 HydrophobicContact CE2-CD2 4.18Å; Y148-F202 HydrophobicContact CE2-CE1 4.45Å; Y148-F202 AromaticContact CE2-CG 3.74Å; Y148-F202 HydrophobicContact CE2-CG 3.74Å; Y148-F202 AromaticContact CG-CD1 3.83Å; Y148-F202 HydrophobicContact CG-CD1 3.83Å; Y148-F202 AromaticContact CG-CE1 3.56Å; Y148-F202 HydrophobicContact CG-CE1 3.56Å; Y148-F202 HydrophobicContact CG-CE2 4.3Å; Y148-F202 HydrophobicContact CG-CG 4.3Å; Y148-F202 AromaticContact CG-CZ 3.79Å; Y148-F202 HydrophobicContact CG-CZ 3.79Å; Y148-F202 AromaticContact CZ-CD1 3.88Å; Y148-W281 HydrophobicContact CE2-CE3 4.12Å; Y148-W281 AromaticContact CE2-CZ3 3.98Å; Y148-W281 HydrophobicContact CE2-CZ3 3.98Å; Y148-R291 CarbonylContact O-C 3.48Å; Y148-R291 WeakPolarHBondContact O-CA 3.28Å; Y148-K292 HydrophobicContact CD2-CB 4.22Å; Y148-K292 HydrophobicContact CE1-CB 3.97Å; Y148-K292 HydrophobicContact CE2-CB 3.51Å; Y148-K292 HydrophobicContact CE2-CD 3.82Å; Y148-K292 HydrophobicContact CE2-CG 4.19Å; Y148-K292 PolarHBondContact N-O 2.92Å; Y148-K292 PolarHBondContact O-N 3.2Å; Y148-K292 WeakPolarHBondContact OH-CB 3.28Å; Y148-K292 VanDerWaalsContact OH-CD 3.24Å; Y148-K292 WeakPolarHBondContact OH-CD 3.4Å; Y148-H294 HydrophobicContact CD1-CB 3.86Å; Y148-H294 HydrophobicContact CE1-CB 4.32Å; Y148-R331 CarbonylContact C-O 3.51Å; Y148-R331 VanDerWaalsContact CA-O 3.31Å; Y148-R331 WeakPolarHBondContact CA-O 2.91Å
149	G	97	Very high	95.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	135.3	174.5	0	0	0	0	0	110.9	F290 K330 R331	G149-F290 CarbonylContact C-O 3.55Å; G149-F290 VanDerWaalsContact CA-O 3.3Å; G149-F290 WeakPolarHBondContact CA-O 3.45Å; G149-K330 CarbonylContact O-C 3.37Å; G149-K330 WeakPolarHBondContact O-CA 3.01Å; G149-R331 PolarHBondContact N-O 2.86Å; G149-R331 PolarHBondContact O-N 3.06Å
150	L	97.6	Very high	95.4	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	137.5	169.9	-67.4	179.4	0	0	0	109.5	F153 F202 W281 N289 F290 Y321 R329 K330	L150-F153 HydrophobicContact CB-CB 4.28Å; L150-F153 HydrophobicContact CD1-CG 4.45Å; L150-F202 HydrophobicContact CD1-CD2 4.21Å; L150-F202 HydrophobicContact CD2-CD2 4.32Å; L150-F202 HydrophobicContact CD2-CE2 4.12Å; L150-W281 HydrophobicContact CD1-CH2 3.8Å; L150-W281 HydrophobicContact CD1-CZ3 3.87Å; L150-N289 WeakPolarHBondContact O-CA 3.33Å; L150-F290 HydrophobicContact CB-CE1 4.19Å; L150-F290 HydrophobicContact CB-CE2 4.08Å; L150-F290 HydrophobicContact CB-CZ 3.84Å; L150-F290 HydrophobicContact CD1-CE2 4.08Å; L150-F290 HydrophobicContact CD1-CZ 3.78Å; L150-F290 HydrophobicContact CG-CE2 4.38Å; L150-F290 HydrophobicContact CG-CZ 4.31Å; L150-F290 PolarHBondContact N-O 2.72Å; L150-F290 PolarHBondContact O-N 3.12Å; L150-Y321 HydrophobicContact CD1-CE1 3.98Å; L150-Y321 HydrophobicContact CD2-CD1 4.38Å; L150-Y321 HydrophobicContact CD2-CE1 4.42Å; L150-R329 WeakPolarHBondContact CA-O 3.47Å; L150-K330 HydrophobicContact CD2-CB 4.46Å; L150-K330 HydrophobicContact CD2-CD 4.26Å; L150-K330 HydrophobicContact CD2-CG 3.77Å
151	S	96.1	Very high	95.7	Very high	15 Å²	15	55.7 Å²	55.7	11%	0.105	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	145.6	171.5	-59.1	0	0	0	0	110.7	F153 N289 G328 R329 R331	S151-F153 VanDerWaalsContact C-N 3.29Å; S151-N289 WeakPolarHBondContact CA-OD1 3.34Å; S151-N289 VanDerWaalsContact CB-OD1 3.28Å; S151-N289 WeakPolarHBondContact CB-OD1 3.42Å; S151-G328 WeakPolarHBondContact O-CA 3.28Å; S151-R329 PolarHBondContact N-O 2.87Å; S151-R329 PolarHBondContact O-N 2.76Å; S151-R329 VanDerWaalsContact O-N 3.15Å; S151-R331 VanDerWaalsContact OG-CZ 3.24Å; S151-R331 PolarHBondContact OG-NH1 2.64Å; S151-R331 PolarHBondContact OG-NH2 2.96Å
152	G	95.3	Very high	96	Very high	21 Å²	21	57.3 Å²	57.3	22%	0.216	26%	0.262	C	S	.	.	S	Bend	trans	71.1	20.7	-178.7	0	0	0	0	0	114.2	P288 N289 F326	G152-P288 PolarHBondContact N-O 3.16Å; G152-N289 PolarHBondContact N-OD1 3.24Å; G152-F326 WeakPolarHBondContact O-CD2 3.44Å
153	F	96.8	Very high	96.4	Very high	24 Å²	24	54.9 Å²	54.9	11%	0.105	25%	0.245	C	C	.	.			trans	-111.2	107.3	179.8	-168	-84.7	0	0	0	111.2	L150 S151 Q155 Y160 W281 P288 F290 Y321 F326	L150-F153 HydrophobicContact CB-CB 4.28Å; L150-F153 HydrophobicContact CD1-CG 4.45Å; S151-F153 VanDerWaalsContact C-N 3.29Å; F153-Q155 HydrophobicContact CD1-CG 3.54Å; F153-Q155 HydrophobicContact CE1-CG 3.55Å; F153-Q155 PolarHBondContact O-N 3.32Å; F153-Y160 HydrophobicContact CE1-CE2 4.4Å; F153-Y160 AromaticContact CE1-CZ 3.97Å; F153-Y160 HydrophobicContact CZ-CE2 4.35Å; F153-W281 HydrophobicContact CE1-CH2 4.01Å; F153-W281 AromaticContact CE1-CZ2 3.98Å; F153-W281 HydrophobicContact CE1-CZ2 3.98Å; F153-W281 HydrophobicContact CZ-CH2 4.25Å; F153-W281 HydrophobicContact CZ-CZ2 4.06Å; F153-P288 PolarHBondContact N-O 3.03Å; F153-P288 VanDerWaalsContact O-CA 3.31Å; F153-P288 WeakPolarHBondContact O-CA 3.38Å; F153-F290 HydrophobicContact CB-CE1 3.95Å; F153-F290 HydrophobicContact CB-CZ 4.36Å; F153-F290 AromaticContact CD1-CE1 3.86Å; F153-F290 HydrophobicContact CD1-CE1 3.86Å; F153-F290 AromaticContact CD1-CZ 3.87Å; F153-F290 HydrophobicContact CD1-CZ 3.87Å; F153-F290 HydrophobicContact CG-CE1 4.33Å; F153-F290 HydrophobicContact CG-CZ 4.41Å; F153-F290 WeakPolarHBondContact O-CE1 3.29Å; F153-Y321 HydrophobicContact CE2-CE1 4.41Å; F153-Y321 WeakPolarHBondContact CE2-OH 3.19Å; F153-Y321 VanDerWaalsContact CZ-OH 3.29Å; F153-Y321 WeakPolarHBondContact CZ-OH 3.45Å; F153-F326 HydrophobicContact CB-CE2 4.28Å; F153-F326 HydrophobicContact CD2-CE1 4.2Å; F153-F326 AromaticContact CD2-CE2 3.9Å; F153-F326 HydrophobicContact CD2-CE2 3.9Å; F153-F326 AromaticContact CD2-CZ 3.61Å; F153-F326 HydrophobicContact CD2-CZ 3.61Å; F153-F326 HydrophobicContact CE2-CE1 4.49Å; F153-F326 HydrophobicContact CE2-CZ 4.29Å
154	Y	96.6	Very high	96.7	Very high	150 Å²	150	56 Å²	56	59%	0.588	24%	0.242	S	C	*	.			trans	-85.1	71.3	-169.1	-63.3	-93	0	0	0	113.6	N156 H157 P288	Y154-N156 PolarHBondContact O-N 3.5Å; Y154-H157 WeakPolarHBondContact O-CB 3.32Å; Y154-H157 PolarHBondContact O-N 3.05Å; Y154-P288 HydrophobicContact CD1-CB 3.69Å; Y154-P288 HydrophobicContact CD1-CG 4.29Å; Y154-P288 HydrophobicContact CE1-CB 3.65Å; Y154-P288 HydrophobicContact CE1-CG 3.95Å; Y154-P288 HydrophobicContact CE2-CB 4.48Å; Y154-P288 HydrophobicContact CG-CB 4.14Å
155	Q	96.9	Very high	96.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-21.8	174.5	-71.1	-158	-31.2	0	0	113.5	F153 H157 Y160 V161 W281 A285 F290	F153-Q155 HydrophobicContact CD1-CG 3.54Å; F153-Q155 HydrophobicContact CE1-CG 3.55Å; F153-Q155 PolarHBondContact O-N 3.32Å; Q155-H157 VanDerWaalsContact C-N 3.29Å; Q155-H157 PolarHBondContact O-N 3.42Å; Q155-Y160 HydrophobicContact CB-CD1 4.32Å; Q155-Y160 HydrophobicContact CB-CE1 3.96Å; Q155-Y160 HydrophobicContact CG-CE1 3.81Å; Q155-Y160 VanDerWaalsContact O-CD1 3.25Å; Q155-Y160 WeakPolarHBondContact O-CD1 3.23Å; Q155-V161 WeakPolarHBondContact O-CG2 3.45Å; Q155-W281 VanDerWaalsContact NE2-CZ2 3.33Å; Q155-A285 HydrophobicContact CB-CB 4.25Å; Q155-F290 HydrophobicContact CG-CE1 3.82Å; Q155-F290 HydrophobicContact CG-CZ 3.88Å
156	N	96.3	Very high	97.1	Very high	72 Å²	72	57.4 Å²	57.4	39%	0.385	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-0.8	-179.3	65.4	-11.1	0	0	0	113.9	Y154 R158 A286	Y154-N156 PolarHBondContact O-N 3.5Å; N156-R158 PolarHBondContact O-N 3Å; N156-A286 WeakPolarHBondContact CB-O 3.28Å; N156-A286 PolarHBondContact ND2-O 2.78Å
157	H	97.1	Very high	97.1	Very high	90 Å²	90	61.6 Å²	61.6	42%	0.417	27%	0.274	S	S	.	.			trans	-63.5	127.6	177.9	-175.7	-83	0	0	0	110.3	Y154 Q155 R159 Y160 V161	Y154-H157 WeakPolarHBondContact O-CB 3.32Å; Y154-H157 PolarHBondContact O-N 3.05Å; Q155-H157 VanDerWaalsContact C-N 3.29Å; Q155-H157 PolarHBondContact O-N 3.42Å; H157-R159 VanDerWaalsContact C-N 3.3Å; H157-R159 PolarHBondContact ND1-N 3.01Å; H157-R159 PolarHBondContact O-N 3.47Å; H157-R159 VanDerWaalsContact O-N 3.11Å; H157-Y160 WeakPolarHBondContact O-CA 3.5Å; H157-Y160 WeakPolarHBondContact O-CB 3.16Å; H157-Y160 PolarHBondContact O-N 2.97Å; H157-V161 PolarHBondContact O-N 3.48Å
158	R	96.5	Very high	97.1	Very high	215 Å²	215	59.8 Å²	59.8	81%	0.811	27%	0.268	S	S	*	.	H	α-helix	trans	-48.7	-46.2	-172.5	-178.1	-177.9	175.2	-161.3	-0.5	113.9	N156 Y160 K162	N156-R158 PolarHBondContact O-N 3Å; R158-Y160 VanDerWaalsContact C-N 3.31Å; R158-Y160 PolarHBondContact O-N 3.15Å; R158-K162 WeakPolarHBondContact O-CB 3.41Å; R158-K162 PolarHBondContact O-N 2.71Å; R158-K162 VanDerWaalsContact O-N 3.16Å
159	R	96.4	Very high	97.1	Very high	201 Å²	201	59.5 Å²	59.5	76%	0.758	27%	0.266	S	S	*	.	H	α-helix	trans	-66.4	-31.7	178.3	-68.2	-169.2	-71	166.5	0	113	H157 S163	H157-R159 VanDerWaalsContact C-N 3.3Å; H157-R159 PolarHBondContact ND1-N 3.01Å; H157-R159 PolarHBondContact O-N 3.47Å; H157-R159 VanDerWaalsContact O-N 3.11Å; R159-S163 VanDerWaalsContact O-CB 3.32Å; R159-S163 WeakPolarHBondContact O-CB 3.37Å; R159-S163 PolarHBondContact O-N 2.82Å
160	Y	97.5	Very high	97.1	Very high	27 Å²	27	63.9 Å²	63.9	11%	0.106	29%	0.289	C	S	.	.	H	α-helix	trans	-73.7	-51.2	178.6	-177.1	-90.2	0	0	0	110.3	F153 Q155 H157 R158 K162 S163 A196 I197 S200	F153-Y160 HydrophobicContact CE1-CE2 4.4Å; F153-Y160 AromaticContact CE1-CZ 3.97Å; F153-Y160 HydrophobicContact CZ-CE2 4.35Å; Q155-Y160 HydrophobicContact CB-CD1 4.32Å; Q155-Y160 HydrophobicContact CB-CE1 3.96Å; Q155-Y160 HydrophobicContact CG-CE1 3.81Å; Q155-Y160 VanDerWaalsContact O-CD1 3.25Å; Q155-Y160 WeakPolarHBondContact O-CD1 3.23Å; H157-Y160 WeakPolarHBondContact O-CA 3.5Å; H157-Y160 WeakPolarHBondContact O-CB 3.16Å; H157-Y160 PolarHBondContact O-N 2.97Å; R158-Y160 VanDerWaalsContact C-N 3.31Å; R158-Y160 PolarHBondContact O-N 3.15Å; Y160-K162 VanDerWaalsContact C-N 3.26Å; Y160-K162 PolarHBondContact O-N 3.21Å; Y160-S163 PolarHBondContact O-N 2.63Å; Y160-A196 HydrophobicContact CD2-CB 3.99Å; Y160-A196 HydrophobicContact CE2-CB 4.36Å; Y160-A196 WeakPolarHBondContact CE2-O 3.37Å; Y160-I197 HydrophobicContact CD1-CG1 3.96Å; Y160-I197 HydrophobicContact CE1-CB 4.26Å; Y160-I197 HydrophobicContact CE1-CG1 3.78Å; Y160-I197 HydrophobicContact CE1-CG2 4.19Å; Y160-I197 WeakPolarHBondContact O-CD1 3.48Å; Y160-I197 WeakPolarHBondContact O-CG1 3.25Å; Y160-S200 PolarHBondContact OH-OG 3.49Å
161	V	97.7	Very high	97	Very high	58 Å²	58	64.7 Å²	64.7	35%	0.352	30%	0.298	S	S	.	.	H	α-helix	trans	-57.5	-38.7	179.4	178.8	0	0	0	0	112.3	Q155 H157 S163	Q155-V161 WeakPolarHBondContact O-CG2 3.45Å; H157-V161 PolarHBondContact O-N 3.48Å; V161-S163 VanDerWaalsContact C-N 3.29Å; V161-S163 PolarHBondContact O-N 2.85Å
162	K	97.4	Very high	97	Very high	116 Å²	116	67.5 Å²	67.5	50%	0.504	31%	0.312	S	S	.	.	H	α-helix	trans	-71.2	-24.5	178.8	-163.2	-177.5	-172.9	-132.1	0	112.7	R158 Y160 R164 D179	R158-K162 WeakPolarHBondContact O-CB 3.41Å; R158-K162 PolarHBondContact O-N 2.71Å; R158-K162 VanDerWaalsContact O-N 3.16Å; Y160-K162 VanDerWaalsContact C-N 3.26Å; Y160-K162 PolarHBondContact O-N 3.21Å; K162-R164 VanDerWaalsContact C-N 3.35Å; K162-R164 PolarHBondContact O-N 3.49Å; K162-D179 VanDerWaalsContact CE-CG 3.41Å; K162-D179 VanDerWaalsContact CE-OD1 3.25Å; K162-D179 WeakPolarHBondContact CE-OD1 3.04Å; K162-D179 WeakPolarHBondContact CE-OD2 3.12Å; K162-D179 HydrophobicContact CG-CB 4.18Å; K162-D179 VanDerWaalsContact NZ-CG 3.32Å; K162-D179 IonicContact NZ-OD1 3.65Å; K162-D179 PolarHBondContact NZ-OD1 3.2Å; K162-D179 IonicContact NZ-OD2 3.95Å
163	S	98.1	Very high	97	Very high	3 Å²	3	67 Å²	67	2%	0.021	31%	0.305	C	S	.	.			trans	-83.3	76.5	-167.4	-164.6	0	0	0	0	112.8	R159 Y160 V161 D179 G195 A196 I197	R159-S163 VanDerWaalsContact O-CB 3.32Å; R159-S163 WeakPolarHBondContact O-CB 3.37Å; R159-S163 PolarHBondContact O-N 2.82Å; Y160-S163 PolarHBondContact O-N 2.63Å; V161-S163 VanDerWaalsContact C-N 3.29Å; V161-S163 PolarHBondContact O-N 2.85Å; S163-D179 VanDerWaalsContact CA-O 3.28Å; S163-D179 WeakPolarHBondContact CA-O 3.4Å; S163-D179 PolarHBondContact OG-O 3.02Å; S163-G195 CarbonylContact O-C 3.58Å; S163-G195 VanDerWaalsContact O-CA 3.29Å; S163-G195 WeakPolarHBondContact O-CA 3.3Å; S163-G195 WeakPolarHBondContact OG-CA 3.27Å; S163-A196 PolarHBondContact O-N 2.7Å; S163-A196 PolarHBondContact OG-N 3.17Å; S163-I197 PolarHBondContact O-N 3.45Å
164	R	97.7	Very high	97	Very high	81 Å²	81	71.5 Å²	71.5	31%	0.306	33%	0.325	S	S	.	.	S	Bend	trans	-159.8	169.8	175	69.1	-175.1	-157.6	-170.3	2.7	110.1	K162 D166 I197 M282	K162-R164 VanDerWaalsContact C-N 3.35Å; K162-R164 PolarHBondContact O-N 3.49Å; R164-D166 WeakPolarHBondContact CD-OD1 3.17Å; R164-D166 IonicContact CZ-OD1 3.59Å; R164-D166 VanDerWaalsContact CZ-OD1 3.22Å; R164-D166 IonicContact CZ-OD2 3.1Å; R164-D166 IonicContact NE-OD1 2.92Å; R164-D166 PolarHBondContact NE-OD1 3.23Å; R164-D166 IonicContact NE-OD2 2.7Å; R164-D166 PolarHBondContact NE-OD2 2.92Å; R164-D166 IonicContact NH2-OD1 3.39Å; R164-D166 PolarHBondContact NH2-OD1 3.12Å; R164-D166 IonicContact NH2-OD2 3.81Å; R164-D166 PolarHBondContact NH2-OD2 3.48Å; R164-I197 HydrophobicContact CB-CD1 4.3Å; R164-I197 HydrophobicContact CG-CD1 4.48Å; R164-M282 HydrophobicContact CB-CE 3.91Å
165	D	98.1	Very high	97	Very high	5 Å²	5	67.1 Å²	67.1	3%	0.027	31%	0.309	C	S	.	.			trans	-127.9	106.1	176	-172.2	-25.6	0	0	0	110.7	I167 Q168 L169 H175 S177 C194	D165-I167 VanDerWaalsContact C-N 3.32Å; D165-I167 PolarHBondContact O-N 3.1Å; D165-I167 PolarHBondContact OD1-N 2.66Å; D165-Q168 HydrophobicContact CB-CB 3.72Å; D165-Q168 WeakPolarHBondContact O-CB 3.43Å; D165-Q168 PolarHBondContact O-N 3.16Å; D165-Q168 PolarHBondContact OD1-N 3.25Å; D165-L169 VanDerWaalsContact O-CG 3.26Å; D165-L169 WeakPolarHBondContact O-CG 3.27Å; D165-L169 PolarHBondContact O-N 3.05Å; D165-H175 VanDerWaalsContact CG-ND1 3.26Å; D165-H175 IonicContact OD1-CE1 2.62Å; D165-H175 IonicContact OD1-ND1 2.82Å; D165-H175 PolarHBondContact OD1-ND1 3.06Å; D165-H175 VanDerWaalsContact OD1-ND1 3.1Å; D165-H175 IonicContact OD2-CE1 3.51Å; D165-H175 PolarHBondContact OD2-CE1 2.87Å; D165-H175 IonicContact OD2-CG 3.03Å; D165-H175 IonicContact OD2-ND1 3.21Å; D165-H175 PolarHBondContact OD2-ND1 2.96Å; D165-S177 VanDerWaalsContact OD2-CB 3.27Å; D165-S177 WeakPolarHBondContact OD2-CB 3.28Å; D165-S177 PolarHBondContact OD2-N 2.95Å; D165-C194 WeakPolarHBondContact CB-SG 3.46Å
166	D	97.5	Very high	96.9	Very high	78 Å²	78	69 Å²	69	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-72.3	-26.2	-176.4	-69.1	-16.3	0	0	0	112.1	R164 L170	R164-D166 WeakPolarHBondContact CD-OD1 3.17Å; R164-D166 IonicContact CZ-OD1 3.59Å; R164-D166 VanDerWaalsContact CZ-OD1 3.22Å; R164-D166 IonicContact CZ-OD2 3.1Å; R164-D166 IonicContact NE-OD1 2.92Å; R164-D166 PolarHBondContact NE-OD1 3.23Å; R164-D166 IonicContact NE-OD2 2.7Å; R164-D166 PolarHBondContact NE-OD2 2.92Å; R164-D166 IonicContact NH2-OD1 3.39Å; R164-D166 PolarHBondContact NH2-OD1 3.12Å; R164-D166 IonicContact NH2-OD2 3.81Å; R164-D166 PolarHBondContact NH2-OD2 3.48Å; D166-L170 WeakPolarHBondContact O-CB 3.27Å; D166-L170 WeakPolarHBondContact O-CD1 3.26Å; D166-L170 WeakPolarHBondContact O-CG 3.38Å; D166-L170 PolarHBondContact O-N 3.23Å; D166-L170 VanDerWaalsContact O-N 3.14Å
167	I	97.6	Very high	96.9	Very high	88 Å²	88	66.7 Å²	66.7	45%	0.451	31%	0.31	S	S	.	.	H	α-helix	trans	-71.3	-40	174.4	-64.3	169.5	0	0	0	109.3	D165 L170 D172 H175	D165-I167 VanDerWaalsContact C-N 3.32Å; D165-I167 PolarHBondContact O-N 3.1Å; D165-I167 PolarHBondContact OD1-N 2.66Å; I167-L170 PolarHBondContact O-N 3.44Å; I167-D172 HydrophobicContact CG2-CB 4.29Å; I167-H175 HydrophobicContact CB-CB 4.48Å; I167-H175 WeakPolarHBondContact CD1-NE2 3.37Å; I167-H175 HydrophobicContact CG2-CB 3.95Å
168	Q	97.3	Very high	96.9	Very high	1 Å²	1	66.8 Å²	66.8	1%	0.005	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-49.9	174.9	-167.5	-173.9	48.8	0	0	111.8	D165 L170 G171 D172 P173 I191 F273	D165-Q168 HydrophobicContact CB-CB 3.72Å; D165-Q168 WeakPolarHBondContact O-CB 3.43Å; D165-Q168 PolarHBondContact O-N 3.16Å; D165-Q168 PolarHBondContact OD1-N 3.25Å; Q168-L170 PolarHBondContact O-N 3.35Å; Q168-G171 PolarHBondContact O-N 2.93Å; Q168-D172 VanDerWaalsContact CA-O 3.27Å; Q168-D172 WeakPolarHBondContact CA-O 3.17Å; Q168-D172 WeakPolarHBondContact CG-O 3.5Å; Q168-D172 PolarHBondContact O-N 3.48Å; Q168-P173 PolarHBondContact NE2-O 3.45Å; Q168-I191 PolarHBondContact NE2-O 3.3Å; Q168-F273 HydrophobicContact CG-CE2 4.19Å; Q168-F273 HydrophobicContact CG-CZ 3.84Å; Q168-F273 WeakPolarHBondContact O-CD2 3.35Å; Q168-F273 WeakPolarHBondContact O-CE2 3.45Å
169	L	97.6	Very high	97	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-65.6	-19.6	-179.8	-64.3	168	0	0	0	113.3	D165 G171 P193 F236 R237 F273 M282	D165-L169 VanDerWaalsContact O-CG 3.26Å; D165-L169 WeakPolarHBondContact O-CG 3.27Å; D165-L169 PolarHBondContact O-N 3.05Å; L169-G171 PolarHBondContact O-N 3.32Å; L169-P193 HydrophobicContact CD2-CB 4.08Å; L169-F236 HydrophobicContact CB-CD1 4.11Å; L169-F236 HydrophobicContact CB-CE1 4.21Å; L169-F236 HydrophobicContact CD1-CE1 3.86Å; L169-F236 HydrophobicContact CD1-CZ 4.42Å; L169-F236 HydrophobicContact CD2-CD1 4.16Å; L169-F236 HydrophobicContact CD2-CE1 3.95Å; L169-F236 HydrophobicContact CG-CD1 4.5Å; L169-F236 HydrophobicContact CG-CE1 4.22Å; L169-F236 WeakPolarHBondContact O-CA 3.48Å; L169-R237 PolarHBondContact O-N 3.37Å; L169-F273 HydrophobicContact CD2-CD1 3.98Å; L169-F273 HydrophobicContact CD2-CE1 4.33Å; L169-F273 HydrophobicContact CD2-CG 4.3Å; L169-M282 HydrophobicContact CD1-CE 3.82Å
170	L	97	Very high	97	Very high	92 Å²	92	49.6 Å²	49.6	48%	0.482	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	6.4	171.4	-75.3	170.3	0	0	0	114.1	D166 I167 Q168 H234 R237	D166-L170 WeakPolarHBondContact O-CB 3.27Å; D166-L170 WeakPolarHBondContact O-CD1 3.26Å; D166-L170 WeakPolarHBondContact O-CG 3.38Å; D166-L170 PolarHBondContact O-N 3.23Å; D166-L170 VanDerWaalsContact O-N 3.14Å; I167-L170 PolarHBondContact O-N 3.44Å; Q168-L170 PolarHBondContact O-N 3.35Å; L170-H234 WeakPolarHBondContact CD2-O 3Å; L170-R237 WeakPolarHBondContact O-CB 3.49Å
171	G	95.8	Very high	97	Very high	19 Å²	19	50.9 Å²	50.9	20%	0.196	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	108.2	15	170	0	0	0	0	0	115.3	Q168 L169 P173 R237 P239	Q168-G171 PolarHBondContact O-N 2.93Å; L169-G171 PolarHBondContact O-N 3.32Å; G171-P173 VanDerWaalsContact O-CD 3.32Å; G171-P173 WeakPolarHBondContact O-CD 3.49Å; G171-R237 WeakPolarHBondContact CA-O 3.25Å; G171-R237 PolarHBondContact N-O 2.98Å; G171-P239 WeakPolarHBondContact O-CB 3.45Å
