A0A087XWA3_POEFO Loading...

Cell cycle control protein

AlphaFold DB , UniProt , Accession A0A087XWA3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 339 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	39.3	Very low	57.4	Low	247 Å²	247	169.2 Å²	169.2	100%	1.217	86%	0.86	S	S	*	*				0	110.7	0	-83.8	171.6	167	0	0	107.1
2	V	41.3	Very low	59.3	Low	142 Å²	142	166.1 Å²	166.1	86%	0.861	83%	0.83	S	S	*	*			trans	-69.5	133.3	-176.1	177.3	0	0	0	0	108.1	E4	V2-E4 PolarHBondContact O-N 3.38Å
3	K	46.5	Very low	61.2	Low	204 Å²	204	160.6 Å²	160.6	89%	0.887	81%	0.813	S	S	*	*			trans	-75	106.9	175.2	-143.2	-179.7	-175.5	-174.3	0	106.2	E5	K3-E5 PolarHBondContact O-N 3.21Å
4	E	51.2	Low	63.1	Low	184 Å²	184	157.4 Å²	157.4	86%	0.86	80%	0.799	S	S	*	*			trans	-64.2	118.6	171.6	-77.7	177.6	157.7	0	0	108.9	V2 Q6	V2-E4 PolarHBondContact O-N 3.38Å; E4-Q6 PolarHBondContact O-N 3.35Å
5	E	54.3	Low	64.8	Low	198 Å²	198	154.1 Å²	154.1	93%	0.925	79%	0.785	S	S	*	*			trans	-74.2	114.6	166.7	-83.3	178.1	152.5	0	0	108.4	K3	K3-E5 PolarHBondContact O-N 3.21Å
6	Q	57.9	Low	66.4	Low	148 Å²	148	148.8 Å²	148.8	69%	0.692	76%	0.762	S	S	*	*			trans	-72.8	131.8	173.2	-78	-174.5	-30.1	0	0	110.3	E4 E8	E4-Q6 PolarHBondContact O-N 3.35Å; Q6-E8 PolarHBondContact O-N 2.97Å
7	E	60.4	Low	67.8	Low	193 Å²	193	143.2 Å²	143.2	90%	0.902	74%	0.743	S	S	*	*			trans	-54.4	122.7	171.7	-73.7	179.9	149.3	0	0	111.6	S9	E7-S9 PolarHBondContact O-N 3.45Å
8	E	60.4	Low	69.2	Low	190 Å²	190	143.9 Å²	143.9	89%	0.888	74%	0.74	S	S	*	*			trans	-76.9	108	176.5	-83.7	-174.5	150.4	0	0	111.3	Q6	Q6-E8 PolarHBondContact O-N 2.97Å
9	S	66.3	Low	70.3	Confident	77 Å²	77	139.6 Å²	139.6	54%	0.538	72%	0.721	S	S	.	*			trans	-74.5	128.7	170.1	73.4	0	0	0	0	111	E7 N11 R12	E7-S9 PolarHBondContact O-N 3.45Å; S9-N11 PolarHBondContact O-N 3.35Å; S9-R12 WeakPolarHBondContact O-CB 3.18Å; S9-R12 PolarHBondContact O-N 3.41Å
10	S	71.8	Confident	71.5	Confident	123 Å²	123	135.8 Å²	135.8	86%	0.86	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.5	-18.5	-176.9	174.3	0	0	0	0	116.8
11	N	81.8	Confident	72.5	Confident	155 Å²	155	137.9 Å²	137.9	83%	0.829	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	14.9	-179.2	-69.1	-25.5	0	0	0	113	S9 P13	S9-N11 PolarHBondContact O-N 3.35Å; N11-P13 WeakPolarHBondContact O-CD 3.46Å
12	R	79.9	Confident	75.1	Confident	132 Å²	132	134.2 Å²	134.2	50%	0.498	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-73.7	125.6	177.3	-166.1	171.5	-178	173.6	0.4	108.9	S9	S9-R12 WeakPolarHBondContact O-CB 3.18Å; S9-R12 PolarHBondContact O-N 3.41Å
13	P	84.4	Confident	77.7	Confident	95 Å²	95	132.3 Å²	132.3	62%	0.617	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-59.2	143.2	172.4	-19.5	30.5	0	0	0	110.1	N11 N15	N11-P13 WeakPolarHBondContact O-CD 3.46Å; P13-N15 PolarHBondContact O-N 3.03Å
14	D	88.1	Confident	79.9	Confident	115 Å²	115	128.8 Å²	128.8	62%	0.615	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-49.7	129.8	174.5	-76.6	-14.3	0	0	0	110.3	T16 T19 Q20	D14-T16 VanDerWaalsContact C-N 3.32Å; D14-T16 PolarHBondContact O-N 3.45Å; D14-T19 HydrophobicContact CB-CG2 4.04Å; D14-T19 PolarHBondContact O-OG1 2.98Å; D14-Q20 PolarHBondContact O-NE2 3.22Å
15	N	88	Confident	82	Confident	109 Å²	109	123.5 Å²	123.5	58%	0.583	65%	0.65	S	S	*	*			trans	-98.9	54.5	179.9	-169.6	19.3	0	0	0	110.2	P13	P13-N15 PolarHBondContact O-N 3.03Å
16	T	91	Very high	83.8	Confident	69 Å²	69	124.9 Å²	124.9	42%	0.423	65%	0.646	S	S	.	*			trans	-99.5	152.7	176.1	65.6	0	0	0	0	110.6	D14 F18 T19 Q20	D14-T16 VanDerWaalsContact C-N 3.32Å; D14-T16 PolarHBondContact O-N 3.45Å; T16-F18 PolarHBondContact O-N 2.96Å; T16-F18 VanDerWaalsContact O-N 3.1Å; T16-T19 PolarHBondContact N-OG1 3.45Å; T16-T19 VanDerWaalsContact N-OG1 3.1Å; T16-T19 PolarHBondContact O-N 3.47Å; T16-T19 PolarHBondContact O-OG1 3.19Å; T16-T19 VanDerWaalsContact O-OG1 3.07Å; T16-T19 WeakPolarHBondContact OG1-CG2 3.32Å; T16-T19 PolarHBondContact OG1-N 3.43Å; T16-T19 PolarHBondContact OG1-OG1 2.95Å; T16-Q20 WeakPolarHBondContact O-CB 3.31Å; T16-Q20 WeakPolarHBondContact O-CG 2.99Å; T16-Q20 PolarHBondContact O-N 3.34Å
17	A	90.3	Very high	85.4	Confident	53 Å²	53	125.8 Å²	125.8	44%	0.438	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.6	-30.2	179.3	0	0	0	0	0	112.9	Q21 R22 L23	A17-Q21 PolarHBondContact O-N 2.97Å; A17-R22 CarbonylContact O-C 3.52Å; A17-R22 PolarHBondContact O-N 3.22Å; A17-L23 HydrophobicContact CB-CD2 4.26Å; A17-L23 PolarHBondContact O-N 3.3Å
18	F	92.2	Very high	86.8	Confident	156 Å²	156	119.8 Å²	119.8	68%	0.684	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	-55.6	175.3	-178.8	-102	0	0	0	112.3	T16 Q20 Q21 L23	T16-F18 PolarHBondContact O-N 2.96Å; T16-F18 VanDerWaalsContact O-N 3.1Å; F18-Q20 VanDerWaalsContact C-N 3.27Å; F18-Q20 PolarHBondContact O-N 3.44Å; F18-Q21 PolarHBondContact O-N 3.44Å; F18-Q21 VanDerWaalsContact O-N 3.1Å; F18-L23 HydrophobicContact CD2-CD1 4.15Å
19	T	90.8	Very high	88.3	Confident	63 Å²	63	117.7 Å²	117.7	39%	0.387	62%	0.622	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.5	-28.9	-176.7	50.5	0	0	0	0	112.9	D14 T16	D14-T19 HydrophobicContact CB-CG2 4.04Å; D14-T19 PolarHBondContact O-OG1 2.98Å; T16-T19 PolarHBondContact N-OG1 3.45Å; T16-T19 VanDerWaalsContact N-OG1 3.1Å; T16-T19 PolarHBondContact O-N 3.47Å; T16-T19 PolarHBondContact O-OG1 3.19Å; T16-T19 VanDerWaalsContact O-OG1 3.07Å; T16-T19 WeakPolarHBondContact OG1-CG2 3.32Å; T16-T19 PolarHBondContact OG1-N 3.43Å; T16-T19 PolarHBondContact OG1-OG1 2.95Å
20	Q	93.6	Very high	89.6	Confident	63 Å²	63	120.4 Å²	120.4	29%	0.294	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	1.8	177.1	-60.4	-64.1	-39.7	0	0	113.7	D14 T16 F18 R22	D14-Q20 PolarHBondContact O-NE2 3.22Å; T16-Q20 WeakPolarHBondContact O-CB 3.31Å; T16-Q20 WeakPolarHBondContact O-CG 2.99Å; T16-Q20 PolarHBondContact O-N 3.34Å; F18-Q20 VanDerWaalsContact C-N 3.27Å; F18-Q20 PolarHBondContact O-N 3.44Å; Q20-R22 VanDerWaalsContact C-N 3.28Å; Q20-R22 HydrophobicContact CB-CG 4.15Å; Q20-R22 WeakPolarHBondContact O-CG 3.31Å; Q20-R22 PolarHBondContact O-N 2.97Å
21	Q	92.8	Very high	90.6	Very high	180 Å²	180	116.8 Å²	116.8	84%	0.841	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.4	36.2	-179.2	-53.6	-180	21.7	0	0	114.1	A17 F18	A17-Q21 PolarHBondContact O-N 2.97Å; F18-Q21 PolarHBondContact O-N 3.44Å; F18-Q21 VanDerWaalsContact O-N 3.1Å
22	R	94	Very high	91	Very high	170 Å²	170	111.1 Å²	111.1	64%	0.642	58%	0.579	S	S	*	*			trans	-111.2	29.4	178.6	-50.7	-176.9	-155.6	166	10.2	111.8	A17 Q20	A17-R22 CarbonylContact O-C 3.52Å; A17-R22 PolarHBondContact O-N 3.22Å; Q20-R22 VanDerWaalsContact C-N 3.28Å; Q20-R22 HydrophobicContact CB-CG 4.15Å; Q20-R22 WeakPolarHBondContact O-CG 3.31Å; Q20-R22 PolarHBondContact O-N 2.97Å
23	L	95.1	Very high	91.4	Very high	101 Å²	101	108.6 Å²	108.6	53%	0.529	58%	0.581	S	S	.	*			trans	-59.4	140.6	172.7	-73.6	177.4	0	0	0	109.4	A17 F18 A25	A17-L23 HydrophobicContact CB-CD2 4.26Å; A17-L23 PolarHBondContact O-N 3.3Å; F18-L23 HydrophobicContact CD2-CD1 4.15Å; L23-A25 PolarHBondContact O-N 3.38Å; L23-A25 VanDerWaalsContact O-N 3.09Å
24	P	94.3	Very high	91.9	Very high	130 Å²	130	108.5 Å²	108.5	84%	0.844	58%	0.575	S	S	*	*			trans	-60	118.6	172	26.1	-32.7	0	0	0	108.4
25	A	93.7	Very high	92.2	Very high	74 Å²	74	104.2 Å²	104.2	61%	0.612	55%	0.553	S	S	*	*			trans	-127	140.2	-177.6	0	0	0	0	0	110	L23 Q27	L23-A25 PolarHBondContact O-N 3.38Å; L23-A25 VanDerWaalsContact O-N 3.09Å; A25-Q27 HydrophobicContact CB-CG 4.44Å
26	W	93.4	Very high	92.6	Very high	227 Å²	227	100 Å²	100	86%	0.86	53%	0.53	S	S	*	.			trans	-87.1	117.2	167.6	179.1	48	0	0	0	108.8	P28	W26-P28 VanDerWaalsContact C-CD 3.45Å; W26-P28 HydrophobicContact CD2-CB 4.41Å; W26-P28 HydrophobicContact CD2-CG 4.02Å; W26-P28 HydrophobicContact CE3-CG 4.19Å; W26-P28 HydrophobicContact CH2-CB 4.25Å; W26-P28 HydrophobicContact CH2-CG 4.04Å; W26-P28 HydrophobicContact CZ2-CB 3.66Å; W26-P28 HydrophobicContact CZ2-CG 3.86Å; W26-P28 HydrophobicContact CZ3-CG 4.19Å; W26-P28 VanDerWaalsContact O-CD 3.24Å; W26-P28 WeakPolarHBondContact O-CD 3.49Å
27	Q	91.2	Very high	92.8	Very high	166 Å²	166	99.3 Å²	99.3	78%	0.776	53%	0.527	S	S	*	.			trans	-115.9	75.5	-178.9	-66.1	-179.3	-30.5	0	0	109.9	A25 I29	A25-Q27 HydrophobicContact CB-CG 4.44Å; Q27-I29 PolarHBondContact O-N 3.28Å
28	P	90.4	Very high	93.1	Very high	67 Å²	67	101.6 Å²	101.6	44%	0.435	53%	0.529	S	S	.	.			trans	-68.3	118	-178.6	26.9	-32.2	0	0	0	110.7	W26	W26-P28 VanDerWaalsContact C-CD 3.45Å; W26-P28 HydrophobicContact CD2-CB 4.41Å; W26-P28 HydrophobicContact CD2-CG 4.02Å; W26-P28 HydrophobicContact CE3-CG 4.19Å; W26-P28 HydrophobicContact CH2-CB 4.25Å; W26-P28 HydrophobicContact CH2-CG 4.04Å; W26-P28 HydrophobicContact CZ2-CB 3.66Å; W26-P28 HydrophobicContact CZ2-CG 3.86Å; W26-P28 HydrophobicContact CZ3-CG 4.19Å; W26-P28 VanDerWaalsContact O-CD 3.24Å; W26-P28 WeakPolarHBondContact O-CD 3.49Å
29	I	92.3	Very high	93.3	Very high	147 Å²	147	97.3 Å²	97.3	75%	0.754	51%	0.511	S	S	*	.			trans	-89.4	112.9	170.9	-56.5	173.3	0	0	0	107.4	Q27 S31	Q27-I29 PolarHBondContact O-N 3.28Å; I29-S31 VanDerWaalsContact C-N 3.33Å; I29-S31 PolarHBondContact O-N 2.9Å
30	L	92.8	Very high	93.7	Very high	133 Å²	133	98.5 Å²	98.5	70%	0.696	51%	0.514	S	S	*	.			trans	-74.8	84	-179.7	-65.7	176	0	0	0	110.6	V35	L30-V35 HydrophobicContact CB-CG2 3.91Å; L30-V35 HydrophobicContact CD2-CG2 4.35Å
31	S	91.5	Very high	93.8	Very high	48 Å²	48	101.4 Å²	101.4	34%	0.336	53%	0.531	S	S	.	.			trans	-83.4	157.5	174.8	68.9	0	0	0	0	111.9	I29 S33 I34 V35	I29-S31 VanDerWaalsContact C-N 3.33Å; I29-S31 PolarHBondContact O-N 2.9Å; S31-S33 PolarHBondContact O-N 3.42Å; S31-I34 PolarHBondContact O-N 2.87Å; S31-V35 WeakPolarHBondContact O-CG2 3.31Å; S31-V35 PolarHBondContact O-N 2.89Å
32	A	91	Very high	94.1	Very high	35 Å²	35	95.9 Å²	95.9	29%	0.289	51%	0.507	S	S	.	.	H	α-helix	trans	-55.6	-37.4	178.4	0	0	0	0	0	112.6	I34 V35 I36 Y330	A32-I34 PolarHBondContact O-N 3.44Å; A32-V35 PolarHBondContact O-N 2.83Å; A32-I36 HydrophobicContact CB-CD1 4.01Å; A32-I36 WeakPolarHBondContact O-CB 3.33Å; A32-I36 WeakPolarHBondContact O-CD1 3.27Å; A32-I36 VanDerWaalsContact O-CG1 3.26Å; A32-I36 WeakPolarHBondContact O-CG1 3.44Å; A32-I36 PolarHBondContact O-N 3.45Å; A32-Y330 HydrophobicContact CB-CD2 3.41Å; A32-Y330 VanDerWaalsContact CB-CD2 3.41Å; A32-Y330 HydrophobicContact CB-CE2 3.84Å; A32-Y330 HydrophobicContact CB-CG 3.9Å
33	S	89.1	Confident	94.3	Very high	79 Å²	79	87.8 Å²	87.8	55%	0.552	48%	0.476	S	S	*	.	H	α-helix	trans	-62.9	-20.6	177.2	-51.7	0	0	0	0	114	S31 P37	S31-S33 PolarHBondContact O-N 3.42Å; S33-P37 WeakPolarHBondContact O-CD 3.36Å; S33-P37 WeakPolarHBondContact O-CG 3.42Å
34	I	93.3	Very high	94.4	Very high	93 Å²	93	85.8 Å²	85.8	48%	0.477	47%	0.474	S	S	.	.	H	α-helix	trans	-97.8	-46	176.6	-61.7	171.1	0	0	0	110.1	S31 A32 P37 M38	S31-I34 PolarHBondContact O-N 2.87Å; A32-I34 PolarHBondContact O-N 3.44Å; I34-P37 WeakPolarHBondContact O-CD 3.4Å; I34-P37 WeakPolarHBondContact O-CG 3.29Å; I34-M38 VanDerWaalsContact O-CB 3.26Å; I34-M38 WeakPolarHBondContact O-CB 3.5Å; I34-M38 PolarHBondContact O-N 3Å
35	V	95.3	Very high	94.6	Very high	26 Å²	26	82.2 Å²	82.2	16%	0.158	46%	0.456	C	S	.	.	H	α-helix	trans	-69.7	-43.7	-173	178.2	0	0	0	0	112	L30 S31 A32 M38 F39 M326	L30-V35 HydrophobicContact CB-CG2 3.91Å; L30-V35 HydrophobicContact CD2-CG2 4.35Å; S31-V35 WeakPolarHBondContact O-CG2 3.31Å; S31-V35 PolarHBondContact O-N 2.89Å; A32-V35 PolarHBondContact O-N 2.83Å; V35-M38 WeakPolarHBondContact O-CB 3.23Å; V35-M38 PolarHBondContact O-N 2.93Å; V35-F39 HydrophobicContact CG1-CD2 3.55Å; V35-F39 HydrophobicContact CG1-CE2 3.61Å; V35-F39 WeakPolarHBondContact O-CD2 3.47Å; V35-F39 PolarHBondContact O-N 3.41Å; V35-M326 HydrophobicContact CG1-SD 3.94Å
36	I	95.6	Very high	94.8	Very high	19 Å²	19	82.2 Å²	82.2	10%	0.097	44%	0.442	C	S	.	.	H	α-helix	trans	-58.7	-54	-178.5	-65.9	167.2	0	0	0	112.3	A32 M38 F39 L40 S323 M326 L327 Y330	A32-I36 HydrophobicContact CB-CD1 4.01Å; A32-I36 WeakPolarHBondContact O-CB 3.33Å; A32-I36 WeakPolarHBondContact O-CD1 3.27Å; A32-I36 VanDerWaalsContact O-CG1 3.26Å; A32-I36 WeakPolarHBondContact O-CG1 3.44Å; A32-I36 PolarHBondContact O-N 3.45Å; I36-M38 VanDerWaalsContact C-N 3.31Å; I36-M38 PolarHBondContact O-N 3.27Å; I36-F39 PolarHBondContact O-N 2.89Å; I36-L40 PolarHBondContact O-N 2.91Å; I36-L40 VanDerWaalsContact O-N 3.09Å; I36-S323 WeakPolarHBondContact CG2-OG 3.44Å; I36-S323 PolarHBondContact O-OG 3.19Å; I36-M326 HydrophobicContact CD1-CB 4.35Å; I36-M326 HydrophobicContact CG1-CB 3.85Å; I36-L327 HydrophobicContact CD1-CB 4.39Å; I36-L327 HydrophobicContact CD1-CD1 4.29Å; I36-L327 HydrophobicContact CG2-CB 4.29Å; I36-L327 HydrophobicContact CG2-CD1 4.4Å; I36-Y330 HydrophobicContact CD1-CD1 4.46Å; I36-Y330 HydrophobicContact CD1-CG 4.32Å
37	P	96.4	Very high	95.1	Very high	56 Å²	56	73.9 Å²	73.9	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-66.2	-33.4	177.7	24.5	-32.8	0	0	0	112.1	S33 I34 L40 L41	S33-P37 WeakPolarHBondContact O-CD 3.36Å; S33-P37 WeakPolarHBondContact O-CG 3.42Å; I34-P37 WeakPolarHBondContact O-CD 3.4Å; I34-P37 WeakPolarHBondContact O-CG 3.29Å; P37-L40 PolarHBondContact O-N 3.19Å; P37-L41 WeakPolarHBondContact O-CB 3.35Å; P37-L41 VanDerWaalsContact O-CG 3.25Å; P37-L41 WeakPolarHBondContact O-CG 3.29Å; P37-L41 PolarHBondContact O-N 3.44Å
38	M	96	Very high	95.4	Very high	100 Å²	100	68 Å²	68	49%	0.493	40%	0.398	S	S	.	.	H	α-helix	trans	-60.2	-48.8	175	-176	-173.2	-165	0	0	111.7	I34 V35 I36 L40 L41 I42	I34-M38 VanDerWaalsContact O-CB 3.26Å; I34-M38 WeakPolarHBondContact O-CB 3.5Å; I34-M38 PolarHBondContact O-N 3Å; V35-M38 WeakPolarHBondContact O-CB 3.23Å; V35-M38 PolarHBondContact O-N 2.93Å; I36-M38 VanDerWaalsContact C-N 3.31Å; I36-M38 PolarHBondContact O-N 3.27Å; M38-L40 VanDerWaalsContact C-N 3.31Å; M38-L40 PolarHBondContact O-N 3.49Å; M38-L41 PolarHBondContact O-N 3.01Å; M38-I42 HydrophobicContact CE-CD1 4.03Å; M38-I42 HydrophobicContact CG-CD1 3.77Å; M38-I42 WeakPolarHBondContact O-CB 3.41Å; M38-I42 VanDerWaalsContact O-CG1 3.3Å; M38-I42 WeakPolarHBondContact O-CG1 3.42Å; M38-I42 PolarHBondContact O-N 3.45Å
39	F	97.3	Very high	95.8	Very high	67 Å²	67	68 Å²	68	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-62.1	-38.6	176.9	-93.2	-101.6	0	0	0	112.2	V35 I36 G43 C319 M322 M326	V35-F39 HydrophobicContact CG1-CD2 3.55Å; V35-F39 HydrophobicContact CG1-CE2 3.61Å; V35-F39 WeakPolarHBondContact O-CD2 3.47Å; V35-F39 PolarHBondContact O-N 3.41Å; I36-F39 PolarHBondContact O-N 2.89Å; F39-G43 PolarHBondContact O-N 2.79Å; F39-C319 HydrophobicContact CD1-CB 4.23Å; F39-M322 HydrophobicContact CD1-CB 4.33Å; F39-M326 HydrophobicContact CE2-CE 4.43Å; F39-M326 HydrophobicContact CZ-CE 4.35Å
40	L	97.6	Very high	96	Very high	87 Å²	87	61 Å²	61	46%	0.455	36%	0.361	S	S	.	.	H	α-helix	trans	-64.7	-46.3	176.8	-169.6	75.1	0	0	0	111.6	I36 P37 M38 G43 A44 V320	I36-L40 PolarHBondContact O-N 2.91Å; I36-L40 VanDerWaalsContact O-N 3.09Å; P37-L40 PolarHBondContact O-N 3.19Å; M38-L40 VanDerWaalsContact C-N 3.31Å; M38-L40 PolarHBondContact O-N 3.49Å; L40-G43 PolarHBondContact O-N 3.24Å; L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 3.43Å; L40-V320 HydrophobicContact CD1-CG1 4.33Å
41	L	97.8	Very high	96.3	Very high	124 Å²	124	57.7 Å²	57.7	65%	0.649	35%	0.346	S	S	*	.	H	α-helix	trans	-66	-45.7	-179.7	-72.3	172.9	0	0	0	111.9	P37 M38 G43 A44 A45	P37-L41 WeakPolarHBondContact O-CB 3.35Å; P37-L41 VanDerWaalsContact O-CG 3.25Å; P37-L41 WeakPolarHBondContact O-CG 3.29Å; P37-L41 PolarHBondContact O-N 3.44Å; M38-L41 PolarHBondContact O-N 3.01Å; L41-G43 VanDerWaalsContact C-N 3.33Å; L41-A44 PolarHBondContact O-N 2.94Å; L41-A45 WeakPolarHBondContact O-CB 3.48Å; L41-A45 PolarHBondContact O-N 3.06Å