172	D	96.3	Very high	96.9	Very high	74 Å²	74	53 Å²	53	40%	0.396	29%	0.292	S	S	.	.			trans	-107.9	82.8	169.7	-173.6	-1.4	0	0	0	111.2	I167 Q168 K174 H175	I167-D172 HydrophobicContact CG2-CB 4.29Å; Q168-D172 VanDerWaalsContact CA-O 3.27Å; Q168-D172 WeakPolarHBondContact CA-O 3.17Å; Q168-D172 WeakPolarHBondContact CG-O 3.5Å; Q168-D172 PolarHBondContact O-N 3.48Å; D172-K174 PolarHBondContact O-N 3Å; D172-K174 PolarHBondContact OD1-N 3.2Å; D172-H175 HydrophobicContact CB-CB 4.12Å; D172-H175 WeakPolarHBondContact O-CB 3.26Å; D172-H175 PolarHBondContact O-N 2.65Å; D172-H175 VanDerWaalsContact O-N 3.07Å; D172-H175 PolarHBondContact OD1-N 2.99Å
173	P	95.6	Very high	96.9	Very high	9 Å²	9	50.1 Å²	50.1	6%	0.058	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.4	-168.7	28.4	-33.5	0	0	0	113.3	Q168 G171 A192 P239 A247 F248 T251 F273	Q168-P173 PolarHBondContact NE2-O 3.45Å; G171-P173 VanDerWaalsContact O-CD 3.32Å; G171-P173 WeakPolarHBondContact O-CD 3.49Å; P173-A192 HydrophobicContact CB-CB 4.4Å; P173-P239 HydrophobicContact CG-CG 3.9Å; P173-A247 VanDerWaalsContact CG-O 3.28Å; P173-A247 WeakPolarHBondContact CG-O 3.28Å; P173-F248 HydrophobicContact CB-CD1 3.6Å; P173-F248 HydrophobicContact CB-CE1 3.62Å; P173-F248 HydrophobicContact CG-CD1 4.35Å; P173-F248 HydrophobicContact CG-CE1 4.47Å; P173-T251 HydrophobicContact CB-CG2 4.22Å; P173-F273 HydrophobicContact CB-CE2 4.23Å; P173-F273 HydrophobicContact CB-CZ 4.3Å
174	K	95.5	Very high	96.9	Very high	120 Å²	120	52 Å²	52	52%	0.522	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-10.1	-178.9	-62	-177.5	-177.9	-175	0	113.2	D172 E249 T251	D172-K174 PolarHBondContact O-N 3Å; D172-K174 PolarHBondContact OD1-N 3.2Å; K174-E249 WeakPolarHBondContact CE-O 3.47Å; K174-E249 PolarHBondContact NZ-O 3.48Å; K174-T251 HydrophobicContact CG-CG2 4.05Å
175	H	97.2	Very high	96.9	Very high	58 Å²	58	53.7 Å²	53.7	27%	0.269	30%	0.295	S	S	.	.			trans	-61.6	138.1	172.7	-174.2	-85.4	0	0	0	110	D165 I167 D172	D165-H175 VanDerWaalsContact CG-ND1 3.26Å; D165-H175 IonicContact OD1-CE1 2.62Å; D165-H175 IonicContact OD1-ND1 2.82Å; D165-H175 PolarHBondContact OD1-ND1 3.06Å; D165-H175 VanDerWaalsContact OD1-ND1 3.1Å; D165-H175 IonicContact OD2-CE1 3.51Å; D165-H175 PolarHBondContact OD2-CE1 2.87Å; D165-H175 IonicContact OD2-CG 3.03Å; D165-H175 IonicContact OD2-ND1 3.21Å; D165-H175 PolarHBondContact OD2-ND1 2.96Å; I167-H175 HydrophobicContact CB-CB 4.48Å; I167-H175 WeakPolarHBondContact CD1-NE2 3.37Å; I167-H175 HydrophobicContact CG2-CB 3.95Å; D172-H175 HydrophobicContact CB-CB 4.12Å; D172-H175 WeakPolarHBondContact O-CB 3.26Å; D172-H175 PolarHBondContact O-N 2.65Å; D172-H175 VanDerWaalsContact O-N 3.07Å; D172-H175 PolarHBondContact OD1-N 2.99Å
176	V	95.3	Very high	96.8	Very high	38 Å²	38	55.7 Å²	55.7	23%	0.23	31%	0.307	C	S	.	.			trans	-129.9	116.1	178.6	-174.4	0	0	0	0	110.6	Q184 Y185 P190	V176-Q184 HydrophobicContact CG1-CB 3.94Å; V176-Q184 HydrophobicContact CG1-CG 4.19Å; V176-Y185 HydrophobicContact CG1-CE1 4.33Å; V176-Y185 HydrophobicContact CG1-CE2 3.96Å; V176-Y185 WeakPolarHBondContact CG1-OH 3.46Å; V176-Y185 HydrophobicContact CG2-CE1 3.96Å; V176-P190 HydrophobicContact CG2-CB 3.61Å
177	S	96.7	Very high	96.5	Very high	25 Å²	25	59.1 Å²	59.1	18%	0.175	33%	0.325	C	S	.	.			trans	-88.5	143.7	170.8	178.7	0	0	0	0	112.3	D165 D179 C180 Q184	D165-S177 VanDerWaalsContact OD2-CB 3.27Å; D165-S177 WeakPolarHBondContact OD2-CB 3.28Å; D165-S177 PolarHBondContact OD2-N 2.95Å; S177-D179 PolarHBondContact O-N 2.89Å; S177-D179 WeakPolarHBondContact OG-CB 3.21Å; S177-D179 PolarHBondContact OG-N 3Å; S177-D179 VanDerWaalsContact OG-N 3.12Å; S177-C180 PolarHBondContact O-N 3.44Å; S177-Q184 PolarHBondContact O-NE2 3.42Å
178	S	96.8	Very high	96.3	Very high	91 Å²	91	64.3 Å²	64.3	64%	0.636	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-60.1	-23.1	168.3	55.8	0	0	0	0	113.1	C180 A181	S178-C180 PolarHBondContact O-N 3.01Å; S178-A181 WeakPolarHBondContact O-CB 3.35Å; S178-A181 PolarHBondContact O-N 2.97Å
179	D	97.2	Very high	96.3	Very high	55 Å²	55	68.2 Å²	68.2	29%	0.294	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-71.1	-23.7	-176.1	-70.8	-6.4	0	0	0	112.5	K162 S163 S177 A181	K162-D179 VanDerWaalsContact CE-CG 3.41Å; K162-D179 VanDerWaalsContact CE-OD1 3.25Å; K162-D179 WeakPolarHBondContact CE-OD1 3.04Å; K162-D179 WeakPolarHBondContact CE-OD2 3.12Å; K162-D179 HydrophobicContact CG-CB 4.18Å; K162-D179 VanDerWaalsContact NZ-CG 3.32Å; K162-D179 IonicContact NZ-OD1 3.65Å; K162-D179 PolarHBondContact NZ-OD1 3.2Å; K162-D179 IonicContact NZ-OD2 3.95Å; S163-D179 VanDerWaalsContact CA-O 3.28Å; S163-D179 WeakPolarHBondContact CA-O 3.4Å; S163-D179 PolarHBondContact OG-O 3.02Å; S177-D179 PolarHBondContact O-N 2.89Å; S177-D179 WeakPolarHBondContact OG-CB 3.21Å; S177-D179 PolarHBondContact OG-N 3Å; S177-D179 VanDerWaalsContact OG-N 3.12Å; D179-A181 PolarHBondContact O-N 3.5Å
180	C	97.9	Very high	96.3	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-71.3	-5.4	176.3	-82.2	0	0	0	0	114.3	S177 S178 F183 Q184 C194 G195	S177-C180 PolarHBondContact O-N 3.44Å; S178-C180 PolarHBondContact O-N 3.01Å; C180-F183 CarbonylContact O-C 3.54Å; C180-F183 WeakPolarHBondContact O-CA 3.24Å; C180-F183 PolarHBondContact O-N 3.41Å; C180-Q184 HydrophobicContact CB-CG 3.66Å; C180-C194 HydrophobicContact CB-CB 3.6Å; C180-C194 WeakPolarHBondContact CB-SG 3.5Å; C180-C194 WeakPolarHBondContact SG-CB 3.31Å; C180-C194 PolarHBondContact SG-O 2.84Å; C180-C194 CovalentContact SG-SG 2.04Å; C180-C194 PolarHBondContact SG-SG 3.2Å; C180-G195 PolarHBondContact SG-N 3.33Å; C180-G195 VanDerWaalsContact SG-N 3.43Å
181	A	96.1	Very high	96.3	Very high	54 Å²	54	64.6 Å²	64.6	45%	0.446	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	135.8	-178.6	0	0	0	0	0	112.3	S178 D179	S178-A181 WeakPolarHBondContact O-CB 3.35Å; S178-A181 PolarHBondContact O-N 2.97Å; D179-A181 PolarHBondContact O-N 3.5Å
182	P	96.6	Very high	96.4	Very high	104 Å²	104	63.8 Å²	63.8	68%	0.675	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	cis	-88.5	1.6	2	36.6	-36.7	0	0	0	114.6	Q184	P182-Q184 PolarHBondContact O-N 2.67Å; P182-Q184 VanDerWaalsContact O-N 3.1Å
183	F	97.8	Very high	96.5	Very high	54 Å²	54	60.3 Å²	60.3	24%	0.237	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	46.7	-175.1	-54.1	-72.4	0	0	0	112.4	C180 I191 C194 G195 A196 N199 P255	C180-F183 CarbonylContact O-C 3.54Å; C180-F183 WeakPolarHBondContact O-CA 3.24Å; C180-F183 PolarHBondContact O-N 3.41Å; F183-I191 HydrophobicContact CB-CD1 4.34Å; F183-C194 WeakPolarHBondContact O-CA 3.33Å; F183-C194 VanDerWaalsContact O-CB 3.24Å; F183-C194 WeakPolarHBondContact O-CB 3.22Å; F183-G195 PolarHBondContact O-N 3.44Å; F183-G195 VanDerWaalsContact O-N 3.11Å; F183-A196 HydrophobicContact CD2-CB 3.83Å; F183-A196 HydrophobicContact CE2-CB 3.69Å; F183-N199 HydrophobicContact CD1-CB 4.11Å; F183-N199 HydrophobicContact CE1-CB 4.32Å; F183-N199 WeakPolarHBondContact CE1-ND2 3.26Å; F183-N199 HydrophobicContact CG-CB 4.21Å; F183-N199 WeakPolarHBondContact CZ-ND2 3.43Å; F183-P255 HydrophobicContact CD1-CG 4.5Å
184	Q	97.3	Very high	96.6	Very high	42 Å²	42	60 Å²	60	20%	0.196	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-37.2	177.7	-64.7	171.1	-79.4	0	0	111.9	V176 S177 C180 P182 P190 I191	V176-Q184 HydrophobicContact CG1-CB 3.94Å; V176-Q184 HydrophobicContact CG1-CG 4.19Å; S177-Q184 PolarHBondContact O-NE2 3.42Å; C180-Q184 HydrophobicContact CB-CG 3.66Å; P182-Q184 PolarHBondContact O-N 2.67Å; P182-Q184 VanDerWaalsContact O-N 3.1Å; Q184-P190 WeakPolarHBondContact O-CA 3.36Å; Q184-I191 PolarHBondContact O-N 3.12Å
185	Y	97.1	Very high	96.8	Very high	118 Å²	118	54.3 Å²	54.3	46%	0.463	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.7	-171.5	-56.6	-83	0	0	0	112	V176 L189 P190	V176-Y185 HydrophobicContact CG1-CE1 4.33Å; V176-Y185 HydrophobicContact CG1-CE2 3.96Å; V176-Y185 WeakPolarHBondContact CG1-OH 3.46Å; V176-Y185 HydrophobicContact CG2-CE1 3.96Å; Y185-L189 CarbonylContact C-O 3.57Å; Y185-L189 WeakPolarHBondContact CA-O 3.45Å; Y185-P190 HydrophobicContact CD1-CB 4.44Å; Y185-P190 HydrophobicContact CE1-CB 4.37Å
186	V	96	Very high	96.8	Very high	46 Å²	46	52.4 Å²	52.4	28%	0.279	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	126.8	157.6	-178.9	0	0	0	0	106.4	K188 L189 I191 V252 P255	V186-K188 PolarHBondContact O-N 2.91Å; V186-K188 VanDerWaalsContact O-N 3.12Å; V186-L189 PolarHBondContact N-O 3.26Å; V186-L189 WeakPolarHBondContact O-CB 3.48Å; V186-L189 PolarHBondContact O-N 3.43Å; V186-I191 HydrophobicContact CG2-CD1 3.74Å; V186-I191 HydrophobicContact CG2-CG1 3.85Å; V186-V252 HydrophobicContact CB-CG1 4.05Å; V186-V252 HydrophobicContact CB-CG2 4.1Å; V186-V252 HydrophobicContact CG2-CG2 4.34Å; V186-P255 HydrophobicContact CG2-CG 4.17Å
187	D	92.6	Very high	97	Very high	150 Å²	150	50.6 Å²	50.6	80%	0.802	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	42.4	179.3	-58.7	-33.9	0	0	0	114.5	L189	D187-L189 PolarHBondContact O-N 3.38Å
188	K	93	Very high	97	Very high	197 Å²	197	49.4 Å²	49.4	86%	0.857	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	-2.4	-176.8	-50.5	174.6	-179.2	174.9	0	115.5	V186	V186-K188 PolarHBondContact O-N 2.91Å; V186-K188 VanDerWaalsContact O-N 3.12Å
189	L	96.5	Very high	97.1	Very high	83 Å²	83	45.5 Å²	45.5	44%	0.435	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	135.5	171.5	-67.5	171.5	0	0	0	110	Y185 V186 D187 V252	Y185-L189 CarbonylContact C-O 3.57Å; Y185-L189 WeakPolarHBondContact CA-O 3.45Å; V186-L189 PolarHBondContact N-O 3.26Å; V186-L189 WeakPolarHBondContact O-CB 3.48Å; V186-L189 PolarHBondContact O-N 3.43Å; D187-L189 PolarHBondContact O-N 3.38Å; L189-V252 HydrophobicContact CB-CB 4.33Å; L189-V252 HydrophobicContact CB-CG1 3.57Å; L189-V252 WeakPolarHBondContact O-CG1 3.49Å
190	P	97.5	Very high	97.1	Very high	18 Å²	18	43.9 Å²	43.9	12%	0.117	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	136.1	176.9	27.6	-35.1	0	0	0	111.1	V176 Q184 Y185 G250 T251 V252	V176-P190 HydrophobicContact CG2-CB 3.61Å; Q184-P190 WeakPolarHBondContact O-CA 3.36Å; Y185-P190 HydrophobicContact CD1-CB 4.44Å; Y185-P190 HydrophobicContact CE1-CB 4.37Å; P190-G250 WeakPolarHBondContact CD-O 3.06Å; P190-T251 HydrophobicContact CG-CG2 4.21Å; P190-T251 CarbonylContact O-C 3.53Å; P190-T251 VanDerWaalsContact O-CA 3.29Å; P190-T251 WeakPolarHBondContact O-CA 3.35Å; P190-T251 WeakPolarHBondContact O-CB 3.38Å; P190-V252 WeakPolarHBondContact O-CG1 3.5Å; P190-V252 PolarHBondContact O-N 3.4Å
191	I	98.4	Very high	97.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.01	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-78	131.3	174.9	-64.8	167.1	0	0	0	109.2	Q168 F183 Q184 V186 P193 C194 V252 P254	Q168-I191 PolarHBondContact NE2-O 3.3Å; F183-I191 HydrophobicContact CB-CD1 4.34Å; Q184-I191 PolarHBondContact O-N 3.12Å; V186-I191 HydrophobicContact CG2-CD1 3.74Å; V186-I191 HydrophobicContact CG2-CG1 3.85Å; I191-P193 WeakPolarHBondContact CG2-O 2.89Å; I191-C194 HydrophobicContact CB-CB 4.35Å; I191-C194 WeakPolarHBondContact O-CB 3.21Å; I191-C194 PolarHBondContact O-N 3.14Å; I191-V252 CarbonylContact C-O 3.57Å; I191-V252 VanDerWaalsContact CA-O 3.25Å; I191-V252 WeakPolarHBondContact CA-O 3.38Å; I191-V252 HydrophobicContact CG1-CG1 4.17Å; I191-P254 HydrophobicContact CG2-CB 4.13Å; I191-P254 HydrophobicContact CG2-CG 3.8Å
192	A	97.8	Very high	97.1	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.008	22%	0.223	C	C	.	.	S	Bend	trans	-128	115.7	174.6	0	0	0	0	0	111.1	P173 F248 T251 V252 F273	P173-A192 HydrophobicContact CB-CB 4.4Å; A192-F248 HydrophobicContact CB-CD1 4.08Å; A192-F248 HydrophobicContact CB-CE1 4.31Å; A192-T251 HydrophobicContact CB-CG2 4.06Å; A192-V252 PolarHBondContact N-O 3.26Å; A192-F273 HydrophobicContact CB-CZ 4.31Å
193	P	98.3	Very high	97.1	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	20%	0.202	C	C	.	.	S	Bend	cis	-75.3	138.5	-8.5	29	-34.9	0	0	0	113.8	L169 I191 A198 P254 W257 F273 L278	L169-P193 HydrophobicContact CD2-CB 4.08Å; I191-P193 WeakPolarHBondContact CG2-O 2.89Å; P193-A198 HydrophobicContact CB-CB 3.87Å; P193-A198 HydrophobicContact CG-CB 3.59Å; P193-P254 HydrophobicContact CG-CG 4.48Å; P193-P254 VanDerWaalsContact O-CG 3.31Å; P193-P254 WeakPolarHBondContact O-CG 3.24Å; P193-W257 HydrophobicContact CG-CH2 3.52Å; P193-W257 HydrophobicContact CG-CZ2 3.84Å; P193-W257 HydrophobicContact CG-CZ3 4.29Å; P193-F273 HydrophobicContact CB-CD1 4.39Å; P193-F273 HydrophobicContact CB-CE1 3.79Å; P193-F273 HydrophobicContact CG-CE1 4.3Å; P193-L278 HydrophobicContact CG-CD2 4.49Å
194	C	98.2	Very high	97	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.02	19%	0.192	C	C	.	.			trans	-78.1	162.4	178.6	75.1	0	0	0	0	113.3	D165 C180 F183 I191	D165-C194 WeakPolarHBondContact CB-SG 3.46Å; C180-C194 HydrophobicContact CB-CB 3.6Å; C180-C194 WeakPolarHBondContact CB-SG 3.5Å; C180-C194 WeakPolarHBondContact SG-CB 3.31Å; C180-C194 PolarHBondContact SG-O 2.84Å; C180-C194 CovalentContact SG-SG 2.04Å; C180-C194 PolarHBondContact SG-SG 3.2Å; F183-C194 WeakPolarHBondContact O-CA 3.33Å; F183-C194 VanDerWaalsContact O-CB 3.24Å; F183-C194 WeakPolarHBondContact O-CB 3.22Å; I191-C194 HydrophobicContact CB-CB 4.35Å; I191-C194 WeakPolarHBondContact O-CB 3.21Å; I191-C194 PolarHBondContact O-N 3.14Å
195	G	98.1	Very high	97	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	99.1	163.6	169.1	0	0	0	0	0	115.9	S163 C180 F183 I197 A198 N199	S163-G195 CarbonylContact O-C 3.58Å; S163-G195 VanDerWaalsContact O-CA 3.29Å; S163-G195 WeakPolarHBondContact O-CA 3.3Å; S163-G195 WeakPolarHBondContact OG-CA 3.27Å; C180-G195 PolarHBondContact SG-N 3.33Å; C180-G195 VanDerWaalsContact SG-N 3.43Å; F183-G195 PolarHBondContact O-N 3.44Å; F183-G195 VanDerWaalsContact O-N 3.11Å; G195-I197 VanDerWaalsContact C-N 3.31Å; G195-I197 PolarHBondContact O-N 3.1Å; G195-A198 PolarHBondContact O-N 2.9Å; G195-N199 WeakPolarHBondContact O-CB 3.23Å; G195-N199 PolarHBondContact O-N 2.98Å
196	A	98	Very high	97	Very high	18 Å²	18	34.8 Å²	34.8	15%	0.149	18%	0.184	C	C	.	.	H	α-helix	trans	-67	-31.7	-173.1	0	0	0	0	0	112.9	Y160 S163 F183 S200	Y160-A196 HydrophobicContact CD2-CB 3.99Å; Y160-A196 HydrophobicContact CE2-CB 4.36Å; Y160-A196 WeakPolarHBondContact CE2-O 3.37Å; S163-A196 PolarHBondContact O-N 2.7Å; S163-A196 PolarHBondContact OG-N 3.17Å; F183-A196 HydrophobicContact CD2-CB 3.83Å; F183-A196 HydrophobicContact CE2-CB 3.69Å; A196-S200 PolarHBondContact O-N 3.32Å; A196-S200 PolarHBondContact O-OG 2.7Å
197	I	98.3	Very high	97.1	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-52.9	178.9	-52.5	179.7	0	0	0	109.4	Y160 S163 R164 G195 S200 W281 M282	Y160-I197 HydrophobicContact CD1-CG1 3.96Å; Y160-I197 HydrophobicContact CE1-CB 4.26Å; Y160-I197 HydrophobicContact CE1-CG1 3.78Å; Y160-I197 HydrophobicContact CE1-CG2 4.19Å; Y160-I197 WeakPolarHBondContact O-CD1 3.48Å; Y160-I197 WeakPolarHBondContact O-CG1 3.25Å; S163-I197 PolarHBondContact O-N 3.45Å; R164-I197 HydrophobicContact CB-CD1 4.3Å; R164-I197 HydrophobicContact CG-CD1 4.48Å; G195-I197 VanDerWaalsContact C-N 3.31Å; G195-I197 PolarHBondContact O-N 3.1Å; I197-S200 PolarHBondContact O-N 3Å; I197-S200 PolarHBondContact O-OG 3.33Å; I197-W281 PolarHBondContact O-NE1 2.84Å; I197-M282 HydrophobicContact CB-CE 4.06Å; I197-M282 HydrophobicContact CB-SD 3.95Å; I197-M282 HydrophobicContact CG2-CE 4.05Å; I197-M282 HydrophobicContact CG2-SD 3.53Å; I197-M282 VanDerWaalsContact CG2-SD 3.53Å
198	A	98.1	Very high	97.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-69.1	-42.8	-177.4	0	0	0	0	0	111.4	P193 G195 S200 L201 W257 M282	P193-A198 HydrophobicContact CB-CB 3.87Å; P193-A198 HydrophobicContact CG-CB 3.59Å; G195-A198 PolarHBondContact O-N 2.9Å; A198-S200 PolarHBondContact O-N 2.8Å; A198-S200 VanDerWaalsContact O-N 3.13Å; A198-L201 WeakPolarHBondContact O-CB 3.08Å; A198-L201 PolarHBondContact O-N 3.42Å; A198-W257 HydrophobicContact CB-CZ2 4.3Å; A198-W257 PolarHBondContact O-NE1 2.85Å; A198-M282 HydrophobicContact CB-CE 4.44Å; A198-M282 HydrophobicContact CB-SD 3.82Å
199	N	98	Very high	97.5	Very high	10 Å²	10	21.4 Å²	21.4	5%	0.053	12%	0.12	C	C	.	.	H	α-helix	trans	-57.4	-31.2	178.2	-176.5	54.4	0	0	0	113.1	F183 G195 L201 P254 P255 N256	F183-N199 HydrophobicContact CD1-CB 4.11Å; F183-N199 HydrophobicContact CE1-CB 4.32Å; F183-N199 WeakPolarHBondContact CE1-ND2 3.26Å; F183-N199 HydrophobicContact CG-CB 4.21Å; F183-N199 WeakPolarHBondContact CZ-ND2 3.43Å; G195-N199 WeakPolarHBondContact O-CB 3.23Å; G195-N199 PolarHBondContact O-N 2.98Å; N199-L201 VanDerWaalsContact C-N 3.31Å; N199-L201 PolarHBondContact O-N 2.87Å; N199-P254 HydrophobicContact CB-CB 4.08Å; N199-P255 WeakPolarHBondContact OD1-CD 3.31Å; N199-N256 PolarHBondContact ND2-ND2 2.93Å; N199-N256 VanDerWaalsContact ND2-ND2 3.18Å; N199-N256 WeakPolarHBondContact O-CB 3.47Å; N199-N256 PolarHBondContact OD1-N 3.07Å; N199-N256 VanDerWaalsContact OD1-N 3.08Å
200	S	97.2	Very high	97.5	Very high	21 Å²	21	19.3 Å²	19.3	15%	0.147	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	28.3	177.8	80.2	0	0	0	0	113.6	Y160 A196 I197 A198 F202 W281 Y321	Y160-S200 PolarHBondContact OH-OG 3.49Å; A196-S200 PolarHBondContact O-N 3.32Å; A196-S200 PolarHBondContact O-OG 2.7Å; I197-S200 PolarHBondContact O-N 3Å; I197-S200 PolarHBondContact O-OG 3.33Å; A198-S200 PolarHBondContact O-N 2.8Å; A198-S200 VanDerWaalsContact O-N 3.13Å; S200-F202 PolarHBondContact O-N 2.04Å; S200-W281 WeakPolarHBondContact O-CZ2 3.44Å; S200-W281 PolarHBondContact O-NE1 3.19Å; S200-Y321 WeakPolarHBondContact O-CE2 3.29Å; S200-Y321 PolarHBondContact O-OH 2.9Å; S200-Y321 VanDerWaalsContact O-OH 3.11Å
201	L	97.6	Very high	97.4	Very high	27 Å²	27	24.7 Å²	24.7	14%	0.141	13%	0.128	C	C	.	.			trans	-54.6	130.5	-178.8	-179.5	62.4	0	0	0	111.7	A198 N199 N203 W257 L278 W281 Y321	A198-L201 WeakPolarHBondContact O-CB 3.08Å; A198-L201 PolarHBondContact O-N 3.42Å; N199-L201 VanDerWaalsContact C-N 3.31Å; N199-L201 PolarHBondContact O-N 2.87Å; L201-N203 PolarHBondContact O-N 3.36Å; L201-W257 HydrophobicContact CB-CZ2 4.03Å; L201-W257 HydrophobicContact CD2-CH2 4Å; L201-W257 HydrophobicContact CD2-CZ2 3.59Å; L201-W257 HydrophobicContact CG-CZ2 4.41Å; L201-L278 HydrophobicContact CD1-CD1 4.31Å; L201-L278 HydrophobicContact CD2-CD1 4.37Å; L201-W281 HydrophobicContact CD1-CB 3.36Å; L201-W281 HydrophobicContact CD1-CD2 4.23Å; L201-W281 HydrophobicContact CD1-CG 3.42Å; L201-W281 VanDerWaalsContact CD1-CG 3.42Å; L201-Y321 WeakPolarHBondContact O-CE2 3.41Å
202	F	97.4	Very high	97	Very high	18 Å²	18	26.7 Å²	26.7	8%	0.079	14%	0.139	C	C	.	.			trans	-64.3	128.6	173.8	-177.5	-92.7	0	0	0	110.9	Y103 Y148 L150 S200 D204 F206 W281 Y321 K330	Y103-F202 WeakPolarHBondContact OH-CZ 3.4Å; Y148-F202 AromaticContact CD1-CD1 3.74Å; Y148-F202 HydrophobicContact CD1-CD1 3.74Å; Y148-F202 AromaticContact CD1-CE1 3.65Å; Y148-F202 HydrophobicContact CD1-CE1 3.65Å; Y148-F202 HydrophobicContact CD1-CZ 4.34Å; Y148-F202 AromaticContact CD2-CD1 3.92Å; Y148-F202 HydrophobicContact CD2-CD1 3.92Å; Y148-F202 HydrophobicContact CD2-CD2 4.01Å; Y148-F202 AromaticContact CD2-CE1 3.99Å; Y148-F202 HydrophobicContact CD2-CE1 3.99Å; Y148-F202 HydrophobicContact CD2-CE2 4.07Å; Y148-F202 AromaticContact CD2-CG 3.91Å; Y148-F202 HydrophobicContact CD2-CG 3.91Å; Y148-F202 HydrophobicContact CD2-CZ 4.03Å; Y148-F202 AromaticContact CE1-CD1 3.8Å; Y148-F202 HydrophobicContact CE1-CD1 3.8Å; Y148-F202 HydrophobicContact CE1-CE1 4.2Å; Y148-F202 HydrophobicContact CE1-CG 4.42Å; Y148-F202 HydrophobicContact CE2-CB 3.95Å; Y148-F202 AromaticContact CE2-CD1 3.92Å; Y148-F202 HydrophobicContact CE2-CD1 3.92Å; Y148-F202 HydrophobicContact CE2-CD2 4.18Å; Y148-F202 HydrophobicContact CE2-CE1 4.45Å; Y148-F202 AromaticContact CE2-CG 3.74Å; Y148-F202 HydrophobicContact CE2-CG 3.74Å; Y148-F202 AromaticContact CG-CD1 3.83Å; Y148-F202 HydrophobicContact CG-CD1 3.83Å; Y148-F202 AromaticContact CG-CE1 3.56Å; Y148-F202 HydrophobicContact CG-CE1 3.56Å; Y148-F202 HydrophobicContact CG-CE2 4.3Å; Y148-F202 HydrophobicContact CG-CG 4.3Å; Y148-F202 AromaticContact CG-CZ 3.79Å; Y148-F202 HydrophobicContact CG-CZ 3.79Å; Y148-F202 AromaticContact CZ-CD1 3.88Å; L150-F202 HydrophobicContact CD1-CD2 4.21Å; L150-F202 HydrophobicContact CD2-CD2 4.32Å; L150-F202 HydrophobicContact CD2-CE2 4.12Å; S200-F202 PolarHBondContact O-N 2.04Å; F202-D204 HydrophobicContact CE1-CB 3.73Å; F202-D204 HydrophobicContact CE2-CB 4.26Å; F202-D204 HydrophobicContact CZ-CB 3.5Å; F202-F206 HydrophobicContact CE1-CE2 4.11Å; F202-F206 HydrophobicContact CE1-CZ 4.25Å; F202-F206 HydrophobicContact CZ-CE2 4.37Å; F202-F206 HydrophobicContact CZ-CZ 4.06Å; F202-W281 HydrophobicContact CB-CD2 4.39Å; F202-W281 HydrophobicContact CB-CE3 3.69Å; F202-W281 HydrophobicContact CB-CH2 4.25Å; F202-W281 HydrophobicContact CB-CZ3 3.61Å; F202-Y321 HydrophobicContact CB-CD2 4.49Å; F202-Y321 AromaticContact CD2-CD1 3.92Å; F202-Y321 HydrophobicContact CD2-CD1 3.92Å; F202-Y321 HydrophobicContact CD2-CD2 4.18Å; F202-Y321 HydrophobicContact CD2-CE1 4.39Å; F202-Y321 AromaticContact CD2-CG 3.79Å; F202-Y321 HydrophobicContact CD2-CG 3.79Å; F202-Y321 HydrophobicContact CE2-CD1 4.33Å; F202-Y321 HydrophobicContact CE2-CG 4.27Å; F202-K330 HydrophobicContact CE2-CD 4.34Å
203	N	95.5	Very high	96.5	Very high	47 Å²	47	33.9 Å²	33.9	25%	0.251	18%	0.183	S	C	.	.			trans	-136.3	18	-169.2	68.2	-10.1	0	0	0	114.3	L201 N320 Y321	L201-N203 PolarHBondContact O-N 3.36Å; N203-N320 WeakPolarHBondContact O-CB 3.41Å; N203-N320 PolarHBondContact O-ND2 3.43Å; N203-N320 WeakPolarHBondContact OD1-CB 3.06Å; N203-Y321 WeakPolarHBondContact OD1-CA 3.35Å; N203-Y321 PolarHBondContact OD1-N 3.47Å
204	D	96.6	Very high	95.9	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.027	22%	0.221	C	C	.	.			trans	-71.8	150.3	164	-63.1	-20.4	0	0	0	109.4	Y103 F202 F206 V318 N320 Y321 K330	Y103-D204 VanDerWaalsContact CE2-OD2 3.31Å; Y103-D204 WeakPolarHBondContact CE2-OD2 3.25Å; Y103-D204 PolarHBondContact OH-OD2 2.95Å; F202-D204 HydrophobicContact CE1-CB 3.73Å; F202-D204 HydrophobicContact CE2-CB 4.26Å; F202-D204 HydrophobicContact CZ-CB 3.5Å; D204-F206 HydrophobicContact CB-CZ 4.36Å; D204-V318 VanDerWaalsContact CA-O 3.28Å; D204-V318 WeakPolarHBondContact CA-O 3.2Å; D204-V318 WeakPolarHBondContact CB-O 3.38Å; D204-N320 PolarHBondContact OD1-N 3.28Å; D204-Y321 WeakPolarHBondContact OD1-CB 3.33Å; D204-Y321 PolarHBondContact OD1-N 2.85Å; D204-K330 IonicContact OD1-NZ 2.92Å; D204-K330 PolarHBondContact OD1-NZ 2.87Å; D204-K330 WeakPolarHBondContact OD2-CD 3.34Å; D204-K330 VanDerWaalsContact OD2-CE 3.31Å; D204-K330 WeakPolarHBondContact OD2-CE 3.16Å; D204-K330 IonicContact OD2-NZ 3.18Å; D204-K330 PolarHBondContact OD2-NZ 3.38Å
205	T	96.3	Very high	95.5	Very high	71 Å²	71	40.7 Å²	40.7	44%	0.436	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.7	176.2	67.7	0	0	0	0	110.9	I317 V318	T205-I317 WeakPolarHBondContact O-CA 3.21Å; T205-V318 PolarHBondContact N-O 3.09Å; T205-V318 PolarHBondContact O-N 3.17Å; T205-V318 WeakPolarHBondContact OG1-CB 2.83Å; T205-V318 WeakPolarHBondContact OG1-CG2 3.39Å
206	F	97.7	Very high	95.2	Very high	12 Å²	12	45.5 Å²	45.5	5%	0.053	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	127.5	-179.8	-50.9	-71.5	0	0	0	111.2	Y103 F202 D204 H294 V315 I317 F332	Y103-F206 HydrophobicContact CD1-CE1 4.48Å; Y103-F206 AromaticContact CE1-CE1 3.75Å; Y103-F206 HydrophobicContact CE1-CE1 3.75Å; Y103-F206 AromaticContact CE1-CZ 3.97Å; Y103-F206 HydrophobicContact CE1-CZ 3.97Å; Y103-F206 HydrophobicContact CE2-CE1 4.41Å; Y103-F206 AromaticContact CZ-CE1 3.73Å; Y103-F206 AromaticContact CZ-CZ 3.88Å; Y103-F206 WeakPolarHBondContact OH-CZ 3.35Å; F202-F206 HydrophobicContact CE1-CE2 4.11Å; F202-F206 HydrophobicContact CE1-CZ 4.25Å; F202-F206 HydrophobicContact CZ-CE2 4.37Å; F202-F206 HydrophobicContact CZ-CZ 4.06Å; D204-F206 HydrophobicContact CB-CZ 4.36Å; F206-H294 AromaticContact CD2-CD2 3.6Å; F206-H294 AromaticContact CD2-CE1 3.79Å; F206-H294 AromaticContact CD2-CG 3.88Å; F206-H294 AromaticContact CD2-ND1 4Å; F206-H294 AromaticContact CD2-NE2 3.53Å; F206-H294 AromaticContact CE2-CD2 3.76Å; F206-V315 HydrophobicContact CB-CG2 4.19Å; F206-V315 HydrophobicContact CD1-CG2 4.27Å; F206-I317 HydrophobicContact CD1-CD1 4.42Å; F206-I317 HydrophobicContact CD1-CG1 4.03Å; F206-I317 HydrophobicContact CD1-CG2 4.07Å; F206-I317 HydrophobicContact CE1-CD1 4.38Å; F206-I317 HydrophobicContact CE1-CG1 4.38Å; F206-I317 HydrophobicContact CE1-CG2 3.92Å; F206-F332 HydrophobicContact CB-CD2 4.26Å; F206-F332 HydrophobicContact CB-CE2 3.96Å; F206-F332 AromaticContact CD1-CD2 3.65Å; F206-F332 HydrophobicContact CD1-CD2 3.65Å; F206-F332 HydrophobicContact CD1-CE2 4.22Å; F206-F332 HydrophobicContact CD1-CG 4.36Å; F206-F332 HydrophobicContact CD2-CD2 4.01Å; F206-F332 HydrophobicContact CD2-CE2 4.23Å; F206-F332 HydrophobicContact CE1-CB 4.23Å; F206-F332 AromaticContact CE1-CD2 3.93Å; F206-F332 HydrophobicContact CE1-CD2 3.93Å; F206-F332 HydrophobicContact CE1-CG 4.47Å; F206-F332 HydrophobicContact CE2-CD2 4.28Å; F206-F332 AromaticContact CG-CD2 3.7Å; F206-F332 HydrophobicContact CG-CD2 3.7Å; F206-F332 AromaticContact CG-CE2 3.87Å; F206-F332 HydrophobicContact CG-CE2 3.87Å; F206-F332 HydrophobicContact CZ-CD2 4.24Å
207	L	97.6	Very high	95.1	Very high	80 Å²	80	47.8 Å²	47.8	42%	0.419	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109.3	167.1	175.4	66.1	0	0	0	108.6	V315 E316	L207-V315 WeakPolarHBondContact O-CA 3.43Å; L207-E316 HydrophobicContact CB-CB 4.23Å; L207-E316 PolarHBondContact N-O 3.08Å; L207-E316 PolarHBondContact O-N 2.81Å
208	L	97.7	Very high	94.9	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.021	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	125.4	-178.5	-176.9	65.3	0	0	0	110.2	F134 L146 V219 Y313 V315 F332 I334	F134-L208 HydrophobicContact CE1-CD1 4.06Å; F134-L208 HydrophobicContact CZ-CD1 3.65Å; L146-L208 HydrophobicContact CD1-CD2 4.44Å; L146-L208 HydrophobicContact CD2-CD2 4.3Å; L208-V219 HydrophobicContact CB-CB 4.25Å; L208-V219 HydrophobicContact CB-CG2 4.33Å; L208-V219 HydrophobicContact CD2-CB 4.09Å; L208-V219 HydrophobicContact CD2-CG1 4.26Å; L208-V219 HydrophobicContact CD2-CG2 3.85Å; L208-V219 HydrophobicContact CG-CB 4.15Å; L208-V219 HydrophobicContact CG-CG2 3.76Å; L208-V219 PolarHBondContact O-N 3.45Å; L208-Y313 HydrophobicContact CD1-CD1 3.92Å; L208-Y313 HydrophobicContact CD1-CG 4.42Å; L208-Y313 HydrophobicContact CD2-CD1 4.39Å; L208-Y313 HydrophobicContact CG-CD1 4.1Å; L208-V315 HydrophobicContact CD1-CB 4.26Å; L208-F332 HydrophobicContact CD1-CE1 4.4Å; L208-F332 HydrophobicContact CD1-CZ 4.45Å; L208-F332 HydrophobicContact CD2-CZ 4.48Å; L208-I334 HydrophobicContact CD2-CD1 4.13Å
209	N	97.1	Very high	94.9	Very high	28 Å²	28	50.7 Å²	50.7	15%	0.15	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.4	178	-63.3	-55	0	0	0	110.4	M216 Q217 A218 Y313 T314	N209-M216 HydrophobicContact CB-CE 3.44Å; N209-M216 VanDerWaalsContact CB-CE 3.44Å; N209-Q217 CarbonylContact C-O 3.58Å; N209-Q217 WeakPolarHBondContact CA-O 3.48Å; N209-A218 VanDerWaalsContact OD1-CA 3.3Å; N209-A218 WeakPolarHBondContact OD1-CA 3.34Å; N209-Y313 CarbonylContact O-C 3.52Å; N209-Y313 VanDerWaalsContact O-CA 3.25Å; N209-Y313 WeakPolarHBondContact O-CA 3.32Å; N209-Y313 WeakPolarHBondContact O-CD1 3.48Å; N209-T314 PolarHBondContact N-O 3.41Å; N209-T314 PolarHBondContact O-N 3.36Å
210	Y	96.5	Very high	94.8	Very high	40 Å²	40	52.4 Å²	52.4	16%	0.157	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	132.8	174.1	177.3	-125.2	0	0	0	110.1	N212 M216 Q217 F304 P309 K310 N312 Y313	Y210-N212 HydrophobicContact CD1-CB 3.9Å; Y210-N212 HydrophobicContact CE1-CB 3.72Å; Y210-N212 PolarHBondContact O-N 3.22Å; Y210-M216 WeakPolarHBondContact O-CA 3.37Å; Y210-Q217 PolarHBondContact N-O 2.77Å; Y210-Q217 PolarHBondContact O-N 3.33Å; Y210-F304 HydrophobicContact CD1-CE1 4.06Å; Y210-F304 HydrophobicContact CD1-CZ 4.13Å; Y210-F304 HydrophobicContact CG-CE1 4.18Å; Y210-F304 HydrophobicContact CG-CZ 4.31Å; Y210-P309 HydrophobicContact CE1-CB 4.49Å; Y210-P309 HydrophobicContact CE1-CG 4.48Å; Y210-P309 HydrophobicContact CE2-CB 4.43Å; Y210-K310 PolarHBondContact OH-O 3.44Å; Y210-N312 WeakPolarHBondContact CD2-O 3.42Å; Y210-Y313 HydrophobicContact CD2-CD1 4.12Å; Y210-Y313 HydrophobicContact CD2-CD2 4.13Å; Y210-Y313 AromaticContact CD2-CE1 3.58Å; Y210-Y313 HydrophobicContact CD2-CE1 3.58Å; Y210-Y313 AromaticContact CD2-CE2 3.56Å; Y210-Y313 HydrophobicContact CD2-CE2 3.56Å; Y210-Y313 HydrophobicContact CD2-CG 4.37Å; Y210-Y313 AromaticContact CD2-CZ 3.24Å; Y210-Y313 WeakPolarHBondContact CD2-OH 3.36Å; Y210-Y313 AromaticContact CE2-CE2 3.91Å; Y210-Y313 HydrophobicContact CE2-CE2 3.91Å; Y210-Y313 AromaticContact CE2-CZ 3.86Å; Y210-Y313 AromaticContact CG-CE1 3.91Å; Y210-Y313 HydrophobicContact CG-CE1 3.91Å; Y210-Y313 AromaticContact CG-CZ 3.94Å
211	K	95.4	Very high	94.7	Very high	130 Å²	130	53.9 Å²	53.9	57%	0.565	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	102.1	172.7	-171.7	178.4	179.3	-179.8	0	109.6	M216 N312	K211-M216 HydrophobicContact CB-SD 3.7Å; K211-M216 HydrophobicContact CG-SD 4.07Å; K211-N312 HydrophobicContact CB-CB 4.16Å; K211-N312 PolarHBondContact N-O 3.38Å
212	N	89.9	Confident	94.6	Very high	44 Å²	44	54.2 Å²	54.2	24%	0.235	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	-175.7	174	73	20.9	0	0	0	111.2	Y210 S214 G215 Q217	Y210-N212 HydrophobicContact CD1-CB 3.9Å; Y210-N212 HydrophobicContact CE1-CB 3.72Å; Y210-N212 PolarHBondContact O-N 3.22Å; N212-S214 VanDerWaalsContact C-N 3.26Å; N212-S214 PolarHBondContact O-N 2.8Å; N212-S214 VanDerWaalsContact OD1-CA 3.28Å; N212-S214 WeakPolarHBondContact OD1-CA 3.2Å; N212-S214 WeakPolarHBondContact OD1-CB 2.98Å; N212-S214 PolarHBondContact OD1-N 3.1Å; N212-G215 PolarHBondContact N-O 3.39Å; N212-G215 PolarHBondContact O-N 3.11Å; N212-G215 PolarHBondContact OD1-N 2.78Å; N212-G215 PolarHBondContact OD1-O 3.21Å; N212-Q217 PolarHBondContact ND2-OE1 3.01Å; N212-Q217 VanDerWaalsContact ND2-OE1 3.08Å
213	T	87	Confident	94.5	Very high	152 Å²	152	57.1 Å²	57.1	93%	0.933	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-22.8	177.8	47.7	0	0	0	0	113.8
214	S	85.2	Confident	94.5	Very high	114 Å²	114	60.7 Å²	60.7	80%	0.797	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	-8.4	-179.1	-45.4	0	0	0	0	113.5	N212	N212-S214 VanDerWaalsContact C-N 3.26Å; N212-S214 PolarHBondContact O-N 2.8Å; N212-S214 VanDerWaalsContact OD1-CA 3.28Å; N212-S214 WeakPolarHBondContact OD1-CA 3.2Å; N212-S214 WeakPolarHBondContact OD1-CB 2.98Å; N212-S214 PolarHBondContact OD1-N 3.1Å
215	G	90.7	Very high	94.4	Very high	34 Å²	34	62.3 Å²	62.3	35%	0.351	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134	-151.6	-177.6	0	0	0	0	0	113.4	N212	N212-G215 PolarHBondContact N-O 3.39Å; N212-G215 PolarHBondContact O-N 3.11Å; N212-G215 PolarHBondContact OD1-N 2.78Å; N212-G215 PolarHBondContact OD1-O 3.21Å
216	M	92.4	Very high	94.4	Very high	100 Å²	100	59.4 Å²	59.4	49%	0.493	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.6	176.1	-68.4	-66.8	-79.9	0	0	109.9	N209 Y210 K211 T314	N209-M216 HydrophobicContact CB-CE 3.44Å; N209-M216 VanDerWaalsContact CB-CE 3.44Å; Y210-M216 WeakPolarHBondContact O-CA 3.37Å; K211-M216 HydrophobicContact CB-SD 3.7Å; K211-M216 HydrophobicContact CG-SD 4.07Å; M216-T314 HydrophobicContact CE-CG2 4.47Å; M216-T314 WeakPolarHBondContact CE-OG1 3.33Å
217	Q	94.3	Very high	94.3	Very high	66 Å²	66	59.3 Å²	59.3	31%	0.308	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	124.6	177.4	-178	179.4	9.4	0	0	109.7	N209 Y210 N212 V219 F304	N209-Q217 CarbonylContact C-O 3.58Å; N209-Q217 WeakPolarHBondContact CA-O 3.48Å; Y210-Q217 PolarHBondContact N-O 2.77Å; Y210-Q217 PolarHBondContact O-N 3.33Å; N212-Q217 PolarHBondContact ND2-OE1 3.01Å; N212-Q217 VanDerWaalsContact ND2-OE1 3.08Å; Q217-V219 PolarHBondContact O-N 2.77Å; Q217-F304 HydrophobicContact CG-CE2 3.96Å; Q217-F304 HydrophobicContact CG-CZ 4.27Å
218	A	95.4	Very high	94.2	Very high	53 Å²	53	63.2 Å²	63.2	44%	0.438	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	132.9	173.9	0	0	0	0	0	110.7	N209	N209-A218 VanDerWaalsContact OD1-CA 3.3Å; N209-A218 WeakPolarHBondContact OD1-CA 3.34Å
219	V	96.7	Very high	94.2	Very high	8 Å²	8	67.5 Å²	67.5	5%	0.048	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-74.4	120.8	173.9	-180	0	0	0	0	107.7	L208 Q217 I221 V297 F304 L308 Y313	L208-V219 HydrophobicContact CB-CB 4.25Å; L208-V219 HydrophobicContact CB-CG2 4.33Å; L208-V219 HydrophobicContact CD2-CB 4.09Å; L208-V219 HydrophobicContact CD2-CG1 4.26Å; L208-V219 HydrophobicContact CD2-CG2 3.85Å; L208-V219 HydrophobicContact CG-CB 4.15Å; L208-V219 HydrophobicContact CG-CG2 3.76Å; L208-V219 PolarHBondContact O-N 3.45Å; Q217-V219 PolarHBondContact O-N 2.77Å; V219-I221 HydrophobicContact CG1-CG2 4.44Å; V219-I221 PolarHBondContact O-N 3.39Å; V219-V297 HydrophobicContact CG1-CG1 3.85Å; V219-V297 HydrophobicContact CG1-CG2 4.03Å; V219-F304 HydrophobicContact CB-CZ 4.48Å; V219-F304 HydrophobicContact CG2-CE1 4.01Å; V219-F304 HydrophobicContact CG2-CZ 3.86Å; V219-L308 HydrophobicContact CG1-CD1 3.92Å; V219-L308 HydrophobicContact CG2-CD1 4.05Å; V219-Y313 HydrophobicContact CG2-CD1 4.36Å; V219-Y313 HydrophobicContact CG2-CE1 3.95Å
220	P	96.4	Very high	94.2	Very high	47 Å²	47	69 Å²	69	31%	0.305	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-70.8	122.9	-178.8	30.8	-34.8	0	0	0	109.1	V297 V298 F304	P220-V297 WeakPolarHBondContact O-CA 3.49Å; P220-V298 HydrophobicContact CB-CB 4.13Å; P220-V298 HydrophobicContact CG-CB 4.34Å; P220-V298 PolarHBondContact O-N 2.86Å; P220-F304 HydrophobicContact CG-CD2 3.97Å
221	I	96.1	Very high	94.2	Very high	52 Å²	52	67.2 Å²	67.2	27%	0.267	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	155.6	179.2	60.8	168.6	0	0	0	110.5	L146 V219 F223 R296	L146-I221 HydrophobicContact CD1-CG2 3.73Å; V219-I221 HydrophobicContact CG1-CG2 4.44Å; V219-I221 PolarHBondContact O-N 3.39Å; I221-F223 HydrophobicContact CD1-CE2 4.5Å; I221-F223 HydrophobicContact CD1-CZ 4.39Å; I221-R296 CarbonylContact C-O 3.55Å; I221-R296 VanDerWaalsContact CA-O 3.28Å; I221-R296 WeakPolarHBondContact CA-O 3.31Å
222	T	95.4	Very high	94.1	Very high	33 Å²	33	63 Å²	63	20%	0.202	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	146.6	172.6	-178.2	0	0	0	0	110.8	K224 S295 R296 V298	T222-K224 PolarHBondContact OG1-N 3.32Å; T222-S295 WeakPolarHBondContact O-CA 3.47Å; T222-S295 WeakPolarHBondContact O-CB 3.42Å; T222-R296 HydrophobicContact CG2-CG 3.39Å; T222-R296 VanDerWaalsContact CG2-NE 3.26Å; T222-R296 PolarHBondContact N-O 3.4Å; T222-R296 PolarHBondContact O-N 3.31Å; T222-V298 HydrophobicContact CG2-CG2 3.7Å
223	F	95.6	Very high	94.3	Very high	79 Å²	79	65.9 Å²	65.9	35%	0.346	38%	0.377	S	S	.	.			trans	-93.7	0.2	174.3	-64.2	-83.5	0	0	0	112.6	I221 I226 H294	I221-F223 HydrophobicContact CD1-CE2 4.5Å; I221-F223 HydrophobicContact CD1-CZ 4.39Å; F223-I226 HydrophobicContact CB-CD1 4.46Å; F223-I226 HydrophobicContact CD1-CD1 4.48Å; F223-I226 WeakPolarHBondContact O-CD1 3.43Å; F223-I226 VanDerWaalsContact O-CG1 3.29Å; F223-I226 WeakPolarHBondContact O-CG1 3.38Å; F223-H294 WeakPolarHBondContact CD1-O 3.37Å; F223-H294 AromaticContact CE1-CE1 3.37Å; F223-H294 WeakPolarHBondContact CE1-CE1 3.32Å; F223-H294 AromaticContact CE1-ND1 3.78Å; F223-H294 AromaticContact CE1-NE2 3.69Å; F223-H294 WeakPolarHBondContact CE1-O 3.4Å; F223-H294 AromaticContact CZ-CE1 3.52Å
224	K	94.8	Very high	94.7	Very high	123 Å²	123	64.3 Å²	64.3	54%	0.535	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	139.4	177.3	-171.9	173.4	-176.3	169.6	0	111.3	T222 E276 R296	T222-K224 PolarHBondContact OG1-N 3.32Å; K224-E276 WeakPolarHBondContact CA-OE1 3.28Å; K224-R296 PolarHBondContact O-NE 2.72Å
225	G	94.3	Very high	95.3	Very high	39 Å²	39	64.2 Å²	64.2	40%	0.402	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	32.5	-179.6	0	0	0	0	0	113.8	E276	G225-E276 WeakPolarHBondContact CA-OE2 3.22Å; G225-E276 PolarHBondContact N-OE1 3.25Å; G225-E276 PolarHBondContact N-OE2 2.8Å
226	I	96.3	Very high	95.6	Very high	10 Å²	10	63.2 Å²	63.2	5%	0.051	33%	0.33	C	S	.	.			trans	-101.9	-24	172	67.8	178.7	0	0	0	112.5	F223 E276 V280 L293 H294	F223-I226 HydrophobicContact CB-CD1 4.46Å; F223-I226 HydrophobicContact CD1-CD1 4.48Å; F223-I226 WeakPolarHBondContact O-CD1 3.43Å; F223-I226 VanDerWaalsContact O-CG1 3.29Å; F223-I226 WeakPolarHBondContact O-CG1 3.38Å; I226-E276 HydrophobicContact CD1-CB 4.01Å; I226-E276 HydrophobicContact CG1-CB 3.52Å; I226-E276 PolarHBondContact N-OE2 3.31Å; I226-V280 HydrophobicContact CB-CG2 4.44Å; I226-V280 HydrophobicContact CD1-CG2 4.31Å; I226-V280 HydrophobicContact CG1-CG2 3.99Å; I226-V280 WeakPolarHBondContact O-CG2 3.37Å; I226-L293 HydrophobicContact CB-CD2 3.59Å; I226-L293 HydrophobicContact CB-CG 3.83Å; I226-L293 HydrophobicContact CG2-CD2 3.86Å; I226-L293 HydrophobicContact CG2-CG 3.95Å; I226-H294 WeakPolarHBondContact CD1-O 3.29Å
227	A	96.6	Very high	95.8	Very high	10 Å²	10	63.2 Å²	63.2	8%	0.083	33%	0.325	C	S	.	.	S	Bend	trans	-85.9	156.9	173	0	0	0	0	0	111.1	L232 E276 I279	A227-L232 HydrophobicContact CB-CD1 4.2Å; A227-L232 HydrophobicContact CB-CG 4.24Å; A227-E276 HydrophobicContact CB-CB 3.89Å; A227-E276 HydrophobicContact CB-CG 3.91Å; A227-E276 PolarHBondContact N-OE2 2.91Å; A227-I279 HydrophobicContact CB-CB 4.08Å; A227-I279 HydrophobicContact CB-CD1 4.43Å; A227-I279 HydrophobicContact CB-CG2 3.81Å