42	I	97.8	Very high	96.5	Very high	65 Å²	65	58 Å²	58	33%	0.333	35%	0.351	S	S	.	.	H	α-helix	trans	-62.5	-44.3	175.8	-67.6	171.1	0	0	0	110	M38 A45 F46	M38-I42 HydrophobicContact CE-CD1 4.03Å; M38-I42 HydrophobicContact CG-CD1 3.77Å; M38-I42 WeakPolarHBondContact O-CB 3.41Å; M38-I42 VanDerWaalsContact O-CG1 3.3Å; M38-I42 WeakPolarHBondContact O-CG1 3.42Å; M38-I42 PolarHBondContact O-N 3.45Å; I42-A45 PolarHBondContact O-N 3.4Å; I42-F46 HydrophobicContact CG2-CD1 4.21Å; I42-F46 HydrophobicContact CG2-CD2 4.42Å; I42-F46 HydrophobicContact CG2-CE1 4.05Å; I42-F46 HydrophobicContact CG2-CE2 4.26Å; I42-F46 HydrophobicContact CG2-CG 4.4Å; I42-F46 HydrophobicContact CG2-CZ 4.08Å; I42-F46 WeakPolarHBondContact O-CB 3.34Å; I42-F46 WeakPolarHBondContact O-CD1 3.22Å; I42-F46 WeakPolarHBondContact O-CG 3.31Å; I42-F46 PolarHBondContact O-N 3.19Å
43	G	98.4	Very high	96.8	Very high	0 Å²	0	57 Å²	57	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-59.3	-49	177.6	0	0	0	0	0	112.7	F39 L40 L41 A45 F46 I47 G316	F39-G43 PolarHBondContact O-N 2.79Å; L40-G43 PolarHBondContact O-N 3.24Å; L41-G43 VanDerWaalsContact C-N 3.33Å; G43-A45 PolarHBondContact O-N 3.43Å; G43-F46 PolarHBondContact O-N 2.9Å; G43-I47 VanDerWaalsContact O-CG1 3.29Å; G43-I47 WeakPolarHBondContact O-CG1 3.39Å; G43-I47 PolarHBondContact O-N 2.9Å; G43-G316 WeakPolarHBondContact CA-O 3.29Å
44	A	97.9	Very high	97.1	Very high	58 Å²	58	55.5 Å²	55.5	48%	0.479	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-42.9	177.2	0	0	0	0	0	112.3	L40 L41 I47 G48	L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 3.43Å; L41-A44 PolarHBondContact O-N 2.94Å; A44-I47 PolarHBondContact O-N 2.96Å; A44-G48 PolarHBondContact O-N 3.27Å
45	A	98.3	Very high	97.2	Very high	56 Å²	56	55.4 Å²	55.4	46%	0.463	32%	0.324	S	S	.	.	H	α-helix	trans	-62.7	-44.1	176.3	0	0	0	0	0	111.8	L41 I42 G43 G48 V49	L41-A45 WeakPolarHBondContact O-CB 3.48Å; L41-A45 PolarHBondContact O-N 3.06Å; I42-A45 PolarHBondContact O-N 3.4Å; G43-A45 PolarHBondContact O-N 3.43Å; A45-G48 PolarHBondContact O-N 3.38Å; A45-V49 WeakPolarHBondContact O-CG2 3.26Å; A45-V49 PolarHBondContact O-N 3.43Å
46	F	98.5	Very high	97.2	Very high	73 Å²	73	56 Å²	56	32%	0.32	33%	0.327	S	S	.	.	H	α-helix	trans	-66.1	-38.7	179.1	-82.7	20.6	0	0	0	112.2	I42 G43 G50 Y312 V315	I42-F46 HydrophobicContact CG2-CD1 4.21Å; I42-F46 HydrophobicContact CG2-CD2 4.42Å; I42-F46 HydrophobicContact CG2-CE1 4.05Å; I42-F46 HydrophobicContact CG2-CE2 4.26Å; I42-F46 HydrophobicContact CG2-CG 4.4Å; I42-F46 HydrophobicContact CG2-CZ 4.08Å; I42-F46 WeakPolarHBondContact O-CB 3.34Å; I42-F46 WeakPolarHBondContact O-CD1 3.22Å; I42-F46 WeakPolarHBondContact O-CG 3.31Å; I42-F46 PolarHBondContact O-N 3.19Å; G43-F46 PolarHBondContact O-N 2.9Å; F46-G50 WeakPolarHBondContact O-CA 3.43Å; F46-G50 PolarHBondContact O-N 3.39Å; F46-Y312 HydrophobicContact CB-CD1 4.21Å; F46-Y312 HydrophobicContact CD1-CD1 4.24Å; F46-Y312 HydrophobicContact CD1-CE1 4.21Å; F46-Y312 HydrophobicContact CD2-CD1 4.36Å; F46-Y312 HydrophobicContact CE1-CE1 4.33Å; F46-Y312 HydrophobicContact CG-CD1 4.02Å; F46-Y312 HydrophobicContact CG-CE1 4.38Å; F46-V315 HydrophobicContact CD2-CB 4.44Å; F46-V315 HydrophobicContact CD2-CG1 3.95Å; F46-V315 HydrophobicContact CE2-CG1 4.08Å
47	I	98.5	Very high	97.2	Very high	52 Å²	52	55 Å²	55	27%	0.267	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-47.7	173.2	-68.1	165.8	0	0	0	110.1	G43 A44 V49 G50 V51 V320	G43-I47 VanDerWaalsContact O-CG1 3.29Å; G43-I47 WeakPolarHBondContact O-CG1 3.39Å; G43-I47 PolarHBondContact O-N 2.9Å; A44-I47 PolarHBondContact O-N 2.96Å; I47-V49 PolarHBondContact O-N 2.96Å; I47-G50 PolarHBondContact O-N 3.22Å; I47-V51 HydrophobicContact CG2-CG2 4.36Å; I47-V51 WeakPolarHBondContact O-CG2 3.46Å; I47-V51 PolarHBondContact O-N 2.93Å; I47-V320 HydrophobicContact CD1-CG2 4.09Å
48	G	98.2	Very high	97	Very high	44 Å²	44	59.7 Å²	59.7	45%	0.454	33%	0.333	S	S	.	.	H	α-helix	trans	-58.6	-48.5	178.9	0	0	0	0	0	112.8	A44 A45 A52	A44-G48 PolarHBondContact O-N 3.27Å; A45-G48 PolarHBondContact O-N 3.38Å; G48-A52 PolarHBondContact O-N 3.49Å; G48-A52 VanDerWaalsContact O-N 3.16Å
49	V	97.8	Very high	96.9	Very high	66 Å²	66	60.3 Å²	60.3	40%	0.4	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-47.9	174.6	172.7	0	0	0	0	110.5	A45 I47 V51 A52 L53 Y312	A45-V49 WeakPolarHBondContact O-CG2 3.26Å; A45-V49 PolarHBondContact O-N 3.43Å; I47-V49 PolarHBondContact O-N 2.96Å; V49-V51 VanDerWaalsContact C-N 3.34Å; V49-V51 PolarHBondContact O-N 3.35Å; V49-A52 PolarHBondContact O-N 3.26Å; V49-A52 VanDerWaalsContact O-N 3.14Å; V49-L53 HydrophobicContact CG1-CD1 3.86Å; V49-L53 HydrophobicContact CG1-CG 4.05Å; V49-L53 VanDerWaalsContact O-CG 3.29Å; V49-L53 WeakPolarHBondContact O-CG 3.5Å; V49-L53 PolarHBondContact O-N 2.91Å; V49-Y312 HydrophobicContact CB-CD1 4.26Å; V49-Y312 HydrophobicContact CG1-CD1 3.98Å; V49-Y312 HydrophobicContact CG1-CE1 4.03Å
50	G	98	Very high	96.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-59.1	-41.8	-178.3	0	0	0	0	0	113.3	F46 I47 L53 F54 G309	F46-G50 WeakPolarHBondContact O-CA 3.43Å; F46-G50 PolarHBondContact O-N 3.39Å; I47-G50 PolarHBondContact O-N 3.22Å; G50-L53 PolarHBondContact O-N 3.27Å; G50-F54 VanDerWaalsContact O-CB 3.25Å; G50-F54 WeakPolarHBondContact O-CB 3.3Å; G50-F54 PolarHBondContact O-N 3.21Å; G50-G309 WeakPolarHBondContact O-CA 3.39Å
51	V	97.7	Very high	96.6	Very high	64 Å²	64	55.4 Å²	55.4	39%	0.388	31%	0.314	S	S	.	.	H	α-helix	trans	-63.4	-46.2	174.3	171.4	0	0	0	0	111	I47 V49 L53 F54 I55 I313	I47-V51 HydrophobicContact CG2-CG2 4.36Å; I47-V51 WeakPolarHBondContact O-CG2 3.46Å; I47-V51 PolarHBondContact O-N 2.93Å; V49-V51 VanDerWaalsContact C-N 3.34Å; V49-V51 PolarHBondContact O-N 3.35Å; V51-L53 PolarHBondContact O-N 2.83Å; V51-F54 PolarHBondContact O-N 3.23Å; V51-I55 HydrophobicContact CG1-CD1 3.81Å; V51-I55 HydrophobicContact CG1-CG1 4.46Å; V51-I55 WeakPolarHBondContact O-CG1 3.43Å; V51-I55 PolarHBondContact O-N 3.42Å; V51-I313 HydrophobicContact CG2-CD1 4.11Å; V51-I313 HydrophobicContact CG2-CG1 4.32Å
52	A	96.4	Very high	96.4	Very high	53 Å²	53	52.3 Å²	52.3	44%	0.438	30%	0.298	S	S	.	.	H	α-helix	trans	-61	-43.3	178.2	0	0	0	0	0	112.2	G48 V49 T56	G48-A52 PolarHBondContact O-N 3.49Å; G48-A52 VanDerWaalsContact O-N 3.16Å; V49-A52 PolarHBondContact O-N 3.26Å; V49-A52 VanDerWaalsContact O-N 3.14Å; A52-T56 WeakPolarHBondContact O-CB 3.44Å; A52-T56 PolarHBondContact O-N 2.86Å; A52-T56 PolarHBondContact O-OG1 3.42Å
53	L	96.4	Very high	96.3	Very high	14 Å²	14	51.9 Å²	51.9	7%	0.073	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-41.8	176.3	-65.5	-176.2	0	0	0	111.8	V49 G50 V51 T56 S57 W300 M301 L308 Y312	V49-L53 HydrophobicContact CG1-CD1 3.86Å; V49-L53 HydrophobicContact CG1-CG 4.05Å; V49-L53 VanDerWaalsContact O-CG 3.29Å; V49-L53 WeakPolarHBondContact O-CG 3.5Å; V49-L53 PolarHBondContact O-N 2.91Å; G50-L53 PolarHBondContact O-N 3.27Å; V51-L53 PolarHBondContact O-N 2.83Å; L53-T56 PolarHBondContact O-N 3.4Å; L53-S57 WeakPolarHBondContact O-CB 3.38Å; L53-S57 PolarHBondContact O-N 2.89Å; L53-W300 HydrophobicContact CD2-CH2 3.89Å; L53-W300 HydrophobicContact CD2-CZ2 3.74Å; L53-M301 HydrophobicContact CB-CE 4.29Å; L53-M301 HydrophobicContact CD1-SD 4.43Å; L53-M301 HydrophobicContact CD2-CE 4.21Å; L53-M301 HydrophobicContact CD2-SD 3.67Å; L53-M301 HydrophobicContact CG-SD 4.4Å; L53-L308 HydrophobicContact CD1-CD2 3.94Å; L53-L308 HydrophobicContact CD1-CG 3.99Å; L53-Y312 HydrophobicContact CD1-CD2 4.27Å; L53-Y312 HydrophobicContact CD1-CE2 4.45Å
54	F	96.6	Very high	96.2	Very high	48 Å²	48	56.1 Å²	56.1	21%	0.211	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-44.9	179.9	-175.3	-102.9	0	0	0	112.3	G50 V51 S57 R58 D306 I310 I313	G50-F54 VanDerWaalsContact O-CB 3.25Å; G50-F54 WeakPolarHBondContact O-CB 3.3Å; G50-F54 PolarHBondContact O-N 3.21Å; V51-F54 PolarHBondContact O-N 3.23Å; F54-S57 PolarHBondContact O-N 2.93Å; F54-R58 HydrophobicContact CE1-CG 4.46Å; F54-R58 VanDerWaalsContact CZ-CZ 3.41Å; F54-R58 PolarHBondContact O-N 3.34Å; F54-D306 HydrophobicContact CD2-CB 4.16Å; F54-D306 HydrophobicContact CE2-CB 4Å; F54-I310 HydrophobicContact CD2-CG1 4.04Å; F54-I310 HydrophobicContact CE2-CD1 4.2Å; F54-I310 HydrophobicContact CE2-CG1 3.93Å; F54-I313 HydrophobicContact CB-CD1 4.48Å
55	I	95.6	Very high	96.1	Very high	92 Å²	92	54.6 Å²	54.6	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-61.8	-48.9	175.5	-66.8	168.6	0	0	0	110	V51 S57 R58 D59	V51-I55 HydrophobicContact CG1-CD1 3.81Å; V51-I55 HydrophobicContact CG1-CG1 4.46Å; V51-I55 WeakPolarHBondContact O-CG1 3.43Å; V51-I55 PolarHBondContact O-N 3.42Å; I55-S57 PolarHBondContact O-N 2.89Å; I55-R58 PolarHBondContact O-N 2.89Å; I55-D59 PolarHBondContact O-N 3.07Å
56	T	94.6	Very high	96.1	Very high	37 Å²	37	55 Å²	55	23%	0.227	29%	0.292	C	S	.	.	H	α-helix	trans	-57.2	-38.7	178.8	-56.2	0	0	0	0	111.9	A52 L53	A52-T56 WeakPolarHBondContact O-CB 3.44Å; A52-T56 PolarHBondContact O-N 2.86Å; A52-T56 PolarHBondContact O-OG1 3.42Å; L53-T56 PolarHBondContact O-N 3.4Å
57	S	94.9	Very high	95.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-68.3	-38.5	177	-178.9	0	0	0	0	112.6	L53 F54 I55 I60 N305 D306	L53-S57 WeakPolarHBondContact O-CB 3.38Å; L53-S57 PolarHBondContact O-N 2.89Å; F54-S57 PolarHBondContact O-N 2.93Å; I55-S57 PolarHBondContact O-N 2.89Å; S57-I60 WeakPolarHBondContact O-CB 3.47Å; S57-I60 PolarHBondContact O-N 2.91Å; S57-N305 PolarHBondContact OG-N 2.89Å; S57-N305 PolarHBondContact OG-O 3.23Å; S57-D306 VanDerWaalsContact CB-OD1 3.31Å; S57-D306 WeakPolarHBondContact CB-OD1 3.45Å; S57-D306 PolarHBondContact OG-N 2.85Å; S57-D306 PolarHBondContact OG-OD1 3.3Å
58	R	93.3	Very high	95.8	Very high	153 Å²	153	49 Å²	49	58%	0.577	27%	0.265	S	S	*	.	H	α-helix	trans	-73.7	-26.7	-179.3	-77.1	-158.3	168.6	-173.6	0.4	114.4	F54 I55 I60 D306	F54-R58 HydrophobicContact CE1-CG 4.46Å; F54-R58 VanDerWaalsContact CZ-CZ 3.41Å; F54-R58 PolarHBondContact O-N 3.34Å; I55-R58 PolarHBondContact O-N 2.89Å; R58-I60 PolarHBondContact O-N 3.43Å; R58-D306 IonicContact NE-OD2 2.68Å
59	D	92.6	Very high	95.4	Very high	113 Å²	113	47 Å²	47	60%	0.604	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-15.8	173.2	-80.1	2.5	0	0	0	112.9	I55 Q61	I55-D59 PolarHBondContact O-N 3.07Å; D59-Q61 PolarHBondContact O-N 3.31Å
60	I	94.3	Very high	95	Very high	7 Å²	7	46.6 Å²	46.6	4%	0.036	24%	0.239	C	C	.	.			trans	-73.3	123	176.8	-60.8	173.7	0	0	0	109.8	S57 R58 N297 G302 K304	S57-I60 WeakPolarHBondContact O-CB 3.47Å; S57-I60 PolarHBondContact O-N 2.91Å; R58-I60 PolarHBondContact O-N 3.43Å; I60-N297 VanDerWaalsContact CA-OD1 3.32Å; I60-N297 WeakPolarHBondContact CA-OD1 3.41Å; I60-N297 WeakPolarHBondContact CG2-O 3.41Å; I60-N297 WeakPolarHBondContact CG2-OD1 3.26Å; I60-G302 WeakPolarHBondContact CD1-O 3.35Å; I60-K304 HydrophobicContact CB-CB 4.05Å; I60-K304 HydrophobicContact CG2-CB 3.78Å
61	Q	94.4	Very high	94.5	Very high	44 Å²	44	52 Å²	52	21%	0.206	27%	0.268	C	S	.	.			trans	-86.3	132.8	174.5	-67.6	169.7	-66.9	0	0	109	D59 T96 L97 F98 S296 N297	D59-Q61 PolarHBondContact O-N 3.31Å; Q61-T96 PolarHBondContact NE2-OG1 3.01Å; Q61-L97 PolarHBondContact NE2-O 2.97Å; Q61-L97 PolarHBondContact OE1-O 3.45Å; Q61-F98 HydrophobicContact CB-CD1 4.28Å; Q61-F98 HydrophobicContact CB-CD2 4.12Å; Q61-F98 HydrophobicContact CB-CE1 4.02Å; Q61-F98 HydrophobicContact CB-CE2 3.84Å; Q61-F98 HydrophobicContact CB-CG 4.33Å; Q61-F98 HydrophobicContact CB-CZ 3.79Å; Q61-F98 WeakPolarHBondContact O-CZ 3.15Å; Q61-S296 WeakPolarHBondContact O-CA 3.49Å; Q61-N297 PolarHBondContact N-OD1 2.93Å; Q61-N297 PolarHBondContact O-N 3.09Å; Q61-N297 PolarHBondContact O-OD1 2.93Å
62	L	94.9	Very high	94	Very high	59 Å²	59	53.6 Å²	53.6	31%	0.309	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	122.2	-177.5	177.5	128.4	0	0	0	108.7	E64 V294 L295 K304	L62-E64 HydrophobicContact CD2-CG 3.52Å; L62-E64 HydrophobicContact CG-CG 4.13Å; L62-V294 HydrophobicContact CD1-CG1 3.89Å; L62-V294 HydrophobicContact CG-CG1 4.14Å; L62-L295 WeakPolarHBondContact CA-O 3.34Å; L62-K304 HydrophobicContact CB-CD 4.26Å; L62-K304 HydrophobicContact CD1-CB 4.49Å
63	Q	95.6	Very high	93.6	Very high	57 Å²	57	59.9 Å²	59.9	27%	0.266	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	116	174.4	178.7	63.8	60.2	0	0	108.2	L65 F92 F98 V294 L295	Q63-L65 HydrophobicContact CG-CG 4.4Å; Q63-F92 HydrophobicContact CG-CD2 4.17Å; Q63-F92 HydrophobicContact CG-CE2 4.29Å; Q63-F98 HydrophobicContact CB-CE2 4.14Å; Q63-V294 CarbonylContact O-C 3.59Å; Q63-V294 WeakPolarHBondContact O-CA 3.45Å; Q63-L295 HydrophobicContact CB-CB 4.33Å; Q63-L295 PolarHBondContact N-O 3.22Å; Q63-L295 PolarHBondContact O-N 3.21Å
64	E	96.3	Very high	93.4	Very high	88 Å²	88	61.3 Å²	61.3	41%	0.411	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	140.8	173.9	-54.2	-161.9	159.9	0	0	110	L62 V293 V294	L62-E64 HydrophobicContact CD2-CG 3.52Å; L62-E64 HydrophobicContact CG-CG 4.13Å; E64-V293 CarbonylContact C-O 3.49Å; E64-V293 WeakPolarHBondContact CA-O 3.14Å; E64-V294 HydrophobicContact CB-CG2 4.39Å; E64-V294 HydrophobicContact CG-CB 4.46Å; E64-V294 HydrophobicContact CG-CG1 4.04Å; E64-V294 HydrophobicContact CG-CG2 3.89Å
65	L	96.4	Very high	93.2	Very high	26 Å²	26	62.3 Å²	62.3	14%	0.136	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	113.4	177.8	-59.6	169.6	0	0	0	107.9	Q63 M90 F92 L276 K292 V293	Q63-L65 HydrophobicContact CG-CG 4.4Å; L65-M90 HydrophobicContact CB-CE 3.74Å; L65-M90 HydrophobicContact CD1-CE 4.38Å; L65-F92 HydrophobicContact CD1-CB 4.34Å; L65-F92 HydrophobicContact CD1-CD1 3.41Å; L65-F92 VanDerWaalsContact CD1-CD1 3.41Å; L65-F92 HydrophobicContact CD1-CD2 4.25Å; L65-F92 HydrophobicContact CD1-CE1 3.63Å; L65-F92 HydrophobicContact CD1-CE2 4.42Å; L65-F92 HydrophobicContact CD1-CG 3.75Å; L65-F92 HydrophobicContact CD1-CZ 4.13Å; L65-F92 HydrophobicContact CD2-CB 3.96Å; L65-F92 HydrophobicContact CD2-CG 4.21Å; L65-L276 HydrophobicContact CD1-CD2 4.41Å; L65-K292 CarbonylContact O-C 3.52Å; L65-K292 VanDerWaalsContact O-CA 3.22Å; L65-K292 WeakPolarHBondContact O-CA 3.28Å; L65-V293 PolarHBondContact N-O 3.01Å; L65-V293 PolarHBondContact O-N 3.23Å
66	D	96.4	Very high	93	Very high	65 Å²	65	57.9 Å²	57.9	35%	0.348	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134	169.2	-164.5	-41.7	0	0	0	108.5	T68 H74	D66-T68 WeakPolarHBondContact OD1-CB 3.5Å; D66-T68 PolarHBondContact OD1-N 2.89Å; D66-T68 PolarHBondContact OD1-OG1 3.25Å; D66-H74 PolarHBondContact O-NE2 2.8Å
67	Y	96	Very high	92.9	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.3	C	S	.	.			trans	-128.2	17	176.5	69.3	-85.2	0	0	0	113.2	G69 C76 M90 F164 D166 F168 I278 Y280 K291 K292 V293	Y67-G69 PolarHBondContact O-N 2.95Å; Y67-C76 WeakPolarHBondContact O-CB 3.4Å; Y67-M90 VanDerWaalsContact CB-SD 3.59Å; Y67-F164 WeakPolarHBondContact OH-CZ 3.4Å; Y67-D166 WeakPolarHBondContact CE2-OD2 3.01Å; Y67-D166 PolarHBondContact OH-OD2 3.18Å; Y67-F168 HydrophobicContact CE1-CE1 4.13Å; Y67-F168 HydrophobicContact CE1-CZ 4.35Å; Y67-F168 HydrophobicContact CE2-CE1 4.38Å; Y67-F168 AromaticContact CZ-CE1 3.87Å; Y67-F168 AromaticContact CZ-CZ 3.94Å; Y67-F168 WeakPolarHBondContact OH-CZ 3.37Å; Y67-I278 HydrophobicContact CD1-CD1 4.2Å; Y67-I278 HydrophobicContact CD2-CD1 3.7Å; Y67-I278 HydrophobicContact CD2-CG2 4.01Å; Y67-I278 HydrophobicContact CE2-CD1 4.4Å; Y67-I278 HydrophobicContact CE2-CG2 3.9Å; Y67-I278 HydrophobicContact CG-CD1 3.58Å; Y67-Y280 HydrophobicContact CD2-CD2 4.02Å; Y67-Y280 AromaticContact CD2-CE2 3.98Å; Y67-Y280 HydrophobicContact CD2-CE2 3.98Å; Y67-Y280 HydrophobicContact CE2-CD2 4.27Å; Y67-Y280 HydrophobicContact CE2-CE2 4.28Å; Y67-Y280 WeakPolarHBondContact O-CE2 3.05Å; Y67-K291 HydrophobicContact CD1-CB 4.17Å; Y67-K291 WeakPolarHBondContact CD1-O 3.48Å; Y67-K291 HydrophobicContact CD2-CB 4.29Å; Y67-K291 HydrophobicContact CE1-CB 3.61Å; Y67-K291 HydrophobicContact CE2-CB 3.76Å; Y67-K291 HydrophobicContact CE2-CD 3.91Å; Y67-K291 VanDerWaalsContact CE2-CE 3.46Å; Y67-K291 HydrophobicContact CE2-CG 4.46Å; Y67-K291 HydrophobicContact CG-CB 4.47Å; Y67-K291 PolarHBondContact N-O 2.81Å; Y67-K292 VanDerWaalsContact CE1-C 3.48Å; Y67-V293 HydrophobicContact CD1-CG2 3.95Å; Y67-V293 HydrophobicContact CE1-CG2 3.69Å