228	W	95.5	Very high	95.9	Very high	161 Å²	161	61.1 Å²	61.1	61%	0.61	32%	0.316	S	S	*	.			trans	-71.3	135.6	175.2	-70.6	77.8	0	0	0	110	S230 D231 L232	W228-S230 PolarHBondContact O-N 2.84Å; W228-S230 VanDerWaalsContact O-N 3.15Å; W228-D231 PolarHBondContact O-N 2.92Å; W228-L232 PolarHBondContact O-N 3.39Å
229	P	96.1	Very high	95.8	Very high	94 Å²	94	59.2 Å²	59.2	61%	0.61	30%	0.298	S	S	*	.	H	α-helix	trans	-53.9	-38	179.4	-28.1	34.9	0	0	0	113.2	D231 L232 E233	P229-D231 VanDerWaalsContact C-N 3.33Å; P229-D231 PolarHBondContact O-N 3.05Å; P229-L232 PolarHBondContact O-N 2.89Å; P229-E233 WeakPolarHBondContact O-CB 3.34Å; P229-E233 PolarHBondContact O-N 2.83Å
230	S	96.7	Very high	95.6	Very high	59 Å²	59	64.6 Å²	64.6	41%	0.413	34%	0.336	S	S	.	.	H	α-helix	trans	-67	-29	179.1	55.7	0	0	0	0	114.1	W228 H234	W228-S230 PolarHBondContact O-N 2.84Å; W228-S230 VanDerWaalsContact O-N 3.15Å; S230-H234 WeakPolarHBondContact O-CB 3.29Å; S230-H234 PolarHBondContact O-N 3.15Å
231	D	96.9	Very high	95.5	Very high	3 Å²	3	65.4 Å²	65.4	2%	0.016	34%	0.341	C	S	.	.	H	α-helix	trans	-72.1	-42.7	173.9	-67.9	-26	0	0	0	110.5	W228 P229 E233 K235 F236 I279 R283	W228-D231 PolarHBondContact O-N 2.92Å; P229-D231 VanDerWaalsContact C-N 3.33Å; P229-D231 PolarHBondContact O-N 3.05Å; D231-E233 VanDerWaalsContact C-N 3.27Å; D231-E233 PolarHBondContact O-N 2.93Å; D231-K235 PolarHBondContact O-N 2.82Å; D231-K235 WeakPolarHBondContact OD1-CD 3.47Å; D231-K235 IonicContact OD1-NZ 3.47Å; D231-K235 PolarHBondContact OD1-NZ 2.82Å; D231-F236 HydrophobicContact CB-CD2 4.03Å; D231-F236 HydrophobicContact CB-CE2 4.25Å; D231-F236 PolarHBondContact O-N 3.31Å; D231-I279 HydrophobicContact CB-CG2 3.77Å; D231-R283 IonicContact OD1-NH2 2.76Å; D231-R283 PolarHBondContact OD1-NH2 3.11Å; D231-R283 IonicContact OD2-CZ 3.59Å; D231-R283 IonicContact OD2-NH1 3.16Å; D231-R283 PolarHBondContact OD2-NH1 2.89Å; D231-R283 IonicContact OD2-NH2 3.7Å; D231-R283 PolarHBondContact OD2-NH2 2.79Å
232	L	94.6	Very high	95.2	Very high	41 Å²	41	68.5 Å²	68.5	22%	0.215	35%	0.352	C	S	.	.	H	α-helix	trans	-64	-33	176.3	-74.8	166	0	0	0	112.5	A227 W228 P229 R237 E276 I279	A227-L232 HydrophobicContact CB-CD1 4.2Å; A227-L232 HydrophobicContact CB-CG 4.24Å; W228-L232 PolarHBondContact O-N 3.39Å; P229-L232 PolarHBondContact O-N 2.89Å; L232-R237 PolarHBondContact O-NH1 2.85Å; L232-E276 HydrophobicContact CD1-CG 4.37Å; L232-E276 HydrophobicContact CD2-CG 4.24Å; L232-I279 HydrophobicContact CD2-CD1 3.4Å; L232-I279 VanDerWaalsContact CD2-CD1 3.4Å; L232-I279 HydrophobicContact CG-CD1 4.07Å
233	E	94.4	Very high	95.1	Very high	106 Å²	106	70.5 Å²	70.5	50%	0.495	37%	0.366	S	S	.	.	H	α-helix	trans	-84.3	-35.3	-177.7	-164.4	177.9	171	0	0	113	P229 D231 R237	P229-E233 WeakPolarHBondContact O-CB 3.34Å; P229-E233 PolarHBondContact O-N 2.83Å; D231-E233 VanDerWaalsContact C-N 3.27Å; D231-E233 PolarHBondContact O-N 2.93Å; E233-R237 PolarHBondContact O-NE 3.15Å; E233-R237 VanDerWaalsContact O-NE 3.12Å; E233-R237 PolarHBondContact O-NH2 3.17Å
234	H	95.3	Very high	94.9	Very high	118 Å²	118	66.9 Å²	66.9	55%	0.546	35%	0.35	S	S	.	.	H	α-helix	trans	-125.1	-15.5	-167.1	-56.5	-53.7	0	0	0	116	L170 S230	L170-H234 WeakPolarHBondContact CD2-O 3Å; S230-H234 WeakPolarHBondContact O-CB 3.29Å; S230-H234 PolarHBondContact O-N 3.15Å
235	K	96.6	Very high	94.9	Very high	113 Å²	113	67.1 Å²	67.1	49%	0.491	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	-28	-172.8	-64.2	-174.7	-166.1	151.2	0	114.4	D231	D231-K235 PolarHBondContact O-N 2.82Å; D231-K235 WeakPolarHBondContact OD1-CD 3.47Å; D231-K235 IonicContact OD1-NZ 3.47Å; D231-K235 PolarHBondContact OD1-NZ 2.82Å
236	F	97.6	Very high	94.9	Very high	13 Å²	13	70.8 Å²	70.8	6%	0.057	36%	0.356	C	S	.	.			trans	-125.8	117.8	-176.4	-66.1	-92.5	0	0	0	109.9	L169 D231 I279 M282	L169-F236 HydrophobicContact CB-CD1 4.11Å; L169-F236 HydrophobicContact CB-CE1 4.21Å; L169-F236 HydrophobicContact CD1-CE1 3.86Å; L169-F236 HydrophobicContact CD1-CZ 4.42Å; L169-F236 HydrophobicContact CD2-CD1 4.16Å; L169-F236 HydrophobicContact CD2-CE1 3.95Å; L169-F236 HydrophobicContact CG-CD1 4.5Å; L169-F236 HydrophobicContact CG-CE1 4.22Å; L169-F236 WeakPolarHBondContact O-CA 3.48Å; D231-F236 HydrophobicContact CB-CD2 4.03Å; D231-F236 HydrophobicContact CB-CE2 4.25Å; D231-F236 PolarHBondContact O-N 3.31Å; F236-I279 HydrophobicContact CB-CD1 3.77Å; F236-I279 HydrophobicContact CB-CG1 4.01Å; F236-I279 HydrophobicContact CD1-CG1 3.84Å; F236-I279 HydrophobicContact CD2-CB 4.46Å; F236-I279 HydrophobicContact CD2-CD1 4.17Å; F236-I279 HydrophobicContact CD2-CG1 3.86Å; F236-I279 HydrophobicContact CD2-CG2 3.93Å; F236-I279 HydrophobicContact CE1-CG1 4.25Å; F236-I279 HydrophobicContact CE2-CB 4.49Å; F236-I279 HydrophobicContact CE2-CG1 4.29Å; F236-I279 HydrophobicContact CE2-CG2 3.87Å; F236-I279 HydrophobicContact CG-CD1 3.93Å; F236-I279 HydrophobicContact CG-CG1 3.63Å; F236-I279 HydrophobicContact CZ-CG1 4.47Å; F236-I279 HydrophobicContact CZ-CG2 4.43Å; F236-M282 HydrophobicContact CE1-CB 4.08Å; F236-M282 HydrophobicContact CE1-CG 4.14Å; F236-M282 HydrophobicContact CZ-CB 3.77Å; F236-M282 HydrophobicContact CZ-CG 4.35Å
237	R	96.5	Very high	94.8	Very high	100 Å²	100	70.7 Å²	70.7	38%	0.377	36%	0.357	S	S	.	.			trans	-135.9	134.9	179	-66.6	-61.9	-173.6	176.5	7.6	109.8	L169 L170 G171 L232 E233	L169-R237 PolarHBondContact O-N 3.37Å; L170-R237 WeakPolarHBondContact O-CB 3.49Å; G171-R237 WeakPolarHBondContact CA-O 3.25Å; G171-R237 PolarHBondContact N-O 2.98Å; L232-R237 PolarHBondContact O-NH1 2.85Å; E233-R237 PolarHBondContact O-NE 3.15Å; E233-R237 VanDerWaalsContact O-NE 3.12Å; E233-R237 PolarHBondContact O-NH2 3.17Å
238	N	95.6	Very high	94.7	Very high	22 Å²	22	70.7 Å²	70.7	12%	0.118	36%	0.355	C	S	.	.			trans	-71.2	149.4	167.2	-78.9	-24	0	0	0	109.1	L244 S271 G272 F273 Q274	N238-L244 HydrophobicContact CB-CD1 3.95Å; N238-S271 PolarHBondContact ND2-O 3.14Å; N238-G272 VanDerWaalsContact OD1-CA 3.3Å; N238-G272 WeakPolarHBondContact OD1-CA 3.31Å; N238-F273 PolarHBondContact OD1-N 3.44Å; N238-Q274 HydrophobicContact CB-CG 4.41Å; N238-Q274 PolarHBondContact OD1-N 3.42Å
239	P	94.9	Very high	94.7	Very high	12 Å²	12	68.5 Å²	68.5	8%	0.078	35%	0.352	C	S	.	.			trans	-59.5	152	173.2	-18.9	31.6	0	0	0	110.8	G171 P173 T241 A247 F248	G171-P239 WeakPolarHBondContact O-CB 3.45Å; P173-P239 HydrophobicContact CG-CG 3.9Å; P239-T241 PolarHBondContact O-N 3.16Å; P239-A247 HydrophobicContact CB-CB 3.67Å; P239-A247 HydrophobicContact CG-CB 3.82Å; P239-F248 HydrophobicContact CG-CZ 4.29Å
240	S	92.6	Very high	94.6	Very high	121 Å²	121	66.1 Å²	66.1	85%	0.846	34%	0.344	S	S	*	.	S	Bend	trans	-69.2	-21	-178.5	55.7	0	0	0	0	113.9
241	T	92.8	Very high	94.6	Very high	64 Å²	64	64.5 Å²	64.5	39%	0.393	33%	0.332	S	S	.	.	S	Bend	trans	-68.9	130.4	-178.2	-57.7	0	0	0	0	111.3	P239 K246 A247	P239-T241 PolarHBondContact O-N 3.16Å; T241-K246 HydrophobicContact CG2-CB 4.38Å; T241-K246 HydrophobicContact CG2-CD 4.34Å; T241-K246 HydrophobicContact CG2-CG 4.23Å; T241-A247 HydrophobicContact CG2-CB 4.47Å
242	K	90.6	Very high	94.6	Very high	118 Å²	118	66.1 Å²	66.1	51%	0.513	34%	0.341	S	S	.	.	S	Bend	trans	-117.5	144.8	175.3	-65.8	-61.7	-167.7	173.4	0	111.2	E268	K242-E268 WeakPolarHBondContact CD-OE1 3.43Å; K242-E268 IonicContact NZ-OE1 2.94Å; K242-E268 PolarHBondContact NZ-OE1 2.81Å
243	P	93	Very high	94.7	Very high	75 Å²	75	66 Å²	66	49%	0.487	34%	0.344	S	S	.	.	S	Bend	cis	-67.4	157.2	-5	31	-36.3	0	0	0	111.9	K245 K246	P243-K245 PolarHBondContact O-N 3.39Å; P243-K245 VanDerWaalsContact O-N 3.13Å; P243-K246 HydrophobicContact CG-CB 4.26Å; P243-K246 WeakPolarHBondContact O-CB 3.48Å; P243-K246 PolarHBondContact O-N 2.75Å
244	L	92.4	Very high	94.9	Very high	3 Å²	3	61 Å²	61	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-51.6	-39.6	-175.8	-170.1	64.6	0	0	0	113.1	N238 K246 A247 F248 D262 E268	N238-L244 HydrophobicContact CB-CD1 3.95Å; L244-K246 VanDerWaalsContact C-N 3.27Å; L244-K246 PolarHBondContact O-N 3.41Å; L244-A247 WeakPolarHBondContact O-CB 3.39Å; L244-A247 PolarHBondContact O-N 3.45Å; L244-F248 HydrophobicContact CD1-CD2 4.38Å; L244-F248 HydrophobicContact CD1-CE2 3.68Å; L244-F248 HydrophobicContact CD2-CE2 4.4Å; L244-F248 HydrophobicContact CG-CD2 4.18Å; L244-F248 HydrophobicContact CG-CE2 3.77Å; L244-F248 WeakPolarHBondContact O-CD2 3.37Å; L244-D262 HydrophobicContact CD2-CB 4.01Å; L244-D262 HydrophobicContact CG-CB 3.99Å; L244-E268 HydrophobicContact CB-CG 3.85Å; L244-E268 WeakPolarHBondContact CB-OE1 3.41Å; L244-E268 HydrophobicContact CD2-CG 4.4Å; L244-E268 PolarHBondContact N-OE1 3.22Å
245	K	93.2	Very high	94.9	Very high	127 Å²	127	59.1 Å²	59.1	55%	0.552	32%	0.319	S	S	*	.	H	α-helix	trans	-53	-40.8	175.9	-174.1	162.5	-170	144.2	0	113.7	P243 A247 F248 D262 E263	P243-K245 PolarHBondContact O-N 3.39Å; P243-K245 VanDerWaalsContact O-N 3.13Å; K245-A247 VanDerWaalsContact C-N 3.28Å; K245-A247 PolarHBondContact O-N 3.28Å; K245-F248 PolarHBondContact O-N 3.26Å; K245-D262 WeakPolarHBondContact CA-OD2 3.39Å; K245-D262 WeakPolarHBondContact CB-OD2 3.14Å; K245-D262 WeakPolarHBondContact CG-OD2 3.5Å; K245-E263 IonicContact NZ-OE1 3.06Å; K245-E263 PolarHBondContact NZ-OE1 2.76Å
246	K	94.6	Very high	94.8	Very high	116 Å²	116	58.8 Å²	58.8	50%	0.504	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-31.8	177.8	-172.2	175.7	-177.4	177.9	0	111.9	T241 P243 L244 F248 E249	T241-K246 HydrophobicContact CG2-CB 4.38Å; T241-K246 HydrophobicContact CG2-CD 4.34Å; T241-K246 HydrophobicContact CG2-CG 4.23Å; P243-K246 HydrophobicContact CG-CB 4.26Å; P243-K246 WeakPolarHBondContact O-CB 3.48Å; P243-K246 PolarHBondContact O-N 2.75Å; L244-K246 VanDerWaalsContact C-N 3.27Å; L244-K246 PolarHBondContact O-N 3.41Å; K246-F248 VanDerWaalsContact C-N 3.25Å; K246-F248 PolarHBondContact O-N 2.96Å; K246-E249 WeakPolarHBondContact O-CB 3.31Å; K246-E249 PolarHBondContact O-N 3.48Å
247	A	93.5	Very high	94.7	Very high	9 Å²	9	59.1 Å²	59.1	7%	0.074	32%	0.323	C	S	.	.	H	α-helix	trans	-65.7	-30.6	178.8	0	0	0	0	0	113	P173 P239 T241 L244 K245	P173-A247 VanDerWaalsContact CG-O 3.28Å; P173-A247 WeakPolarHBondContact CG-O 3.28Å; P239-A247 HydrophobicContact CB-CB 3.67Å; P239-A247 HydrophobicContact CG-CB 3.82Å; T241-A247 HydrophobicContact CG2-CB 4.47Å; L244-A247 WeakPolarHBondContact O-CB 3.39Å; L244-A247 PolarHBondContact O-N 3.45Å; K245-A247 VanDerWaalsContact C-N 3.28Å; K245-A247 PolarHBondContact O-N 3.28Å
248	F	95.6	Very high	94.3	Very high	10 Å²	10	59.8 Å²	59.8	4%	0.044	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	3.3	179.7	-68.8	-77.8	0	0	0	113.8	P173 A192 P239 L244 K245 K246 G250 T251 V261 D262 F273	P173-F248 HydrophobicContact CB-CD1 3.6Å; P173-F248 HydrophobicContact CB-CE1 3.62Å; P173-F248 HydrophobicContact CG-CD1 4.35Å; P173-F248 HydrophobicContact CG-CE1 4.47Å; A192-F248 HydrophobicContact CB-CD1 4.08Å; A192-F248 HydrophobicContact CB-CE1 4.31Å; P239-F248 HydrophobicContact CG-CZ 4.29Å; L244-F248 HydrophobicContact CD1-CD2 4.38Å; L244-F248 HydrophobicContact CD1-CE2 3.68Å; L244-F248 HydrophobicContact CD2-CE2 4.4Å; L244-F248 HydrophobicContact CG-CD2 4.18Å; L244-F248 HydrophobicContact CG-CE2 3.77Å; L244-F248 WeakPolarHBondContact O-CD2 3.37Å; K245-F248 PolarHBondContact O-N 3.26Å; K246-F248 VanDerWaalsContact C-N 3.25Å; K246-F248 PolarHBondContact O-N 2.96Å; F248-G250 PolarHBondContact O-N 3.3Å; F248-T251 WeakPolarHBondContact O-CB 3.35Å; F248-T251 PolarHBondContact O-N 3.25Å; F248-T251 PolarHBondContact O-OG1 3.13Å; F248-V261 HydrophobicContact CD1-CG1 3.66Å; F248-V261 HydrophobicContact CD2-CG1 4.19Å; F248-V261 HydrophobicContact CE1-CG1 3.34Å; F248-V261 HydrophobicContact CE2-CG1 3.91Å; F248-V261 HydrophobicContact CG-CG1 4.09Å; F248-V261 HydrophobicContact CZ-CG1 3.49Å; F248-V261 VanDerWaalsContact CZ-CG1 3.49Å; F248-D262 HydrophobicContact CD2-CB 3.83Å; F248-D262 HydrophobicContact CE2-CB 4.19Å; F248-F273 HydrophobicContact CE1-CD2 4.49Å; F248-F273 AromaticContact CE1-CE1 3.93Å; F248-F273 HydrophobicContact CE1-CE1 3.93Å; F248-F273 AromaticContact CE1-CE2 3.82Å; F248-F273 HydrophobicContact CE1-CE2 3.82Å; F248-F273 AromaticContact CE1-CZ 3.53Å; F248-F273 HydrophobicContact CE1-CZ 3.53Å; F248-F273 HydrophobicContact CZ-CD2 4.31Å; F248-F273 HydrophobicContact CZ-CE1 4.3Å; F248-F273 HydrophobicContact CZ-CE2 4.09Å; F248-F273 HydrophobicContact CZ-CZ 4.1Å
249	E	95.2	Very high	94.2	Very high	115 Å²	115	63.6 Å²	63.6	54%	0.537	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	130.1	174.8	-78.7	175.6	-170.6	0	0	111.8	K174 K246	K174-E249 WeakPolarHBondContact CE-O 3.47Å; K174-E249 PolarHBondContact NZ-O 3.48Å; K246-E249 WeakPolarHBondContact O-CB 3.31Å; K246-E249 PolarHBondContact O-N 3.48Å
250	G	94.8	Very high	94.2	Very high	43 Å²	43	65 Å²	65	44%	0.443	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	12.4	-174.7	0	0	0	0	0	114.2	P190 F248	P190-G250 WeakPolarHBondContact CD-O 3.06Å; F248-G250 PolarHBondContact O-N 3.3Å
251	T	96.8	Very high	94.4	Very high	26 Å²	26	59.4 Å²	59.4	16%	0.16	33%	0.326	C	S	.	.			trans	-117	169.2	168.1	73.3	0	0	0	0	110.8	P173 K174 P190 A192 F248	P173-T251 HydrophobicContact CB-CG2 4.22Å; K174-T251 HydrophobicContact CG-CG2 4.05Å; P190-T251 HydrophobicContact CG-CG2 4.21Å; P190-T251 CarbonylContact O-C 3.53Å; P190-T251 VanDerWaalsContact O-CA 3.29Å; P190-T251 WeakPolarHBondContact O-CA 3.35Å; P190-T251 WeakPolarHBondContact O-CB 3.38Å; A192-T251 HydrophobicContact CB-CG2 4.06Å; F248-T251 WeakPolarHBondContact O-CB 3.35Å; F248-T251 PolarHBondContact O-N 3.25Å; F248-T251 PolarHBondContact O-OG1 3.13Å
252	V	97.2	Very high	94.5	Very high	37 Å²	37	57.4 Å²	57.4	22%	0.224	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-133.1	149.2	-179.5	43.9	0	0	0	0	110.1	V186 L189 P190 I191 A192	V186-V252 HydrophobicContact CB-CG1 4.05Å; V186-V252 HydrophobicContact CB-CG2 4.1Å; V186-V252 HydrophobicContact CG2-CG2 4.34Å; L189-V252 HydrophobicContact CB-CB 4.33Å; L189-V252 HydrophobicContact CB-CG1 3.57Å; L189-V252 WeakPolarHBondContact O-CG1 3.49Å; P190-V252 WeakPolarHBondContact O-CG1 3.5Å; P190-V252 PolarHBondContact O-N 3.4Å; I191-V252 CarbonylContact C-O 3.57Å; I191-V252 VanDerWaalsContact CA-O 3.25Å; I191-V252 WeakPolarHBondContact CA-O 3.38Å; I191-V252 HydrophobicContact CG1-CG1 4.17Å; A192-V252 PolarHBondContact N-O 3.26Å
253	S	96.8	Very high	94.7	Very high	37 Å²	37	55.7 Å²	55.7	26%	0.259	31%	0.306	S	S	.	.			trans	-69.3	155.4	176.9	56.3	0	0	0	0	112
254	P	97.4	Very high	94.8	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.297	C	S	.	.			trans	-56.5	146.6	171.7	-24.9	34.7	0	0	0	112.1	I191 P193 N199 N256 W257	I191-P254 HydrophobicContact CG2-CB 4.13Å; I191-P254 HydrophobicContact CG2-CG 3.8Å; P193-P254 HydrophobicContact CG-CG 4.48Å; P193-P254 VanDerWaalsContact O-CG 3.31Å; P193-P254 WeakPolarHBondContact O-CG 3.24Å; N199-P254 HydrophobicContact CB-CB 4.08Å; P254-N256 PolarHBondContact O-N 2.78Å; P254-N256 VanDerWaalsContact O-N 3.07Å; P254-W257 HydrophobicContact CB-CB 4.47Å; P254-W257 HydrophobicContact CB-CD2 4.25Å; P254-W257 HydrophobicContact CB-CG 3.87Å; P254-W257 HydrophobicContact CG-CD2 3.75Å; P254-W257 HydrophobicContact CG-CE3 4.32Å; P254-W257 HydrophobicContact CG-CG 3.91Å; P254-W257 HydrophobicContact CG-CZ2 4.19Å; P254-W257 WeakPolarHBondContact O-CB 3.33Å; P254-W257 PolarHBondContact O-N 2.7Å
255	P	94.9	Very high	94.8	Very high	79 Å²	79	56 Å²	56	51%	0.513	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.1	-175	-30.1	34.5	0	0	0	115.8	F183 V186 N199	F183-P255 HydrophobicContact CD1-CG 4.5Å; V186-P255 HydrophobicContact CG2-CG 4.17Å; N199-P255 WeakPolarHBondContact OD1-CD 3.31Å
256	N	94.2	Very high	94.5	Very high	106 Å²	106	60 Å²	60	57%	0.567	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	7.1	-178.8	-68.7	-22	0	0	0	113.7	N199 P254	N199-N256 PolarHBondContact ND2-ND2 2.93Å; N199-N256 VanDerWaalsContact ND2-ND2 3.18Å; N199-N256 WeakPolarHBondContact O-CB 3.47Å; N199-N256 PolarHBondContact OD1-N 3.07Å; N199-N256 VanDerWaalsContact OD1-N 3.08Å; P254-N256 PolarHBondContact O-N 2.78Å; P254-N256 VanDerWaalsContact O-N 3.07Å
257	W	95.3	Very high	94.3	Very high	21 Å²	21	57.4 Å²	57.4	8%	0.08	32%	0.318	C	S	.	.			trans	-92.6	131.4	-178.9	-75.9	29.4	0	0	0	110.8	P193 A198 L201 P254 K259 V261 L264 L278	P193-W257 HydrophobicContact CG-CH2 3.52Å; P193-W257 HydrophobicContact CG-CZ2 3.84Å; P193-W257 HydrophobicContact CG-CZ3 4.29Å; A198-W257 HydrophobicContact CB-CZ2 4.3Å; A198-W257 PolarHBondContact O-NE1 2.85Å; L201-W257 HydrophobicContact CB-CZ2 4.03Å; L201-W257 HydrophobicContact CD2-CH2 4Å; L201-W257 HydrophobicContact CD2-CZ2 3.59Å; L201-W257 HydrophobicContact CG-CZ2 4.41Å; P254-W257 HydrophobicContact CB-CB 4.47Å; P254-W257 HydrophobicContact CB-CD2 4.25Å; P254-W257 HydrophobicContact CB-CG 3.87Å; P254-W257 HydrophobicContact CG-CD2 3.75Å; P254-W257 HydrophobicContact CG-CE3 4.32Å; P254-W257 HydrophobicContact CG-CG 3.91Å; P254-W257 HydrophobicContact CG-CZ2 4.19Å; P254-W257 WeakPolarHBondContact O-CB 3.33Å; P254-W257 PolarHBondContact O-N 2.7Å; W257-K259 VanDerWaalsContact C-N 3.29Å; W257-V261 HydrophobicContact CH2-CG2 4.23Å; W257-V261 HydrophobicContact CZ3-CB 3.8Å; W257-V261 HydrophobicContact CZ3-CG2 3.94Å; W257-L264 HydrophobicContact CE3-CD2 4.27Å; W257-L264 HydrophobicContact CH2-CD1 4.16Å; W257-L264 HydrophobicContact CZ3-CD1 3.91Å; W257-L264 HydrophobicContact CZ3-CD2 4.04Å; W257-L264 HydrophobicContact CZ3-CG 4.28Å; W257-L278 HydrophobicContact CH2-CD1 3.86Å; W257-L278 HydrophobicContact CH2-CD2 4.26Å; W257-L278 HydrophobicContact CZ2-CD1 3.95Å
258	P	89.8	Confident	94	Very high	113 Å²	113	60.7 Å²	60.7	73%	0.734	33%	0.331	S	S	*	.	S	Bend	trans	-77.2	-17.7	176.4	31.6	-35.3	0	0	0	113
259	K	92.8	Very high	93.6	Very high	103 Å²	103	67.1 Å²	67.1	45%	0.448	36%	0.362	S	S	.	.	S	Bend	trans	-142.7	150.5	-175.8	-64.4	-174.9	-178.7	-176.3	0	109.9	W257	W257-K259 VanDerWaalsContact C-N 3.29Å
260	P	95.5	Very high	93.4	Very high	42 Å²	42	64.6 Å²	64.6	27%	0.273	35%	0.35	S	S	.	.			trans	-71.2	165	174.7	34.2	-37.7	0	0	0	111.7	D262 E263	P260-D262 VanDerWaalsContact C-N 3.28Å; P260-D262 VanDerWaalsContact CB-OD1 3.3Å; P260-D262 WeakPolarHBondContact CB-OD1 3.37Å; P260-D262 WeakPolarHBondContact CG-OD1 3.35Å; P260-D262 PolarHBondContact O-N 3.07Å; P260-E263 HydrophobicContact CG-CB 4.06Å; P260-E263 HydrophobicContact CG-CG 3.91Å; P260-E263 PolarHBondContact O-N 3.01Å; P260-E263 VanDerWaalsContact O-N 3.08Å