68	T	94.6	Very high	92.6	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	S	Bend	trans	-61.5	-31.4	-177.8	-47.8	0	0	0	0	112.5	D66 D70 Y280 V284 H285 K290 K291	D66-T68 WeakPolarHBondContact OD1-CB 3.5Å; D66-T68 PolarHBondContact OD1-N 2.89Å; D66-T68 PolarHBondContact OD1-OG1 3.25Å; T68-D70 WeakPolarHBondContact CG2-OD1 3.3Å; T68-Y280 PolarHBondContact O-OH 3.28Å; T68-V284 HydrophobicContact CG2-CG2 4.04Å; T68-H285 PolarHBondContact O-NE2 3.38Å; T68-K290 HydrophobicContact CG2-CB 4.34Å; T68-K290 WeakPolarHBondContact OG1-CA 3.13Å; T68-K290 WeakPolarHBondContact OG1-CB 3.37Å; T68-K291 PolarHBondContact OG1-N 3.48Å; T68-K291 PolarHBondContact OG1-O 3.43Å
69	G	91.8	Very high	92.5	Very high	1 Å²	1	58 Å²	58	1%	0.01	30%	0.299	C	S	.	.			trans	71.5	48.6	-179.6	0	0	0	0	0	112.9	Y67 F77	Y67-G69 PolarHBondContact O-N 2.95Å; G69-F77 VanDerWaalsContact O-CD2 3.31Å; G69-F77 WeakPolarHBondContact O-CD2 3.33Å
70	D	88.4	Confident	92	Very high	57 Å²	57	58.7 Å²	58.7	31%	0.305	29%	0.293	S	S	.	.			trans	-71.6	-40.5	177.5	-71	-19.8	0	0	0	111.4	T68 H285 K290	T68-D70 WeakPolarHBondContact CG2-OD1 3.3Å; D70-H285 IonicContact OD1-CE1 2.54Å; D70-H285 PolarHBondContact OD1-CE1 2.97Å; D70-K290 IonicContact OD2-NZ 2.68Å; D70-K290 PolarHBondContact OD2-NZ 3.32Å
71	D	88.6	Confident	91.2	Very high	114 Å²	114	63.6 Å²	63.6	61%	0.61	32%	0.324	S	S	*	.	S	Bend	trans	-90.3	144.1	-177.1	-57.7	-45.8	0	0	0	112.6	E73 H74 F77	D71-E73 PolarHBondContact O-N 3.49Å; D71-H74 HydrophobicContact CB-CB 4.43Å; D71-H74 WeakPolarHBondContact O-CB 3.45Å; D71-H74 PolarHBondContact O-N 3.46Å; D71-F77 WeakPolarHBondContact O-CB 3.31Å; D71-F77 VanDerWaalsContact O-CD2 3.27Å; D71-F77 WeakPolarHBondContact O-CD2 3.29Å
72	S	85.8	Confident	90.2	Very high	97 Å²	97	65.2 Å²	65.2	68%	0.678	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-24.5	179.9	52.1	0	0	0	0	114.2	H74	S72-H74 VanDerWaalsContact C-N 3.31Å
73	E	88.6	Confident	88.8	Confident	185 Å²	185	69.3 Å²	69.3	86%	0.864	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-12	176.2	-61.4	-174.6	172.7	0	0	112.6	D71	D71-E73 PolarHBondContact O-N 3.49Å
74	H	91.9	Very high	87.8	Confident	44 Å²	44	73.7 Å²	73.7	20%	0.204	38%	0.382	C	S	.	.	S	Bend	trans	-72.4	133.2	-175.7	-166.2	-81.4	0	0	0	111.3	D66 D71 S72 C76 F77 M90	D66-H74 PolarHBondContact O-NE2 2.8Å; D71-H74 HydrophobicContact CB-CB 4.43Å; D71-H74 WeakPolarHBondContact O-CB 3.45Å; D71-H74 PolarHBondContact O-N 3.46Å; S72-H74 VanDerWaalsContact C-N 3.31Å; H74-C76 PolarHBondContact ND1-N 3.42Å; H74-C76 VanDerWaalsContact ND1-N 3.17Å; H74-C76 PolarHBondContact O-N 3.02Å; H74-F77 WeakPolarHBondContact O-CB 3.31Å; H74-F77 PolarHBondContact O-N 2.87Å; H74-M90 VanDerWaalsContact CE1-SD 3.6Å
75	P	91.6	Very high	87.2	Confident	69 Å²	69	78.8 Å²	78.8	45%	0.448	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-28.4	-176.9	-27	33.9	0	0	0	115.1	S89	P75-S89 WeakPolarHBondContact CB-O 3.3Å
76	C	92.5	Very high	87	Confident	0 Å²	0	78 Å²	78	0%	0	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-2.6	178.1	-58.3	0	0	0	0	114.8	Y67 H74 K78 C79 C88	Y67-C76 WeakPolarHBondContact O-CB 3.4Å; H74-C76 PolarHBondContact ND1-N 3.42Å; H74-C76 VanDerWaalsContact ND1-N 3.17Å; H74-C76 PolarHBondContact O-N 3.02Å; C76-K78 VanDerWaalsContact C-N 3.26Å; C76-K78 PolarHBondContact O-N 2.61Å; C76-C79 WeakPolarHBondContact O-CB 3.36Å; C76-C79 PolarHBondContact O-N 3.1Å; C76-C88 HydrophobicContact CB-CB 3.71Å; C76-C88 WeakPolarHBondContact CB-SG 3.25Å; C76-C88 WeakPolarHBondContact SG-CB 3.21Å; C76-C88 CovalentContact SG-SG 2.04Å; C76-C88 PolarHBondContact SG-SG 3.28Å
77	F	91.7	Very high	86.9	Confident	65 Å²	65	78.7 Å²	78.7	29%	0.285	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-39.2	179.8	-178.1	-97.3	0	0	0	112.4	G69 D71 H74 C79 R80	G69-F77 VanDerWaalsContact O-CD2 3.31Å; G69-F77 WeakPolarHBondContact O-CD2 3.33Å; D71-F77 WeakPolarHBondContact O-CB 3.31Å; D71-F77 VanDerWaalsContact O-CD2 3.27Å; D71-F77 WeakPolarHBondContact O-CD2 3.29Å; H74-F77 WeakPolarHBondContact O-CB 3.31Å; H74-F77 PolarHBondContact O-N 2.87Å; F77-C79 PolarHBondContact O-N 3.36Å; F77-C79 VanDerWaalsContact O-N 3.08Å; F77-R80 WeakPolarHBondContact O-CB 3.31Å; F77-R80 PolarHBondContact O-N 3.49Å
78	K	90	Very high	86.9	Confident	121 Å²	121	78.8 Å²	78.8	53%	0.526	41%	0.407	S	S	.	.	H	α-helix	trans	-57	-25.2	176.1	66.3	178.5	-177.5	172.6	0	114.2	C76 R80 T81 T87	C76-K78 VanDerWaalsContact C-N 3.26Å; C76-K78 PolarHBondContact O-N 2.61Å; K78-R80 VanDerWaalsContact C-N 3.32Å; K78-T81 PolarHBondContact O-OG1 3.06Å; K78-T87 WeakPolarHBondContact CE-O 3.42Å; K78-T87 PolarHBondContact NZ-O 2.82Å
79	C	89.8	Confident	86.9	Confident	6 Å²	6	81.6 Å²	81.6	4%	0.041	43%	0.426	C	S	.	.	H	α-helix	trans	-84.4	-7.3	179.7	-64.1	0	0	0	0	113.3	C76 F77 C86 Y280	C76-C79 WeakPolarHBondContact O-CB 3.36Å; C76-C79 PolarHBondContact O-N 3.1Å; F77-C79 PolarHBondContact O-N 3.36Å; F77-C79 VanDerWaalsContact O-N 3.08Å; C79-C86 WeakPolarHBondContact CA-SG 3.08Å; C79-C86 HydrophobicContact CB-CB 3.57Å; C79-C86 WeakPolarHBondContact CB-SG 3.27Å; C79-C86 WeakPolarHBondContact SG-CB 3.18Å; C79-C86 CovalentContact SG-SG 2.04Å; C79-C86 PolarHBondContact SG-SG 3.33Å; C79-Y280 HydrophobicContact CB-CD1 3.94Å; C79-Y280 HydrophobicContact CB-CD2 4.25Å; C79-Y280 HydrophobicContact CB-CG 3.74Å
80	R	83.6	Confident	87	Confident	127 Å²	127	82.3 Å²	82.3	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-72.9	-37.7	174.1	-177.9	177.8	172.7	-175.6	-0.6	112.2	F77 K78	F77-R80 WeakPolarHBondContact O-CB 3.31Å; F77-R80 PolarHBondContact O-N 3.49Å; K78-R80 VanDerWaalsContact C-N 3.32Å
81	T	75.9	Confident	87.4	Confident	111 Å²	111	85.1 Å²	85.1	68%	0.681	45%	0.449	S	S	*	.	H	α-helix	trans	-94.4	-16.5	-173	52.4	0	0	0	0	113.2	K78	K78-T81 PolarHBondContact O-OG1 3.06Å
82	N	74.3	Confident	87.7	Confident	77 Å²	77	80.6 Å²	80.6	41%	0.412	42%	0.424	S	S	.	.			trans	-87.9	128.1	-175	-160.1	-8.8	0	0	0	111.2	E84 C86	N82-E84 VanDerWaalsContact C-N 3.35Å; N82-E84 PolarHBondContact OD1-N 3.32Å; N82-E84 VanDerWaalsContact OD1-N 3.12Å; N82-C86 HydrophobicContact CB-CB 4.44Å
83	T	64.5	Low	88.2	Confident	146 Å²	146	79.1 Å²	79.1	90%	0.896	41%	0.414	S	S	*	.	S	Bend	trans	-84.8	-8.9	175.8	43.9	0	0	0	0	113.2
84	E	75.1	Confident	88.5	Confident	149 Å²	149	70.6 Å²	70.6	70%	0.696	37%	0.374	S	S	*	.	S	Bend	trans	-93.2	172.8	176.4	-62.4	-170.8	168.3	0	0	112.8	N82 C86	N82-E84 VanDerWaalsContact C-N 3.35Å; N82-E84 PolarHBondContact OD1-N 3.32Å; N82-E84 VanDerWaalsContact OD1-N 3.12Å; E84-C86 PolarHBondContact O-N 3.49Å
85	K	84.3	Confident	88.6	Confident	194 Å²	194	73.6 Å²	73.6	84%	0.843	40%	0.398	S	S	*	.			trans	-58	96.9	176.2	-68.4	-179.8	-178.8	175	0	110.3
86	C	92.4	Very high	88.7	Confident	9 Å²	9	74.2 Å²	74.2	6%	0.061	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.2	-177.9	-168.6	0	0	0	0	111.6	C79 N82 E84 Y280	C79-C86 WeakPolarHBondContact CA-SG 3.08Å; C79-C86 HydrophobicContact CB-CB 3.57Å; C79-C86 WeakPolarHBondContact CB-SG 3.27Å; C79-C86 WeakPolarHBondContact SG-CB 3.18Å; C79-C86 CovalentContact SG-SG 2.04Å; C79-C86 PolarHBondContact SG-SG 3.33Å; N82-C86 HydrophobicContact CB-CB 4.44Å; E84-C86 PolarHBondContact O-N 3.49Å; C86-Y280 PolarHBondContact O-N 3.29Å
87	T	94.1	Very high	88.8	Confident	81 Å²	81	78.3 Å²	78.3	50%	0.497	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	137.4	172	56.8	0	0	0	0	110.9	K78 I278 A279	K78-T87 WeakPolarHBondContact CE-O 3.42Å; K78-T87 PolarHBondContact NZ-O 2.82Å; T87-I278 VanDerWaalsContact CA-O 3.23Å; T87-I278 WeakPolarHBondContact CA-O 3.32Å; T87-A279 HydrophobicContact CG2-CB 4.34Å
88	C	94.7	Very high	88.9	Confident	1 Å²	1	75.5 Å²	75.5	1%	0.007	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.7	171.6	64.5	0	0	0	0	110.4	C76 I278	C76-C88 HydrophobicContact CB-CB 3.71Å; C76-C88 WeakPolarHBondContact CB-SG 3.25Å; C76-C88 WeakPolarHBondContact SG-CB 3.21Å; C76-C88 CovalentContact SG-SG 2.04Å; C76-C88 PolarHBondContact SG-SG 3.28Å; C88-I278 PolarHBondContact N-O 2.77Å; C88-I278 PolarHBondContact O-N 3.39Å
89	S	95.4	Very high	89.1	Confident	59 Å²	59	75.9 Å²	75.9	41%	0.413	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	137.2	179.7	-61.8	0	0	0	0	109.4	P75 L276 T277	P75-S89 WeakPolarHBondContact CB-O 3.3Å; S89-L276 CarbonylContact C-O 3.55Å; S89-L276 VanDerWaalsContact CA-O 3.27Å; S89-L276 WeakPolarHBondContact CA-O 3.31Å; S89-T277 PolarHBondContact OG-OG1 3.45Å; S89-T277 VanDerWaalsContact OG-OG1 3.08Å
90	M	95	Very high	88.9	Confident	16 Å²	16	77 Å²	77	8%	0.079	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.2	178.4	-54.2	-167.2	-43	0	0	109.5	L65 Y67 H74 T275 L276 I278	L65-M90 HydrophobicContact CB-CE 3.74Å; L65-M90 HydrophobicContact CD1-CE 4.38Å; Y67-M90 VanDerWaalsContact CB-SD 3.59Å; H74-M90 VanDerWaalsContact CE1-SD 3.6Å; M90-T275 CarbonylContact O-C 3.59Å; M90-T275 WeakPolarHBondContact O-CA 3.5Å; M90-L276 HydrophobicContact CE-CD2 4.15Å; M90-L276 PolarHBondContact N-O 3.35Å; M90-L276 PolarHBondContact O-N 2.87Å; M90-I278 HydrophobicContact CE-CD1 4.17Å; M90-I278 HydrophobicContact SD-CD1 4.5Å
91	T	95.4	Very high	89.4	Confident	116 Å²	116	73.7 Å²	73.7	71%	0.712	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	134.8	177.7	54.1	0	0	0	0	110	Y274 T275	T91-Y274 CarbonylContact C-O 3.54Å; T91-Y274 WeakPolarHBondContact CA-O 3.09Å; T91-T275 HydrophobicContact CG2-CG2 4.3Å
92	F	95.6	Very high	90.3	Very high	19 Å²	19	68.4 Å²	68.4	8%	0.083	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	157.6	175.4	66.1	-81.2	0	0	0	110.2	Q63 L65 I94 L170 Y274 L276 L295	Q63-F92 HydrophobicContact CG-CD2 4.17Å; Q63-F92 HydrophobicContact CG-CE2 4.29Å; L65-F92 HydrophobicContact CD1-CB 4.34Å; L65-F92 HydrophobicContact CD1-CD1 3.41Å; L65-F92 VanDerWaalsContact CD1-CD1 3.41Å; L65-F92 HydrophobicContact CD1-CD2 4.25Å; L65-F92 HydrophobicContact CD1-CE1 3.63Å; L65-F92 HydrophobicContact CD1-CE2 4.42Å; L65-F92 HydrophobicContact CD1-CG 3.75Å; L65-F92 HydrophobicContact CD1-CZ 4.13Å; L65-F92 HydrophobicContact CD2-CB 3.96Å; L65-F92 HydrophobicContact CD2-CG 4.21Å; F92-I94 HydrophobicContact CD2-CG1 4.24Å; F92-I94 HydrophobicContact CE2-CD1 4.14Å; F92-I94 HydrophobicContact CE2-CG1 3.96Å; F92-L170 HydrophobicContact CE1-CD1 3.99Å; F92-L170 HydrophobicContact CZ-CD1 3.91Å; F92-Y274 HydrophobicContact CE2-CD2 4.47Å; F92-Y274 HydrophobicContact CE2-CG 4.3Å; F92-Y274 VanDerWaalsContact CZ-CB 3.48Å; F92-Y274 HydrophobicContact CZ-CG 4.16Å; F92-Y274 PolarHBondContact N-O 2.9Å; F92-Y274 PolarHBondContact O-N 3.26Å; F92-L276 HydrophobicContact CE1-CB 4.15Å; F92-L295 HydrophobicContact CE2-CD1 4.02Å; F92-L295 HydrophobicContact CZ-CD1 3.81Å
93	S	95.4	Very high	91.4	Very high	67 Å²	67	66.2 Å²	66.2	47%	0.469	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136	-178.9	-163.6	0	0	0	0	110.4	G272 N273	S93-G272 WeakPolarHBondContact CA-O 3.48Å; S93-G272 PolarHBondContact OG-O 3.17Å; S93-N273 VanDerWaalsContact CB-OD1 3.23Å; S93-N273 WeakPolarHBondContact CB-OD1 3.4Å; S93-N273 PolarHBondContact OG-OD1 2.86Å
94	I	95.6	Very high	92.9	Very high	5 Å²	5	59.3 Å²	59.3	3%	0.026	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	115.8	172.1	-54.8	-176.6	0	0	0	107.2	F92 T96 F98 L269 A271 G272 Y274	F92-I94 HydrophobicContact CD2-CG1 4.24Å; F92-I94 HydrophobicContact CE2-CD1 4.14Å; F92-I94 HydrophobicContact CE2-CG1 3.96Å; I94-T96 WeakPolarHBondContact CG2-O 3.36Å; I94-F98 HydrophobicContact CD1-CB 4.48Å; I94-F98 HydrophobicContact CD1-CD2 4.36Å; I94-F98 HydrophobicContact CG2-CB 4.14Å; I94-F98 HydrophobicContact CG2-CD2 4.24Å; I94-L269 HydrophobicContact CD1-CB 3.97Å; I94-L269 HydrophobicContact CD1-CD1 3.96Å; I94-A271 CarbonylContact O-C 3.59Å; I94-A271 WeakPolarHBondContact O-CA 3.39Å; I94-A271 WeakPolarHBondContact O-CB 3.21Å; I94-G272 PolarHBondContact N-O 2.68Å; I94-G272 PolarHBondContact O-N 2.9Å; I94-Y274 HydrophobicContact CB-CD2 4.47Å; I94-Y274 HydrophobicContact CB-CE2 4.26Å; I94-Y274 HydrophobicContact CD1-CD2 3.75Å; I94-Y274 HydrophobicContact CD1-CE2 3.56Å; I94-Y274 HydrophobicContact CG1-CD2 3.8Å; I94-Y274 HydrophobicContact CG1-CE2 3.89Å
95	P	93.8	Very high	94	Very high	108 Å²	108	53.8 Å²	53.8	70%	0.701	30%	0.304	S	S	*	.			trans	-75.9	-29.3	-171.3	28.6	-35.3	0	0	0	113.8
96	T	93.8	Very high	94.7	Very high	81 Å²	81	44.9 Å²	44.9	50%	0.497	27%	0.265	S	S	.	.	S	Bend	trans	-134.1	161.9	-177.9	57.9	0	0	0	0	109.8	Q61 I94 F98	Q61-T96 PolarHBondContact NE2-OG1 3.01Å; I94-T96 WeakPolarHBondContact CG2-O 3.36Å; T96-F98 PolarHBondContact O-N 2.6Å; T96-F98 VanDerWaalsContact O-N 3.07Å
97	L	94.6	Very high	95	Very high	87 Å²	87	44.5 Å²	44.5	46%	0.455	26%	0.263	S	S	.	.			trans	-51.7	121.1	175.7	177.9	67.9	0	0	0	110.2	Q61 K99	Q61-L97 PolarHBondContact NE2-O 2.97Å; Q61-L97 PolarHBondContact OE1-O 3.45Å; L97-K99 PolarHBondContact O-N 3.25Å
98	F	94.5	Very high	95.2	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.026	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	97.3	174.8	-158.1	-65.8	0	0	0	108.2	Q61 Q63 I94 T96 G100 V102 G268 L269 L295 N297	Q61-F98 HydrophobicContact CB-CD1 4.28Å; Q61-F98 HydrophobicContact CB-CD2 4.12Å; Q61-F98 HydrophobicContact CB-CE1 4.02Å; Q61-F98 HydrophobicContact CB-CE2 3.84Å; Q61-F98 HydrophobicContact CB-CG 4.33Å; Q61-F98 HydrophobicContact CB-CZ 3.79Å; Q61-F98 WeakPolarHBondContact O-CZ 3.15Å; Q63-F98 HydrophobicContact CB-CE2 4.14Å; I94-F98 HydrophobicContact CD1-CB 4.48Å; I94-F98 HydrophobicContact CD1-CD2 4.36Å; I94-F98 HydrophobicContact CG2-CB 4.14Å; I94-F98 HydrophobicContact CG2-CD2 4.24Å; T96-F98 PolarHBondContact O-N 2.6Å; T96-F98 VanDerWaalsContact O-N 3.07Å; F98-G100 PolarHBondContact O-N 3.35Å; F98-V102 HydrophobicContact CD1-CB 4.5Å; F98-V102 HydrophobicContact CD1-CG1 4.11Å; F98-V102 HydrophobicContact CD1-CG2 3.59Å; F98-V102 HydrophobicContact CE1-CG1 3.95Å; F98-V102 HydrophobicContact CE1-CG2 4.09Å; F98-G268 CarbonylContact O-C 3.54Å; F98-G268 WeakPolarHBondContact O-CA 3.49Å; F98-L269 HydrophobicContact CB-CB 3.91Å; F98-L269 WeakPolarHBondContact CB-O 3.17Å; F98-L269 PolarHBondContact N-O 3.29Å; F98-L269 PolarHBondContact O-N 2.98Å; F98-L295 HydrophobicContact CZ-CB 4.36Å; F98-L295 WeakPolarHBondContact CZ-O 3.4Å; F98-N297 HydrophobicContact CE1-CB 4.03Å
99	K	92.9	Very high	95.3	Very high	129 Å²	129	41.4 Å²	41.4	56%	0.561	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-58.7	127.1	-169.2	-64.3	178.9	-178.6	175.3	0	111.5	L97 N297	L97-K99 PolarHBondContact O-N 3.25Å; K99-N297 WeakPolarHBondContact O-CB 3.5Å; K99-N297 PolarHBondContact O-ND2 2.86Å
100	G	87.2	Confident	95.4	Very high	30 Å²	30	41.3 Å²	41.3	31%	0.309	24%	0.238	S	C	.	.	S	Bend	trans	-75	164.8	176.8	0	0	0	0	0	113.6	F98 A267	F98-G100 PolarHBondContact O-N 3.35Å; G100-A267 PolarHBondContact N-O 3.43Å
101	P	92.5	Very high	95.5	Very high	57 Å²	57	41.6 Å²	41.6	37%	0.37	24%	0.239	S	C	.	.	S	Bend	cis	-71.5	138	-2.2	29	-34.5	0	0	0	112.5	F103 T261	P101-F103 HydrophobicContact CB-CE2 4.12Å; P101-F103 HydrophobicContact CB-CZ 4.42Å; P101-F103 HydrophobicContact CG-CE2 3.98Å; P101-F103 HydrophobicContact CG-CZ 4.38Å; P101-T261 HydrophobicContact CB-CG2 3.8Å
102	V	95.4	Very high	95.6	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	133.7	-179.6	-175.3	0	0	0	0	110.2	F98 I260 L269 L295	F98-V102 HydrophobicContact CD1-CB 4.5Å; F98-V102 HydrophobicContact CD1-CG1 4.11Å; F98-V102 HydrophobicContact CD1-CG2 3.59Å; F98-V102 HydrophobicContact CE1-CG1 3.95Å; F98-V102 HydrophobicContact CE1-CG2 4.09Å; V102-I260 HydrophobicContact CB-CB 4.26Å; V102-I260 HydrophobicContact CG1-CD1 4.32Å; V102-I260 PolarHBondContact N-O 3.09Å; V102-I260 PolarHBondContact O-N 3.39Å; V102-L269 HydrophobicContact CG1-CD1 4.04Å; V102-L269 HydrophobicContact CG1-CG 4.45Å; V102-L269 HydrophobicContact CG2-CG 4.28Å; V102-L295 HydrophobicContact CG1-CB 4.46Å
103	F	96.6	Very high	95.6	Very high	30 Å²	30	40.4 Å²	40.4	13%	0.132	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.7	178.9	-63.2	-91.4	0	0	0	109.9	P101 Y105 L256 R259 L295 S296 V298	P101-F103 HydrophobicContact CB-CE2 4.12Å; P101-F103 HydrophobicContact CB-CZ 4.42Å; P101-F103 HydrophobicContact CG-CE2 3.98Å; P101-F103 HydrophobicContact CG-CZ 4.38Å; F103-Y105 HydrophobicContact CB-CD2 4.21Å; F103-Y105 HydrophobicContact CB-CE2 3.34Å; F103-Y105 WeakPolarHBondContact CB-OH 3.31Å; F103-Y105 HydrophobicContact CG-CE2 4.43Å; F103-L256 HydrophobicContact CB-CD1 3.86Å; F103-L256 HydrophobicContact CD1-CD1 3.75Å; F103-L256 HydrophobicContact CD1-CD2 4.2Å; F103-L256 HydrophobicContact CG-CD1 4.28Å; F103-R259 HydrophobicContact CD1-CG 3.87Å; F103-R259 HydrophobicContact CE1-CG 3.91Å; F103-L295 WeakPolarHBondContact O-CA 3.32Å; F103-S296 PolarHBondContact N-O 2.85Å; F103-S296 PolarHBondContact O-N 3.02Å; F103-V298 HydrophobicContact CD2-CG1 3.72Å; F103-V298 HydrophobicContact CD2-CG2 4.15Å; F103-V298 HydrophobicContact CE2-CB 4.23Å; F103-V298 HydrophobicContact CE2-CG1 3.85Å; F103-V298 HydrophobicContact CE2-CG2 3.42Å; F103-V298 VanDerWaalsContact CE2-CG2 3.42Å; F103-V298 HydrophobicContact CZ-CG2 4.13Å
104	F	97.6	Very high	95.7	Very high	1 Å²	1	40.9 Å²	40.9	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	119.6	174.9	-171.5	-52	0	0	0	108.5	F168 L183 Y257 R258 L276 V293 L295	F104-F168 HydrophobicContact CE1-CB 4.29Å; F104-F168 HydrophobicContact CE1-CD1 4.32Å; F104-F168 AromaticContact CE1-CD2 3.87Å; F104-F168 HydrophobicContact CE1-CD2 3.87Å; F104-F168 HydrophobicContact CE1-CE2 4.25Å; F104-F168 AromaticContact CE1-CG 3.9Å; F104-F168 HydrophobicContact CE1-CG 3.9Å; F104-F168 HydrophobicContact CE2-CB 4.13Å; F104-F168 HydrophobicContact CZ-CB 3.58Å; F104-F168 AromaticContact CZ-CD1 3.87Å; F104-F168 HydrophobicContact CZ-CD1 3.87Å; F104-F168 AromaticContact CZ-CD2 4Å; F104-F168 HydrophobicContact CZ-CD2 4Å; F104-F168 AromaticContact CZ-CG 3.54Å; F104-F168 HydrophobicContact CZ-CG 3.54Å; F104-L183 HydrophobicContact CD2-CD2 4.21Å; F104-Y257 AromaticContact CD1-CD1 3.8Å; F104-Y257 HydrophobicContact CD1-CD1 3.8Å; F104-Y257 HydrophobicContact CD1-CG 4.21Å; F104-Y257 AromaticContact CE1-CD1 3.91Å; F104-Y257 HydrophobicContact CE1-CD1 3.91Å; F104-Y257 HydrophobicContact CE1-CG 4.44Å; F104-Y257 HydrophobicContact CG-CD1 4.29Å; F104-Y257 HydrophobicContact CZ-CD1 4.46Å; F104-Y257 WeakPolarHBondContact O-CA 3.28Å; F104-Y257 WeakPolarHBondContact O-CB 3.49Å; F104-Y257 PolarHBondContact O-N 3.13Å; F104-R258 HydrophobicContact CB-CB 4.22Å; F104-R258 WeakPolarHBondContact CB-O 3.39Å; F104-R258 PolarHBondContact N-O 3.14Å; F104-R258 PolarHBondContact O-N 3.45Å; F104-R258 VanDerWaalsContact O-N 3.11Å; F104-L276 HydrophobicContact CE2-CD1 3.98Å; F104-L276 HydrophobicContact CZ-CD1 3.99Å; F104-V293 HydrophobicContact CD1-CG1 4.21Å; F104-V293 HydrophobicContact CE1-CB 4.34Å; F104-V293 HydrophobicContact CE1-CG1 3.51Å; F104-V293 HydrophobicContact CE1-CG2 3.96Å; F104-V293 HydrophobicContact CE2-CG1 4.06Å; F104-V293 HydrophobicContact CZ-CB 4.35Å; F104-V293 HydrophobicContact CZ-CG1 3.41Å; F104-V293 VanDerWaalsContact CZ-CG1 3.41Å; F104-V293 HydrophobicContact CZ-CG2 3.96Å; F104-L295 HydrophobicContact CB-CD2 3.93Å; F104-L295 HydrophobicContact CD2-CD2 3.61Å; F104-L295 HydrophobicContact CE2-CD2 4.3Å; F104-L295 HydrophobicContact CG-CD2 3.84Å
105	Y	98.3	Very high	95.7	Very high	33 Å²	33	45.2 Å²	45.2	13%	0.129	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	147.4	173.3	-54.3	-94.9	0	0	0	111.3	F103 R254 K255 L256 V293 V294	F103-Y105 HydrophobicContact CB-CD2 4.21Å; F103-Y105 HydrophobicContact CB-CE2 3.34Å; F103-Y105 WeakPolarHBondContact CB-OH 3.31Å; F103-Y105 HydrophobicContact CG-CE2 4.43Å; Y105-R254 HydrophobicContact CD1-CG 4.2Å; Y105-R254 HydrophobicContact CG-CG 4.38Å; Y105-K255 WeakPolarHBondContact CA-O 3.24Å; Y105-K255 WeakPolarHBondContact CB-O 3.48Å; Y105-L256 HydrophobicContact CD1-CB 4.05Å; Y105-L256 HydrophobicContact CD1-CD1 4.17Å; Y105-L256 HydrophobicContact CE1-CB 3.86Å; Y105-L256 HydrophobicContact CE1-CD1 3.79Å; Y105-L256 HydrophobicContact CE1-CG 4.4Å; Y105-V293 WeakPolarHBondContact O-CA 3.47Å; Y105-V294 PolarHBondContact N-O 3.26Å; Y105-V294 PolarHBondContact O-N 2.87Å
106	Y	98.3	Very high	95.8	Very high	7 Å²	7	50.8 Å²	50.8	3%	0.027	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	143.7	155.7	63.4	-95.8	0	0	0	108.9	F164 W244 R254 K255 Y257 K292	Y106-F164 AromaticContact CD1-CD1 3.97Å; Y106-F164 HydrophobicContact CD1-CD1 3.97Å; Y106-F164 AromaticContact CD1-CE1 3.93Å; Y106-F164 HydrophobicContact CD1-CE1 3.93Å; Y106-F164 AromaticContact CD2-CD1 3.95Å; Y106-F164 HydrophobicContact CD2-CD1 3.95Å; Y106-F164 HydrophobicContact CD2-CD2 4.15Å; Y106-F164 HydrophobicContact CD2-CE1 4.04Å; Y106-F164 HydrophobicContact CD2-CE2 4.22Å; Y106-F164 AromaticContact CD2-CG 3.99Å; Y106-F164 HydrophobicContact CD2-CG 3.99Å; Y106-F164 HydrophobicContact CD2-CZ 4.14Å; Y106-F164 AromaticContact CE1-CD1 3.93Å; Y106-F164 HydrophobicContact CE1-CD1 3.93Å; Y106-F164 HydrophobicContact CE1-CE1 4.37Å; Y106-F164 HydrophobicContact CE2-CB 3.97Å; Y106-F164 AromaticContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD2 4.19Å; Y106-F164 HydrophobicContact CE2-CE1 4.43Å; Y106-F164 AromaticContact CE2-CG 3.72Å; Y106-F164 HydrophobicContact CE2-CG 3.72Å; Y106-F164 AromaticContact CG-CD1 4Å; Y106-F164 HydrophobicContact CG-CD1 4Å; Y106-F164 AromaticContact CG-CE1 3.78Å; Y106-F164 HydrophobicContact CG-CE1 3.78Å; Y106-F164 HydrophobicContact CG-CG 4.5Å; Y106-F164 HydrophobicContact CG-CZ 4.08Å; Y106-F164 AromaticContact CZ-CD1 3.87Å; Y106-W244 HydrophobicContact CE2-CE3 4.49Å; Y106-W244 HydrophobicContact CE2-CZ3 4.45Å; Y106-R254 CarbonylContact O-C 3.6Å; Y106-R254 VanDerWaalsContact O-CA 3.23Å; Y106-R254 WeakPolarHBondContact O-CA 3.47Å; Y106-K255 HydrophobicContact CD2-CB 4.28Å; Y106-K255 HydrophobicContact CE1-CB 3.9Å; Y106-K255 HydrophobicContact CE2-CB 3.62Å; Y106-K255 HydrophobicContact CE2-CD 3.84Å; Y106-K255 HydrophobicContact CE2-CG 4.25Å; Y106-K255 PolarHBondContact N-O 3.4Å; Y106-K255 VanDerWaalsContact N-O 3.08Å; Y106-K255 PolarHBondContact O-N 3.01Å; Y106-K255 WeakPolarHBondContact OH-CB 3.21Å; Y106-K255 WeakPolarHBondContact OH-CD 3.36Å; Y106-Y257 HydrophobicContact CD1-CD2 4.08Å; Y106-Y257 HydrophobicContact CD1-CG 4.33Å; Y106-Y257 HydrophobicContact CE1-CD2 4.29Å; Y106-K292 CarbonylContact C-O 3.51Å; Y106-K292 WeakPolarHBondContact CA-O 3.43Å
107	G	98	Very high	95.8	Very high	2 Å²	2	55 Å²	55	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	136.8	178.3	0	0	0	0	0	110.9	F253 K291 K292	G107-F253 CarbonylContact C-O 3.53Å; G107-F253 WeakPolarHBondContact CA-O 3.26Å; G107-K291 WeakPolarHBondContact O-CA 3.22Å; G107-K292 PolarHBondContact N-O 2.95Å; G107-K292 PolarHBondContact O-N 3.33Å
108	L	98.1	Very high	95.9	Very high	1 Å²	1	52.4 Å²	52.4	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	141.7	170.9	-64.8	178.8	0	0	0	108.2	Y111 F164 W244 D252 F253 Y282 V284 K290 K291	L108-Y111 HydrophobicContact CD1-CD2 4.21Å; L108-Y111 HydrophobicContact CD1-CG 4.31Å; L108-F164 HydrophobicContact CD1-CD2 4.23Å; L108-F164 HydrophobicContact CD2-CD2 4.27Å; L108-F164 HydrophobicContact CD2-CE2 4.09Å; L108-W244 HydrophobicContact CD1-CH2 4.14Å; L108-W244 HydrophobicContact CD1-CZ3 4Å; L108-D252 WeakPolarHBondContact O-CA 3.41Å; L108-F253 HydrophobicContact CB-CE1 4.22Å; L108-F253 HydrophobicContact CB-CE2 4.2Å; L108-F253 HydrophobicContact CB-CZ 3.9Å; L108-F253 HydrophobicContact CD1-CE2 4.21Å; L108-F253 HydrophobicContact CD1-CZ 3.84Å; L108-F253 HydrophobicContact CG-CE2 4.45Å; L108-F253 HydrophobicContact CG-CZ 4.33Å; L108-F253 PolarHBondContact N-O 3.37Å; L108-F253 PolarHBondContact O-N 2.76Å; L108-Y282 HydrophobicContact CD1-CE1 4.05Å; L108-Y282 HydrophobicContact CD2-CD1 4.44Å; L108-Y282 HydrophobicContact CD2-CE1 4.48Å; L108-V284 HydrophobicContact CD2-CG1 4.19Å; L108-K290 WeakPolarHBondContact CA-O 3.4Å; L108-K291 HydrophobicContact CD2-CD 4.34Å; L108-K291 HydrophobicContact CD2-CG 3.8Å
109	T	97.8	Very high	95.8	Very high	15 Å²	15	52.1 Å²	52.1	9%	0.092	24%	0.243	C	C	.	.	S	Bend	trans	-120.6	154.8	174	57.2	0	0	0	0	110.4	Y111 D252 G289 K290	T109-Y111 PolarHBondContact O-N 2.8Å; T109-D252 WeakPolarHBondContact CA-OD1 3.36Å; T109-D252 WeakPolarHBondContact CB-OD1 3.36Å; T109-D252 HydrophobicContact CG2-CB 4.32Å; T109-G289 VanDerWaalsContact O-CA 3.3Å; T109-G289 WeakPolarHBondContact O-CA 3.37Å; T109-K290 PolarHBondContact N-O 3.01Å; T109-K290 VanDerWaalsContact OG1-CA 3.28Å; T109-K290 WeakPolarHBondContact OG1-CA 3.38Å; T109-K290 WeakPolarHBondContact OG1-CB 3.14Å; T109-K290 PolarHBondContact OG1-N 3.06Å; T109-K290 PolarHBondContact OG1-O 3.25Å
110	N	97.1	Very high	95.9	Very high	57 Å²	57	48.3 Å²	48.3	31%	0.305	24%	0.235	S	C	.	.	S	Bend	trans	54.7	36.2	-176.9	-162	25.2	0	0	0	112.3	F112 P251 D252 F287 N288	N110-F112 VanDerWaalsContact OD1-CE2 3.22Å; N110-F112 WeakPolarHBondContact OD1-CE2 3.29Å; N110-P251 PolarHBondContact N-O 3.36Å; N110-D252 PolarHBondContact N-OD1 3.46Å; N110-F287 PolarHBondContact ND2-O 2.91Å; N110-N288 PolarHBondContact ND2-O 2.65Å
111	Y	97.4	Very high	96.4	Very high	23 Å²	23	47 Å²	47	9%	0.09	22%	0.222	C	C	.	.			trans	-120.7	104.5	-179.2	-168	-71.3	0	0	0	110.9	L108 T109 Q113 Y118 S162 W244 P251 F253 Y282 F287	L108-Y111 HydrophobicContact CD1-CD2 4.21Å; L108-Y111 HydrophobicContact CD1-CG 4.31Å; T109-Y111 PolarHBondContact O-N 2.8Å; Y111-Q113 HydrophobicContact CD1-CG 3.58Å; Y111-Q113 HydrophobicContact CE1-CG 3.53Å; Y111-Q113 PolarHBondContact O-N 3.29Å; Y111-Y118 AromaticContact CE1-CZ 3.97Å; Y111-Y118 WeakPolarHBondContact CE1-OH 3.25Å; Y111-Y118 PolarHBondContact OH-OH 3.06Å; Y111-S162 VanDerWaalsContact OH-CB 3.24Å; Y111-S162 WeakPolarHBondContact OH-CB 3.49Å; Y111-S162 PolarHBondContact OH-OG 2.99Å; Y111-S162 VanDerWaalsContact OH-OG 3.12Å; Y111-W244 HydrophobicContact CE1-CH2 4.06Å; Y111-W244 HydrophobicContact CE1-CZ2 4.34Å; Y111-W244 AromaticContact CZ-CH2 3.94Å; Y111-P251 PolarHBondContact N-O 2.89Å; Y111-P251 WeakPolarHBondContact O-CA 3.47Å; Y111-F253 AromaticContact CD1-CE1 3.78Å; Y111-F253 HydrophobicContact CD1-CE1 3.78Å; Y111-F253 AromaticContact CD1-CZ 3.94Å; Y111-F253 HydrophobicContact CD1-CZ 3.94Å; Y111-F253 HydrophobicContact CG-CE1 4.15Å; Y111-F253 HydrophobicContact CG-CZ 4.33Å; Y111-F253 WeakPolarHBondContact O-CE1 3.43Å; Y111-Y282 HydrophobicContact CE2-CE1 4.2Å; Y111-Y282 WeakPolarHBondContact CE2-OH 3.49Å; Y111-Y282 PolarHBondContact OH-OH 3.14Å; Y111-F287 AromaticContact CD2-CE2 3.9Å; Y111-F287 HydrophobicContact CD2-CE2 3.9Å; Y111-F287 AromaticContact CD2-CZ 3.7Å; Y111-F287 HydrophobicContact CD2-CZ 3.7Å; Y111-F287 HydrophobicContact CE2-CZ 4.15Å
112	F	96.9	Very high	96.5	Very high	109 Å²	109	45.8 Å²	45.8	48%	0.478	21%	0.211	S	C	.	.			trans	-87	73.9	-168.8	-62.4	-90.6	0	0	0	113.9	N110 N114 Q115 P251	N110-F112 VanDerWaalsContact OD1-CE2 3.22Å; N110-F112 WeakPolarHBondContact OD1-CE2 3.29Å; F112-N114 PolarHBondContact O-N 2.92Å; F112-Q115 HydrophobicContact CB-CB 4.47Å; F112-Q115 WeakPolarHBondContact O-CB 3.37Å; F112-Q115 PolarHBondContact O-N 3.05Å; F112-P251 HydrophobicContact CD1-CB 3.73Å; F112-P251 HydrophobicContact CD1-CG 4.33Å; F112-P251 HydrophobicContact CE1-CB 3.56Å; F112-P251 HydrophobicContact CE1-CG 3.88Å; F112-P251 HydrophobicContact CE2-CB 4.4Å; F112-P251 HydrophobicContact CG-CB 4.22Å; F112-P251 HydrophobicContact CZ-CB 3.91Å; F112-P251 HydrophobicContact CZ-CG 4.41Å
113	Q	97	Very high	96.6	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-18.7	173.3	-69.3	-161.1	-16.8	0	0	114.1	Y111 Q115 Y118 A248 F253	Y111-Q113 HydrophobicContact CD1-CG 3.58Å; Y111-Q113 HydrophobicContact CE1-CG 3.53Å; Y111-Q113 PolarHBondContact O-N 3.29Å; Q113-Q115 VanDerWaalsContact C-N 3.33Å; Q113-Y118 HydrophobicContact CB-CD1 4.47Å; Q113-Y118 HydrophobicContact CB-CE1 3.95Å; Q113-Y118 HydrophobicContact CG-CE1 3.87Å; Q113-Y118 WeakPolarHBondContact O-CD1 3.35Å; Q113-A248 HydrophobicContact CB-CB 4.33Å; Q113-F253 HydrophobicContact CG-CE1 3.84Å; Q113-F253 HydrophobicContact CG-CZ 3.92Å
114	N	96.2	Very high	96.6	Very high	77 Å²	77	48.4 Å²	48.4	41%	0.412	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-2.1	-179.2	64.2	-10.6	0	0	0	113.7	F112 R116 A249	F112-N114 PolarHBondContact O-N 2.92Å; N114-R116 PolarHBondContact O-N 3.07Å; N114-A249 PolarHBondContact ND2-O 2.95Å
115	Q	96.3	Very high	96.6	Very high	97 Å²	97	51.9 Å²	51.9	45%	0.453	25%	0.245	S	C	.	.			trans	-63.4	131.8	175.7	-165.9	-94.5	19.1	0	0	110.1	F112 Q113 K117 Y118 G119	F112-Q115 HydrophobicContact CB-CB 4.47Å; F112-Q115 WeakPolarHBondContact O-CB 3.37Å; F112-Q115 PolarHBondContact O-N 3.05Å; Q113-Q115 VanDerWaalsContact C-N 3.33Å; Q115-K117 PolarHBondContact O-N 3.24Å; Q115-Y118 PolarHBondContact O-N 3.43Å; Q115-G119 PolarHBondContact O-N 2.98Å
116	R	94.8	Very high	96.5	Very high	224 Å²	224	50.3 Å²	50.3	85%	0.845	24%	0.239	S	C	*	.	H	α-helix	trans	-54.3	-50.2	-168.4	-179.6	-178.3	172.7	-158.2	-1.8	113.5	N114 A120	N114-R116 PolarHBondContact O-N 3.07Å; R116-A120 VanDerWaalsContact O-CB 3.24Å; R116-A120 WeakPolarHBondContact O-CB 3.33Å; R116-A120 PolarHBondContact O-N 3.3Å
117	K	94.4	Very high	96.4	Very high	169 Å²	169	50.2 Å²	50.2	74%	0.735	24%	0.238	S	C	*	.	H	α-helix	trans	-68.3	-46.1	-177.2	-68.4	-171.9	176.2	-175	0	111	Q115 G119 A120 S121	Q115-K117 PolarHBondContact O-N 3.24Å; K117-G119 VanDerWaalsContact C-N 3.33Å; K117-G119 PolarHBondContact O-N 3.06Å; K117-A120 PolarHBondContact O-N 3.33Å; K117-S121 WeakPolarHBondContact O-CB 3.23Å; K117-S121 PolarHBondContact O-N 2.95Å
118	Y	96	Very high	96.3	Very high	33 Å²	33	55.2 Å²	55.2	13%	0.129	26%	0.257	C	S	.	.	H	α-helix	trans	-56.8	-48.1	176.2	177.1	-88.4	0	0	0	111.2	Y111 Q113 Q115 S121 A158 L159 S162 W244	Y111-Y118 AromaticContact CE1-CZ 3.97Å; Y111-Y118 WeakPolarHBondContact CE1-OH 3.25Å; Y111-Y118 PolarHBondContact OH-OH 3.06Å; Q113-Y118 HydrophobicContact CB-CD1 4.47Å; Q113-Y118 HydrophobicContact CB-CE1 3.95Å; Q113-Y118 HydrophobicContact CG-CE1 3.87Å; Q113-Y118 WeakPolarHBondContact O-CD1 3.35Å; Q115-Y118 PolarHBondContact O-N 3.43Å; Y118-S121 PolarHBondContact O-N 2.77Å; Y118-A158 HydrophobicContact CD2-CB 3.99Å; Y118-A158 HydrophobicContact CE2-CB 4.44Å; Y118-L159 HydrophobicContact CD1-CD1 4.48Å; Y118-L159 HydrophobicContact CE1-CD1 3.53Å; Y118-S162 WeakPolarHBondContact CE2-OG 3.41Å; Y118-S162 PolarHBondContact OH-OG 2.87Å; Y118-W244 WeakPolarHBondContact OH-CZ2 3.36Å
119	G	93.1	Very high	96.1	Very high	1 Å²	1	55.7 Å²	55.7	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-74.5	-26	-176.5	0	0	0	0	0	114.5	Q115 K117 R247	Q115-G119 PolarHBondContact O-N 2.98Å; K117-G119 VanDerWaalsContact C-N 3.33Å; K117-G119 PolarHBondContact O-N 3.06Å; G119-R247 WeakPolarHBondContact O-CD 3.34Å; G119-R247 PolarHBondContact O-NH1 3.35Å
120	A	94.9	Very high	96	Very high	48 Å²	48	57.6 Å²	57.6	40%	0.397	27%	0.272	S	S	.	.	H	α-helix	trans	-81.4	-21.3	172.6	0	0	0	0	0	112.6	R116 K117 K122	R116-A120 VanDerWaalsContact O-CB 3.24Å; R116-A120 WeakPolarHBondContact O-CB 3.33Å; R116-A120 PolarHBondContact O-N 3.3Å; K117-A120 PolarHBondContact O-N 3.33Å; A120-K122 VanDerWaalsContact C-N 3.31Å; A120-K122 PolarHBondContact O-N 3.27Å
121	S	97.1	Very high	95.9	Very high	4 Å²	4	58 Å²	58	3%	0.028	27%	0.274	C	S	.	.			trans	-75.3	78.5	-174.8	-168.4	0	0	0	0	113	K117 Y118 D140 C141 G157 A158 L159	K117-S121 WeakPolarHBondContact O-CB 3.23Å; K117-S121 PolarHBondContact O-N 2.95Å; Y118-S121 PolarHBondContact O-N 2.77Å; S121-D140 VanDerWaalsContact CA-O 3.26Å; S121-D140 WeakPolarHBondContact CA-O 3.07Å; S121-D140 PolarHBondContact OG-O 3.45Å; S121-C141 PolarHBondContact OG-O 3.16Å; S121-G157 CarbonylContact O-C 3.54Å; S121-G157 VanDerWaalsContact O-CA 3.28Å; S121-G157 WeakPolarHBondContact O-CA 3.43Å; S121-G157 WeakPolarHBondContact OG-CA 3.22Å; S121-A158 PolarHBondContact O-N 3.21Å; S121-A158 PolarHBondContact OG-N 3.3Å; S121-L159 PolarHBondContact O-N 3.45Å