261	V	96.5	Very high	93.4	Very high	2 Å²	2	62.6 Å²	62.6	1%	0.012	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-64.9	-29.9	-170.9	69.6	0	0	0	0	113.6	F248 W257 E263 L264 G272 F273 L278	F248-V261 HydrophobicContact CD1-CG1 3.66Å; F248-V261 HydrophobicContact CD2-CG1 4.19Å; F248-V261 HydrophobicContact CE1-CG1 3.34Å; F248-V261 HydrophobicContact CE2-CG1 3.91Å; F248-V261 HydrophobicContact CG-CG1 4.09Å; F248-V261 HydrophobicContact CZ-CG1 3.49Å; F248-V261 VanDerWaalsContact CZ-CG1 3.49Å; W257-V261 HydrophobicContact CH2-CG2 4.23Å; W257-V261 HydrophobicContact CZ3-CB 3.8Å; W257-V261 HydrophobicContact CZ3-CG2 3.94Å; V261-E263 VanDerWaalsContact C-N 3.27Å; V261-E263 PolarHBondContact O-N 3.05Å; V261-L264 HydrophobicContact CG2-CD1 3.98Å; V261-L264 WeakPolarHBondContact O-CG 3.15Å; V261-G272 VanDerWaalsContact O-CA 3.28Å; V261-G272 WeakPolarHBondContact O-CA 3.35Å; V261-G272 PolarHBondContact O-N 3.11Å; V261-F273 HydrophobicContact CG1-CE1 4.38Å; V261-F273 HydrophobicContact CG2-CD1 3.98Å; V261-F273 HydrophobicContact CG2-CE1 4.19Å; V261-L278 HydrophobicContact CG2-CD2 4.09Å
262	D	94.7	Very high	93.3	Very high	22 Å²	22	61.3 Å²	61.3	12%	0.118	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-74.6	-12.9	176.1	59.3	-51.1	0	0	0	113.8	L244 K245 F248 P260 S271	L244-D262 HydrophobicContact CD2-CB 4.01Å; L244-D262 HydrophobicContact CG-CB 3.99Å; K245-D262 WeakPolarHBondContact CA-OD2 3.39Å; K245-D262 WeakPolarHBondContact CB-OD2 3.14Å; K245-D262 WeakPolarHBondContact CG-OD2 3.5Å; F248-D262 HydrophobicContact CD2-CB 3.83Å; F248-D262 HydrophobicContact CE2-CB 4.19Å; P260-D262 VanDerWaalsContact C-N 3.28Å; P260-D262 VanDerWaalsContact CB-OD1 3.3Å; P260-D262 WeakPolarHBondContact CB-OD1 3.37Å; P260-D262 WeakPolarHBondContact CG-OD1 3.35Å; P260-D262 PolarHBondContact O-N 3.07Å; D262-S271 VanDerWaalsContact O-CB 3.28Å; D262-S271 WeakPolarHBondContact O-CB 3.44Å; D262-S271 PolarHBondContact O-OG 2.99Å
263	E	95.2	Very high	93.3	Very high	82 Å²	82	59.6 Å²	59.6	38%	0.383	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-113.2	17.8	-178.9	-60.9	-177.7	-175	0	0	112.5	K245 P260 V261 S265	K245-E263 IonicContact NZ-OE1 3.06Å; K245-E263 PolarHBondContact NZ-OE1 2.76Å; P260-E263 HydrophobicContact CG-CB 4.06Å; P260-E263 HydrophobicContact CG-CG 3.91Å; P260-E263 PolarHBondContact O-N 3.01Å; P260-E263 VanDerWaalsContact O-N 3.08Å; V261-E263 VanDerWaalsContact C-N 3.27Å; V261-E263 PolarHBondContact O-N 3.05Å; E263-S265 VanDerWaalsContact C-N 3.34Å
264	L	94	Very high	93.3	Very high	55 Å²	55	60.2 Å²	60.2	29%	0.288	31%	0.309	S	S	.	.	S	Bend	trans	-67.8	-30.6	177.4	-71	180	0	0	0	113.4	W257 V261 N275 L278	W257-L264 HydrophobicContact CE3-CD2 4.27Å; W257-L264 HydrophobicContact CH2-CD1 4.16Å; W257-L264 HydrophobicContact CZ3-CD1 3.91Å; W257-L264 HydrophobicContact CZ3-CD2 4.04Å; W257-L264 HydrophobicContact CZ3-CG 4.28Å; V261-L264 HydrophobicContact CG2-CD1 3.98Å; V261-L264 WeakPolarHBondContact O-CG 3.15Å; L264-N275 HydrophobicContact CB-CB 4.44Å; L264-N275 HydrophobicContact CD1-CB 3.98Å; L264-L278 HydrophobicContact CD1-CB 4.45Å; L264-L278 HydrophobicContact CD1-CD2 4.44Å
265	S	92.1	Very high	93.3	Very high	31 Å²	31	61 Å²	61	22%	0.217	31%	0.313	C	S	.	.	S	Bend	trans	-126.1	155.5	172.8	-173.6	0	0	0	0	110.6	E263 V267 S271	E263-S265 VanDerWaalsContact C-N 3.34Å; S265-V267 PolarHBondContact OG-N 2.92Å; S265-S271 WeakPolarHBondContact CA-OG 3.25Å; S265-S271 WeakPolarHBondContact CB-OG 3.33Å; S265-S271 PolarHBondContact N-OG 2.89Å; S265-S271 PolarHBondContact O-OG 3.17Å
266	F	88.5	Confident	93.5	Very high	211 Å²	211	58.5 Å²	58.5	93%	0.925	30%	0.295	S	S	*	.	S	Bend	trans	-72.9	-19.9	169.5	-61.4	-73.6	0	0	0	112.2
267	V	89.8	Confident	93.6	Very high	60 Å²	60	55.2 Å²	55.2	36%	0.364	28%	0.28	S	S	.	.	S	Bend	trans	-95.8	118.8	178.1	-176.8	0	0	0	0	108.5	S265 E269 E270 S271	S265-V267 PolarHBondContact OG-N 2.92Å; V267-E269 VanDerWaalsContact C-N 3.26Å; V267-E269 WeakPolarHBondContact CG1-OE2 3.38Å; V267-E269 PolarHBondContact O-N 3.04Å; V267-E270 HydrophobicContact CB-CB 4.16Å; V267-E270 HydrophobicContact CB-CG 4.05Å; V267-E270 HydrophobicContact CG1-CG 4.02Å; V267-E270 CarbonylContact O-C 3.51Å; V267-E270 PolarHBondContact O-N 3.31Å; V267-S271 PolarHBondContact O-N 2.87Å
268	E	86.6	Confident	93.7	Very high	78 Å²	78	54.2 Å²	54.2	36%	0.364	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-59.5	-35.8	-173.9	-168.7	-174.3	151.9	0	0	112.3	K242 L244 E270 S271	K242-E268 WeakPolarHBondContact CD-OE1 3.43Å; K242-E268 IonicContact NZ-OE1 2.94Å; K242-E268 PolarHBondContact NZ-OE1 2.81Å; L244-E268 HydrophobicContact CB-CG 3.85Å; L244-E268 WeakPolarHBondContact CB-OE1 3.41Å; L244-E268 HydrophobicContact CD2-CG 4.4Å; L244-E268 PolarHBondContact N-OE1 3.22Å; E268-E270 PolarHBondContact O-N 3.29Å; E268-S271 PolarHBondContact O-N 3.14Å
269	E	86.8	Confident	94.1	Very high	146 Å²	146	48.9 Å²	48.9	68%	0.682	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-70	-19.7	177.2	-57.2	97.1	-177.4	0	0	113.8	V267	V267-E269 VanDerWaalsContact C-N 3.26Å; V267-E269 WeakPolarHBondContact CG1-OE2 3.38Å; V267-E269 PolarHBondContact O-N 3.04Å
270	E	91.7	Very high	94.4	Very high	62 Å²	62	44.6 Å²	44.6	29%	0.29	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-99.7	4.7	177.8	-57	-175.2	175.5	0	0	112.3	V267 E268 N275	V267-E270 HydrophobicContact CB-CB 4.16Å; V267-E270 HydrophobicContact CB-CG 4.05Å; V267-E270 HydrophobicContact CG1-CG 4.02Å; V267-E270 CarbonylContact O-C 3.51Å; V267-E270 PolarHBondContact O-N 3.31Å; E268-E270 PolarHBondContact O-N 3.29Å; E270-N275 WeakPolarHBondContact O-CA 3.32Å; E270-N275 WeakPolarHBondContact O-CB 3.17Å; E270-N275 PolarHBondContact O-ND2 3.02Å
271	S	94.3	Very high	94.5	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	S	Bend	trans	-102.4	174.7	176.8	-81.7	0	0	0	0	112.2	N238 D262 S265 V267 E268	N238-S271 PolarHBondContact ND2-O 3.14Å; D262-S271 VanDerWaalsContact O-CB 3.28Å; D262-S271 WeakPolarHBondContact O-CB 3.44Å; D262-S271 PolarHBondContact O-OG 2.99Å; S265-S271 WeakPolarHBondContact CA-OG 3.25Å; S265-S271 WeakPolarHBondContact CB-OG 3.33Å; S265-S271 PolarHBondContact N-OG 2.89Å; S265-S271 PolarHBondContact O-OG 3.17Å; V267-S271 PolarHBondContact O-N 2.87Å; E268-S271 PolarHBondContact O-N 3.14Å
272	G	96.1	Very high	94.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	78.1	-155.6	179.6	0	0	0	0	0	112.9	N238 V261 Q274 N275	N238-G272 VanDerWaalsContact OD1-CA 3.3Å; N238-G272 WeakPolarHBondContact OD1-CA 3.31Å; V261-G272 VanDerWaalsContact O-CA 3.28Å; V261-G272 WeakPolarHBondContact O-CA 3.35Å; V261-G272 PolarHBondContact O-N 3.11Å; G272-Q274 PolarHBondContact O-N 2.86Å; G272-N275 VanDerWaalsContact O-CB 3.32Å; G272-N275 WeakPolarHBondContact O-CB 3.23Å; G272-N275 PolarHBondContact O-N 3.22Å; G272-N275 VanDerWaalsContact O-N 3.14Å
273	F	97	Very high	94.7	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-66.2	-17.8	176.8	-60.8	-34.4	0	0	0	113.2	Q168 L169 P173 A192 P193 N238 F248 V261 N275	Q168-F273 HydrophobicContact CG-CE2 4.19Å; Q168-F273 HydrophobicContact CG-CZ 3.84Å; Q168-F273 WeakPolarHBondContact O-CD2 3.35Å; Q168-F273 WeakPolarHBondContact O-CE2 3.45Å; L169-F273 HydrophobicContact CD2-CD1 3.98Å; L169-F273 HydrophobicContact CD2-CE1 4.33Å; L169-F273 HydrophobicContact CD2-CG 4.3Å; P173-F273 HydrophobicContact CB-CE2 4.23Å; P173-F273 HydrophobicContact CB-CZ 4.3Å; A192-F273 HydrophobicContact CB-CZ 4.31Å; P193-F273 HydrophobicContact CB-CD1 4.39Å; P193-F273 HydrophobicContact CB-CE1 3.79Å; P193-F273 HydrophobicContact CG-CE1 4.3Å; N238-F273 PolarHBondContact OD1-N 3.44Å; F248-F273 HydrophobicContact CE1-CD2 4.49Å; F248-F273 AromaticContact CE1-CE1 3.93Å; F248-F273 HydrophobicContact CE1-CE1 3.93Å; F248-F273 AromaticContact CE1-CE2 3.82Å; F248-F273 HydrophobicContact CE1-CE2 3.82Å; F248-F273 AromaticContact CE1-CZ 3.53Å; F248-F273 HydrophobicContact CE1-CZ 3.53Å; F248-F273 HydrophobicContact CZ-CD2 4.31Å; F248-F273 HydrophobicContact CZ-CE1 4.3Å; F248-F273 HydrophobicContact CZ-CE2 4.09Å; F248-F273 HydrophobicContact CZ-CZ 4.1Å; V261-F273 HydrophobicContact CG1-CE1 4.38Å; V261-F273 HydrophobicContact CG2-CD1 3.98Å; V261-F273 HydrophobicContact CG2-CE1 4.19Å; F273-N275 VanDerWaalsContact C-N 3.33Å
274	Q	96.3	Very high	94.8	Very high	50 Å²	50	43.8 Å²	43.8	23%	0.234	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-88.2	4.2	175	-64.4	-173.1	-76.7	0	0	114.1	N238 G272 E276	N238-Q274 HydrophobicContact CB-CG 4.41Å; N238-Q274 PolarHBondContact OD1-N 3.42Å; G272-Q274 PolarHBondContact O-N 2.86Å; Q274-E276 PolarHBondContact O-N 2.92Å; Q274-E276 VanDerWaalsContact O-N 3.13Å
275	N	97.5	Very high	95	Very high	17 Å²	17	42 Å²	42	9%	0.091	21%	0.209	C	C	.	.			trans	-59.8	117.7	170	-179	-92	0	0	0	110.3	L264 E270 G272 F273 S277 L278 I279	L264-N275 HydrophobicContact CB-CB 4.44Å; L264-N275 HydrophobicContact CD1-CB 3.98Å; E270-N275 WeakPolarHBondContact O-CA 3.32Å; E270-N275 WeakPolarHBondContact O-CB 3.17Å; E270-N275 PolarHBondContact O-ND2 3.02Å; G272-N275 VanDerWaalsContact O-CB 3.32Å; G272-N275 WeakPolarHBondContact O-CB 3.23Å; G272-N275 PolarHBondContact O-N 3.22Å; G272-N275 VanDerWaalsContact O-N 3.14Å; F273-N275 VanDerWaalsContact C-N 3.33Å; N275-S277 VanDerWaalsContact C-N 3.3Å; N275-S277 PolarHBondContact O-N 2.8Å; N275-S277 WeakPolarHBondContact OD1-CB 3.3Å; N275-S277 PolarHBondContact OD1-N 2.89Å; N275-L278 HydrophobicContact CB-CB 4.12Å; N275-L278 WeakPolarHBondContact O-CB 3.34Å; N275-L278 PolarHBondContact O-N 2.86Å; N275-L278 VanDerWaalsContact O-N 3.14Å; N275-L278 PolarHBondContact OD1-N 2.81Å; N275-I279 WeakPolarHBondContact O-CG1 3.41Å; N275-I279 PolarHBondContact O-N 2.78Å
276	E	98	Very high	95.1	Very high	28 Å²	28	44.5 Å²	44.5	13%	0.131	23%	0.231	C	C	.	.	H	α-helix	trans	-66.4	-31.8	-171.8	-65.4	-165.2	-142.4	0	0	113	K224 G225 I226 A227 L232 Q274 L278 I279 V280	K224-E276 WeakPolarHBondContact CA-OE1 3.28Å; G225-E276 WeakPolarHBondContact CA-OE2 3.22Å; G225-E276 PolarHBondContact N-OE1 3.25Å; G225-E276 PolarHBondContact N-OE2 2.8Å; I226-E276 HydrophobicContact CD1-CB 4.01Å; I226-E276 HydrophobicContact CG1-CB 3.52Å; I226-E276 PolarHBondContact N-OE2 3.31Å; A227-E276 HydrophobicContact CB-CB 3.89Å; A227-E276 HydrophobicContact CB-CG 3.91Å; A227-E276 PolarHBondContact N-OE2 2.91Å; L232-E276 HydrophobicContact CD1-CG 4.37Å; L232-E276 HydrophobicContact CD2-CG 4.24Å; Q274-E276 PolarHBondContact O-N 2.92Å; Q274-E276 VanDerWaalsContact O-N 3.13Å; E276-L278 VanDerWaalsContact C-N 3.34Å; E276-I279 PolarHBondContact O-N 2.74Å; E276-V280 WeakPolarHBondContact O-CG2 2.93Å; E276-V280 PolarHBondContact O-N 2.82Å
277	S	97.3	Very high	95.4	Very high	36 Å²	36	40 Å²	40	25%	0.252	22%	0.216	S	C	.	.	H	α-helix	trans	-64.1	-40.2	174.9	-58.7	0	0	0	0	111.6	N275 W281	N275-S277 VanDerWaalsContact C-N 3.3Å; N275-S277 PolarHBondContact O-N 2.8Å; N275-S277 WeakPolarHBondContact OD1-CB 3.3Å; N275-S277 PolarHBondContact OD1-N 2.89Å; S277-W281 PolarHBondContact O-N 3.13Å; S277-W281 VanDerWaalsContact O-N 3.08Å
278	L	97.7	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-48.1	171.1	175	63.2	0	0	0	110.7	P193 L201 W257 V261 L264 N275 E276 V280 W281 M282	P193-L278 HydrophobicContact CG-CD2 4.49Å; L201-L278 HydrophobicContact CD1-CD1 4.31Å; L201-L278 HydrophobicContact CD2-CD1 4.37Å; W257-L278 HydrophobicContact CH2-CD1 3.86Å; W257-L278 HydrophobicContact CH2-CD2 4.26Å; W257-L278 HydrophobicContact CZ2-CD1 3.95Å; V261-L278 HydrophobicContact CG2-CD2 4.09Å; L264-L278 HydrophobicContact CD1-CB 4.45Å; L264-L278 HydrophobicContact CD1-CD2 4.44Å; N275-L278 HydrophobicContact CB-CB 4.12Å; N275-L278 WeakPolarHBondContact O-CB 3.34Å; N275-L278 PolarHBondContact O-N 2.86Å; N275-L278 VanDerWaalsContact O-N 3.14Å; N275-L278 PolarHBondContact OD1-N 2.81Å; E276-L278 VanDerWaalsContact C-N 3.34Å; L278-V280 PolarHBondContact O-N 3.03Å; L278-W281 WeakPolarHBondContact O-CB 3.45Å; L278-W281 PolarHBondContact O-N 3.36Å; L278-W281 VanDerWaalsContact O-N 3.09Å; L278-M282 HydrophobicContact CD1-CG 3.85Å; L278-M282 HydrophobicContact CD1-SD 4.26Å; L278-M282 HydrophobicContact CG-CG 4.16Å; L278-M282 VanDerWaalsContact O-CG 3.26Å; L278-M282 WeakPolarHBondContact O-CG 3.32Å; L278-M282 PolarHBondContact O-N 3.18Å
279	I	98.3	Very high	96.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-45.2	-179.9	-64.8	172.3	0	0	0	111.5	A227 D231 L232 F236 N275 E276 W281 M282 R283	A227-I279 HydrophobicContact CB-CB 4.08Å; A227-I279 HydrophobicContact CB-CD1 4.43Å; A227-I279 HydrophobicContact CB-CG2 3.81Å; D231-I279 HydrophobicContact CB-CG2 3.77Å; L232-I279 HydrophobicContact CD2-CD1 3.4Å; L232-I279 VanDerWaalsContact CD2-CD1 3.4Å; L232-I279 HydrophobicContact CG-CD1 4.07Å; F236-I279 HydrophobicContact CB-CD1 3.77Å; F236-I279 HydrophobicContact CB-CG1 4.01Å; F236-I279 HydrophobicContact CD1-CG1 3.84Å; F236-I279 HydrophobicContact CD2-CB 4.46Å; F236-I279 HydrophobicContact CD2-CD1 4.17Å; F236-I279 HydrophobicContact CD2-CG1 3.86Å; F236-I279 HydrophobicContact CD2-CG2 3.93Å; F236-I279 HydrophobicContact CE1-CG1 4.25Å; F236-I279 HydrophobicContact CE2-CB 4.49Å; F236-I279 HydrophobicContact CE2-CG1 4.29Å; F236-I279 HydrophobicContact CE2-CG2 3.87Å; F236-I279 HydrophobicContact CG-CD1 3.93Å; F236-I279 HydrophobicContact CG-CG1 3.63Å; F236-I279 HydrophobicContact CZ-CG1 4.47Å; F236-I279 HydrophobicContact CZ-CG2 4.43Å; N275-I279 WeakPolarHBondContact O-CG1 3.41Å; N275-I279 PolarHBondContact O-N 2.78Å; E276-I279 PolarHBondContact O-N 2.74Å; I279-W281 VanDerWaalsContact C-N 3.26Å; I279-W281 PolarHBondContact O-N 2.86Å; I279-M282 PolarHBondContact O-N 3.08Å; I279-R283 PolarHBondContact O-N 2.62Å
280	V	98.3	Very high	96.6	Very high	13 Å²	13	33.4 Å²	33.4	8%	0.079	19%	0.187	C	C	.	.	H	α-helix	trans	-59.9	-39.8	176.2	170.6	0	0	0	0	110.9	I226 E276 L278 K292 L293	I226-V280 HydrophobicContact CB-CG2 4.44Å; I226-V280 HydrophobicContact CD1-CG2 4.31Å; I226-V280 HydrophobicContact CG1-CG2 3.99Å; I226-V280 WeakPolarHBondContact O-CG2 3.37Å; E276-V280 WeakPolarHBondContact O-CG2 2.93Å; E276-V280 PolarHBondContact O-N 2.82Å; L278-V280 PolarHBondContact O-N 3.03Å; V280-K292 HydrophobicContact CG1-CB 3.83Å; V280-K292 HydrophobicContact CG1-CD 4.44Å; V280-K292 HydrophobicContact CG1-CG 4.13Å; V280-K292 PolarHBondContact O-NZ 3.41Å; V280-L293 WeakPolarHBondContact CG1-O 3.37Å
281	W	98.2	Very high	96.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.8	-46.2	176.1	-176.7	-104	0	0	0	112.6	Y148 L150 F153 Q155 I197 S200 L201 F202 S277 L278 I279 R283 F290 K292	Y148-W281 HydrophobicContact CE2-CE3 4.12Å; Y148-W281 AromaticContact CE2-CZ3 3.98Å; Y148-W281 HydrophobicContact CE2-CZ3 3.98Å; L150-W281 HydrophobicContact CD1-CH2 3.8Å; L150-W281 HydrophobicContact CD1-CZ3 3.87Å; F153-W281 HydrophobicContact CE1-CH2 4.01Å; F153-W281 AromaticContact CE1-CZ2 3.98Å; F153-W281 HydrophobicContact CE1-CZ2 3.98Å; F153-W281 HydrophobicContact CZ-CH2 4.25Å; F153-W281 HydrophobicContact CZ-CZ2 4.06Å; Q155-W281 VanDerWaalsContact NE2-CZ2 3.33Å; I197-W281 PolarHBondContact O-NE1 2.84Å; S200-W281 WeakPolarHBondContact O-CZ2 3.44Å; S200-W281 PolarHBondContact O-NE1 3.19Å; L201-W281 HydrophobicContact CD1-CB 3.36Å; L201-W281 HydrophobicContact CD1-CD2 4.23Å; L201-W281 HydrophobicContact CD1-CG 3.42Å; L201-W281 VanDerWaalsContact CD1-CG 3.42Å; F202-W281 HydrophobicContact CB-CD2 4.39Å; F202-W281 HydrophobicContact CB-CE3 3.69Å; F202-W281 HydrophobicContact CB-CH2 4.25Å; F202-W281 HydrophobicContact CB-CZ3 3.61Å; S277-W281 PolarHBondContact O-N 3.13Å; S277-W281 VanDerWaalsContact O-N 3.08Å; L278-W281 WeakPolarHBondContact O-CB 3.45Å; L278-W281 PolarHBondContact O-N 3.36Å; L278-W281 VanDerWaalsContact O-N 3.09Å; I279-W281 VanDerWaalsContact C-N 3.26Å; I279-W281 PolarHBondContact O-N 2.86Å; W281-R283 PolarHBondContact O-N 2.82Å; W281-R283 VanDerWaalsContact O-N 3.16Å; W281-F290 HydrophobicContact CH2-CZ 4.38Å; W281-F290 HydrophobicContact CZ3-CE2 4.25Å; W281-F290 HydrophobicContact CZ3-CZ 4.35Å; W281-K292 HydrophobicContact CE3-CD 3.59Å; W281-K292 HydrophobicContact CZ3-CD 3.99Å; W281-K292 PolarHBondContact O-NZ 2.79Å
282	M	98.1	Very high	96.9	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-62.7	-21.1	-177.3	-70.4	-58.2	-67.9	0	0	113.9	R164 L169 I197 A198 F236 L278 I279 S284	R164-M282 HydrophobicContact CB-CE 3.91Å; L169-M282 HydrophobicContact CD1-CE 3.82Å; I197-M282 HydrophobicContact CB-CE 4.06Å; I197-M282 HydrophobicContact CB-SD 3.95Å; I197-M282 HydrophobicContact CG2-CE 4.05Å; I197-M282 HydrophobicContact CG2-SD 3.53Å; I197-M282 VanDerWaalsContact CG2-SD 3.53Å; A198-M282 HydrophobicContact CB-CE 4.44Å; A198-M282 HydrophobicContact CB-SD 3.82Å; F236-M282 HydrophobicContact CE1-CB 4.08Å; F236-M282 HydrophobicContact CE1-CG 4.14Å; F236-M282 HydrophobicContact CZ-CB 3.77Å; F236-M282 HydrophobicContact CZ-CG 4.35Å; L278-M282 HydrophobicContact CD1-CG 3.85Å; L278-M282 HydrophobicContact CD1-SD 4.26Å; L278-M282 HydrophobicContact CG-CG 4.16Å; L278-M282 VanDerWaalsContact O-CG 3.26Å; L278-M282 WeakPolarHBondContact O-CG 3.32Å; L278-M282 PolarHBondContact O-N 3.18Å; I279-M282 PolarHBondContact O-N 3.08Å; M282-S284 PolarHBondContact O-N 3.42Å; M282-S284 VanDerWaalsContact O-N 3.1Å
283	R	97.5	Very high	97	Very high	95 Å²	95	36.6 Å²	36.6	36%	0.358	20%	0.199	S	C	.	.	S	Bend	trans	-72.6	95.1	167.8	-178.3	-172.7	-93.9	92.6	0.8	110.5	D231 I279 W281 A285 K292	D231-R283 IonicContact OD1-NH2 2.76Å; D231-R283 PolarHBondContact OD1-NH2 3.11Å; D231-R283 IonicContact OD2-CZ 3.59Å; D231-R283 IonicContact OD2-NH1 3.16Å; D231-R283 PolarHBondContact OD2-NH1 2.89Å; D231-R283 IonicContact OD2-NH2 3.7Å; D231-R283 PolarHBondContact OD2-NH2 2.79Å; I279-R283 PolarHBondContact O-N 2.62Å; W281-R283 PolarHBondContact O-N 2.82Å; W281-R283 VanDerWaalsContact O-N 3.16Å; R283-A285 PolarHBondContact O-N 2.82Å; R283-K292 PolarHBondContact O-NZ 3.46Å
284	S	96.8	Very high	97	Very high	34 Å²	34	37.3 Å²	37.3	24%	0.238	20%	0.202	C	C	.	.			trans	-56.6	133.1	178.8	-49.9	0	0	0	0	112.8	M282	M282-S284 PolarHBondContact O-N 3.42Å; M282-S284 VanDerWaalsContact O-N 3.1Å
285	A	97.3	Very high	97	Very high	19 Å²	19	35 Å²	35	16%	0.157	19%	0.191	C	C	.	.			trans	-74.8	146.2	173.5	0	0	0	0	0	111.9	Q155 R283 L287 F290	Q155-A285 HydrophobicContact CB-CB 4.25Å; R283-A285 PolarHBondContact O-N 2.82Å; A285-L287 VanDerWaalsContact C-N 3.35Å; A285-F290 HydrophobicContact CB-CB 3.57Å; A285-F290 HydrophobicContact CB-CD1 3.58Å; A285-F290 HydrophobicContact CB-CD2 4.11Å; A285-F290 HydrophobicContact CB-CE1 4.26Å; A285-F290 HydrophobicContact CB-CG 3.48Å; A285-F290 VanDerWaalsContact CB-CG 3.48Å
286	A	95.6	Very high	96.9	Very high	82 Å²	82	39.1 Å²	39.1	68%	0.678	21%	0.205	S	C	*	.	S	Bend	trans	-75.6	-22.4	179.9	0	0	0	0	0	113.7	N156	N156-A286 WeakPolarHBondContact CB-O 3.28Å; N156-A286 PolarHBondContact ND2-O 2.78Å
287	L	95.2	Very high	96.9	Very high	116 Å²	116	38 Å²	38	61%	0.607	20%	0.201	S	C	*	.	S	Bend	trans	-125.5	155	-174.4	-64.9	174.1	0	0	0	110.7	A285 N289 F290	A285-L287 VanDerWaalsContact C-N 3.35Å; L287-N289 PolarHBondContact O-N 2.92Å; L287-F290 WeakPolarHBondContact O-CD1 3.42Å