122	K	96	Very high	95.7	Very high	31 Å²	31	62.1 Å²	62.1	14%	0.135	30%	0.298	C	S	.	.	S	Bend	trans	-161.9	159	173.6	63.8	-178.1	177.8	69.8	0	109.6	A120 D124 L127 C141 L159 M245	A120-K122 VanDerWaalsContact C-N 3.31Å; A120-K122 PolarHBondContact O-N 3.27Å; K122-D124 IonicContact NZ-OD1 3.52Å; K122-D124 PolarHBondContact NZ-OD1 3.16Å; K122-D124 IonicContact NZ-OD2 2.93Å; K122-D124 PolarHBondContact NZ-OD2 3.15Å; K122-L127 HydrophobicContact CB-CD1 4.19Å; K122-C141 VanDerWaalsContact CA-SG 3.58Å; K122-L159 HydrophobicContact CD-CD2 4.11Å; K122-M245 HydrophobicContact CB-CE 4.28Å; K122-M245 HydrophobicContact CD-CE 4.41Å
123	D	97.1	Very high	95.6	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.027	29%	0.29	C	S	.	.			trans	-115.7	109.5	173.3	-175.5	-28.2	0	0	0	109.8	N125 Q126 L127 Y133 S138 C141 C156	D123-N125 VanDerWaalsContact C-N 3.34Å; D123-N125 PolarHBondContact O-N 2.79Å; D123-N125 PolarHBondContact OD1-N 3.46Å; D123-Q126 HydrophobicContact CB-CB 3.76Å; D123-Q126 PolarHBondContact O-N 3.03Å; D123-Q126 PolarHBondContact OD1-N 3.25Å; D123-L127 WeakPolarHBondContact O-CB 3.24Å; D123-L127 VanDerWaalsContact O-CD1 3.32Å; D123-L127 WeakPolarHBondContact O-CD1 3.11Å; D123-L127 WeakPolarHBondContact O-CG 3.32Å; D123-L127 PolarHBondContact O-N 3.48Å; D123-Y133 VanDerWaalsContact OD2-CD1 3.3Å; D123-Y133 WeakPolarHBondContact OD2-CD1 3.43Å; D123-S138 WeakPolarHBondContact OD2-CB 3.03Å; D123-S138 PolarHBondContact OD2-N 2.04Å; D123-C141 PolarHBondContact N-SG 3.31Å; D123-C141 VanDerWaalsContact N-SG 3.44Å; D123-C156 WeakPolarHBondContact CB-SG 3.1Å
124	D	96.3	Very high	95.5	Very high	79 Å²	79	60.9 Å²	60.9	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-67.4	-32.6	-177.7	-73.3	-51.6	0	0	0	113	K122 L127 Y128	K122-D124 IonicContact NZ-OD1 3.52Å; K122-D124 PolarHBondContact NZ-OD1 3.16Å; K122-D124 IonicContact NZ-OD2 2.93Å; K122-D124 PolarHBondContact NZ-OD2 3.15Å; D124-L127 PolarHBondContact O-N 3.21Å; D124-Y128 WeakPolarHBondContact O-CB 3.48Å; D124-Y128 PolarHBondContact O-N 3.34Å
125	N	96.6	Very high	95.2	Very high	74 Å²	74	61.5 Å²	61.5	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-72.8	-37.7	179.3	-65.1	-42.1	0	0	0	110.7	D123 L127 Y128 G129 D130 Y133	D123-N125 VanDerWaalsContact C-N 3.34Å; D123-N125 PolarHBondContact O-N 2.79Å; D123-N125 PolarHBondContact OD1-N 3.46Å; N125-L127 VanDerWaalsContact C-N 3.35Å; N125-Y128 PolarHBondContact O-N 3.27Å; N125-G129 PolarHBondContact O-N 2.92Å; N125-D130 WeakPolarHBondContact O-CB 3.1Å; N125-D130 PolarHBondContact O-N 3.4Å; N125-Y133 HydrophobicContact CB-CD1 3.96Å; N125-Y133 HydrophobicContact CB-CD2 3.38Å; N125-Y133 HydrophobicContact CB-CE1 4.07Å; N125-Y133 HydrophobicContact CB-CE2 3.5Å; N125-Y133 HydrophobicContact CB-CG 3.62Å; N125-Y133 PolarHBondContact ND2-OH 3.35Å
126	Q	96.1	Very high	95.1	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-45.2	171.4	-169.6	-174.7	78.8	0	0	111.2	D123 Y128 G129 Y133 F134 I153 V154 P155 F236	D123-Q126 HydrophobicContact CB-CB 3.76Å; D123-Q126 PolarHBondContact O-N 3.03Å; D123-Q126 PolarHBondContact OD1-N 3.25Å; Q126-Y128 PolarHBondContact O-N 3.5Å; Q126-G129 PolarHBondContact O-N 3.17Å; Q126-Y133 PolarHBondContact NE2-O 2.9Å; Q126-F134 HydrophobicContact CG-CD1 3.76Å; Q126-F134 HydrophobicContact CG-CE1 3.91Å; Q126-I153 PolarHBondContact NE2-O 3.05Å; Q126-V154 HydrophobicContact CG-CG1 4.1Å; Q126-P155 VanDerWaalsContact OE1-CA 3.26Å; Q126-F236 WeakPolarHBondContact O-CE2 3.44Å
127	L	96.8	Very high	94.9	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-70.5	-19.1	179.2	-67.5	166.1	0	0	0	113.4	K122 D123 D124 N125 G129 P155 Y198 R199 F236 F241 M245	K122-L127 HydrophobicContact CB-CD1 4.19Å; D123-L127 WeakPolarHBondContact O-CB 3.24Å; D123-L127 VanDerWaalsContact O-CD1 3.32Å; D123-L127 WeakPolarHBondContact O-CD1 3.11Å; D123-L127 WeakPolarHBondContact O-CG 3.32Å; D123-L127 PolarHBondContact O-N 3.48Å; D124-L127 PolarHBondContact O-N 3.21Å; N125-L127 VanDerWaalsContact C-N 3.35Å; L127-G129 VanDerWaalsContact C-N 3.28Å; L127-P155 HydrophobicContact CD2-CB 4.04Å; L127-Y198 HydrophobicContact CB-CD1 3.8Å; L127-Y198 HydrophobicContact CB-CE1 3.91Å; L127-Y198 HydrophobicContact CD1-CE1 3.96Å; L127-Y198 HydrophobicContact CD2-CD1 4.33Å; L127-Y198 HydrophobicContact CD2-CE1 4.17Å; L127-Y198 HydrophobicContact CG-CD1 4.47Å; L127-Y198 HydrophobicContact CG-CE1 4.22Å; L127-Y198 WeakPolarHBondContact O-CA 3.28Å; L127-R199 PolarHBondContact O-N 3.44Å; L127-R199 VanDerWaalsContact O-N 3.16Å; L127-F236 HydrophobicContact CD2-CD1 4.09Å; L127-F236 HydrophobicContact CD2-CE1 4.21Å; L127-F241 HydrophobicContact CD2-CE1 3.88Å; L127-F241 HydrophobicContact CD2-CZ 3.64Å; L127-M245 HydrophobicContact CD1-CE 3.52Å; L127-M245 HydrophobicContact CD2-CE 4.2Å
128	Y	95.7	Very high	94.9	Very high	107 Å²	107	43.8 Å²	43.8	42%	0.42	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-1.9	168.9	-164.7	-100.5	0	0	0	112.9	D124 N125 Q126 I196 K197 R199	D124-Y128 WeakPolarHBondContact O-CB 3.48Å; D124-Y128 PolarHBondContact O-N 3.34Å; N125-Y128 PolarHBondContact O-N 3.27Å; Q126-Y128 PolarHBondContact O-N 3.5Å; Y128-I196 WeakPolarHBondContact CE2-O 3.3Å; Y128-K197 WeakPolarHBondContact CD2-O 3.48Å; Y128-R199 CarbonylContact C-O 3.45Å; Y128-R199 HydrophobicContact CD2-CG 4.33Å; Y128-R199 HydrophobicContact CE2-CG 4.2Å; Y128-R199 WeakPolarHBondContact O-CB 3.35Å; Y128-R199 VanDerWaalsContact OH-CZ 3.24Å; Y128-R199 PolarHBondContact OH-NH1 3.06Å
129	G	94.6	Very high	94.8	Very high	11 Å²	11	47.3 Å²	47.3	11%	0.113	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.9	18.7	176.1	0	0	0	0	0	114.9	N125 Q126 L127 L131 R199	N125-G129 PolarHBondContact O-N 2.92Å; Q126-G129 PolarHBondContact O-N 3.17Å; L127-G129 VanDerWaalsContact C-N 3.28Å; G129-L131 PolarHBondContact O-N 3Å; G129-R199 WeakPolarHBondContact CA-O 3.17Å; G129-R199 PolarHBondContact N-O 2.95Å
130	D	95.3	Very high	94.9	Very high	55 Å²	55	52 Å²	52	29%	0.294	29%	0.289	S	S	.	.			trans	-74.4	115.4	172	-173.1	-15.4	0	0	0	110.6	N125 N132 Y133 F134	N125-D130 WeakPolarHBondContact O-CB 3.1Å; N125-D130 PolarHBondContact O-N 3.4Å; D130-N132 PolarHBondContact O-N 2.91Å; D130-N132 WeakPolarHBondContact OD1-CB 3.45Å; D130-N132 PolarHBondContact OD1-N 3.41Å; D130-N132 PolarHBondContact OD1-ND2 3Å; D130-Y133 HydrophobicContact CB-CD2 3.93Å; D130-Y133 PolarHBondContact O-N 3.15Å; D130-Y133 WeakPolarHBondContact OD2-CD2 3.21Å; D130-Y133 WeakPolarHBondContact OD2-CE2 3.22Å; D130-F134 VanDerWaalsContact O-CD1 3.26Å; D130-F134 WeakPolarHBondContact O-CD1 3.46Å
131	L	94.5	Very high	94.9	Very high	67 Å²	67	49.7 Å²	49.7	35%	0.351	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.1	-176.6	-62	173.3	0	0	0	113.2	G129 Y133 F134 P201 I203 A209	G129-L131 PolarHBondContact O-N 3Å; L131-Y133 VanDerWaalsContact C-N 3.28Å; L131-Y133 PolarHBondContact O-N 3.24Å; L131-F134 HydrophobicContact CD2-CD2 4.2Å; L131-F134 HydrophobicContact CD2-CE2 4.17Å; L131-F134 HydrophobicContact CD2-CG 4.49Å; L131-F134 HydrophobicContact CD2-CZ 4.43Å; L131-F134 WeakPolarHBondContact O-CB 3.28Å; L131-F134 PolarHBondContact O-N 2.83Å; L131-F134 VanDerWaalsContact O-N 3.16Å; L131-P201 HydrophobicContact CD2-CB 3.74Å; L131-P201 HydrophobicContact CD2-CG 4.33Å; L131-P201 HydrophobicContact CG-CB 4.35Å; L131-I203 HydrophobicContact CD1-CD1 3.45Å; L131-I203 VanDerWaalsContact CD1-CD1 3.45Å; L131-I203 HydrophobicContact CD1-CG1 4.17Å; L131-I203 HydrophobicContact CD2-CD1 4.23Å; L131-I203 HydrophobicContact CG-CD1 4.5Å; L131-A209 HydrophobicContact CD2-CB 4.2Å
132	N	94.2	Very high	94.7	Very high	108 Å²	108	53.8 Å²	53.8	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-61.5	-43.5	176	-63.8	-48.3	0	0	0	110.3	D130 F134 T135 S136	D130-N132 PolarHBondContact O-N 2.91Å; D130-N132 WeakPolarHBondContact OD1-CB 3.45Å; D130-N132 PolarHBondContact OD1-N 3.41Å; D130-N132 PolarHBondContact OD1-ND2 3Å; N132-F134 PolarHBondContact O-N 2.97Å; N132-T135 PolarHBondContact O-N 2.93Å; N132-T135 VanDerWaalsContact O-N 3.14Å; N132-T135 PolarHBondContact O-OG1 3.08Å; N132-S136 PolarHBondContact O-N 3.01Å; N132-S136 VanDerWaalsContact O-N 3.12Å; N132-S136 PolarHBondContact O-OG 3.26Å
133	Y	94.6	Very high	94.6	Very high	79 Å²	79	57.1 Å²	57.1	31%	0.31	32%	0.316	S	S	.	.	H	α-helix	trans	-76	-3.9	179.2	-67	-92.1	0	0	0	113.8	D123 N125 Q126 D130 L131 P137	D123-Y133 VanDerWaalsContact OD2-CD1 3.3Å; D123-Y133 WeakPolarHBondContact OD2-CD1 3.43Å; N125-Y133 HydrophobicContact CB-CD1 3.96Å; N125-Y133 HydrophobicContact CB-CD2 3.38Å; N125-Y133 HydrophobicContact CB-CE1 4.07Å; N125-Y133 HydrophobicContact CB-CE2 3.5Å; N125-Y133 HydrophobicContact CB-CG 3.62Å; N125-Y133 PolarHBondContact ND2-OH 3.35Å; Q126-Y133 PolarHBondContact NE2-O 2.9Å; D130-Y133 HydrophobicContact CB-CD2 3.93Å; D130-Y133 PolarHBondContact O-N 3.15Å; D130-Y133 WeakPolarHBondContact OD2-CD2 3.21Å; D130-Y133 WeakPolarHBondContact OD2-CE2 3.22Å; L131-Y133 VanDerWaalsContact C-N 3.28Å; L131-Y133 PolarHBondContact O-N 3.24Å; Y133-P137 WeakPolarHBondContact O-CA 3.17Å
134	F	94.3	Very high	94.5	Very high	4 Å²	4	60.7 Å²	60.7	2%	0.018	33%	0.33	C	S	.	.	H	α-helix	trans	-77.4	-32.3	167.9	-76.1	36.9	0	0	0	110.9	Q126 D130 L131 N132 P152 V154 P201 A209 F210 T213 F236	Q126-F134 HydrophobicContact CG-CD1 3.76Å; Q126-F134 HydrophobicContact CG-CE1 3.91Å; D130-F134 VanDerWaalsContact O-CD1 3.26Å; D130-F134 WeakPolarHBondContact O-CD1 3.46Å; L131-F134 HydrophobicContact CD2-CD2 4.2Å; L131-F134 HydrophobicContact CD2-CE2 4.17Å; L131-F134 HydrophobicContact CD2-CG 4.49Å; L131-F134 HydrophobicContact CD2-CZ 4.43Å; L131-F134 WeakPolarHBondContact O-CB 3.28Å; L131-F134 PolarHBondContact O-N 2.83Å; L131-F134 VanDerWaalsContact O-N 3.16Å; N132-F134 PolarHBondContact O-N 2.97Å; F134-P152 WeakPolarHBondContact O-CB 3.32Å; F134-P152 VanDerWaalsContact O-CG 3.31Å; F134-P152 WeakPolarHBondContact O-CG 3.33Å; F134-V154 HydrophobicContact CB-CG2 4.18Å; F134-V154 HydrophobicContact CD1-CG1 4.45Å; F134-V154 HydrophobicContact CD2-CG1 4.2Å; F134-V154 HydrophobicContact CD2-CG2 4.19Å; F134-V154 HydrophobicContact CE1-CG1 4.34Å; F134-V154 HydrophobicContact CE2-CG1 4.08Å; F134-V154 HydrophobicContact CG-CG1 4.39Å; F134-V154 HydrophobicContact CG-CG2 4.1Å; F134-V154 HydrophobicContact CZ-CG1 4.15Å; F134-P201 HydrophobicContact CE2-CG 4.47Å; F134-P201 HydrophobicContact CZ-CG 4.21Å; F134-A209 WeakPolarHBondContact CD2-O 3.41Å; F134-F210 HydrophobicContact CD2-CD1 4.28Å; F134-F210 HydrophobicContact CD2-CE1 4.42Å; F134-F210 AromaticContact CE2-CD1 3.74Å; F134-F210 HydrophobicContact CE2-CD1 3.74Å; F134-F210 AromaticContact CE2-CE1 3.53Å; F134-F210 HydrophobicContact CE2-CE1 3.53Å; F134-F210 HydrophobicContact CE2-CE2 4.45Å; F134-F210 HydrophobicContact CE2-CG 4.3Å; F134-F210 AromaticContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CE2-CZ 3.92Å; F134-F210 AromaticContact CZ-CE1 3.98Å; F134-F210 HydrophobicContact CZ-CE1 3.98Å; F134-F210 HydrophobicContact CZ-CZ 4.17Å; F134-T213 HydrophobicContact CB-CG2 4.2Å; F134-T213 HydrophobicContact CD2-CG2 4.28Å; F134-F236 AromaticContact CE1-CE2 3.86Å; F134-F236 HydrophobicContact CE1-CE2 3.86Å; F134-F236 HydrophobicContact CE1-CZ 4.16Å; F134-F236 AromaticContact CZ-CE2 3.54Å; F134-F236 HydrophobicContact CZ-CE2 3.54Å; F134-F236 AromaticContact CZ-CZ 3.89Å; F134-F236 HydrophobicContact CZ-CZ 3.89Å
135	T	91.5	Very high	94.5	Very high	91 Å²	91	58 Å²	58	56%	0.558	32%	0.316	S	S	*	.	H	α-helix	trans	-91.7	-35.3	-179.2	65.3	0	0	0	0	112.6	N132 R146	N132-T135 PolarHBondContact O-N 2.93Å; N132-T135 VanDerWaalsContact O-N 3.14Å; N132-T135 PolarHBondContact O-OG1 3.08Å; T135-R146 PolarHBondContact O-NH2 3.24Å
136	S	92.6	Very high	94.4	Very high	68 Å²	68	58.7 Å²	58.7	48%	0.476	31%	0.314	S	S	.	.	S	Bend	trans	-128.3	78.5	178	57.9	0	0	0	0	110.6	N132	N132-S136 PolarHBondContact O-N 3.01Å; N132-S136 VanDerWaalsContact O-N 3.12Å; N132-S136 PolarHBondContact O-OG 3.26Å
137	P	91.4	Very high	94.3	Very high	19 Å²	19	60.9 Å²	60.9	12%	0.123	33%	0.325	C	S	.	.			trans	-65.2	155	177.1	27	-34	0	0	0	112	Y133 T145 C156	Y133-P137 WeakPolarHBondContact O-CA 3.17Å; P137-T145 HydrophobicContact CB-CG2 4.48Å; P137-T145 HydrophobicContact CG-CG2 4.19Å; P137-C156 HydrophobicContact CB-CB 4.26Å
138	S	93.6	Very high	94	Very high	31 Å²	31	66 Å²	66	22%	0.217	36%	0.362	C	S	.	.			trans	-57	146.3	175.1	178.4	0	0	0	0	112.4	D123 D140 C141 T145	D123-S138 WeakPolarHBondContact OD2-CB 3.03Å; D123-S138 PolarHBondContact OD2-N 2.04Å; S138-D140 PolarHBondContact O-N 3.22Å; S138-D140 PolarHBondContact OG-N 3.21Å; S138-D140 PolarHBondContact OG-OD2 2.86Å; S138-C141 WeakPolarHBondContact O-CB 3.4Å; S138-C141 PolarHBondContact O-N 2.88Å; S138-T145 VanDerWaalsContact O-CG2 3.32Å; S138-T145 WeakPolarHBondContact O-CG2 3.45Å
139	T	94.1	Very high	93.7	Very high	107 Å²	107	69.1 Å²	69.1	66%	0.656	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-62.3	-19.6	172.7	52.1	0	0	0	0	112.9	C141 D142	T139-C141 PolarHBondContact O-N 2.81Å; T139-D142 WeakPolarHBondContact O-CB 3.42Å; T139-D142 PolarHBondContact O-N 2.85Å; T139-D142 VanDerWaalsContact O-N 3.11Å
140	D	94.8	Very high	93.6	Very high	98 Å²	98	74 Å²	74	52%	0.524	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-60.6	-28.4	176.1	-65.5	-37.6	0	0	0	112.1	S121 S138 D142	S121-D140 VanDerWaalsContact CA-O 3.26Å; S121-D140 WeakPolarHBondContact CA-O 3.07Å; S121-D140 PolarHBondContact OG-O 3.45Å; S138-D140 PolarHBondContact O-N 3.22Å; S138-D140 PolarHBondContact OG-N 3.21Å; S138-D140 PolarHBondContact OG-OD2 2.86Å; D140-D142 PolarHBondContact O-N 2.85Å
141	C	95.4	Very high	93.6	Very high	0 Å²	0	74.8 Å²	74.8	0%	0	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-72.5	-6.9	178.5	-85.6	0	0	0	0	114.1	S121 K122 D123 S138 T139 Y144 T145 C156 G157	S121-C141 PolarHBondContact OG-O 3.16Å; K122-C141 VanDerWaalsContact CA-SG 3.58Å; D123-C141 PolarHBondContact N-SG 3.31Å; D123-C141 VanDerWaalsContact N-SG 3.44Å; S138-C141 WeakPolarHBondContact O-CB 3.4Å; S138-C141 PolarHBondContact O-N 2.88Å; T139-C141 PolarHBondContact O-N 2.81Å; C141-Y144 CarbonylContact O-C 3.56Å; C141-Y144 WeakPolarHBondContact O-CA 3.44Å; C141-Y144 WeakPolarHBondContact O-CB 3.37Å; C141-Y144 PolarHBondContact O-N 2.83Å; C141-T145 HydrophobicContact CB-CG2 3.49Å; C141-T145 VanDerWaalsContact CB-CG2 3.49Å; C141-C156 HydrophobicContact CB-CB 3.57Å; C141-C156 WeakPolarHBondContact CB-SG 3.22Å; C141-C156 WeakPolarHBondContact SG-CB 3.29Å; C141-C156 PolarHBondContact SG-O 3.07Å; C141-C156 CovalentContact SG-SG 2.05Å; C141-C156 PolarHBondContact SG-SG 3.2Å; C141-G157 PolarHBondContact SG-N 2.82Å
142	D	93.2	Very high	93.6	Very high	91 Å²	91	72.1 Å²	72.1	49%	0.487	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	140.2	-175.3	-76.2	-25.6	0	0	0	112.7	T139 D140 T145	T139-D142 WeakPolarHBondContact O-CB 3.42Å; T139-D142 PolarHBondContact O-N 2.85Å; T139-D142 VanDerWaalsContact O-N 3.11Å; D140-D142 PolarHBondContact O-N 2.85Å; D142-T145 WeakPolarHBondContact OD1-CG2 3.33Å; D142-T145 PolarHBondContact OD1-OG1 2.92Å
143	P	94	Very high	93.8	Very high	100 Å²	100	67.2 Å²	67.2	65%	0.649	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	cis	-87.3	8.8	2.5	36.5	-37.5	0	0	0	114.6	T145	P143-T145 VanDerWaalsContact C-N 3.26Å; P143-T145 PolarHBondContact O-N 2.8Å
144	Y	95.9	Very high	93.9	Very high	81 Å²	81	63.5 Å²	63.5	32%	0.318	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	28.9	-174.1	-56.7	-81.5	0	0	0	113.3	C141 C156 G157 A158 N161	C141-Y144 CarbonylContact O-C 3.56Å; C141-Y144 WeakPolarHBondContact O-CA 3.44Å; C141-Y144 WeakPolarHBondContact O-CB 3.37Å; C141-Y144 PolarHBondContact O-N 2.83Å; Y144-C156 WeakPolarHBondContact O-CB 3.38Å; Y144-G157 PolarHBondContact O-N 2.97Å; Y144-A158 HydrophobicContact CD2-CB 3.69Å; Y144-A158 HydrophobicContact CE2-CB 3.45Å; Y144-A158 VanDerWaalsContact CE2-CB 3.45Å; Y144-N161 HydrophobicContact CD1-CB 4.13Å; Y144-N161 HydrophobicContact CE1-CB 4.36Å; Y144-N161 WeakPolarHBondContact CE1-ND2 3.48Å
145	T	95.8	Very high	94	Very high	21 Å²	21	63.3 Å²	63.3	13%	0.129	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-39	176.4	43.2	0	0	0	0	111.8	P137 S138 C141 D142 P143 I153	P137-T145 HydrophobicContact CB-CG2 4.48Å; P137-T145 HydrophobicContact CG-CG2 4.19Å; S138-T145 VanDerWaalsContact O-CG2 3.32Å; S138-T145 WeakPolarHBondContact O-CG2 3.45Å; C141-T145 HydrophobicContact CB-CG2 3.49Å; C141-T145 VanDerWaalsContact CB-CG2 3.49Å; D142-T145 WeakPolarHBondContact OD1-CG2 3.33Å; D142-T145 PolarHBondContact OD1-OG1 2.92Å; P143-T145 VanDerWaalsContact C-N 3.26Å; P143-T145 PolarHBondContact O-N 2.8Å; T145-I153 PolarHBondContact O-N 3.18Å
146	R	94.6	Very high	94.3	Very high	90 Å²	90	59 Å²	59	34%	0.34	32%	0.322	S	S	.	.	B	Isolated β-bridge	trans	-138.4	152.1	-176.2	-62	-174.8	175.6	-86.3	-10.8	111.6	T135 N150 M151	T135-R146 PolarHBondContact O-NH2 3.24Å; R146-N150 WeakPolarHBondContact CD-OD1 3.12Å; R146-N150 PolarHBondContact NH1-O 2.86Å; R146-M151 CarbonylContact C-O 3.46Å; R146-M151 WeakPolarHBondContact CA-O 3.34Å
147	D	92.8	Very high	94.5	Very high	47 Å²	47	55.8 Å²	55.8	25%	0.251	30%	0.3	S	S	.	.			trans	-78.3	168.5	170.6	-171.6	7.9	0	0	0	110.8	K149 N150 M151 I153	D147-K149 PolarHBondContact O-N 2.8Å; D147-N150 WeakPolarHBondContact O-CA 3.48Å; D147-N150 PolarHBondContact O-N 3.29Å; D147-M151 PolarHBondContact N-O 3.43Å; D147-I153 HydrophobicContact CB-CD1 4.4Å; D147-I153 HydrophobicContact CB-CG1 4.38Å
148	S	91.1	Very high	94.8	Very high	112 Å²	112	55.5 Å²	55.5	78%	0.783	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.2	-30.1	171.1	55.3	0	0	0	0	115.1	N150	S148-N150 VanDerWaalsContact C-N 3.32Å
149	K	90.8	Very high	94.9	Very high	172 Å²	172	54 Å²	54	75%	0.748	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	14.8	176.8	-61.3	-175.7	-179.3	-176.9	0	113.9	D147 M151	D147-K149 PolarHBondContact O-N 2.8Å; K149-M151 HydrophobicContact CB-CG 4.38Å; K149-M151 PolarHBondContact O-N 2.88Å
150	N	91.8	Very high	95.1	Very high	112 Å²	112	49 Å²	49	60%	0.599	26%	0.257	S	S	*	.	S	Bend	trans	62.3	17.7	-177.2	-156.4	47.4	0	0	0	115.1	R146 D147 S148	R146-N150 WeakPolarHBondContact CD-OD1 3.12Å; R146-N150 PolarHBondContact NH1-O 2.86Å; D147-N150 WeakPolarHBondContact O-CA 3.48Å; D147-N150 PolarHBondContact O-N 3.29Å; S148-N150 VanDerWaalsContact C-N 3.32Å
151	M	94.3	Very high	95.2	Very high	73 Å²	73	44.6 Å²	44.6	36%	0.36	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-80.9	134.6	175.9	-67.8	-68	-70.5	0	0	110.3	R146 D147 K149 G212 K214	R146-M151 CarbonylContact C-O 3.46Å; R146-M151 WeakPolarHBondContact CA-O 3.34Å; D147-M151 PolarHBondContact N-O 3.43Å; K149-M151 HydrophobicContact CB-CG 4.38Å; K149-M151 PolarHBondContact O-N 2.88Å; M151-G212 VanDerWaalsContact CE-C 3.44Å; M151-G212 WeakPolarHBondContact CE-O 3.12Å; M151-K214 HydrophobicContact CB-CB 4.38Å
152	P	96.3	Very high	95.3	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.071	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-67.1	137.2	-179.7	29.4	-34.1	0	0	0	111.5	F134 T213 K214	F134-P152 WeakPolarHBondContact O-CB 3.32Å; F134-P152 VanDerWaalsContact O-CG 3.31Å; F134-P152 WeakPolarHBondContact O-CG 3.33Å; P152-T213 HydrophobicContact CG-CG2 4.46Å; P152-T213 CarbonylContact O-C 3.56Å; P152-T213 WeakPolarHBondContact O-CA 3.35Å; P152-K214 PolarHBondContact O-N 3.32Å
153	I	97.2	Very high	95.5	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.021	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-91.7	134.3	-179.9	-66	173.6	0	0	0	109.8	Q126 T145 D147 P155 C156 K214 P216	Q126-I153 PolarHBondContact NE2-O 3.05Å; T145-I153 PolarHBondContact O-N 3.18Å; D147-I153 HydrophobicContact CB-CD1 4.4Å; D147-I153 HydrophobicContact CB-CG1 4.38Å; I153-P155 WeakPolarHBondContact CG2-O 3.43Å; I153-C156 WeakPolarHBondContact O-CB 3.44Å; I153-C156 PolarHBondContact O-N 2.96Å; I153-K214 CarbonylContact C-O 3.57Å; I153-K214 VanDerWaalsContact CA-O 3.28Å; I153-K214 WeakPolarHBondContact CA-O 3.45Å; I153-P216 HydrophobicContact CG2-CB 4.26Å; I153-P216 HydrophobicContact CG2-CG 4.13Å
154	V	96.7	Very high	95.6	Very high	2 Å²	2	38.3 Å²	38.3	1%	0.012	20%	0.195	C	C	.	.	S	Bend	trans	-136	121.6	176.5	-171.1	0	0	0	0	110.2	Q126 F134 F210 T213 K214 F236	Q126-V154 HydrophobicContact CG-CG1 4.1Å; F134-V154 HydrophobicContact CB-CG2 4.18Å; F134-V154 HydrophobicContact CD1-CG1 4.45Å; F134-V154 HydrophobicContact CD2-CG1 4.2Å; F134-V154 HydrophobicContact CD2-CG2 4.19Å; F134-V154 HydrophobicContact CE1-CG1 4.34Å; F134-V154 HydrophobicContact CE2-CG1 4.08Å; F134-V154 HydrophobicContact CG-CG1 4.39Å; F134-V154 HydrophobicContact CG-CG2 4.1Å; F134-V154 HydrophobicContact CZ-CG1 4.15Å; V154-F210 HydrophobicContact CB-CD1 4.16Å; V154-F210 HydrophobicContact CB-CE1 4.27Å; V154-F210 HydrophobicContact CG1-CD1 3.9Å; V154-F210 HydrophobicContact CG1-CE1 3.54Å; V154-T213 HydrophobicContact CG2-CG2 3.68Å; V154-K214 PolarHBondContact N-O 3.48Å; V154-F236 HydrophobicContact CG1-CE1 4.12Å; V154-F236 HydrophobicContact CG1-CZ 3.53Å
155	P	97.4	Very high	95.6	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	S	Bend	cis	-69.1	138.2	-9.3	27.3	-34.4	0	0	0	113.1	Q126 L127 I153 A160 P216 W219 I223 F236 F241	Q126-P155 VanDerWaalsContact OE1-CA 3.26Å; L127-P155 HydrophobicContact CD2-CB 4.04Å; I153-P155 WeakPolarHBondContact CG2-O 3.43Å; P155-A160 HydrophobicContact CB-CB 3.83Å; P155-A160 HydrophobicContact CG-CB 3.69Å; P155-P216 HydrophobicContact CG-CG 4.14Å; P155-P216 WeakPolarHBondContact O-CG 3.45Å; P155-W219 HydrophobicContact CG-CH2 3.69Å; P155-W219 HydrophobicContact CG-CZ2 3.98Å; P155-W219 HydrophobicContact CG-CZ3 4.27Å; P155-I223 HydrophobicContact CG-CD1 4.42Å; P155-F236 HydrophobicContact CB-CE1 3.98Å; P155-F236 HydrophobicContact CG-CE1 4.41Å; P155-F241 HydrophobicContact CB-CZ 4.25Å; P155-F241 HydrophobicContact CG-CE2 4Å; P155-F241 HydrophobicContact CG-CZ 4.09Å
156	C	97.1	Very high	95.6	Very high	1 Å²	1	36 Å²	36	1%	0.007	19%	0.188	C	C	.	.			trans	-78.3	161.3	175.5	72.9	0	0	0	0	112.4	D123 P137 C141 Y144 I153	D123-C156 WeakPolarHBondContact CB-SG 3.1Å; P137-C156 HydrophobicContact CB-CB 4.26Å; C141-C156 HydrophobicContact CB-CB 3.57Å; C141-C156 WeakPolarHBondContact CB-SG 3.22Å; C141-C156 WeakPolarHBondContact SG-CB 3.29Å; C141-C156 PolarHBondContact SG-O 3.07Å; C141-C156 CovalentContact SG-SG 2.05Å; C141-C156 PolarHBondContact SG-SG 3.2Å; Y144-C156 WeakPolarHBondContact O-CB 3.38Å; I153-C156 WeakPolarHBondContact O-CB 3.44Å; I153-C156 PolarHBondContact O-N 2.96Å
157	G	97.3	Very high	95.7	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.192	C	C	.	.	S	Bend	trans	103.1	155.2	169.3	0	0	0	0	0	115.4	S121 C141 Y144 L159 A160 N161	S121-G157 CarbonylContact O-C 3.54Å; S121-G157 VanDerWaalsContact O-CA 3.28Å; S121-G157 WeakPolarHBondContact O-CA 3.43Å; S121-G157 WeakPolarHBondContact OG-CA 3.22Å; C141-G157 PolarHBondContact SG-N 2.82Å; Y144-G157 PolarHBondContact O-N 2.97Å; G157-L159 VanDerWaalsContact C-N 3.26Å; G157-L159 PolarHBondContact O-N 2.85Å; G157-A160 PolarHBondContact O-N 3.3Å; G157-N161 WeakPolarHBondContact O-CB 3.48Å; G157-N161 PolarHBondContact O-N 3.28Å
158	A	96.9	Very high	95.9	Very high	13 Å²	13	33.2 Å²	33.2	11%	0.107	18%	0.182	C	C	.	.	H	α-helix	trans	-62.4	-35.6	-177.5	0	0	0	0	0	112.3	Y118 S121 Y144 S162	Y118-A158 HydrophobicContact CD2-CB 3.99Å; Y118-A158 HydrophobicContact CE2-CB 4.44Å; S121-A158 PolarHBondContact O-N 3.21Å; S121-A158 PolarHBondContact OG-N 3.3Å; Y144-A158 HydrophobicContact CD2-CB 3.69Å; Y144-A158 HydrophobicContact CE2-CB 3.45Å; Y144-A158 VanDerWaalsContact CE2-CB 3.45Å; A158-S162 WeakPolarHBondContact O-CB 3.21Å; A158-S162 PolarHBondContact O-N 2.88Å; A158-S162 PolarHBondContact O-OG 3.05Å
159	L	96.9	Very high	96.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-50.4	-179.6	-179.7	62.2	0	0	0	110.7	Y118 S121 K122 G157 S162 W244 M245 R247	Y118-L159 HydrophobicContact CD1-CD1 4.48Å; Y118-L159 HydrophobicContact CE1-CD1 3.53Å; S121-L159 PolarHBondContact O-N 3.45Å; K122-L159 HydrophobicContact CD-CD2 4.11Å; G157-L159 VanDerWaalsContact C-N 3.26Å; G157-L159 PolarHBondContact O-N 2.85Å; L159-S162 PolarHBondContact O-OG 2.79Å; L159-W244 PolarHBondContact O-NE1 3.12Å; L159-M245 HydrophobicContact CD2-CE 3.88Å; L159-M245 HydrophobicContact CD2-SD 4.03Å; L159-M245 HydrophobicContact CG-CE 4.24Å; L159-M245 HydrophobicContact CG-SD 3.85Å; L159-R247 HydrophobicContact CD1-CG 4.19Å; L159-R247 HydrophobicContact CD2-CG 4Å
160	A	97.1	Very high	96.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-69.3	-43.8	178.8	0	0	0	0	0	111.5	P155 G157 S162 M163 W219 F241 M245	P155-A160 HydrophobicContact CB-CB 3.83Å; P155-A160 HydrophobicContact CG-CB 3.69Å; G157-A160 PolarHBondContact O-N 3.3Å; A160-S162 PolarHBondContact O-N 2.04Å; A160-S162 VanDerWaalsContact O-N 3.14Å; A160-M163 WeakPolarHBondContact O-CB 3.44Å; A160-M163 PolarHBondContact O-N 2.72Å; A160-M163 VanDerWaalsContact O-N 3.13Å; A160-W219 HydrophobicContact CB-CZ2 4.46Å; A160-W219 WeakPolarHBondContact O-CZ2 3.49Å; A160-W219 PolarHBondContact O-NE1 3.14Å; A160-F241 HydrophobicContact CB-CE2 4.17Å; A160-M245 HydrophobicContact CB-CE 4.47Å; A160-M245 HydrophobicContact CB-SD 4Å
161	N	97.3	Very high	96.7	Very high	7 Å²	7	17.9 Å²	17.9	4%	0.037	10%	0.102	C	C	.	.	H	α-helix	trans	-58	-32.3	-177.7	-176.9	53.7	0	0	0	113.5	Y144 G157 M163 P216 T217 N218	Y144-N161 HydrophobicContact CD1-CB 4.13Å; Y144-N161 HydrophobicContact CE1-CB 4.36Å; Y144-N161 WeakPolarHBondContact CE1-ND2 3.48Å; G157-N161 WeakPolarHBondContact O-CB 3.48Å; G157-N161 PolarHBondContact O-N 3.28Å; N161-M163 VanDerWaalsContact C-N 3.33Å; N161-M163 PolarHBondContact O-N 2.85Å; N161-P216 HydrophobicContact CB-CB 4.14Å; N161-P216 WeakPolarHBondContact OD1-CB 3.21Å; N161-T217 PolarHBondContact OD1-N 2.72Å; N161-T217 VanDerWaalsContact OD1-N 3.13Å; N161-N218 PolarHBondContact ND2-ND2 2.94Å; N161-N218 WeakPolarHBondContact O-CB 3.35Å; N161-N218 PolarHBondContact OD1-N 3.22Å
162	S	96.6	Very high	96.7	Very high	19 Å²	19	15.1 Å²	15.1	13%	0.133	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	19.4	-178.4	58.4	0	0	0	0	114.6	Y111 Y118 A158 L159 A160 F164 W244 Y282	Y111-S162 VanDerWaalsContact OH-CB 3.24Å; Y111-S162 WeakPolarHBondContact OH-CB 3.49Å; Y111-S162 PolarHBondContact OH-OG 2.99Å; Y111-S162 VanDerWaalsContact OH-OG 3.12Å; Y118-S162 WeakPolarHBondContact CE2-OG 3.41Å; Y118-S162 PolarHBondContact OH-OG 2.87Å; A158-S162 WeakPolarHBondContact O-CB 3.21Å; A158-S162 PolarHBondContact O-N 2.88Å; A158-S162 PolarHBondContact O-OG 3.05Å; L159-S162 PolarHBondContact O-OG 2.79Å; A160-S162 PolarHBondContact O-N 2.04Å; A160-S162 VanDerWaalsContact O-N 3.14Å; S162-F164 PolarHBondContact O-N 2.96Å; S162-W244 WeakPolarHBondContact O-CZ2 3.39Å; S162-Y282 VanDerWaalsContact O-CE2 3.28Å; S162-Y282 WeakPolarHBondContact O-CE2 3.28Å; S162-Y282 PolarHBondContact O-OH 3.32Å
163	M	97.3	Very high	96.6	Very high	26 Å²	26	16.8 Å²	16.8	13%	0.128	10%	0.099	C	C	.	.			trans	-50.2	131	178.8	-175	176.1	173.7	0	0	113.2	A160 N161 W219 D240 F241 W244 Y282	A160-M163 WeakPolarHBondContact O-CB 3.44Å; A160-M163 PolarHBondContact O-N 2.72Å; A160-M163 VanDerWaalsContact O-N 3.13Å; N161-M163 VanDerWaalsContact C-N 3.33Å; N161-M163 PolarHBondContact O-N 2.85Å; M163-W219 HydrophobicContact CB-CZ2 4.05Å; M163-W219 HydrophobicContact SD-CH2 4.07Å; M163-W219 HydrophobicContact SD-CZ2 3.8Å; M163-D240 HydrophobicContact CE-CB 3.99Å; M163-F241 HydrophobicContact CE-CB 4.03Å; M163-F241 HydrophobicContact SD-CB 4.26Å; M163-F241 HydrophobicContact SD-CD2 3.85Å; M163-W244 HydrophobicContact CB-CG 4.28Å; M163-W244 HydrophobicContact CG-CB 4.24Å; M163-W244 HydrophobicContact CG-CG 4Å; M163-Y282 WeakPolarHBondContact O-CE2 3.46Å
164	F	97.1	Very high	96.3	Very high	14 Å²	14	19.6 Å²	19.6	6%	0.061	12%	0.115	C	C	.	.			trans	-61.1	132.6	175.3	-175.3	-94.9	0	0	0	111.4	Y67 Y106 L108 S162 D166 F168 W244 Y282 K291	Y67-F164 WeakPolarHBondContact OH-CZ 3.4Å; Y106-F164 AromaticContact CD1-CD1 3.97Å; Y106-F164 HydrophobicContact CD1-CD1 3.97Å; Y106-F164 AromaticContact CD1-CE1 3.93Å; Y106-F164 HydrophobicContact CD1-CE1 3.93Å; Y106-F164 AromaticContact CD2-CD1 3.95Å; Y106-F164 HydrophobicContact CD2-CD1 3.95Å; Y106-F164 HydrophobicContact CD2-CD2 4.15Å; Y106-F164 HydrophobicContact CD2-CE1 4.04Å; Y106-F164 HydrophobicContact CD2-CE2 4.22Å; Y106-F164 AromaticContact CD2-CG 3.99Å; Y106-F164 HydrophobicContact CD2-CG 3.99Å; Y106-F164 HydrophobicContact CD2-CZ 4.14Å; Y106-F164 AromaticContact CE1-CD1 3.93Å; Y106-F164 HydrophobicContact CE1-CD1 3.93Å; Y106-F164 HydrophobicContact CE1-CE1 4.37Å; Y106-F164 HydrophobicContact CE2-CB 3.97Å; Y106-F164 AromaticContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD2 4.19Å; Y106-F164 HydrophobicContact CE2-CE1 4.43Å; Y106-F164 AromaticContact CE2-CG 3.72Å; Y106-F164 HydrophobicContact CE2-CG 3.72Å; Y106-F164 AromaticContact CG-CD1 4Å; Y106-F164 HydrophobicContact CG-CD1 4Å; Y106-F164 AromaticContact CG-CE1 3.78Å; Y106-F164 HydrophobicContact CG-CE1 3.78Å; Y106-F164 HydrophobicContact CG-CG 4.5Å; Y106-F164 HydrophobicContact CG-CZ 4.08Å; Y106-F164 AromaticContact CZ-CD1 3.87Å; L108-F164 HydrophobicContact CD1-CD2 4.23Å; L108-F164 HydrophobicContact CD2-CD2 4.27Å; L108-F164 HydrophobicContact CD2-CE2 4.09Å; S162-F164 PolarHBondContact O-N 2.96Å; F164-D166 HydrophobicContact CE1-CB 3.69Å; F164-D166 HydrophobicContact CE2-CB 4.26Å; F164-D166 HydrophobicContact CZ-CB 3.44Å; F164-D166 VanDerWaalsContact CZ-CB 3.44Å; F164-D166 WeakPolarHBondContact CZ-OD2 3.44Å; F164-F168 AromaticContact CE1-CE2 3.82Å; F164-F168 HydrophobicContact CE1-CE2 3.82Å; F164-F168 HydrophobicContact CE1-CZ 4.08Å; F164-F168 HydrophobicContact CZ-CE2 4.19Å; F164-F168 AromaticContact CZ-CZ 3.95Å; F164-F168 HydrophobicContact CZ-CZ 3.95Å; F164-W244 HydrophobicContact CB-CE3 3.77Å; F164-W244 HydrophobicContact CB-CH2 4.45Å; F164-W244 HydrophobicContact CB-CZ3 3.72Å; F164-Y282 AromaticContact CD2-CD1 3.84Å; F164-Y282 HydrophobicContact CD2-CD1 3.84Å; F164-Y282 HydrophobicContact CD2-CD2 4.17Å; F164-Y282 HydrophobicContact CD2-CE1 4.26Å; F164-Y282 AromaticContact CD2-CG 3.77Å; F164-Y282 HydrophobicContact CD2-CG 3.77Å; F164-Y282 HydrophobicContact CE2-CD1 4.18Å; F164-Y282 HydrophobicContact CE2-CG 4.14Å; F164-K291 HydrophobicContact CE2-CD 4.38Å
165	N	95.4	Very high	95.8	Very high	49 Å²	49	27.4 Å²	27.4	26%	0.262	16%	0.157	S	C	.	.			trans	-138.3	15.3	-169.6	69.7	-6.6	0	0	0	114.8	N281 Y282	N165-N281 PolarHBondContact O-ND2 3.18Å; N165-N281 WeakPolarHBondContact OD1-CB 3.32Å; N165-Y282 WeakPolarHBondContact OD1-CA 3.44Å; N165-Y282 WeakPolarHBondContact OD1-CB 3.12Å; N165-Y282 WeakPolarHBondContact OD1-CD2 3.38Å; N165-Y282 PolarHBondContact OD1-N 3.19Å
166	D	96.1	Very high	95.2	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.021	19%	0.192	C	C	.	.			trans	-70.3	148.4	165.4	-63.4	-23.1	0	0	0	109.6	Y67 F164 F168 A279 N281 Y282 K291	Y67-D166 WeakPolarHBondContact CE2-OD2 3.01Å; Y67-D166 PolarHBondContact OH-OD2 3.18Å; F164-D166 HydrophobicContact CE1-CB 3.69Å; F164-D166 HydrophobicContact CE2-CB 4.26Å; F164-D166 HydrophobicContact CZ-CB 3.44Å; F164-D166 VanDerWaalsContact CZ-CB 3.44Å; F164-D166 WeakPolarHBondContact CZ-OD2 3.44Å; D166-F168 HydrophobicContact CB-CE2 4.45Å; D166-F168 HydrophobicContact CB-CZ 4.1Å; D166-A279 VanDerWaalsContact CA-O 3.31Å; D166-A279 WeakPolarHBondContact CA-O 3.45Å; D166-A279 WeakPolarHBondContact CB-O 3.49Å; D166-N281 WeakPolarHBondContact OD1-CA 3.49Å; D166-N281 PolarHBondContact OD1-N 2.79Å; D166-Y282 WeakPolarHBondContact OD1-CB 3.18Å; D166-Y282 PolarHBondContact OD1-N 3.21Å; D166-K291 IonicContact OD1-NZ 3.42Å; D166-K291 WeakPolarHBondContact OD2-CD 3.49Å; D166-K291 WeakPolarHBondContact OD2-CE 3.3Å; D166-K291 IonicContact OD2-NZ 3.71Å; D166-K291 PolarHBondContact OD2-NZ 3.14Å