288	P	95.7	Very high	96.8	Very high	31 Å²	31	39.1 Å²	39.1	20%	0.201	21%	0.205	C	C	.	.	S	Bend	trans	-70.6	-18	179.7	28	-35.7	0	0	0	114.4	G152 F153 Y154	G152-P288 PolarHBondContact N-O 3.16Å; F153-P288 PolarHBondContact N-O 3.03Å; F153-P288 VanDerWaalsContact O-CA 3.31Å; F153-P288 WeakPolarHBondContact O-CA 3.38Å; Y154-P288 HydrophobicContact CD1-CB 3.69Å; Y154-P288 HydrophobicContact CD1-CG 4.29Å; Y154-P288 HydrophobicContact CE1-CB 3.65Å; Y154-P288 HydrophobicContact CE1-CG 3.95Å; Y154-P288 HydrophobicContact CE2-CB 4.48Å; Y154-P288 HydrophobicContact CG-CB 4.14Å
289	N	95.6	Very high	96.6	Very high	94 Å²	94	41.1 Å²	41.1	50%	0.503	22%	0.215	S	C	.	.	S	Bend	trans	-108.7	116.2	172.9	-59.5	-25.2	0	0	0	107.2	L150 S151 G152 L287	L150-N289 WeakPolarHBondContact O-CA 3.33Å; S151-N289 WeakPolarHBondContact CA-OD1 3.34Å; S151-N289 VanDerWaalsContact CB-OD1 3.28Å; S151-N289 WeakPolarHBondContact CB-OD1 3.42Å; G152-N289 PolarHBondContact N-OD1 3.24Å; L287-N289 PolarHBondContact O-N 2.92Å
290	F	96	Very high	96.2	Very high	21 Å²	21	43.8 Å²	43.8	9%	0.092	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	165.6	-177	61.3	-92.8	0	0	0	111.1	G149 L150 F153 Q155 W281 A285 L287 K292	G149-F290 CarbonylContact C-O 3.55Å; G149-F290 VanDerWaalsContact CA-O 3.3Å; G149-F290 WeakPolarHBondContact CA-O 3.45Å; L150-F290 HydrophobicContact CB-CE1 4.19Å; L150-F290 HydrophobicContact CB-CE2 4.08Å; L150-F290 HydrophobicContact CB-CZ 3.84Å; L150-F290 HydrophobicContact CD1-CE2 4.08Å; L150-F290 HydrophobicContact CD1-CZ 3.78Å; L150-F290 HydrophobicContact CG-CE2 4.38Å; L150-F290 HydrophobicContact CG-CZ 4.31Å; L150-F290 PolarHBondContact N-O 2.72Å; L150-F290 PolarHBondContact O-N 3.12Å; F153-F290 HydrophobicContact CB-CE1 3.95Å; F153-F290 HydrophobicContact CB-CZ 4.36Å; F153-F290 AromaticContact CD1-CE1 3.86Å; F153-F290 HydrophobicContact CD1-CE1 3.86Å; F153-F290 AromaticContact CD1-CZ 3.87Å; F153-F290 HydrophobicContact CD1-CZ 3.87Å; F153-F290 HydrophobicContact CG-CE1 4.33Å; F153-F290 HydrophobicContact CG-CZ 4.41Å; F153-F290 WeakPolarHBondContact O-CE1 3.29Å; Q155-F290 HydrophobicContact CG-CE1 3.82Å; Q155-F290 HydrophobicContact CG-CZ 3.88Å; W281-F290 HydrophobicContact CH2-CZ 4.38Å; W281-F290 HydrophobicContact CZ3-CE2 4.25Å; W281-F290 HydrophobicContact CZ3-CZ 4.35Å; A285-F290 HydrophobicContact CB-CB 3.57Å; A285-F290 HydrophobicContact CB-CD1 3.58Å; A285-F290 HydrophobicContact CB-CD2 4.11Å; A285-F290 HydrophobicContact CB-CE1 4.26Å; A285-F290 HydrophobicContact CB-CG 3.48Å; A285-F290 VanDerWaalsContact CB-CG 3.48Å; L287-F290 WeakPolarHBondContact O-CD1 3.42Å; F290-K292 HydrophobicContact CD2-CD 4.21Å; F290-K292 HydrophobicContact CD2-CG 4.03Å; F290-K292 HydrophobicContact CE2-CD 3.83Å; F290-K292 VanDerWaalsContact CE2-CE 3.49Å; F290-K292 HydrophobicContact CE2-CG 4.16Å
291	R	95.4	Very high	95.3	Very high	89 Å²	89	47.8 Å²	47.8	34%	0.336	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	151.4	166.6	68.6	-176.4	-175.9	-171.5	7.1	109.7	E98 Y147 Y148 I333	E98-R291 IonicContact OE1-NH1 2.85Å; E98-R291 PolarHBondContact OE1-NH1 2.63Å; E98-R291 IonicContact OE2-CZ 3.67Å; E98-R291 IonicContact OE2-NH1 3.59Å; E98-R291 PolarHBondContact OE2-NH1 2.85Å; E98-R291 IonicContact OE2-NH2 3.48Å; Y147-R291 HydrophobicContact CD1-CG 4.23Å; Y148-R291 CarbonylContact O-C 3.48Å; Y148-R291 WeakPolarHBondContact O-CA 3.28Å; R291-I333 HydrophobicContact CB-CD1 4Å
292	K	97.3	Very high	94.6	Very high	15 Å²	15	50.8 Å²	50.8	7%	0.065	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.1	176	-80.3	174.5	-174.3	-86.1	0	109	Y147 Y148 V280 W281 R283 F290 H294	Y147-K292 VanDerWaalsContact CA-O 3.22Å; Y147-K292 WeakPolarHBondContact CA-O 3.29Å; Y147-K292 VanDerWaalsContact CB-O 3.31Å; Y147-K292 WeakPolarHBondContact CB-O 3.36Å; Y148-K292 HydrophobicContact CD2-CB 4.22Å; Y148-K292 HydrophobicContact CE1-CB 3.97Å; Y148-K292 HydrophobicContact CE2-CB 3.51Å; Y148-K292 HydrophobicContact CE2-CD 3.82Å; Y148-K292 HydrophobicContact CE2-CG 4.19Å; Y148-K292 PolarHBondContact N-O 2.92Å; Y148-K292 PolarHBondContact O-N 3.2Å; Y148-K292 WeakPolarHBondContact OH-CB 3.28Å; Y148-K292 VanDerWaalsContact OH-CD 3.24Å; Y148-K292 WeakPolarHBondContact OH-CD 3.4Å; V280-K292 HydrophobicContact CG1-CB 3.83Å; V280-K292 HydrophobicContact CG1-CD 4.44Å; V280-K292 HydrophobicContact CG1-CG 4.13Å; V280-K292 PolarHBondContact O-NZ 3.41Å; W281-K292 HydrophobicContact CE3-CD 3.59Å; W281-K292 HydrophobicContact CZ3-CD 3.99Å; W281-K292 PolarHBondContact O-NZ 2.79Å; R283-K292 PolarHBondContact O-NZ 3.46Å; F290-K292 HydrophobicContact CD2-CD 4.21Å; F290-K292 HydrophobicContact CD2-CG 4.03Å; F290-K292 HydrophobicContact CE2-CD 3.83Å; F290-K292 VanDerWaalsContact CE2-CE 3.49Å; F290-K292 HydrophobicContact CE2-CG 4.16Å; K292-H294 PolarHBondContact O-N 2.91Å
293	L	96.9	Very high	94.1	Very high	26 Å²	26	52.6 Å²	52.6	14%	0.136	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.4	-179.8	-176.7	58.2	0	0	0	108.9	Y145 L146 Y147 I226 V280	Y145-L293 HydrophobicContact CD1-CD1 3.7Å; Y145-L293 HydrophobicContact CD1-CD2 4.12Å; Y145-L293 HydrophobicContact CG-CD1 4.06Å; L146-L293 WeakPolarHBondContact O-CD1 3.19Å; Y147-L293 HydrophobicContact CD1-CB 4.04Å; Y147-L293 HydrophobicContact CD1-CD1 4.11Å; Y147-L293 HydrophobicContact CE1-CB 3.88Å; Y147-L293 HydrophobicContact CE1-CD1 3.74Å; Y147-L293 HydrophobicContact CE1-CG 4.37Å; Y147-L293 HydrophobicContact CE2-CD1 4.33Å; I226-L293 HydrophobicContact CB-CD2 3.59Å; I226-L293 HydrophobicContact CB-CG 3.83Å; I226-L293 HydrophobicContact CG2-CD2 3.86Å; I226-L293 HydrophobicContact CG2-CG 3.95Å; V280-L293 WeakPolarHBondContact CG1-O 3.37Å
294	H	97.8	Very high	94	Very high	15 Å²	15	48.2 Å²	48.2	7%	0.069	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	-55.5	178.7	176.6	-92.2	0	0	0	110.3	L146 Y148 F206 F223 I226 K292	L146-H294 WeakPolarHBondContact O-CA 3.46Å; L146-H294 VanDerWaalsContact O-CB 3.31Å; L146-H294 WeakPolarHBondContact O-CB 3.19Å; L146-H294 PolarHBondContact O-N 3.03Å; Y148-H294 HydrophobicContact CD1-CB 3.86Å; Y148-H294 HydrophobicContact CE1-CB 4.32Å; F206-H294 AromaticContact CD2-CD2 3.6Å; F206-H294 AromaticContact CD2-CE1 3.79Å; F206-H294 AromaticContact CD2-CG 3.88Å; F206-H294 AromaticContact CD2-ND1 4Å; F206-H294 AromaticContact CD2-NE2 3.53Å; F206-H294 AromaticContact CE2-CD2 3.76Å; F223-H294 WeakPolarHBondContact CD1-O 3.37Å; F223-H294 AromaticContact CE1-CE1 3.37Å; F223-H294 WeakPolarHBondContact CE1-CE1 3.32Å; F223-H294 AromaticContact CE1-ND1 3.78Å; F223-H294 AromaticContact CE1-NE2 3.69Å; F223-H294 WeakPolarHBondContact CE1-O 3.4Å; F223-H294 AromaticContact CZ-CE1 3.52Å; I226-H294 WeakPolarHBondContact CD1-O 3.29Å; K292-H294 PolarHBondContact O-N 2.91Å
295	S	97.3	Very high	93.8	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	168	-176.6	55.5	0	0	0	0	109.6	L146 T222	L146-S295 PolarHBondContact N-O 2.71Å; L146-S295 PolarHBondContact O-N 3.11Å; T222-S295 WeakPolarHBondContact O-CA 3.47Å; T222-S295 WeakPolarHBondContact O-CB 3.42Å
296	R	95.6	Very high	93.6	Very high	104 Å²	104	51.4 Å²	51.4	39%	0.392	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	148.7	171.1	66.8	-176.3	-165.1	167.2	6.3	110.1	Y145 I221 T222 K224	Y145-R296 HydrophobicContact CD1-CB 3.9Å; Y145-R296 HydrophobicContact CE1-CB 4.2Å; I221-R296 CarbonylContact C-O 3.55Å; I221-R296 VanDerWaalsContact CA-O 3.28Å; I221-R296 WeakPolarHBondContact CA-O 3.31Å; T222-R296 HydrophobicContact CG2-CG 3.39Å; T222-R296 VanDerWaalsContact CG2-NE 3.26Å; T222-R296 PolarHBondContact N-O 3.4Å; T222-R296 PolarHBondContact O-N 3.31Å; K224-R296 PolarHBondContact O-NE 2.72Å
297	V	96	Very high	93.5	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.036	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	134.9	174.3	179.2	0	0	0	0	108.8	V144 L146 V219 P220 H299	V144-V297 HydrophobicContact CB-CB 4.02Å; V144-V297 HydrophobicContact CB-CG2 3.86Å; V144-V297 HydrophobicContact CG1-CG2 3.8Å; V144-V297 PolarHBondContact O-N 2.88Å; L146-V297 HydrophobicContact CD2-CG2 4.49Å; V219-V297 HydrophobicContact CG1-CG1 3.85Å; V219-V297 HydrophobicContact CG1-CG2 4.03Å; P220-V297 WeakPolarHBondContact O-CA 3.49Å; V297-H299 PolarHBondContact O-CD2 3.24Å; V297-H299 PolarHBondContact O-N 3Å
298	V	96.1	Very high	93.4	Very high	58 Å²	58	44.6 Å²	44.6	35%	0.352	27%	0.269	S	S	.	.			trans	-82.8	112.4	174.9	-178.7	0	0	0	0	108.2	P220 T222	P220-V298 HydrophobicContact CB-CB 4.13Å; P220-V298 HydrophobicContact CG-CB 4.34Å; P220-V298 PolarHBondContact O-N 2.86Å; T222-V298 HydrophobicContact CG2-CG2 3.7Å
299	H	93.9	Very high	93.4	Very high	42 Å²	42	44 Å²	44	19%	0.194	27%	0.265	C	S	.	.			trans	-93.1	165.7	176.6	-67.7	-65.1	0	0	0	111.2	S142 V144 V297 F304 A305	S142-H299 PolarHBondContact OG-CD2 2.77Å; V144-H299 PolarHBondContact N-NE2 2.96Å; V144-H299 VanDerWaalsContact N-NE2 3.17Å; V297-H299 PolarHBondContact O-CD2 3.24Å; V297-H299 PolarHBondContact O-N 3Å; H299-F304 PolarHBondContact ND1-O 3.28Å; H299-A305 WeakPolarHBondContact CB-O 3.41Å
300	G	88.6	Confident	93.3	Very high	58 Å²	58	45.5 Å²	45.5	60%	0.598	27%	0.267	S	S	*	.	S	Bend	trans	107.6	-8.3	176.2	0	0	0	0	0	116.7	A305	G300-A305 PolarHBondContact N-O 3.36Å
301	T	80.3	Confident	93.2	Very high	97 Å²	97	45.2 Å²	45.2	60%	0.595	27%	0.27	S	S	*	.	S	Bend	trans	-141.8	141.4	178.6	57.1	0	0	0	0	113.1
302	G	83.8	Confident	93.3	Very high	63 Å²	63	44.8 Å²	44.8	65%	0.649	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	66.3	-151.6	172.8	0	0	0	0	0	114	F304 A305	G302-F304 PolarHBondContact O-N 3.02Å; G302-A305 PolarHBondContact O-N 3.02Å
303	G	88.3	Confident	93.3	Very high	40 Å²	40	44.1 Å²	44.1	41%	0.412	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-66.2	-3	-178.6	0	0	0	0	0	115.5	P309	G303-P309 WeakPolarHBondContact O-CG 3.47Å
304	F	94.3	Very high	93.3	Very high	2 Å²	2	44 Å²	44	1%	0.009	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-116.1	19.5	-179.2	-47.3	-64.2	0	0	0	112.8	Y210 Q217 V219 P220 H299 G302 D306 K307 L308	Y210-F304 HydrophobicContact CD1-CE1 4.06Å; Y210-F304 HydrophobicContact CD1-CZ 4.13Å; Y210-F304 HydrophobicContact CG-CE1 4.18Å; Y210-F304 HydrophobicContact CG-CZ 4.31Å; Q217-F304 HydrophobicContact CG-CE2 3.96Å; Q217-F304 HydrophobicContact CG-CZ 4.27Å; V219-F304 HydrophobicContact CB-CZ 4.48Å; V219-F304 HydrophobicContact CG2-CE1 4.01Å; V219-F304 HydrophobicContact CG2-CZ 3.86Å; P220-F304 HydrophobicContact CG-CD2 3.97Å; H299-F304 PolarHBondContact ND1-O 3.28Å; G302-F304 PolarHBondContact O-N 3.02Å; F304-D306 PolarHBondContact O-N 2.69Å; F304-K307 CarbonylContact C-O 3.57Å; F304-K307 VanDerWaalsContact CA-O 3.28Å; F304-K307 WeakPolarHBondContact CA-O 3.39Å; F304-L308 HydrophobicContact CD1-CD1 3.92Å; F304-L308 HydrophobicContact CE1-CD1 4.04Å
305	A	93	Very high	93.3	Very high	42 Å²	42	43.3 Å²	43.3	35%	0.347	27%	0.269	S	S	.	.	S	Bend	trans	-58.8	-44.4	-171.1	0	0	0	0	0	113.8	H299 G300 G302	H299-A305 WeakPolarHBondContact CB-O 3.41Å; G300-A305 PolarHBondContact N-O 3.36Å; G302-A305 PolarHBondContact O-N 3.02Å
306	D	92.5	Very high	93.3	Very high	79 Å²	79	45.7 Å²	45.7	42%	0.422	28%	0.28	S	S	.	.	S	Bend	trans	-121.1	-14.2	-173.5	58.7	-35.6	0	0	0	113.4	S142 F304	S142-D306 WeakPolarHBondContact CB-O 3.38Å; S142-D306 PolarHBondContact N-O 2.87Å; F304-D306 PolarHBondContact O-N 2.69Å
307	K	93	Very high	93.4	Very high	54 Å²	54	40.7 Å²	40.7	24%	0.235	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	170.1	-173.5	63.7	-154.6	163.3	-136.2	0	112.4	N139 V140 F304	N139-K307 HydrophobicContact CB-CD 4.04Å; V140-K307 CarbonylContact O-C 3.59Å; V140-K307 VanDerWaalsContact O-CA 3.29Å; V140-K307 WeakPolarHBondContact O-CA 3.21Å; V140-K307 WeakPolarHBondContact O-CB 3.29Å; F304-K307 CarbonylContact C-O 3.57Å; F304-K307 VanDerWaalsContact CA-O 3.28Å; F304-K307 WeakPolarHBondContact CA-O 3.39Å
308	L	94.6	Very high	93.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.7	158.1	-166.1	65	0	0	0	107.9	L136 N139 V140 V144 V219 F304 Y313 I334	L136-L308 HydrophobicContact CD1-CD2 3.73Å; L136-L308 HydrophobicContact CD1-CG 4.16Å; N139-L308 CarbonylContact C-O 3.58Å; N139-L308 WeakPolarHBondContact CA-O 3.46Å; V140-L308 HydrophobicContact CB-CB 4.13Å; V140-L308 PolarHBondContact N-O 2.81Å; V140-L308 PolarHBondContact O-N 3.23Å; V144-L308 HydrophobicContact CG1-CB 4.42Å; V144-L308 HydrophobicContact CG1-CD2 4.3Å; V144-L308 HydrophobicContact CG2-CB 4.19Å; V219-L308 HydrophobicContact CG1-CD1 3.92Å; V219-L308 HydrophobicContact CG2-CD1 4.05Å; F304-L308 HydrophobicContact CD1-CD1 3.92Å; F304-L308 HydrophobicContact CE1-CD1 4.04Å; L308-Y313 HydrophobicContact CD1-CE1 3.72Å; L308-Y313 WeakPolarHBondContact CD1-OH 3.34Å; L308-Y313 HydrophobicContact CD2-CE1 4.34Å; L308-Y313 HydrophobicContact CG-CE1 4.03Å; L308-Y313 VanDerWaalsContact CG-OH 3.31Å; L308-Y313 WeakPolarHBondContact CG-OH 3.44Å; L308-I334 HydrophobicContact CD2-CD1 4.07Å; L308-I334 HydrophobicContact CD2-CG2 3.79Å
309	P	94.7	Very high	93.4	Very high	19 Å²	19	38.8 Å²	38.8	12%	0.123	25%	0.249	C	C	.	.			trans	-62.3	149.4	-175.2	-23.5	33	0	0	0	112.9	Y210 G303 Y313	Y210-P309 HydrophobicContact CE1-CB 4.49Å; Y210-P309 HydrophobicContact CE1-CG 4.48Å; Y210-P309 HydrophobicContact CE2-CB 4.43Å; G303-P309 WeakPolarHBondContact O-CG 3.47Å; P309-Y313 WeakPolarHBondContact CD-OH 3.5Å; P309-Y313 WeakPolarHBondContact O-CE2 3.37Å; P309-Y313 PolarHBondContact O-OH 2.83Å
310	K	94.1	Very high	93.4	Very high	126 Å²	126	38.9 Å²	38.9	55%	0.548	25%	0.251	S	S	.	.	S	Bend	trans	-60.6	154	166	69.8	178.4	-177	174.8	0	111.2	L136 N139 Y210	L136-K310 WeakPolarHBondContact O-CA 3.4Å; L136-K310 WeakPolarHBondContact O-CB 3.31Å; N139-K310 PolarHBondContact OD1-N 3.31Å; Y210-K310 PolarHBondContact OH-O 3.44Å
311	G	94.8	Very high	93.8	Very high	15 Å²	15	36.7 Å²	36.7	16%	0.155	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	128.3	-159.9	177.1	0	0	0	0	0	113	E135 L136 Y313	E135-G311 CarbonylContact C-O 3.52Å; E135-G311 WeakPolarHBondContact CA-O 3.36Å; L136-G311 PolarHBondContact N-O 3.2Å; L136-G311 PolarHBondContact O-N 2.83Å; G311-Y313 VanDerWaalsContact O-CD2 3.29Å; G311-Y313 WeakPolarHBondContact O-CD2 3.28Å
312	N	96.4	Very high	94.4	Very high	79 Å²	79	35.4 Å²	35.4	42%	0.422	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.9	-169.2	-69.9	-43.7	0	0	0	112.2	Y210 K211	Y210-N312 WeakPolarHBondContact CD2-O 3.42Å; K211-N312 HydrophobicContact CB-CB 4.16Å; K211-N312 PolarHBondContact N-O 3.38Å
313	Y	97.3	Very high	95	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	153.7	176.4	-71.6	-95.1	0	0	0	110.8	N133 F134 L136 L208 N209 Y210 V219 L308 P309 G311	N133-Y313 WeakPolarHBondContact CA-O 3.31Å; F134-Y313 HydrophobicContact CE2-CD2 4.33Å; F134-Y313 HydrophobicContact CE2-CG 4.07Å; F134-Y313 VanDerWaalsContact CZ-CB 3.47Å; F134-Y313 HydrophobicContact CZ-CG 4.2Å; F134-Y313 PolarHBondContact N-O 2.88Å; F134-Y313 PolarHBondContact O-N 3.2Å; F134-Y313 VanDerWaalsContact O-O 3.05Å; L136-Y313 HydrophobicContact CB-CD2 4.32Å; L136-Y313 HydrophobicContact CB-CE2 4.15Å; L136-Y313 HydrophobicContact CD1-CD2 3.85Å; L136-Y313 HydrophobicContact CD1-CE2 3.5Å; L136-Y313 HydrophobicContact CG-CD2 3.77Å; L136-Y313 HydrophobicContact CG-CE2 3.83Å; L208-Y313 HydrophobicContact CD1-CD1 3.92Å; L208-Y313 HydrophobicContact CD1-CG 4.42Å; L208-Y313 HydrophobicContact CD2-CD1 4.39Å; L208-Y313 HydrophobicContact CG-CD1 4.1Å; N209-Y313 CarbonylContact O-C 3.52Å; N209-Y313 VanDerWaalsContact O-CA 3.25Å; N209-Y313 WeakPolarHBondContact O-CA 3.32Å; N209-Y313 WeakPolarHBondContact O-CD1 3.48Å; Y210-Y313 HydrophobicContact CD2-CD1 4.12Å; Y210-Y313 HydrophobicContact CD2-CD2 4.13Å; Y210-Y313 AromaticContact CD2-CE1 3.58Å; Y210-Y313 HydrophobicContact CD2-CE1 3.58Å; Y210-Y313 AromaticContact CD2-CE2 3.56Å; Y210-Y313 HydrophobicContact CD2-CE2 3.56Å; Y210-Y313 HydrophobicContact CD2-CG 4.37Å; Y210-Y313 AromaticContact CD2-CZ 3.24Å; Y210-Y313 WeakPolarHBondContact CD2-OH 3.36Å; Y210-Y313 AromaticContact CE2-CE2 3.91Å; Y210-Y313 HydrophobicContact CE2-CE2 3.91Å; Y210-Y313 AromaticContact CE2-CZ 3.86Å; Y210-Y313 AromaticContact CG-CE1 3.91Å; Y210-Y313 HydrophobicContact CG-CE1 3.91Å; Y210-Y313 AromaticContact CG-CZ 3.94Å; V219-Y313 HydrophobicContact CG2-CD1 4.36Å; V219-Y313 HydrophobicContact CG2-CE1 3.95Å; L308-Y313 HydrophobicContact CD1-CE1 3.72Å; L308-Y313 WeakPolarHBondContact CD1-OH 3.34Å; L308-Y313 HydrophobicContact CD2-CE1 4.34Å; L308-Y313 HydrophobicContact CG-CE1 4.03Å; L308-Y313 VanDerWaalsContact CG-OH 3.31Å; L308-Y313 WeakPolarHBondContact CG-OH 3.44Å; P309-Y313 WeakPolarHBondContact CD-OH 3.5Å; P309-Y313 WeakPolarHBondContact O-CE2 3.37Å; P309-Y313 PolarHBondContact O-OH 2.83Å; G311-Y313 VanDerWaalsContact O-CD2 3.29Å; G311-Y313 WeakPolarHBondContact O-CD2 3.28Å
314	T	96.9	Very high	95.2	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.141	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	127	170	-59.6	0	0	0	0	107.9	V131 L132 N133 N209 M216	V131-T314 HydrophobicContact CG1-CG2 3.23Å; L132-T314 CarbonylContact O-C 3.57Å; L132-T314 WeakPolarHBondContact O-CA 3.32Å; N133-T314 WeakPolarHBondContact OD1-CB 3.02Å; N133-T314 VanDerWaalsContact OD1-CG2 3.31Å; N133-T314 WeakPolarHBondContact OD1-CG2 3.38Å; N133-T314 PolarHBondContact OD1-OG1 3.43Å; N209-T314 PolarHBondContact N-O 3.41Å; N209-T314 PolarHBondContact O-N 3.36Å; M216-T314 HydrophobicContact CE-CG2 4.47Å; M216-T314 WeakPolarHBondContact CE-OG1 3.33Å
315	V	97.4	Very high	95	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.2	168.8	64	0	0	0	0	109.1	L101 L132 F134 F206 L207 L208 I317 F332	L101-V315 HydrophobicContact CD2-CG1 3.73Å; L132-V315 HydrophobicContact CB-CG1 3.95Å; L132-V315 PolarHBondContact N-O 3.38Å; L132-V315 PolarHBondContact O-N 2.83Å; F134-V315 HydrophobicContact CD1-CG1 4.34Å; F134-V315 HydrophobicContact CE1-CB 4.03Å; F134-V315 HydrophobicContact CE1-CG1 3.87Å; F206-V315 HydrophobicContact CB-CG2 4.19Å; F206-V315 HydrophobicContact CD1-CG2 4.27Å; L207-V315 WeakPolarHBondContact O-CA 3.43Å; L208-V315 HydrophobicContact CD1-CB 4.26Å; V315-I317 HydrophobicContact CG1-CD1 4.14Å; V315-I317 HydrophobicContact CG1-CG1 4.19Å; V315-I317 HydrophobicContact CG2-CG1 3.92Å; V315-F332 HydrophobicContact CG2-CE1 4.36Å; V315-F332 HydrophobicContact CG2-CE2 4.5Å; V315-F332 HydrophobicContact CG2-CZ 4.36Å
316	E	97	Very high	95	Very high	50 Å²	50	38.2 Å²	38.2	23%	0.234	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.4	165.6	178.3	-178.1	172.2	0	0	108.1	R129 V131 L207	R129-E316 IonicContact NH1-OE1 3.07Å; R129-E316 PolarHBondContact NH1-OE1 3.3Å; V131-E316 HydrophobicContact CG2-CB 4.36Å; V131-E316 HydrophobicContact CG2-CG 4.25Å; L207-E316 HydrophobicContact CB-CB 4.23Å; L207-E316 PolarHBondContact N-O 3.08Å; L207-E316 PolarHBondContact O-N 2.81Å
317	I	97.7	Very high	95	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.2	-175.3	-49.2	179.9	0	0	0	108	Y103 R129 C130 L132 T205 F206 V315 Y319	Y103-I317 HydrophobicContact CD1-CD1 4.05Å; Y103-I317 HydrophobicContact CD2-CD1 3.71Å; Y103-I317 HydrophobicContact CD2-CG2 4.02Å; Y103-I317 HydrophobicContact CE2-CD1 4.39Å; Y103-I317 HydrophobicContact CE2-CG2 3.85Å; Y103-I317 HydrophobicContact CG-CD1 3.52Å; R129-I317 WeakPolarHBondContact CA-O 3.45Å; C130-I317 PolarHBondContact N-O 3Å; C130-I317 PolarHBondContact O-N 2.96Å; L132-I317 HydrophobicContact CD1-CD1 3.97Å; T205-I317 WeakPolarHBondContact O-CA 3.21Å; F206-I317 HydrophobicContact CD1-CD1 4.42Å; F206-I317 HydrophobicContact CD1-CG1 4.03Å; F206-I317 HydrophobicContact CD1-CG2 4.07Å; F206-I317 HydrophobicContact CE1-CD1 4.38Å; F206-I317 HydrophobicContact CE1-CG1 4.38Å; F206-I317 HydrophobicContact CE1-CG2 3.92Å; V315-I317 HydrophobicContact CG1-CD1 4.14Å; V315-I317 HydrophobicContact CG1-CG1 4.19Å; V315-I317 HydrophobicContact CG2-CG1 3.92Å; I317-Y319 PolarHBondContact O-N 2.96Å
318	V	96.8	Very high	95.1	Very high	23 Å²	23	34.9 Å²	34.9	14%	0.139	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	106.4	164.2	-170.5	0	0	0	0	107	R129 D204 T205 N320	R129-V318 HydrophobicContact CG-CG2 4.24Å; D204-V318 VanDerWaalsContact CA-O 3.28Å; D204-V318 WeakPolarHBondContact CA-O 3.2Å; D204-V318 WeakPolarHBondContact CB-O 3.38Å; T205-V318 PolarHBondContact N-O 3.09Å; T205-V318 PolarHBondContact O-N 3.17Å; T205-V318 WeakPolarHBondContact OG1-CB 2.83Å; T205-V318 WeakPolarHBondContact OG1-CG2 3.39Å; V318-N320 PolarHBondContact O-N 2.89Å
319	Y	96	Very high	95.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	104.2	-174.6	-164	-63	0	0	0	109.1	Y103 T104 C106 C113 I117 C128 I317 K330	Y103-Y319 AromaticContact CD2-CD2 4Å; Y103-Y319 HydrophobicContact CD2-CD2 4Å; Y103-Y319 HydrophobicContact CD2-CE2 4.07Å; Y103-Y319 HydrophobicContact CE2-CD2 4.09Å; Y103-Y319 HydrophobicContact CE2-CE2 4.24Å; T104-Y319 WeakPolarHBondContact O-CE2 3.22Å; T104-Y319 PolarHBondContact O-OH 3.07Å; C106-Y319 VanDerWaalsContact SG-CD2 3.51Å; C113-Y319 HydrophobicContact CB-CD1 4.07Å; C113-Y319 HydrophobicContact CB-CD2 3.81Å; C113-Y319 HydrophobicContact CB-CE2 4.28Å; C113-Y319 HydrophobicContact CB-CG 3.67Å; I117-Y319 HydrophobicContact CB-CD1 4.39Å; I117-Y319 WeakPolarHBondContact CD1-O 3.25Å; I117-Y319 HydrophobicContact CG1-CD1 4Å; I117-Y319 WeakPolarHBondContact CG1-O 3.2Å; C128-Y319 PolarHBondContact O-N 3.12Å; I317-Y319 PolarHBondContact O-N 2.96Å; Y319-K330 WeakPolarHBondContact OH-CE 3.3Å
320	N	94.8	Very high	95.3	Very high	44 Å²	44	38.2 Å²	38.2	24%	0.235	23%	0.234	C	C	.	.			trans	-120.2	-30.3	-177.8	-64.5	-38.8	0	0	0	112.5	I117 N203 D204 V318 P322	I117-N320 WeakPolarHBondContact CG2-O 3.4Å; N203-N320 WeakPolarHBondContact O-CB 3.41Å; N203-N320 PolarHBondContact O-ND2 3.43Å; N203-N320 WeakPolarHBondContact OD1-CB 3.06Å; D204-N320 PolarHBondContact OD1-N 3.28Å; V318-N320 PolarHBondContact O-N 2.89Å; N320-P322 WeakPolarHBondContact O-CD 3.36Å
321	Y	95.3	Very high	95.4	Very high	13 Å²	13	34.6 Å²	34.6	5%	0.051	22%	0.217	C	C	.	.			trans	-80.9	114.8	-171.9	-161.4	-103.7	0	0	0	111.1	L150 F153 S200 L201 F202 N203 D204 V323 K330	L150-Y321 HydrophobicContact CD1-CE1 3.98Å; L150-Y321 HydrophobicContact CD2-CD1 4.38Å; L150-Y321 HydrophobicContact CD2-CE1 4.42Å; F153-Y321 HydrophobicContact CE2-CE1 4.41Å; F153-Y321 WeakPolarHBondContact CE2-OH 3.19Å; F153-Y321 VanDerWaalsContact CZ-OH 3.29Å; F153-Y321 WeakPolarHBondContact CZ-OH 3.45Å; S200-Y321 WeakPolarHBondContact O-CE2 3.29Å; S200-Y321 PolarHBondContact O-OH 2.9Å; S200-Y321 VanDerWaalsContact O-OH 3.11Å; L201-Y321 WeakPolarHBondContact O-CE2 3.41Å; F202-Y321 HydrophobicContact CB-CD2 4.49Å; F202-Y321 AromaticContact CD2-CD1 3.92Å; F202-Y321 HydrophobicContact CD2-CD1 3.92Å; F202-Y321 HydrophobicContact CD2-CD2 4.18Å; F202-Y321 HydrophobicContact CD2-CE1 4.39Å; F202-Y321 AromaticContact CD2-CG 3.79Å; F202-Y321 HydrophobicContact CD2-CG 3.79Å; F202-Y321 HydrophobicContact CE2-CD1 4.33Å; F202-Y321 HydrophobicContact CE2-CG 4.27Å; N203-Y321 WeakPolarHBondContact OD1-CA 3.35Å; N203-Y321 PolarHBondContact OD1-N 3.47Å; D204-Y321 WeakPolarHBondContact OD1-CB 3.33Å; D204-Y321 PolarHBondContact OD1-N 2.85Å; Y321-V323 HydrophobicContact CD1-CG1 4.04Å; Y321-V323 HydrophobicContact CE1-CG1 4.48Å; Y321-K330 HydrophobicContact CD1-CD 4.49Å; Y321-K330 PolarHBondContact O-NZ 2.61Å
322	P	94.3	Very high	95.6	Very high	69 Å²	69	33.9 Å²	33.9	45%	0.448	21%	0.21	S	C	.	.			trans	-77.1	126.7	-175.7	29.9	-32.8	0	0	0	111	I117 N320 F326	I117-P322 HydrophobicContact CG2-CB 4.03Å; N320-P322 WeakPolarHBondContact O-CD 3.36Å; P322-F326 VanDerWaalsContact O-CE1 3.25Å; P322-F326 WeakPolarHBondContact O-CE1 3.32Å
323	V	95.1	Very high	95.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.006	19%	0.19	C	C	.	.			trans	-120.8	-10.5	175.1	-60.2	0	0	0	0	114.1	T104 Y321 G325 F326 G327 G328 K330	T104-V323 HydrophobicContact CG2-CG2 4.02Å; Y321-V323 HydrophobicContact CD1-CG1 4.04Å; Y321-V323 HydrophobicContact CE1-CG1 4.48Å; V323-G325 PolarHBondContact O-N 3.31Å; V323-F326 HydrophobicContact CB-CE1 4.38Å; V323-F326 HydrophobicContact CB-CE2 4.31Å; V323-F326 HydrophobicContact CB-CZ 3.9Å; V323-F326 HydrophobicContact CG1-CE1 4.43Å; V323-F326 HydrophobicContact CG1-CE2 4.39Å; V323-F326 HydrophobicContact CG1-CZ 3.74Å; V323-F326 PolarHBondContact O-N 3.23Å; V323-G327 PolarHBondContact O-N 3.23Å; V323-G327 VanDerWaalsContact O-N 3.15Å; V323-G328 WeakPolarHBondContact CG2-O 3.33Å; V323-G328 PolarHBondContact O-N 3.18Å; V323-K330 HydrophobicContact CB-CG 4.49Å; V323-K330 HydrophobicContact CG1-CD 3.71Å; V323-K330 HydrophobicContact CG1-CG 3.57Å; V323-K330 HydrophobicContact CG2-CD 4.5Å; V323-K330 HydrophobicContact CG2-CG 4.18Å
324	A	93.3	Very high	95.4	Very high	35 Å²	35	30.3 Å²	30.3	29%	0.289	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-59	-44	-177.3	0	0	0	0	0	112.6	K114 A118 F326 G327	K114-A324 HydrophobicContact CG-CB 3.93Å; A118-A324 HydrophobicContact CB-CB 3.77Å; A324-F326 PolarHBondContact O-N 2.97Å; A324-F326 VanDerWaalsContact O-N 3.16Å; A324-G327 PolarHBondContact O-N 2.7Å
325	G	90.8	Very high	95.1	Very high	85 Å²	85	29.3 Å²	29.3	88%	0.876	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-64	-21.9	-173.8	0	0	0	0	0	115.3	V323	V323-G325 PolarHBondContact O-N 3.31Å
326	F	92.3	Very high	94.7	Very high	86 Å²	86	30 Å²	30	38%	0.377	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-120	11.2	176.8	60.6	-94.2	0	0	0	113.1	G152 F153 P322 V323 A324 G328	G152-F326 WeakPolarHBondContact O-CD2 3.44Å; F153-F326 HydrophobicContact CB-CE2 4.28Å; F153-F326 HydrophobicContact CD2-CE1 4.2Å; F153-F326 AromaticContact CD2-CE2 3.9Å; F153-F326 HydrophobicContact CD2-CE2 3.9Å; F153-F326 AromaticContact CD2-CZ 3.61Å; F153-F326 HydrophobicContact CD2-CZ 3.61Å; F153-F326 HydrophobicContact CE2-CE1 4.49Å; F153-F326 HydrophobicContact CE2-CZ 4.29Å; P322-F326 VanDerWaalsContact O-CE1 3.25Å; P322-F326 WeakPolarHBondContact O-CE1 3.32Å; V323-F326 HydrophobicContact CB-CE1 4.38Å; V323-F326 HydrophobicContact CB-CE2 4.31Å; V323-F326 HydrophobicContact CB-CZ 3.9Å; V323-F326 HydrophobicContact CG1-CE1 4.43Å; V323-F326 HydrophobicContact CG1-CE2 4.39Å; V323-F326 HydrophobicContact CG1-CZ 3.74Å; V323-F326 PolarHBondContact O-N 3.23Å; A324-F326 PolarHBondContact O-N 2.97Å; A324-F326 VanDerWaalsContact O-N 3.16Å; F326-G328 VanDerWaalsContact CE2-CA 3.49Å; F326-G328 PolarHBondContact O-N 2.76Å
327	G	93.1	Very high	93.7	Very high	62 Å²	62	30.1 Å²	30.1	64%	0.639	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	26.4	179.7	0	0	0	0	0	114.3	V323 A324	V323-G327 PolarHBondContact O-N 3.23Å; V323-G327 VanDerWaalsContact O-N 3.15Å; A324-G327 PolarHBondContact O-N 2.7Å
328	G	95.2	Very high	92.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.01	21%	0.207	C	C	.	.			trans	-75	165.1	-179.2	0	0	0	0	0	113.8	S151 V323 F326	S151-G328 WeakPolarHBondContact O-CA 3.28Å; V323-G328 WeakPolarHBondContact CG2-O 3.33Å; V323-G328 PolarHBondContact O-N 3.18Å; F326-G328 VanDerWaalsContact CE2-CA 3.49Å; F326-G328 PolarHBondContact O-N 2.76Å
329	R	96.3	Very high	91.1	Very high	89 Å²	89	38.5 Å²	38.5	34%	0.336	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	151.1	173.1	-57.4	-172.5	72	116.8	8.5	111.2	D102 T104 L150 S151	D102-R329 IonicContact OD1-NH2 3.72Å; D102-R329 IonicContact OD2-CZ 2.7Å; D102-R329 IonicContact OD2-NE 3.91Å; D102-R329 PolarHBondContact OD2-NE 2.8Å; D102-R329 IonicContact OD2-NH2 3.45Å; D102-R329 PolarHBondContact OD2-NH2 3.49Å; T104-R329 HydrophobicContact CG2-CB 4.46Å; T104-R329 HydrophobicContact CG2-CG 4.49Å; T104-R329 WeakPolarHBondContact OG1-CA 3.46Å; T104-R329 WeakPolarHBondContact OG1-CB 3.43Å; L150-R329 WeakPolarHBondContact CA-O 3.47Å; S151-R329 PolarHBondContact N-O 2.87Å; S151-R329 PolarHBondContact O-N 2.76Å; S151-R329 VanDerWaalsContact O-N 3.15Å
330	K	96.8	Very high	89.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	139.2	-179.8	-55.8	-164.4	-70.8	-175.6	0	111.3	Y103 T104 G149 L150 F202 D204 Y319 Y321 V323	Y103-K330 HydrophobicContact CD1-CB 4.36Å; Y103-K330 HydrophobicContact CD2-CB 4.39Å; Y103-K330 HydrophobicContact CE1-CB 3.8Å; Y103-K330 HydrophobicContact CE2-CB 3.83Å; Y103-K330 HydrophobicContact CE2-CD 4.1Å; Y103-K330 VanDerWaalsContact CZ-CB 3.48Å; Y103-K330 PolarHBondContact N-O 3.12Å; Y103-K330 VanDerWaalsContact N-O 3.16Å; T104-K330 PolarHBondContact OG1-N 2.04Å; T104-K330 PolarHBondContact OG1-O 3.18Å; G149-K330 CarbonylContact O-C 3.37Å; G149-K330 WeakPolarHBondContact O-CA 3.01Å; L150-K330 HydrophobicContact CD2-CB 4.46Å; L150-K330 HydrophobicContact CD2-CD 4.26Å; L150-K330 HydrophobicContact CD2-CG 3.77Å; F202-K330 HydrophobicContact CE2-CD 4.34Å; D204-K330 IonicContact OD1-NZ 2.92Å; D204-K330 PolarHBondContact OD1-NZ 2.87Å; D204-K330 WeakPolarHBondContact OD2-CD 3.34Å; D204-K330 VanDerWaalsContact OD2-CE 3.31Å; D204-K330 WeakPolarHBondContact OD2-CE 3.16Å; D204-K330 IonicContact OD2-NZ 3.18Å; D204-K330 PolarHBondContact OD2-NZ 3.38Å; Y319-K330 WeakPolarHBondContact OH-CE 3.3Å; Y321-K330 HydrophobicContact CD1-CD 4.49Å; Y321-K330 PolarHBondContact O-NZ 2.61Å; V323-K330 HydrophobicContact CB-CG 4.49Å; V323-K330 HydrophobicContact CG1-CD 3.71Å; V323-K330 HydrophobicContact CG1-CG 3.57Å; V323-K330 HydrophobicContact CG2-CD 4.5Å; V323-K330 HydrophobicContact CG2-CG 4.18Å
331	R	97	Very high	88.4	Confident	50 Å²	50	40.9 Å²	40.9	19%	0.189	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	142.2	-178.1	-61.6	179	-76.7	-128.9	-4.9	111.6	E100 L101 D102 Y148 G149 S151 I333	E100-R331 HydrophobicContact CG-CB 4.29Å; E100-R331 HydrophobicContact CG-CG 4.4Å; E100-R331 WeakPolarHBondContact OE1-CD 3.34Å; E100-R331 IonicContact OE1-CZ 2.71Å; E100-R331 IonicContact OE1-NE 2.63Å; E100-R331 IonicContact OE1-NH1 3.22Å; L101-R331 CarbonylContact O-C 3.58Å; L101-R331 VanDerWaalsContact O-CA 3.25Å; L101-R331 WeakPolarHBondContact O-CA 3.36Å; D102-R331 HydrophobicContact CB-CG 4.35Å; Y148-R331 CarbonylContact C-O 3.51Å; Y148-R331 VanDerWaalsContact CA-O 3.31Å; Y148-R331 WeakPolarHBondContact CA-O 2.91Å; G149-R331 PolarHBondContact N-O 2.86Å; G149-R331 PolarHBondContact O-N 3.06Å; S151-R331 VanDerWaalsContact OG-CZ 3.24Å; S151-R331 PolarHBondContact OG-NH1 2.64Å; S151-R331 PolarHBondContact OG-NH2 2.96Å; R331-I333 HydrophobicContact CB-CD1 4.49Å; R331-I333 HydrophobicContact CB-CG1 4.33Å
332	F	97.2	Very high	87	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	127.3	169.7	173.6	-103.9	0	0	0	107.7	L101 Y103 F134 L146 F206 L208 V315 I334	L101-F332 HydrophobicContact CB-CB 4.48Å; L101-F332 PolarHBondContact N-O 3.29Å; L101-F332 PolarHBondContact O-N 3.22Å; Y103-F332 HydrophobicContact CD1-CB 3.99Å; Y103-F332 HydrophobicContact CE1-CB 4.16Å; F134-F332 HydrophobicContact CZ-CE1 4.23Å; L146-F332 HydrophobicContact CB-CE2 4.33Å; L146-F332 HydrophobicContact CD1-CE2 4.26Å; L146-F332 HydrophobicContact CD1-CZ 4.2Å; L146-F332 HydrophobicContact CD2-CZ 4.04Å; F206-F332 HydrophobicContact CB-CD2 4.26Å; F206-F332 HydrophobicContact CB-CE2 3.96Å; F206-F332 AromaticContact CD1-CD2 3.65Å; F206-F332 HydrophobicContact CD1-CD2 3.65Å; F206-F332 HydrophobicContact CD1-CE2 4.22Å; F206-F332 HydrophobicContact CD1-CG 4.36Å; F206-F332 HydrophobicContact CD2-CD2 4.01Å; F206-F332 HydrophobicContact CD2-CE2 4.23Å; F206-F332 HydrophobicContact CE1-CB 4.23Å; F206-F332 AromaticContact CE1-CD2 3.93Å; F206-F332 HydrophobicContact CE1-CD2 3.93Å; F206-F332 HydrophobicContact CE1-CG 4.47Å; F206-F332 HydrophobicContact CE2-CD2 4.28Å; F206-F332 AromaticContact CG-CD2 3.7Å; F206-F332 HydrophobicContact CG-CD2 3.7Å; F206-F332 AromaticContact CG-CE2 3.87Å; F206-F332 HydrophobicContact CG-CE2 3.87Å; F206-F332 HydrophobicContact CZ-CD2 4.24Å; L208-F332 HydrophobicContact CD1-CE1 4.4Å; L208-F332 HydrophobicContact CD1-CZ 4.45Å; L208-F332 HydrophobicContact CD2-CZ 4.48Å; V315-F332 HydrophobicContact CG2-CE1 4.36Å; V315-F332 HydrophobicContact CG2-CE2 4.5Å; V315-F332 HydrophobicContact CG2-CZ 4.36Å; F332-I334 HydrophobicContact CD1-CG1 4.48Å; F332-I334 HydrophobicContact CE1-CD1 3.88Å; F332-I334 HydrophobicContact CE1-CG1 3.67Å; F332-I334 HydrophobicContact CZ-CD1 4.36Å; F332-I334 HydrophobicContact CZ-CG1 4.02Å
333	I	95	Very high	86	Confident	4 Å²	4	42.3 Å²	42.3	2%	0.021	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	133.7	-171.1	-57.4	158.6	0	0	0	109	E98 F99 E100 L146 Y147 R291 R331	E98-I333 HydrophobicContact CG-CG2 3.85Å; F99-I333 CarbonylContact O-C 3.58Å; F99-I333 WeakPolarHBondContact O-CA 3.3Å; F99-I333 WeakPolarHBondContact O-CG2 3.28Å; E100-I333 HydrophobicContact CB-CG1 4.29Å; E100-I333 HydrophobicContact CG-CG1 4.02Å; L146-I333 CarbonylContact C-O 3.59Å; L146-I333 WeakPolarHBondContact CA-O 3.46Å; Y147-I333 HydrophobicContact CD2-CG2 4.44Å; Y147-I333 PolarHBondContact N-O 3.34Å; Y147-I333 PolarHBondContact O-N 3.26Å; R291-I333 HydrophobicContact CB-CD1 4Å; R331-I333 HydrophobicContact CB-CD1 4.49Å; R331-I333 HydrophobicContact CB-CG1 4.33Å
334	I	94.9	Very high	85.2	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.9	171	-52	-178.4	0	0	0	107.3	E98 F99 F134 L136 V144 L146 L208 L308 F332	E98-I334 CarbonylContact C-O 3.56Å; E98-I334 WeakPolarHBondContact CA-O 3.15Å; F99-I334 HydrophobicContact CB-CB 4.28Å; F99-I334 HydrophobicContact CD1-CD1 4.18Å; F99-I334 HydrophobicContact CD1-CG1 4.16Å; F99-I334 PolarHBondContact N-O 2.96Å; F99-I334 PolarHBondContact O-N 3.44Å; F134-I334 HydrophobicContact CE2-CD1 3.96Å; F134-I334 HydrophobicContact CZ-CD1 3.92Å; L136-I334 HydrophobicContact CD1-CD1 4.42Å; V144-I334 HydrophobicContact CG1-CG2 3.68Å; L146-I334 HydrophobicContact CD2-CB 4.27Å; L146-I334 HydrophobicContact CD2-CD1 4.41Å; L146-I334 HydrophobicContact CD2-CG1 3.79Å; L146-I334 HydrophobicContact CD2-CG2 4.08Å; L208-I334 HydrophobicContact CD2-CD1 4.13Å; L308-I334 HydrophobicContact CD2-CD1 4.07Å; L308-I334 HydrophobicContact CD2-CG2 3.79Å; F332-I334 HydrophobicContact CD1-CG1 4.48Å; F332-I334 HydrophobicContact CE1-CD1 3.88Å; F332-I334 HydrophobicContact CE1-CG1 3.67Å; F332-I334 HydrophobicContact CZ-CD1 4.36Å; F332-I334 HydrophobicContact CZ-CG1 4.02Å
335	S	91	Very high	84.8	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.014	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	147.4	177.1	-176	0	0	0	0	112.7	K97 Y145	K97-S335 VanDerWaalsContact O-CA 3.23Å; K97-S335 WeakPolarHBondContact O-CA 3.13Å; K97-S335 PolarHBondContact O-OG 2.98Å; Y145-S335 WeakPolarHBondContact CA-O 3.19Å; Y145-S335 WeakPolarHBondContact CB-O 3.42Å; Y145-S335 PolarHBondContact N-O 3.49Å; Y145-S335 PolarHBondContact O-N 3.19Å
336	N	89.4	Confident	84.8	Confident	15 Å²	15	50 Å²	50	8%	0.08	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	163	166.7	64.8	-15.9	0	0	0	111.5	L95 V96 K97 V140 E141 P143	L95-N336 PolarHBondContact O-ND2 3.45Å; V96-N336 WeakPolarHBondContact CA-OD1 3.46Å; V96-N336 WeakPolarHBondContact CG1-OD1 3.38Å; K97-N336 PolarHBondContact N-OD1 3.07Å; K97-N336 PolarHBondContact O-N 3.26Å; K97-N336 PolarHBondContact O-OD1 3.01Å; V140-N336 HydrophobicContact CG1-CB 3.87Å; E141-N336 WeakPolarHBondContact O-CB 3.4Å; P143-N336 VanDerWaalsContact O-CA 3.26Å; P143-N336 WeakPolarHBondContact O-CA 3.45Å; P143-N336 WeakPolarHBondContact O-CB 3.36Å
337	A	76	Confident	84.7	Confident	52 Å²	52	50 Å²	50	43%	0.43	28%	0.282	S	S	.	.			trans	-81.4	139.8	173	0	0	0	0	0	111.7	P143 Y145	P143-A337 HydrophobicContact CG-CB 4.26Å; P143-A337 PolarHBondContact O-N 3.36Å; Y145-A337 HydrophobicContact CD2-CB 4.42Å; Y145-A337 HydrophobicContact CE2-CB 3.64Å
338	S	69.7	Low	84.6	Confident	29 Å²	29	47 Å²	47	20%	0.203	25%	0.252	C	S	.	.			trans	-115	164.7	151.3	75.7	0	0	0	0	111.6	V96 A340 G341	V96-S338 VanDerWaalsContact CG2-OG 3.24Å; V96-S338 WeakPolarHBondContact CG2-OG 3.39Å; S338-A340 PolarHBondContact O-N 2.92Å; S338-A340 PolarHBondContact OG-N 2.98Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.17Å; S338-G341 PolarHBondContact OG-N 3.38Å; S338-G341 VanDerWaalsContact OG-N 3.14Å; S338-G341 PolarHBondContact OG-O 2.97Å
339	W	69.1	Low	84.6	Confident	170 Å²	170	51 Å²	51	64%	0.644	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-30	172.9	74.2	-90	0	0	0	112.9	L50	L50-W339 HydrophobicContact CD2-CH2 4.11Å
340	A	64.5	Low	84.7	Confident	58 Å²	58	48.2 Å²	48.2	48%	0.479	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.2	-179	0	0	0	0	0	113.3	S338	S338-A340 PolarHBondContact O-N 2.92Å; S338-A340 PolarHBondContact OG-N 2.98Å
341	G	69.4	Low	84.7	Confident	37 Å²	37	51.9 Å²	51.9	38%	0.381	28%	0.283	S	S	.	.			trans	91.5	-140.6	-176.2	0	0	0	0	0	113.2	V96 S338	V96-G341 WeakPolarHBondContact CG2-O 3.25Å; S338-G341 PolarHBondContact O-N 3.08Å; S338-G341 VanDerWaalsContact O-N 3.17Å; S338-G341 PolarHBondContact OG-N 3.38Å; S338-G341 VanDerWaalsContact OG-N 3.14Å; S338-G341 PolarHBondContact OG-O 2.97Å
342	G	67.4	Low	84.7	Confident	23 Å²	23	51.5 Å²	51.5	24%	0.237	28%	0.284	C	S	.	.	S	Bend	trans	-92.2	-176.3	177.5	0	0	0	0	0	112.8	N344	G342-N344 PolarHBondContact O-N 3.3Å; G342-N344 VanDerWaalsContact O-N 3.16Å
343	K	72.3	Confident	84.8	Confident	88 Å²	88	55.1 Å²	55.1	38%	0.383	31%	0.306	S	S	.	.			trans	-57.2	117.4	175.6	-170.1	164.1	-169.7	160.6	0	111.2	V57 N59	V57-K343 HydrophobicContact CB-CB 3.72Å; V57-K343 HydrophobicContact CB-CD 4.21Å; V57-K343 HydrophobicContact CB-CG 4.07Å; V57-K343 HydrophobicContact CG1-CB 3.65Å; V57-K343 HydrophobicContact CG1-CD 4.46Å; V57-K343 HydrophobicContact CG1-CG 4.42Å; V57-K343 HydrophobicContact CG2-CB 4.17Å; V57-K343 PolarHBondContact O-NZ 3.07Å; N59-K343 WeakPolarHBondContact ND2-CD 3.44Å