167	T	96.1	Very high	94.9	Very high	70 Å²	70	35.5 Å²	35.5	43%	0.429	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	146.3	175.2	67.5	0	0	0	0	110.8	I278 A279	T167-I278 WeakPolarHBondContact O-CA 3.39Å; T167-A279 PolarHBondContact N-O 3.11Å; T167-A279 PolarHBondContact O-N 3.21Å; T167-A279 WeakPolarHBondContact OG1-CB 3.44Å
168	F	97.4	Very high	94.6	Very high	9 Å²	9	41.1 Å²	41.1	4%	0.039	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.6	-174.7	-54.1	-79.9	0	0	0	111	Y67 F104 F164 D166 Y257 L276 I278 V293	Y67-F168 HydrophobicContact CE1-CE1 4.13Å; Y67-F168 HydrophobicContact CE1-CZ 4.35Å; Y67-F168 HydrophobicContact CE2-CE1 4.38Å; Y67-F168 AromaticContact CZ-CE1 3.87Å; Y67-F168 AromaticContact CZ-CZ 3.94Å; Y67-F168 WeakPolarHBondContact OH-CZ 3.37Å; F104-F168 HydrophobicContact CE1-CB 4.29Å; F104-F168 HydrophobicContact CE1-CD1 4.32Å; F104-F168 AromaticContact CE1-CD2 3.87Å; F104-F168 HydrophobicContact CE1-CD2 3.87Å; F104-F168 HydrophobicContact CE1-CE2 4.25Å; F104-F168 AromaticContact CE1-CG 3.9Å; F104-F168 HydrophobicContact CE1-CG 3.9Å; F104-F168 HydrophobicContact CE2-CB 4.13Å; F104-F168 HydrophobicContact CZ-CB 3.58Å; F104-F168 AromaticContact CZ-CD1 3.87Å; F104-F168 HydrophobicContact CZ-CD1 3.87Å; F104-F168 AromaticContact CZ-CD2 4Å; F104-F168 HydrophobicContact CZ-CD2 4Å; F104-F168 AromaticContact CZ-CG 3.54Å; F104-F168 HydrophobicContact CZ-CG 3.54Å; F164-F168 AromaticContact CE1-CE2 3.82Å; F164-F168 HydrophobicContact CE1-CE2 3.82Å; F164-F168 HydrophobicContact CE1-CZ 4.08Å; F164-F168 HydrophobicContact CZ-CE2 4.19Å; F164-F168 AromaticContact CZ-CZ 3.95Å; F164-F168 HydrophobicContact CZ-CZ 3.95Å; D166-F168 HydrophobicContact CB-CE2 4.45Å; D166-F168 HydrophobicContact CB-CZ 4.1Å; F168-Y257 HydrophobicContact CB-CD1 4.38Å; F168-Y257 HydrophobicContact CB-CE1 3.84Å; F168-Y257 AromaticContact CD2-CD1 3.64Å; F168-Y257 HydrophobicContact CD2-CD1 3.64Å; F168-Y257 HydrophobicContact CD2-CD2 4.28Å; F168-Y257 AromaticContact CD2-CE1 3.49Å; F168-Y257 HydrophobicContact CD2-CE1 3.49Å; F168-Y257 VanDerWaalsContact CD2-CE1 3.49Å; F168-Y257 HydrophobicContact CD2-CE2 4.08Å; F168-Y257 HydrophobicContact CD2-CG 4.08Å; F168-Y257 AromaticContact CD2-CZ 3.7Å; F168-Y257 HydrophobicContact CE2-CD1 4.42Å; F168-Y257 HydrophobicContact CE2-CD2 4.48Å; F168-Y257 HydrophobicContact CE2-CE2 4.49Å; F168-Y257 HydrophobicContact CE2-CG 4.45Å; F168-Y257 HydrophobicContact CG-CD1 4.42Å; F168-Y257 HydrophobicContact CG-CE1 4.14Å; F168-L276 HydrophobicContact CB-CD1 4.16Å; F168-L276 HydrophobicContact CD1-CD1 4.25Å; F168-I278 HydrophobicContact CD1-CB 4.48Å; F168-I278 HydrophobicContact CD1-CG1 4.03Å; F168-I278 HydrophobicContact CD1-CG2 4.1Å; F168-I278 HydrophobicContact CE1-CD1 4.47Å; F168-I278 HydrophobicContact CE1-CG1 4.29Å; F168-I278 HydrophobicContact CE1-CG2 3.86Å; F168-V293 HydrophobicContact CD1-CG2 3.87Å; F168-V293 HydrophobicContact CE1-CG2 3.41Å; F168-V293 VanDerWaalsContact CE1-CG2 3.41Å; F168-V293 HydrophobicContact CZ-CG2 3.94Å
169	T	97.2	Very high	94.4	Very high	61 Å²	61	45.1 Å²	45.1	37%	0.374	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	124.4	168.2	-57.5	0	0	0	0	108.2	I180 T277	T169-I180 HydrophobicContact CG2-CG2 4.49Å; T169-T277 PolarHBondContact N-O 3.32Å; T169-T277 PolarHBondContact O-N 3.35Å
170	L	96.8	Very high	94.3	Very high	2 Å²	2	50.6 Å²	50.6	1%	0.01	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	128.5	-180	-178.1	65.1	0	0	0	109.3	F92 V181 L183 I260 Y274	F92-L170 HydrophobicContact CE1-CD1 3.99Å; F92-L170 HydrophobicContact CZ-CD1 3.91Å; L170-V181 HydrophobicContact CB-CB 4.18Å; L170-V181 HydrophobicContact CB-CG2 4.43Å; L170-V181 HydrophobicContact CD2-CB 4.05Å; L170-V181 HydrophobicContact CD2-CG1 4.14Å; L170-V181 HydrophobicContact CD2-CG2 4.02Å; L170-V181 HydrophobicContact CG-CB 4.07Å; L170-V181 HydrophobicContact CG-CG2 3.86Å; L170-V181 PolarHBondContact O-N 3.17Å; L170-L183 HydrophobicContact CB-CD2 4.43Å; L170-I260 HydrophobicContact CD2-CD1 4.1Å; L170-Y274 HydrophobicContact CD1-CD1 4.11Å; L170-Y274 HydrophobicContact CG-CD1 4.26Å
171	S	96.3	Very high	94.2	Very high	10 Å²	10	50.7 Å²	50.7	7%	0.07	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	134.9	178.3	-63.3	0	0	0	0	110.4	K179 Y274 T275	S171-K179 CarbonylContact C-O 3.56Å; S171-K179 WeakPolarHBondContact CA-O 3.46Å; S171-Y274 CarbonylContact O-C 3.53Å; S171-Y274 VanDerWaalsContact O-CA 3.29Å; S171-Y274 WeakPolarHBondContact O-CA 3.41Å; S171-T275 PolarHBondContact N-O 2.94Å; S171-T275 PolarHBondContact O-N 2.54Å
172	H	95.3	Very high	94	Very high	16 Å²	16	52.3 Å²	52.3	7%	0.074	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.4	175	-177	-154.6	0	0	0	109.8	V174 K179 V181 Y265 Y274	H172-V174 VanDerWaalsContact CE1-CG2 3.48Å; H172-V174 WeakPolarHBondContact CE1-CG2 3.5Å; H172-V174 WeakPolarHBondContact ND1-CG2 3.43Å; H172-K179 PolarHBondContact N-O 2.81Å; H172-K179 PolarHBondContact O-N 2.84Å; H172-V181 HydrophobicContact CB-CG2 4.05Å; H172-Y265 HydrophobicContact CB-CE1 4.47Å; H172-Y265 VanDerWaalsContact CB-OH 3.28Å; H172-Y265 WeakPolarHBondContact CB-OH 3.42Å; H172-Y265 AromaticContact ND1-CE1 3.9Å; H172-Y265 PolarHBondContact ND1-OH 3.43Å; H172-Y274 HydrophobicContact CB-CD1 3.89Å; H172-Y274 HydrophobicContact CB-CE1 3.5Å; H172-Y274 AromaticContact CD2-CE1 3.67Å; H172-Y274 AromaticContact CD2-CE2 3.71Å; H172-Y274 AromaticContact CD2-CZ 3.4Å; H172-Y274 VanDerWaalsContact CD2-CZ 3.4Å; H172-Y274 AromaticContact CG-CE1 3.58Å; H172-Y274 AromaticContact CG-CZ 3.67Å; H172-Y274 AromaticContact NE2-CZ 3.87Å
173	T	94.1	Very high	93.9	Very high	46 Å²	46	53.4 Å²	53.4	28%	0.282	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	110.1	179.8	-49.7	0	0	0	0	110.1	V177 N273	T173-V177 WeakPolarHBondContact CA-O 3.4Å; T173-N273 WeakPolarHBondContact CB-O 3.25Å; T173-N273 PolarHBondContact N-O 3.42Å; T173-N273 PolarHBondContact OG1-O 3.48Å
174	V	90.2	Very high	93.7	Very high	62 Å²	62	53.7 Å²	53.7	38%	0.376	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.1	179.1	-175.4	0	0	0	0	108.6	H172 G176 V177	H172-V174 VanDerWaalsContact CE1-CG2 3.48Å; H172-V174 WeakPolarHBondContact CE1-CG2 3.5Å; H172-V174 WeakPolarHBondContact ND1-CG2 3.43Å; V174-G176 PolarHBondContact O-N 2.86Å; V174-G176 VanDerWaalsContact O-N 3.16Å; V174-V177 PolarHBondContact N-O 2.86Å; V174-V177 PolarHBondContact O-N 3.03Å
175	N	86.1	Confident	93.4	Very high	166 Å²	166	53.6 Å²	53.6	89%	0.888	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.5	37.2	-179.8	-59.6	-23.6	0	0	0	114	V177	N175-V177 VanDerWaalsContact C-N 3.28Å; N175-V177 PolarHBondContact O-N 3.22Å
176	G	84.3	Confident	93.1	Very high	70 Å²	70	57.1 Å²	57.1	72%	0.722	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-5.1	-178.1	0	0	0	0	0	115.2	V174	V174-G176 PolarHBondContact O-N 2.86Å; V174-G176 VanDerWaalsContact O-N 3.16Å
177	V	91.1	Very high	92.9	Very high	101 Å²	101	59 Å²	59	61%	0.612	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100	132.2	176.8	-177.1	0	0	0	0	110	T173 V174 N175	T173-V177 WeakPolarHBondContact CA-O 3.4Å; V174-V177 PolarHBondContact N-O 2.86Å; V174-V177 PolarHBondContact O-N 3.03Å; N175-V177 VanDerWaalsContact C-N 3.28Å; N175-V177 PolarHBondContact O-N 3.22Å
178	Q	91.6	Very high	92.9	Very high	118 Å²	118	56.2 Å²	56.2	55%	0.551	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	114	174.5	-68.6	-171.5	31.8	0	0	110.6
179	K	93.3	Very high	92.8	Very high	97 Å²	97	56.5 Å²	56.5	42%	0.422	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	126.2	172.4	-176.6	171.6	-176.6	165.4	0	110	S171 H172 V181 D264	S171-K179 CarbonylContact C-O 3.56Å; S171-K179 WeakPolarHBondContact CA-O 3.46Å; H172-K179 PolarHBondContact N-O 2.81Å; H172-K179 PolarHBondContact O-N 2.84Å; K179-V181 PolarHBondContact O-N 2.85Å; K179-D264 IonicContact NZ-OD2 2.74Å; K179-D264 PolarHBondContact NZ-OD2 3.08Å
180	I	94.3	Very high	92.8	Very high	115 Å²	115	61.4 Å²	61.4	59%	0.59	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68	133	177.6	-60.9	173.2	0	0	0	109.5	T169	T169-I180 HydrophobicContact CG2-CG2 4.49Å
181	V	94.7	Very high	92.8	Very high	2 Å²	2	69.6 Å²	69.6	1%	0.012	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-83.3	124	173	-176.5	0	0	0	0	108.1	L170 H172 K179 L183 I260 Y265 L269 Y274	L170-V181 HydrophobicContact CB-CB 4.18Å; L170-V181 HydrophobicContact CB-CG2 4.43Å; L170-V181 HydrophobicContact CD2-CB 4.05Å; L170-V181 HydrophobicContact CD2-CG1 4.14Å; L170-V181 HydrophobicContact CD2-CG2 4.02Å; L170-V181 HydrophobicContact CG-CB 4.07Å; L170-V181 HydrophobicContact CG-CG2 3.86Å; L170-V181 PolarHBondContact O-N 3.17Å; H172-V181 HydrophobicContact CB-CG2 4.05Å; K179-V181 PolarHBondContact O-N 2.85Å; V181-L183 PolarHBondContact O-N 2.81Å; V181-I260 HydrophobicContact CG1-CD1 4.25Å; V181-I260 HydrophobicContact CG1-CG2 3.78Å; V181-Y265 HydrophobicContact CB-CE2 4.29Å; V181-Y265 HydrophobicContact CG1-CD1 4.48Å; V181-Y265 HydrophobicContact CG1-CD2 4.01Å; V181-Y265 HydrophobicContact CG1-CE2 4.06Å; V181-Y265 HydrophobicContact CG1-CG 4.21Å; V181-Y265 HydrophobicContact CG2-CE1 4.18Å; V181-Y265 HydrophobicContact CG2-CE2 4.18Å; V181-L269 HydrophobicContact CG1-CD2 4.13Å; V181-Y274 HydrophobicContact CG2-CD1 4.36Å; V181-Y274 HydrophobicContact CG2-CE1 4.07Å
182	P	93.7	Very high	92.9	Very high	42 Å²	42	72.4 Å²	72.4	27%	0.273	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-66	121.4	177.7	28.8	-34.5	0	0	0	109.7	D263 Y265	P182-D263 HydrophobicContact CG-CB 4.34Å; P182-D263 WeakPolarHBondContact CG-OD2 3.46Å; P182-Y265 HydrophobicContact CG-CD2 4.08Å
183	L	93.9	Very high	93	Very high	41 Å²	41	72.1 Å²	72.1	22%	0.215	39%	0.389	C	S	.	.			trans	-105.7	106.7	178	-63.4	-175.1	0	0	0	109.3	F104 L170 V181 Y257 R258 I260	F104-L183 HydrophobicContact CD2-CD2 4.21Å; L170-L183 HydrophobicContact CB-CD2 4.43Å; V181-L183 PolarHBondContact O-N 2.81Å; L183-Y257 HydrophobicContact CD1-CE1 4.47Å; L183-R258 HydrophobicContact CB-CB 3.83Å; L183-R258 HydrophobicContact CB-CG 3.76Å; L183-R258 HydrophobicContact CD1-CG 4.43Å; L183-R258 HydrophobicContact CD2-CB 4.37Å; L183-I260 HydrophobicContact CD2-CD1 3.92Å; L183-I260 HydrophobicContact CD2-CG1 3.82Å
184	D	92.3	Very high	93.1	Very high	32 Å²	32	72.7 Å²	72.7	17%	0.171	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-83	122.7	-179	-169.6	2.1	0	0	0	111.1	K186 R258 R259 H262	D184-K186 WeakPolarHBondContact OD1-CB 3.46Å; D184-K186 PolarHBondContact OD1-N 2.76Å; D184-R258 VanDerWaalsContact C-CD 3.45Å; D184-R258 CarbonylContact O-C 3.51Å; D184-R258 VanDerWaalsContact O-CA 3.25Å; D184-R258 WeakPolarHBondContact O-CA 3.39Å; D184-R258 VanDerWaalsContact O-CD 3.31Å; D184-R258 WeakPolarHBondContact O-CD 3.47Å; D184-R259 HydrophobicContact CB-CB 4.44Å; D184-R259 WeakPolarHBondContact CB-O 3.26Å; D184-R259 PolarHBondContact N-O 2.89Å; D184-R259 PolarHBondContact O-N 2.74Å; D184-H262 IonicContact OD2-CD2 3.13Å; D184-H262 IonicContact OD2-NE2 3.77Å; D184-H262 PolarHBondContact OD2-NE2 3.14Å
185	G	90.8	Very high	93.3	Very high	13 Å²	13	72.7 Å²	72.7	13%	0.134	38%	0.384	C	S	.	.			trans	-92.6	-2.5	175.2	0	0	0	0	0	114.2	I188 R258	G185-I188 WeakPolarHBondContact O-CG1 3.21Å; G185-R258 VanDerWaalsContact CA-CD 3.48Å
186	K	89.5	Confident	93.8	Very high	122 Å²	122	69 Å²	69	53%	0.53	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	142.9	-178.9	-55.4	-167.9	-168	-156.4	0	111.2	D184 I188 D230	D184-K186 WeakPolarHBondContact OD1-CB 3.46Å; D184-K186 PolarHBondContact OD1-N 2.76Å; K186-I188 VanDerWaalsContact C-N 3.34Å; K186-I188 PolarHBondContact O-N 3.32Å; K186-D230 VanDerWaalsContact CE-OD2 3.29Å; K186-D230 WeakPolarHBondContact CE-OD2 3.46Å; K186-D230 IonicContact NZ-OD2 2.68Å; K186-D230 PolarHBondContact NZ-OD2 3.28Å
187	G	91.4	Very high	94.4	Very high	44 Å²	44	70 Å²	70	45%	0.454	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.4	38.4	177.4	0	0	0	0	0	113.6	R259	G187-R259 PolarHBondContact O-NH1 2.98Å
188	I	96.3	Very high	94.7	Very high	12 Å²	12	65.4 Å²	65.4	6%	0.062	32%	0.32	C	S	.	.			trans	-96.5	-27.5	172.5	60.4	175.3	0	0	0	112	G185 K186 Q239 V243 L256 Y257 R259	G185-I188 WeakPolarHBondContact O-CG1 3.21Å; K186-I188 VanDerWaalsContact C-N 3.34Å; K186-I188 PolarHBondContact O-N 3.32Å; I188-Q239 HydrophobicContact CD1-CB 3.85Å; I188-Q239 HydrophobicContact CG1-CB 3.59Å; I188-Q239 HydrophobicContact CG1-CG 4.45Å; I188-Q239 VanDerWaalsContact N-OE1 3.11Å; I188-V243 HydrophobicContact CB-CG2 4.32Å; I188-V243 HydrophobicContact CD1-CG2 4.13Å; I188-V243 HydrophobicContact CG1-CG2 3.93Å; I188-L256 HydrophobicContact CB-CD2 3.7Å; I188-L256 HydrophobicContact CB-CG 3.93Å; I188-L256 HydrophobicContact CG2-CD2 3.83Å; I188-L256 HydrophobicContact CG2-CG 3.95Å; I188-Y257 VanDerWaalsContact CD1-O 3.27Å; I188-Y257 WeakPolarHBondContact CD1-O 3.43Å; I188-R259 HydrophobicContact CG2-CG 4.12Å
189	A	96.9	Very high	94.9	Very high	14 Å²	14	64.9 Å²	64.9	12%	0.116	31%	0.313	C	S	.	.	S	Bend	trans	-86.1	158.8	171.4	0	0	0	0	0	110.8	L242 V243	A189-L242 HydrophobicContact CB-CB 3.67Å; A189-L242 HydrophobicContact CB-CD1 3.87Å; A189-L242 HydrophobicContact CB-CG 4.44Å; A189-V243 HydrophobicContact CB-CG2 4.29Å
190	W	96.8	Very high	95	Very high	165 Å²	165	62.3 Å²	62.3	63%	0.625	30%	0.304	S	S	*	.			trans	-71.2	146.9	177.5	-74	75.2	0	0	0	111.2	T192 D193 Y194 R246	W190-T192 PolarHBondContact O-N 2.86Å; W190-D193 PolarHBondContact O-N 3.4Å; W190-Y194 PolarHBondContact O-N 2.92Å; W190-R246 VanDerWaalsContact CB-NH2 3.31Å; W190-R246 VanDerWaalsContact CD1-NH2 3.26Å
191	W	97.1	Very high	95	Very high	173 Å²	173	57.3 Å²	57.3	66%	0.655	28%	0.279	S	S	*	.	H	α-helix	trans	-56.1	-38.9	-179.6	-174.6	94.3	0	0	0	112.6	Y194 N195 I196	W191-Y194 PolarHBondContact O-N 2.92Å; W191-N195 HydrophobicContact CD2-CB 4.31Å; W191-N195 VanDerWaalsContact CE2-ND2 3.27Å; W191-N195 VanDerWaalsContact CG-ND2 3.31Å; W191-N195 HydrophobicContact CH2-CB 4.28Å; W191-N195 HydrophobicContact CZ2-CB 4.03Å; W191-N195 PolarHBondContact NE1-ND2 2.88Å; W191-N195 WeakPolarHBondContact O-CB 3.23Å; W191-N195 PolarHBondContact O-N 2.8Å; W191-N195 PolarHBondContact O-ND2 3.16Å; W191-I196 HydrophobicContact CE3-CD1 4.49Å; W191-I196 HydrophobicContact CH2-CD1 4.26Å; W191-I196 HydrophobicContact CH2-CG1 4.46Å; W191-I196 HydrophobicContact CZ3-CD1 3.62Å; W191-I196 HydrophobicContact CZ3-CG1 4.06Å
192	T	97.3	Very high	94.8	Very high	70 Å²	70	63.1 Å²	63.1	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-69.4	-36.5	178	50.3	0	0	0	0	112.9	W190 I196 K197	W190-T192 PolarHBondContact O-N 2.86Å; T192-I196 HydrophobicContact CG2-CD1 4.48Å; T192-I196 WeakPolarHBondContact O-CA 3.07Å; T192-I196 WeakPolarHBondContact O-CB 3.23Å; T192-I196 PolarHBondContact O-N 3.31Å; T192-I196 VanDerWaalsContact O-N 3.07Å; T192-K197 PolarHBondContact O-N 2.83Å
193	D	96.8	Very high	94.7	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.053	32%	0.322	C	S	.	.	I	π-helix	trans	-65	-46.5	175	-75.3	-10.1	0	0	0	109.7	W190 Y198 R246	W190-D193 PolarHBondContact O-N 3.4Å; D193-Y198 HydrophobicContact CB-CD2 4.22Å; D193-Y198 HydrophobicContact CB-CE2 4.28Å; D193-Y198 WeakPolarHBondContact O-CD2 3.48Å; D193-Y198 PolarHBondContact O-N 3.1Å; D193-R246 VanDerWaalsContact CG-NH2 3.26Å; D193-R246 IonicContact OD1-NH2 3.58Å; D193-R246 PolarHBondContact OD1-NH2 3.42Å; D193-R246 IonicContact OD2-CZ 2.8Å; D193-R246 VanDerWaalsContact OD2-CZ 3.28Å; D193-R246 IonicContact OD2-NE 3.28Å; D193-R246 PolarHBondContact OD2-NE 2.85Å; D193-R246 VanDerWaalsContact OD2-NE 3.09Å; D193-R246 IonicContact OD2-NH2 2.72Å; D193-R246 PolarHBondContact OD2-NH2 3.36Å