344	N	78.1	Confident	84.9	Confident	95 Å²	95	58.2 Å²	58.2	51%	0.508	33%	0.325	S	S	.	.			trans	-152.2	90.2	173.5	-170.1	-2.8	0	0	0	111.8	S54 G342 F346	S54-N344 PolarHBondContact OG-N 3.29Å; S54-N344 PolarHBondContact OG-O 3.41Å; G342-N344 PolarHBondContact O-N 3.3Å; G342-N344 VanDerWaalsContact O-N 3.16Å; N344-F346 PolarHBondContact O-N 3.32Å; N344-F346 WeakPolarHBondContact OD1-CB 3.39Å; N344-F346 PolarHBondContact OD1-N 2.95Å
345	P	85.5	Confident	85.1	Confident	45 Å²	45	58.1 Å²	58.1	29%	0.292	32%	0.324	S	S	.	.	H	α-helix	trans	-71.8	-12.8	-177.7	29.4	-35.5	0	0	0	112.7	L51 S54 L347 G348 I349	L51-P345 HydrophobicContact CD1-CB 3.67Å; S54-P345 VanDerWaalsContact OG-N 3.07Å; P345-L347 VanDerWaalsContact C-N 3.32Å; P345-L347 PolarHBondContact O-N 3.24Å; P345-G348 PolarHBondContact O-N 2.95Å; P345-I349 HydrophobicContact CB-CD1 4.09Å; P345-I349 VanDerWaalsContact O-CG1 3.31Å; P345-I349 WeakPolarHBondContact O-CG1 3.49Å; P345-I349 PolarHBondContact O-N 3.13Å
346	F	91.1	Very high	85.4	Confident	144 Å²	144	60.8 Å²	60.8	63%	0.632	34%	0.343	S	S	*	.	H	α-helix	trans	-56.5	-44.3	-176	176.1	-100.1	0	0	0	112.4	N344 I349 A350	N344-F346 PolarHBondContact O-N 3.32Å; N344-F346 WeakPolarHBondContact OD1-CB 3.39Å; N344-F346 PolarHBondContact OD1-N 2.95Å; F346-I349 PolarHBondContact O-N 3.24Å; F346-A350 VanDerWaalsContact O-CB 3.23Å; F346-A350 WeakPolarHBondContact O-CB 3.48Å; F346-A350 PolarHBondContact O-N 3.33Å
347	L	89.5	Confident	85.8	Confident	84 Å²	84	64.9 Å²	64.9	44%	0.44	36%	0.364	S	S	.	.	H	α-helix	trans	-63.8	-48	-178.3	-164.3	77.3	0	0	0	110.3	L50 P345 I349 A350 Y351	L50-L347 HydrophobicContact CD1-CD2 3.72Å; L50-L347 HydrophobicContact CD1-CG 4.05Å; L50-L347 HydrophobicContact CD2-CD2 4.2Å; P345-L347 VanDerWaalsContact C-N 3.32Å; P345-L347 PolarHBondContact O-N 3.24Å; L347-I349 PolarHBondContact O-N 3.21Å; L347-A350 PolarHBondContact O-N 3.31Å; L347-Y351 HydrophobicContact CD1-CD2 4.46Å; L347-Y351 HydrophobicContact CD1-CE2 4.06Å; L347-Y351 HydrophobicContact CG-CD2 4.15Å; L347-Y351 HydrophobicContact CG-CE2 4.03Å; L347-Y351 VanDerWaalsContact O-CD2 3.3Å; L347-Y351 WeakPolarHBondContact O-CD2 3.36Å; L347-Y351 PolarHBondContact O-N 2.86Å
348	G	92	Very high	86.8	Confident	1 Å²	1	63.2 Å²	63.2	1%	0.01	35%	0.349	C	S	.	.	H	α-helix	trans	-58	-48.9	176.3	0	0	0	0	0	112.5	G47 P345 A350 Y351 I352	G47-G348 WeakPolarHBondContact O-CA 3.39Å; P345-G348 PolarHBondContact O-N 2.95Å; G348-A350 PolarHBondContact O-N 3.28Å; G348-Y351 PolarHBondContact O-N 2.88Å; G348-I352 WeakPolarHBondContact O-CG1 3.4Å; G348-I352 PolarHBondContact O-N 3.29Å
349	I	95.2	Very high	88.1	Confident	83 Å²	83	64.3 Å²	64.3	43%	0.426	35%	0.352	S	S	.	.	H	α-helix	trans	-60.2	-44.7	177.5	-65.7	167.1	0	0	0	111.1	L51 P345 F346 L347 Y351 I352 V353	L51-I349 HydrophobicContact CD1-CG1 4.07Å; P345-I349 HydrophobicContact CB-CD1 4.09Å; P345-I349 VanDerWaalsContact O-CG1 3.31Å; P345-I349 WeakPolarHBondContact O-CG1 3.49Å; P345-I349 PolarHBondContact O-N 3.13Å; F346-I349 PolarHBondContact O-N 3.24Å; L347-I349 PolarHBondContact O-N 3.21Å; I349-Y351 PolarHBondContact O-N 3.08Å; I349-I352 PolarHBondContact O-N 3.04Å; I349-V353 HydrophobicContact CG2-CG2 4.1Å; I349-V353 WeakPolarHBondContact O-CB 3.42Å; I349-V353 VanDerWaalsContact O-CG2 3.3Å; I349-V353 WeakPolarHBondContact O-CG2 3.31Å; I349-V353 PolarHBondContact O-N 3.47Å
350	A	96.9	Very high	89.4	Confident	32 Å²	32	62.2 Å²	62.2	26%	0.264	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-43.7	-179.3	0	0	0	0	0	112	F346 L347 G348 V353 V354	F346-A350 VanDerWaalsContact O-CB 3.23Å; F346-A350 WeakPolarHBondContact O-CB 3.48Å; F346-A350 PolarHBondContact O-N 3.33Å; L347-A350 PolarHBondContact O-N 3.31Å; G348-A350 PolarHBondContact O-N 3.28Å; A350-V353 PolarHBondContact O-N 2.86Å; A350-V354 WeakPolarHBondContact O-CB 3.27Å; A350-V354 WeakPolarHBondContact O-CG2 3.32Å; A350-V354 PolarHBondContact O-N 2.86Å
351	Y	97.2	Very high	90.9	Very high	77 Å²	77	62.8 Å²	62.8	30%	0.302	34%	0.342	S	S	.	.	H	α-helix	trans	-63.1	-43.2	175.7	-90.4	-96.2	0	0	0	112	F43 V46 G47 L50 L347 G348 I349 G355	F43-Y351 HydrophobicContact CB-CD1 4.06Å; F43-Y351 HydrophobicContact CD1-CD1 4.17Å; F43-Y351 HydrophobicContact CD1-CE1 4.17Å; F43-Y351 AromaticContact CD2-CD1 3.85Å; F43-Y351 HydrophobicContact CD2-CD1 3.85Å; F43-Y351 HydrophobicContact CD2-CE1 4.19Å; F43-Y351 HydrophobicContact CE1-CE1 4.17Å; F43-Y351 HydrophobicContact CE2-CD1 4.3Å; F43-Y351 HydrophobicContact CE2-CE1 4.2Å; F43-Y351 AromaticContact CG-CD1 3.77Å; F43-Y351 HydrophobicContact CG-CD1 3.77Å; F43-Y351 HydrophobicContact CG-CE1 4.17Å; F43-Y351 HydrophobicContact CZ-CE1 4.18Å; V46-Y351 HydrophobicContact CB-CD1 4.38Å; V46-Y351 HydrophobicContact CG1-CD1 3.97Å; V46-Y351 HydrophobicContact CG1-CE1 4.03Å; G47-Y351 VanDerWaalsContact CA-CB 3.5Å; L50-Y351 HydrophobicContact CD1-CD2 4.1Å; L50-Y351 HydrophobicContact CD1-CE2 4.28Å; L347-Y351 HydrophobicContact CD1-CD2 4.46Å; L347-Y351 HydrophobicContact CD1-CE2 4.06Å; L347-Y351 HydrophobicContact CG-CD2 4.15Å; L347-Y351 HydrophobicContact CG-CE2 4.03Å; L347-Y351 VanDerWaalsContact O-CD2 3.3Å; L347-Y351 WeakPolarHBondContact O-CD2 3.36Å; L347-Y351 PolarHBondContact O-N 2.86Å; G348-Y351 PolarHBondContact O-N 2.88Å; I349-Y351 PolarHBondContact O-N 3.08Å; Y351-G355 PolarHBondContact O-N 2.85Å
352	I	97.7	Very high	92.1	Very high	42 Å²	42	61 Å²	61	22%	0.215	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-45.3	176.8	-66.5	168.1	0	0	0	110.9	V48 L51 G348 I349 S356	V48-I352 HydrophobicContact CG2-CD1 4.11Å; V48-I352 HydrophobicContact CG2-CG1 4.37Å; L51-I352 HydrophobicContact CD2-CD1 3.94Å; G348-I352 WeakPolarHBondContact O-CG1 3.4Å; G348-I352 PolarHBondContact O-N 3.29Å; I349-I352 PolarHBondContact O-N 3.04Å; I352-S356 VanDerWaalsContact O-CB 3.26Å; I352-S356 WeakPolarHBondContact O-CB 3.32Å; I352-S356 PolarHBondContact O-N 2.89Å; I352-S356 PolarHBondContact O-OG 3.45Å
353	V	98.1	Very high	93.4	Very high	75 Å²	75	64.1 Å²	64.1	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-64.9	-51.3	-178.9	169.6	0	0	0	0	110.7	I349 A350 G355 S356 L357	I349-V353 HydrophobicContact CG2-CG2 4.1Å; I349-V353 WeakPolarHBondContact O-CB 3.42Å; I349-V353 VanDerWaalsContact O-CG2 3.3Å; I349-V353 WeakPolarHBondContact O-CG2 3.31Å; I349-V353 PolarHBondContact O-N 3.47Å; A350-V353 PolarHBondContact O-N 2.86Å; V353-G355 PolarHBondContact O-N 2.8Å; V353-S356 PolarHBondContact O-N 2.84Å; V353-L357 HydrophobicContact CG1-CD1 3.97Å; V353-L357 WeakPolarHBondContact O-CB 3.36Å; V353-L357 WeakPolarHBondContact O-CG 3.4Å; V353-L357 PolarHBondContact O-N 2.97Å
354	V	98	Very high	94.4	Very high	69 Å²	69	62.4 Å²	62.4	42%	0.418	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-44.4	179.5	173.8	0	0	0	0	110.5	F43 A350 S356 L357 C358	F43-V354 HydrophobicContact CD2-CB 4.46Å; F43-V354 HydrophobicContact CD2-CG1 4.08Å; F43-V354 HydrophobicContact CE2-CG1 4.23Å; A350-V354 WeakPolarHBondContact O-CB 3.27Å; A350-V354 WeakPolarHBondContact O-CG2 3.32Å; A350-V354 PolarHBondContact O-N 2.86Å; V354-S356 PolarHBondContact O-N 2.78Å; V354-L357 PolarHBondContact O-N 2.83Å; V354-C358 PolarHBondContact O-N 2.86Å; V354-C358 PolarHBondContact O-SG 3.47Å; V354-C358 VanDerWaalsContact O-SG 3.37Å
355	G	98.2	Very high	95.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-60.1	-44.2	176.8	0	0	0	0	0	112.7	G40 Y351 V353 C358 I359	G40-G355 WeakPolarHBondContact CA-O 3.23Å; Y351-G355 PolarHBondContact O-N 2.85Å; V353-G355 PolarHBondContact O-N 2.8Å; G355-C358 PolarHBondContact O-N 2.75Å; G355-I359 WeakPolarHBondContact O-CG1 3.32Å; G355-I359 PolarHBondContact O-N 2.96Å; G355-I359 VanDerWaalsContact O-N 3.07Å
356	S	98	Very high	95.4	Very high	57 Å²	57	63.1 Å²	63.1	40%	0.399	33%	0.328	S	S	.	.	H	α-helix	trans	-66.2	-41	177.7	-57.3	0	0	0	0	112.2	I352 V353 V354 C358 I359 F360	I352-S356 VanDerWaalsContact O-CB 3.26Å; I352-S356 WeakPolarHBondContact O-CB 3.32Å; I352-S356 PolarHBondContact O-N 2.89Å; I352-S356 PolarHBondContact O-OG 3.45Å; V353-S356 PolarHBondContact O-N 2.84Å; V354-S356 PolarHBondContact O-N 2.78Å; S356-C358 VanDerWaalsContact C-N 3.33Å; S356-C358 PolarHBondContact O-N 2.93Å; S356-I359 PolarHBondContact O-N 3.38Å; S356-F360 WeakPolarHBondContact O-CB 3.03Å; S356-F360 PolarHBondContact O-N 3.4Å
357	L	97.8	Very high	95.5	Very high	101 Å²	101	60 Å²	60	53%	0.529	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-40	174.4	-74.6	171.3	0	0	0	111.5	V353 V354 F360 M361	V353-L357 HydrophobicContact CG1-CD1 3.97Å; V353-L357 WeakPolarHBondContact O-CB 3.36Å; V353-L357 WeakPolarHBondContact O-CG 3.4Å; V353-L357 PolarHBondContact O-N 2.97Å; V354-L357 PolarHBondContact O-N 2.83Å; L357-F360 PolarHBondContact O-N 2.93Å; L357-M361 WeakPolarHBondContact O-CB 3.28Å; L357-M361 VanDerWaalsContact O-CG 3.3Å; L357-M361 WeakPolarHBondContact O-CG 3.12Å; L357-M361 PolarHBondContact O-N 3.41Å
358	C	97.4	Very high	95.5	Very high	17 Å²	17	60 Å²	60	12%	0.115	32%	0.32	C	S	.	.	H	α-helix	trans	-62.5	-43.1	175.6	-76	0	0	0	0	112.4	F36 I39 V354 G355 S356 G362	F36-C358 HydrophobicContact CD1-CB 4.09Å; I39-C358 HydrophobicContact CG2-CB 4.41Å; V354-C358 PolarHBondContact O-N 2.86Å; V354-C358 PolarHBondContact O-SG 3.47Å; V354-C358 VanDerWaalsContact O-SG 3.37Å; G355-C358 PolarHBondContact O-N 2.75Å; S356-C358 VanDerWaalsContact C-N 3.33Å; S356-C358 PolarHBondContact O-N 2.93Å; C358-G362 PolarHBondContact O-N 2.81Å
359	I	97.1	Very high	95.3	Very high	52 Å²	52	64.1 Å²	64.1	27%	0.267	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-46.3	175.7	-64.4	173	0	0	0	110.5	F37 V44 G355 S356 G362 L363	F37-I359 HydrophobicContact CE1-CG2 4.32Å; V44-I359 HydrophobicContact CG2-CD1 4.37Å; G355-I359 WeakPolarHBondContact O-CG1 3.32Å; G355-I359 PolarHBondContact O-N 2.96Å; G355-I359 VanDerWaalsContact O-N 3.07Å; S356-I359 PolarHBondContact O-N 3.38Å; I359-G362 PolarHBondContact O-N 2.04Å; I359-L363 HydrophobicContact CG2-CD1 4.23Å; I359-L363 WeakPolarHBondContact O-CG 3.47Å; I359-L363 PolarHBondContact O-N 3.24Å
360	F	96.9	Very high	95	Very high	127 Å²	127	65.7 Å²	65.7	56%	0.557	35%	0.352	S	S	*	.	H	α-helix	trans	-60.1	-48.8	179	177.2	-100.3	0	0	0	112	S356 L357 G362 L363 V364	S356-F360 WeakPolarHBondContact O-CB 3.03Å; S356-F360 PolarHBondContact O-N 3.4Å; L357-F360 PolarHBondContact O-N 2.93Å; F360-G362 VanDerWaalsContact C-N 3.31Å; F360-G362 PolarHBondContact O-N 3.44Å; F360-L363 WeakPolarHBondContact O-CB 3.49Å; F360-L363 PolarHBondContact O-N 2.96Å; F360-V364 HydrophobicContact CD1-CG2 4.34Å; F360-V364 HydrophobicContact CE1-CG2 3.89Å; F360-V364 HydrophobicContact CE2-CG2 4.29Å; F360-V364 HydrophobicContact CZ-CG2 3.86Å; F360-V364 WeakPolarHBondContact O-CG2 3.03Å; F360-V364 PolarHBondContact O-N 2.98Å
361	M	94.8	Very high	94.7	Very high	70 Å²	70	71.9 Å²	71.9	35%	0.345	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-38.4	176.2	-71.9	-62.3	-63.6	0	0	111.9	F36 L357 L363 V364 F365	F36-M361 HydrophobicContact CD1-CB 4.4Å; F36-M361 HydrophobicContact CE1-CB 4.3Å; L357-M361 WeakPolarHBondContact O-CB 3.28Å; L357-M361 VanDerWaalsContact O-CG 3.3Å; L357-M361 WeakPolarHBondContact O-CG 3.12Å; L357-M361 PolarHBondContact O-N 3.41Å; M361-L363 VanDerWaalsContact C-N 3.34Å; M361-L363 PolarHBondContact O-N 3.36Å; M361-V364 PolarHBondContact O-N 3.24Å; M361-F365 HydrophobicContact CE-CE1 3.93Å; M361-F365 HydrophobicContact CE-CE2 4Å; M361-F365 HydrophobicContact CE-CZ 3.5Å; M361-F365 WeakPolarHBondContact O-CB 3.37Å; M361-F365 WeakPolarHBondContact O-CG 3.41Å; M361-F365 PolarHBondContact O-N 3.37Å
362	G	94.8	Very high	94	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-57.9	-44.2	172.5	0	0	0	0	0	112.4	L33 F37 C358 I359 F360 L366	L33-G362 WeakPolarHBondContact CD2-O 3.23Å; F37-G362 VanDerWaalsContact CZ-C 3.46Å; C358-G362 PolarHBondContact O-N 2.81Å; I359-G362 PolarHBondContact O-N 2.04Å; F360-G362 VanDerWaalsContact C-N 3.31Å; F360-G362 PolarHBondContact O-N 3.44Å; G362-L366 VanDerWaalsContact O-CB 3.23Å; G362-L366 WeakPolarHBondContact O-CB 3.3Å; G362-L366 PolarHBondContact O-N 2.86Å
363	L	95.2	Very high	92.6	Very high	88 Å²	88	75.1 Å²	75.1	46%	0.461	40%	0.397	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.8	-69.6	169.8	0	0	0	112.1	F37 I359 F360 M361 L366 V367	F37-L363 HydrophobicContact CE1-CD2 4.06Å; F37-L363 HydrophobicContact CE1-CG 4.08Å; F37-L363 HydrophobicContact CZ-CD2 3.98Å; F37-L363 HydrophobicContact CZ-CG 4.16Å; I359-L363 HydrophobicContact CG2-CD1 4.23Å; I359-L363 WeakPolarHBondContact O-CG 3.47Å; I359-L363 PolarHBondContact O-N 3.24Å; F360-L363 WeakPolarHBondContact O-CB 3.49Å; F360-L363 PolarHBondContact O-N 2.96Å; M361-L363 VanDerWaalsContact C-N 3.34Å; M361-L363 PolarHBondContact O-N 3.36Å; L363-L366 PolarHBondContact O-N 2.94Å; L363-V367 WeakPolarHBondContact O-CG2 3.4Å; L363-V367 PolarHBondContact O-N 2.81Å
364	V	93	Very high	90.5	Very high	51 Å²	51	80.7 Å²	80.7	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-61.4	-48.7	177.8	171.6	0	0	0	0	110.9	F360 M361 L366 V367 I368	F360-V364 HydrophobicContact CD1-CG2 4.34Å; F360-V364 HydrophobicContact CE1-CG2 3.89Å; F360-V364 HydrophobicContact CE2-CG2 4.29Å; F360-V364 HydrophobicContact CZ-CG2 3.86Å; F360-V364 WeakPolarHBondContact O-CG2 3.03Å; F360-V364 PolarHBondContact O-N 2.98Å; M361-V364 PolarHBondContact O-N 3.24Å; V364-L366 VanDerWaalsContact C-N 3.28Å; V364-L366 PolarHBondContact O-N 3.08Å; V364-V367 PolarHBondContact O-N 2.95Å; V364-I368 HydrophobicContact CG1-CD1 3.9Å; V364-I368 WeakPolarHBondContact O-CG1 3.28Å; V364-I368 PolarHBondContact O-N 2.85Å
365	F	91.7	Very high	88	Confident	80 Å²	80	86.5 Å²	86.5	35%	0.351	46%	0.462	S	S	.	.	H	α-helix	trans	-64.7	-33.6	177.2	-70.2	-23.7	0	0	0	112.5	L33 F36 M361 I368 H369	L33-F365 HydrophobicContact CD2-CB 3.59Å; F36-F365 HydrophobicContact CD2-CD2 4.4Å; F36-F365 HydrophobicContact CE2-CD2 4.14Å; F36-F365 AromaticContact CE2-CE2 3.89Å; F36-F365 HydrophobicContact CE2-CE2 3.89Å; F36-F365 HydrophobicContact CZ-CE2 4.14Å; M361-F365 HydrophobicContact CE-CE1 3.93Å; M361-F365 HydrophobicContact CE-CE2 4Å; M361-F365 HydrophobicContact CE-CZ 3.5Å; M361-F365 WeakPolarHBondContact O-CB 3.37Å; M361-F365 WeakPolarHBondContact O-CG 3.41Å; M361-F365 PolarHBondContact O-N 3.37Å; F365-I368 PolarHBondContact O-N 2.84Å; F365-H369 WeakPolarHBondContact O-CB 3.17Å; F365-H369 PolarHBondContact O-N 3.42Å
366	L	93	Very high	87.5	Confident	75 Å²	75	90.9 Å²	90.9	39%	0.393	49%	0.485	S	S	.	.	H	α-helix	trans	-64.9	-44.3	174.4	-174.7	134.4	0	0	0	111	L33 F37 G362 L363 V364 I368 H369 V370	L33-L366 HydrophobicContact CD2-CB 4.07Å; F37-L366 HydrophobicContact CE2-CD1 4.26Å; G362-L366 VanDerWaalsContact O-CB 3.23Å; G362-L366 WeakPolarHBondContact O-CB 3.3Å; G362-L366 PolarHBondContact O-N 2.86Å; L363-L366 PolarHBondContact O-N 2.94Å; V364-L366 VanDerWaalsContact C-N 3.28Å; V364-L366 PolarHBondContact O-N 3.08Å; L366-I368 PolarHBondContact O-N 2.8Å; L366-H369 PolarHBondContact O-N 3.41Å; L366-V370 HydrophobicContact CD2-CG2 4.49Å; L366-V370 WeakPolarHBondContact O-CB 3.5Å; L366-V370 VanDerWaalsContact O-CG2 3.27Å; L366-V370 WeakPolarHBondContact O-CG2 3.26Å; L366-V370 PolarHBondContact O-N 3.47Å
367	V	92	Very high	87	Confident	78 Å²	78	92.6 Å²	92.6	47%	0.473	49%	0.49	S	S	.	.	H	α-helix	trans	-62.1	-44.3	175.6	171.2	0	0	0	0	111.5	L363 V364 V370 K371	L363-V367 WeakPolarHBondContact O-CG2 3.4Å; L363-V367 PolarHBondContact O-N 2.81Å; V364-V367 PolarHBondContact O-N 2.95Å; V367-V370 PolarHBondContact O-N 3.07Å; V367-K371 WeakPolarHBondContact O-CB 3.4Å; V367-K371 PolarHBondContact O-N 3.1Å
368	I	89.9	Confident	86.4	Confident	85 Å²	85	92.2 Å²	92.2	44%	0.436	49%	0.488	S	S	.	.	H	α-helix	trans	-63.7	-44.6	177.4	-68.1	170	0	0	0	110.3	V364 F365 L366 V370 K371 F372	V364-I368 HydrophobicContact CG1-CD1 3.9Å; V364-I368 WeakPolarHBondContact O-CG1 3.28Å; V364-I368 PolarHBondContact O-N 2.85Å; F365-I368 PolarHBondContact O-N 2.84Å; L366-I368 PolarHBondContact O-N 2.8Å; I368-V370 VanDerWaalsContact C-N 3.34Å; I368-V370 PolarHBondContact O-N 3.43Å; I368-K371 PolarHBondContact O-N 3.49Å; I368-F372 HydrophobicContact CG2-CD2 4.14Å; I368-F372 WeakPolarHBondContact O-CB 3.28Å; I368-F372 PolarHBondContact O-N 3.01Å
369	H	88.9	Confident	85.7	Confident	87 Å²	87	96.6 Å²	96.6	40%	0.403	51%	0.51	S	S	.	.	H	α-helix	trans	-65.4	-36.7	179.1	-171.9	53.4	0	0	0	112	A29 L33 F365 L366 G373	A29-H369 HydrophobicContact CB-CB 4.37Å; L33-H369 HydrophobicContact CD1-CB 4.35Å; F365-H369 WeakPolarHBondContact O-CB 3.17Å; F365-H369 PolarHBondContact O-N 3.42Å; L366-H369 PolarHBondContact O-N 3.41Å; H369-G373 WeakPolarHBondContact O-CA 3.39Å; H369-G373 PolarHBondContact O-N 3.47Å
370	V	88.7	Confident	85	Confident	116 Å²	116	99.4 Å²	99.4	70%	0.703	53%	0.525	S	S	*	.	H	α-helix	trans	-68.2	-38	173.9	171.7	0	0	0	0	111.7	L366 V367 I368	L366-V370 HydrophobicContact CD2-CG2 4.49Å; L366-V370 WeakPolarHBondContact O-CB 3.5Å; L366-V370 VanDerWaalsContact O-CG2 3.27Å; L366-V370 WeakPolarHBondContact O-CG2 3.26Å; L366-V370 PolarHBondContact O-N 3.47Å; V367-V370 PolarHBondContact O-N 3.07Å; I368-V370 VanDerWaalsContact C-N 3.34Å; I368-V370 PolarHBondContact O-N 3.43Å
371	K	89.4	Confident	84.2	Confident	163 Å²	163	97.5 Å²	97.5	71%	0.709	52%	0.523	S	S	*	.	H	α-helix	trans	-78.4	-38	-179.2	-80	-164.6	174.5	-172.2	0	114.6	V367 I368	V367-K371 WeakPolarHBondContact O-CB 3.4Å; V367-K371 PolarHBondContact O-N 3.1Å; I368-K371 PolarHBondContact O-N 3.49Å
372	F	84.1	Confident	83.4	Confident	153 Å²	153	99.5 Å²	99.5	67%	0.671	54%	0.535	S	S	*	.	H	α-helix	trans	-124.3	-0.4	-169.1	-59.8	-78.6	0	0	0	113.1	I368 Q374	I368-F372 HydrophobicContact CG2-CD2 4.14Å; I368-F372 WeakPolarHBondContact O-CB 3.28Å; I368-F372 PolarHBondContact O-N 3.01Å; F372-Q374 PolarHBondContact O-N 2.64Å; F372-Q374 VanDerWaalsContact O-N 3.1Å
373	G	66.8	Low	82.6	Confident	34 Å²	34	107.2 Å²	107.2	35%	0.351	58%	0.576	S	S	.	*			trans	-77.5	13.7	-173	0	0	0	0	0	115.9	H369 S375	H369-G373 WeakPolarHBondContact O-CA 3.39Å; H369-G373 PolarHBondContact O-N 3.47Å; G373-S375 PolarHBondContact O-N 3.31Å
374	Q	55.7	Low	81.5	Confident	191 Å²	191	108.8 Å²	108.8	89%	0.893	59%	0.586	S	S	*	*			trans	-90.7	90	160.6	-74.3	-166.2	-18.3	0	0	109.1	F372	F372-Q374 PolarHBondContact O-N 2.64Å; F372-Q374 VanDerWaalsContact O-N 3.1Å
375	S	44.9	Very low	80.5	Confident	192 Å²	192	114 Å²	114	100%	1.343	61%	0.611	S	S	*	*			trans	-153.3	0	154.5	-73.7	0	0	0	0	109.2	G373	G373-S375 PolarHBondContact O-N 3.31Å

Retrieved 375 of 375 residues in 680.1 ms (Link to these results)

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