194	Y	96.6	Very high	94.4	Very high	57 Å²	57	68.2 Å²	68.2	22%	0.224	35%	0.349	C	S	.	.	I	π-helix	trans	-73.1	-39	-176.1	-178.6	-94.9	0	0	0	114.4	W190 W191 Y232 I237 L242	W190-Y194 PolarHBondContact O-N 2.92Å; W191-Y194 PolarHBondContact O-N 2.92Å; Y194-Y232 WeakPolarHBondContact CE2-O 3.44Å; Y194-Y232 PolarHBondContact OH-O 2.83Å; Y194-I237 HydrophobicContact CD2-CB 4.19Å; Y194-I237 WeakPolarHBondContact CD2-O 3.48Å; Y194-I237 HydrophobicContact CE2-CB 4.02Å; Y194-I237 HydrophobicContact CE2-CD1 4.37Å; Y194-I237 HydrophobicContact CE2-CG1 4.45Å; Y194-I237 WeakPolarHBondContact CE2-O 2.97Å; Y194-L242 HydrophobicContact CD2-CD1 3.9Å; Y194-L242 HydrophobicContact CG-CD1 4.4Å
195	N	95.8	Very high	94.3	Very high	63 Å²	63	70.5 Å²	70.5	34%	0.337	37%	0.365	S	S	.	.	I	π-helix	trans	-100.8	-24.3	-172.5	-62.8	-78.5	0	0	0	114.5	W191	W191-N195 HydrophobicContact CD2-CB 4.31Å; W191-N195 VanDerWaalsContact CE2-ND2 3.27Å; W191-N195 VanDerWaalsContact CG-ND2 3.31Å; W191-N195 HydrophobicContact CH2-CB 4.28Å; W191-N195 HydrophobicContact CZ2-CB 4.03Å; W191-N195 PolarHBondContact NE1-ND2 2.88Å; W191-N195 WeakPolarHBondContact O-CB 3.23Å; W191-N195 PolarHBondContact O-N 2.8Å; W191-N195 PolarHBondContact O-ND2 3.16Å
196	I	95.6	Very high	94.3	Very high	89 Å²	89	71.5 Å²	71.5	46%	0.456	37%	0.367	S	S	.	.	I	π-helix	trans	-114.7	-57.6	-172	-58.2	-179.1	0	0	0	110.7	Y128 W191 T192	Y128-I196 WeakPolarHBondContact CE2-O 3.3Å; W191-I196 HydrophobicContact CE3-CD1 4.49Å; W191-I196 HydrophobicContact CH2-CD1 4.26Å; W191-I196 HydrophobicContact CH2-CG1 4.46Å; W191-I196 HydrophobicContact CZ3-CD1 3.62Å; W191-I196 HydrophobicContact CZ3-CG1 4.06Å; T192-I196 HydrophobicContact CG2-CD1 4.48Å; T192-I196 WeakPolarHBondContact O-CA 3.07Å; T192-I196 WeakPolarHBondContact O-CB 3.23Å; T192-I196 PolarHBondContact O-N 3.31Å; T192-I196 VanDerWaalsContact O-N 3.07Å
197	K	96.8	Very high	94.5	Very high	91 Å²	91	69.6 Å²	69.6	40%	0.396	36%	0.362	S	S	.	.	I	π-helix	trans	-76.5	-40.9	-164.3	-176	177.2	172	-177.8	0	114	Y128 T192	Y128-K197 WeakPolarHBondContact CD2-O 3.48Å; T192-K197 PolarHBondContact O-N 2.83Å
198	Y	96.9	Very high	94.6	Very high	3 Å²	3	71.9 Å²	71.9	1%	0.012	36%	0.364	C	S	.	.			trans	-111.7	140.5	-179.5	-64.1	-95.7	0	0	0	109.8	L127 D193 F241 L242 M245	L127-Y198 HydrophobicContact CB-CD1 3.8Å; L127-Y198 HydrophobicContact CB-CE1 3.91Å; L127-Y198 HydrophobicContact CD1-CE1 3.96Å; L127-Y198 HydrophobicContact CD2-CD1 4.33Å; L127-Y198 HydrophobicContact CD2-CE1 4.17Å; L127-Y198 HydrophobicContact CG-CD1 4.47Å; L127-Y198 HydrophobicContact CG-CE1 4.22Å; L127-Y198 WeakPolarHBondContact O-CA 3.28Å; D193-Y198 HydrophobicContact CB-CD2 4.22Å; D193-Y198 HydrophobicContact CB-CE2 4.28Å; D193-Y198 WeakPolarHBondContact O-CD2 3.48Å; D193-Y198 PolarHBondContact O-N 3.1Å; Y198-F241 HydrophobicContact CD1-CE1 4.43Å; Y198-F241 HydrophobicContact CE1-CE1 4.44Å; Y198-L242 HydrophobicContact CD1-CD2 3.9Å; Y198-L242 HydrophobicContact CD2-CD2 3.24Å; Y198-L242 HydrophobicContact CE1-CD2 4.36Å; Y198-L242 HydrophobicContact CE2-CD2 3.75Å; Y198-L242 HydrophobicContact CG-CD2 3.31Å; Y198-M245 HydrophobicContact CE1-CB 4.36Å; Y198-M245 HydrophobicContact CE1-CG 4.47Å; Y198-M245 VanDerWaalsContact OH-CB 3.28Å; Y198-M245 WeakPolarHBondContact OH-CB 3.27Å
199	R	96.1	Very high	94.5	Very high	107 Å²	107	71.8 Å²	71.8	40%	0.404	37%	0.365	S	S	.	.			trans	-148.4	142.6	-178.4	-64.6	-175.5	177	-170.1	-6.3	111	L127 Y128 G129 F236	L127-R199 PolarHBondContact O-N 3.44Å; L127-R199 VanDerWaalsContact O-N 3.16Å; Y128-R199 CarbonylContact C-O 3.45Å; Y128-R199 HydrophobicContact CD2-CG 4.33Å; Y128-R199 HydrophobicContact CE2-CG 4.2Å; Y128-R199 WeakPolarHBondContact O-CB 3.35Å; Y128-R199 VanDerWaalsContact OH-CZ 3.24Å; Y128-R199 PolarHBondContact OH-NH1 3.06Å; G129-R199 WeakPolarHBondContact CA-O 3.17Å; G129-R199 PolarHBondContact N-O 2.95Å; R199-F236 WeakPolarHBondContact O-CD2 3.41Å
200	N	95.5	Very high	94.3	Very high	43 Å²	43	71.5 Å²	71.5	23%	0.23	36%	0.361	C	S	.	.			trans	-76.3	149.3	167.4	-75.1	-25.9	0	0	0	110.3	L206 N234 G235 F236	N200-L206 HydrophobicContact CB-CD1 4.07Å; N200-N234 PolarHBondContact ND2-O 2.78Å; N200-G235 WeakPolarHBondContact OD1-CA 3.45Å; N200-F236 PolarHBondContact OD1-N 2.98Å
201	P	94.4	Very high	94.1	Very high	11 Å²	11	70.6 Å²	70.6	7%	0.071	37%	0.368	C	S	.	.			trans	-63.8	154.3	172.2	27.1	-34.3	0	0	0	111.3	L131 F134 I203 L206 A209	L131-P201 HydrophobicContact CD2-CB 3.74Å; L131-P201 HydrophobicContact CD2-CG 4.33Å; L131-P201 HydrophobicContact CG-CB 4.35Å; F134-P201 HydrophobicContact CE2-CG 4.47Å; F134-P201 HydrophobicContact CZ-CG 4.21Å; P201-I203 PolarHBondContact O-N 3.35Å; P201-I203 VanDerWaalsContact O-N 3.14Å; P201-L206 HydrophobicContact CG-CD1 4.01Å; P201-A209 HydrophobicContact CB-CB 4.07Å; P201-A209 HydrophobicContact CG-CB 3.36Å
202	S	90.7	Very high	93.8	Very high	123 Å²	123	64.3 Å²	64.3	86%	0.86	36%	0.357	S	S	*	.	S	Bend	trans	-72	-2.9	-176.1	-50.8	0	0	0	0	115.2
203	I	90.8	Very high	93.7	Very high	65 Å²	65	62.1 Å²	62.1	33%	0.333	34%	0.344	S	S	.	.			trans	-77.9	130.2	-176.6	-62.5	174.8	0	0	0	110.4	L131 P201 N208 A209	L131-I203 HydrophobicContact CD1-CD1 3.45Å; L131-I203 VanDerWaalsContact CD1-CD1 3.45Å; L131-I203 HydrophobicContact CD1-CG1 4.17Å; L131-I203 HydrophobicContact CD2-CD1 4.23Å; L131-I203 HydrophobicContact CG-CD1 4.5Å; P201-I203 PolarHBondContact O-N 3.35Å; P201-I203 VanDerWaalsContact O-N 3.14Å; I203-N208 HydrophobicContact CG2-CB 3.75Å; I203-A209 HydrophobicContact CB-CB 4.07Å; I203-A209 HydrophobicContact CD1-CB 4.28Å
204	T	88.4	Confident	93.6	Very high	125 Å²	125	66.4 Å²	66.4	77%	0.767	36%	0.362	S	S	*	.	S	Bend	trans	-120.5	136.6	176.6	52.6	0	0	0	0	111.2
205	P	90.4	Very high	93.6	Very high	81 Å²	81	66.8 Å²	66.8	53%	0.526	37%	0.365	S	S	.	.	S	Bend	cis	-63.4	150.7	-10.7	28.7	-37.5	0	0	0	112.9	I207 N208	P205-I207 HydrophobicContact CB-CG2 4.11Å; P205-I207 HydrophobicContact CG-CG2 4Å; P205-I207 PolarHBondContact O-N 3.33Å; P205-N208 WeakPolarHBondContact CD-ND2 3.14Å; P205-N208 WeakPolarHBondContact O-CB 3.48Å; P205-N208 PolarHBondContact O-N 3.33Å
206	L	91.4	Very high	93.6	Very high	33 Å²	33	63.9 Å²	63.9	17%	0.173	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-52.3	-36.4	-172.6	-179.5	61.6	0	0	0	113.4	N200 P201 N208 A209 F210	N200-L206 HydrophobicContact CB-CD1 4.07Å; P201-L206 HydrophobicContact CG-CD1 4.01Å; L206-N208 PolarHBondContact O-N 3.32Å; L206-N208 VanDerWaalsContact O-N 3.17Å; L206-A209 VanDerWaalsContact O-CB 3.28Å; L206-A209 WeakPolarHBondContact O-CB 3.28Å; L206-A209 PolarHBondContact O-N 3.33Å; L206-F210 HydrophobicContact CD1-CE2 3.78Å; L206-F210 HydrophobicContact CG-CE2 3.88Å; L206-F210 VanDerWaalsContact O-CD2 3.28Å; L206-F210 WeakPolarHBondContact O-CD2 3.41Å
207	I	93.1	Very high	93.6	Very high	83 Å²	83	63.7 Å²	63.7	43%	0.426	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-53.3	-34.7	177.6	-171.4	166.9	0	0	0	113.4	P205 A209 F210 Y224	P205-I207 HydrophobicContact CB-CG2 4.11Å; P205-I207 HydrophobicContact CG-CG2 4Å; P205-I207 PolarHBondContact O-N 3.33Å; I207-A209 PolarHBondContact O-N 2.95Å; I207-F210 PolarHBondContact O-N 2.99Å; I207-F210 VanDerWaalsContact O-N 3.07Å; I207-Y224 HydrophobicContact CB-CD2 4.24Å; I207-Y224 HydrophobicContact CB-CE2 4.35Å; I207-Y224 HydrophobicContact CD1-CD2 4.48Å; I207-Y224 HydrophobicContact CD1-CE2 3.88Å; I207-Y224 HydrophobicContact CG1-CD2 4.15Å; I207-Y224 HydrophobicContact CG1-CE2 3.76Å
208	N	93.3	Very high	93.4	Very high	92 Å²	92	64.3 Å²	64.3	49%	0.492	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-66.5	-27.2	-178.1	-70	-10.4	0	0	0	112	I203 P205 L206 F210 N211	I203-N208 HydrophobicContact CG2-CB 3.75Å; P205-N208 WeakPolarHBondContact CD-ND2 3.14Å; P205-N208 WeakPolarHBondContact O-CB 3.48Å; P205-N208 PolarHBondContact O-N 3.33Å; L206-N208 PolarHBondContact O-N 3.32Å; L206-N208 VanDerWaalsContact O-N 3.17Å; N208-F210 PolarHBondContact O-N 3.42Å; N208-N211 PolarHBondContact O-N 3.09Å
209	A	92.9	Very high	93.4	Very high	9 Å²	9	64.7 Å²	64.7	7%	0.074	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-65.9	-22.9	175.9	0	0	0	0	0	112.9	L131 F134 P201 I203 L206 I207	L131-A209 HydrophobicContact CD2-CB 4.2Å; F134-A209 WeakPolarHBondContact CD2-O 3.41Å; P201-A209 HydrophobicContact CB-CB 4.07Å; P201-A209 HydrophobicContact CG-CB 3.36Å; I203-A209 HydrophobicContact CB-CB 4.07Å; I203-A209 HydrophobicContact CD1-CB 4.28Å; L206-A209 VanDerWaalsContact O-CB 3.28Å; L206-A209 WeakPolarHBondContact O-CB 3.28Å; L206-A209 PolarHBondContact O-N 3.33Å; I207-A209 PolarHBondContact O-N 2.95Å
210	F	93.6	Very high	93.2	Very high	8 Å²	8	64.5 Å²	64.5	4%	0.035	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-100.7	9.5	-176.4	-63.4	-89.7	0	0	0	112.6	F134 V154 L206 I207 N208 G212 T213 I223 Y224 F236	F134-F210 HydrophobicContact CD2-CD1 4.28Å; F134-F210 HydrophobicContact CD2-CE1 4.42Å; F134-F210 AromaticContact CE2-CD1 3.74Å; F134-F210 HydrophobicContact CE2-CD1 3.74Å; F134-F210 AromaticContact CE2-CE1 3.53Å; F134-F210 HydrophobicContact CE2-CE1 3.53Å; F134-F210 HydrophobicContact CE2-CE2 4.45Å; F134-F210 HydrophobicContact CE2-CG 4.3Å; F134-F210 AromaticContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CE2-CZ 3.92Å; F134-F210 AromaticContact CZ-CE1 3.98Å; F134-F210 HydrophobicContact CZ-CE1 3.98Å; F134-F210 HydrophobicContact CZ-CZ 4.17Å; V154-F210 HydrophobicContact CB-CD1 4.16Å; V154-F210 HydrophobicContact CB-CE1 4.27Å; V154-F210 HydrophobicContact CG1-CD1 3.9Å; V154-F210 HydrophobicContact CG1-CE1 3.54Å; L206-F210 HydrophobicContact CD1-CE2 3.78Å; L206-F210 HydrophobicContact CG-CE2 3.88Å; L206-F210 VanDerWaalsContact O-CD2 3.28Å; L206-F210 WeakPolarHBondContact O-CD2 3.41Å; I207-F210 PolarHBondContact O-N 2.99Å; I207-F210 VanDerWaalsContact O-N 3.07Å; N208-F210 PolarHBondContact O-N 3.42Å; F210-G212 PolarHBondContact O-N 2.84Å; F210-T213 WeakPolarHBondContact CA-OG1 3.49Å; F210-T213 WeakPolarHBondContact CB-OG1 3.48Å; F210-T213 WeakPolarHBondContact O-CB 3.17Å; F210-T213 PolarHBondContact O-N 3.07Å; F210-T213 PolarHBondContact O-OG1 3.12Å; F210-I223 HydrophobicContact CD1-CG2 4.06Å; F210-I223 HydrophobicContact CE1-CG2 3.34Å; F210-I223 HydrophobicContact CE2-CG2 4.28Å; F210-I223 HydrophobicContact CZ-CG2 3.48Å; F210-I223 VanDerWaalsContact CZ-CG2 3.48Å; F210-Y224 HydrophobicContact CB-CD1 3.85Å; F210-Y224 HydrophobicContact CB-CE1 3.63Å; F210-Y224 HydrophobicContact CD1-CD1 4.14Å; F210-Y224 HydrophobicContact CD1-CE1 4.47Å; F210-Y224 AromaticContact CD2-CD1 3.39Å; F210-Y224 HydrophobicContact CD2-CD1 3.39Å; F210-Y224 HydrophobicContact CD2-CE1 4.1Å; F210-Y224 HydrophobicContact CD2-CG 4.13Å; F210-Y224 AromaticContact CE2-CD1 3.94Å; F210-Y224 HydrophobicContact CE2-CD1 3.94Å; F210-Y224 HydrophobicContact CE2-CG 4.47Å; F210-Y224 AromaticContact CG-CD1 3.51Å; F210-Y224 HydrophobicContact CG-CD1 3.51Å; F210-Y224 AromaticContact CG-CE1 3.82Å; F210-Y224 HydrophobicContact CG-CE1 3.82Å; F210-F236 HydrophobicContact CE1-CZ 4.05Å; F210-F236 HydrophobicContact CZ-CE2 4.35Å; F210-F236 HydrophobicContact CZ-CZ 4.25Å
211	N	92.6	Very high	93.1	Very high	146 Å²	146	68 Å²	68	78%	0.781	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	134	176.4	-167	11.2	0	0	0	110.5	N208 T213	N208-N211 PolarHBondContact O-N 3.09Å; N211-T213 VanDerWaalsContact C-N 3.27Å; N211-T213 PolarHBondContact O-N 2.87Å
212	G	91.4	Very high	93.2	Very high	41 Å²	41	68.3 Å²	68.3	42%	0.423	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.4	10.8	-174.6	0	0	0	0	0	115	M151 F210	M151-G212 VanDerWaalsContact CE-C 3.44Å; M151-G212 WeakPolarHBondContact CE-O 3.12Å; F210-G212 PolarHBondContact O-N 2.84Å
213	T	94.6	Very high	93.4	Very high	25 Å²	25	62.4 Å²	62.4	15%	0.153	35%	0.348	C	S	.	.			trans	-113.9	168.6	174.3	74.4	0	0	0	0	111.8	F134 P152 V154 F210 N211	F134-T213 HydrophobicContact CB-CG2 4.2Å; F134-T213 HydrophobicContact CD2-CG2 4.28Å; P152-T213 HydrophobicContact CG-CG2 4.46Å; P152-T213 CarbonylContact O-C 3.56Å; P152-T213 WeakPolarHBondContact O-CA 3.35Å; V154-T213 HydrophobicContact CG2-CG2 3.68Å; F210-T213 WeakPolarHBondContact CA-OG1 3.49Å; F210-T213 WeakPolarHBondContact CB-OG1 3.48Å; F210-T213 WeakPolarHBondContact O-CB 3.17Å; F210-T213 PolarHBondContact O-N 3.07Å; F210-T213 PolarHBondContact O-OG1 3.12Å; N211-T213 VanDerWaalsContact C-N 3.27Å; N211-T213 PolarHBondContact O-N 2.87Å
214	K	95.6	Very high	93.6	Very high	100 Å²	100	61.9 Å²	61.9	44%	0.435	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-125.8	145.5	176.2	-161.2	66.7	175.7	178.2	0	111.2	M151 P152 I153 V154	M151-K214 HydrophobicContact CB-CB 4.38Å; P152-K214 PolarHBondContact O-N 3.32Å; I153-K214 CarbonylContact C-O 3.57Å; I153-K214 VanDerWaalsContact CA-O 3.28Å; I153-K214 WeakPolarHBondContact CA-O 3.45Å; V154-K214 PolarHBondContact N-O 3.48Å
215	K	95.8	Very high	93.9	Very high	65 Å²	65	59.5 Å²	59.5	28%	0.283	32%	0.323	S	S	.	.			trans	-62.7	158.6	168.8	67.6	171.8	-176.7	65.6	0	111	W219 P222	K215-W219 HydrophobicContact CD-CB 4.39Å; K215-W219 WeakPolarHBondContact CD-O 3.35Å; K215-W219 WeakPolarHBondContact CE-O 3.48Å; K215-W219 PolarHBondContact NZ-O 3.04Å; K215-P222 HydrophobicContact CB-CB 4.11Å
216	P	96.7	Very high	94	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.006	31%	0.311	C	S	.	.			trans	-57.2	151.8	171.4	-22.8	34.1	0	0	0	112.3	I153 P155 N161 N218 W219	I153-P216 HydrophobicContact CG2-CB 4.26Å; I153-P216 HydrophobicContact CG2-CG 4.13Å; P155-P216 HydrophobicContact CG-CG 4.14Å; P155-P216 WeakPolarHBondContact O-CG 3.45Å; N161-P216 HydrophobicContact CB-CB 4.14Å; N161-P216 WeakPolarHBondContact OD1-CB 3.21Å; P216-N218 VanDerWaalsContact C-N 3.33Å; P216-N218 PolarHBondContact O-N 3.49Å; P216-W219 HydrophobicContact CB-CB 4.31Å; P216-W219 HydrophobicContact CB-CD2 4.09Å; P216-W219 HydrophobicContact CB-CG 3.73Å; P216-W219 HydrophobicContact CG-CD2 3.62Å; P216-W219 HydrophobicContact CG-CE3 4.11Å; P216-W219 HydrophobicContact CG-CG 3.81Å; P216-W219 HydrophobicContact CG-CZ2 4.27Å; P216-W219 PolarHBondContact O-N 3.16Å
217	T	94.1	Very high	94	Very high	85 Å²	85	58.1 Å²	58.1	52%	0.521	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-45.9	-173	-50.4	0	0	0	0	112.2	N161 W219	N161-T217 PolarHBondContact OD1-N 2.72Å; N161-T217 VanDerWaalsContact OD1-N 3.13Å; T217-W219 VanDerWaalsContact C-N 3.33Å; T217-W219 PolarHBondContact O-N 2.75Å
218	N	94.1	Very high	93.8	Very high	104 Å²	104	59.7 Å²	59.7	56%	0.556	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-0	-174.5	-66.4	-13.1	0	0	0	113.8	N161 P216	N161-N218 PolarHBondContact ND2-ND2 2.94Å; N161-N218 WeakPolarHBondContact O-CB 3.35Å; N161-N218 PolarHBondContact OD1-N 3.22Å; P216-N218 VanDerWaalsContact C-N 3.33Å; P216-N218 PolarHBondContact O-N 3.49Å
219	W	95.7	Very high	93.6	Very high	11 Å²	11	61.5 Å²	61.5	4%	0.042	34%	0.339	C	S	.	.			trans	-82.5	134.6	-177.1	-77.3	27.6	0	0	0	111.2	P155 A160 M163 K215 P216 T217 I223 L226 F241	P155-W219 HydrophobicContact CG-CH2 3.69Å; P155-W219 HydrophobicContact CG-CZ2 3.98Å; P155-W219 HydrophobicContact CG-CZ3 4.27Å; A160-W219 HydrophobicContact CB-CZ2 4.46Å; A160-W219 WeakPolarHBondContact O-CZ2 3.49Å; A160-W219 PolarHBondContact O-NE1 3.14Å; M163-W219 HydrophobicContact CB-CZ2 4.05Å; M163-W219 HydrophobicContact SD-CH2 4.07Å; M163-W219 HydrophobicContact SD-CZ2 3.8Å; K215-W219 HydrophobicContact CD-CB 4.39Å; K215-W219 WeakPolarHBondContact CD-O 3.35Å; K215-W219 WeakPolarHBondContact CE-O 3.48Å; K215-W219 PolarHBondContact NZ-O 3.04Å; P216-W219 HydrophobicContact CB-CB 4.31Å; P216-W219 HydrophobicContact CB-CD2 4.09Å; P216-W219 HydrophobicContact CB-CG 3.73Å; P216-W219 HydrophobicContact CG-CD2 3.62Å; P216-W219 HydrophobicContact CG-CE3 4.11Å; P216-W219 HydrophobicContact CG-CG 3.81Å; P216-W219 HydrophobicContact CG-CZ2 4.27Å; P216-W219 PolarHBondContact O-N 3.16Å; T217-W219 VanDerWaalsContact C-N 3.33Å; T217-W219 PolarHBondContact O-N 2.75Å; W219-I223 HydrophobicContact CH2-CB 4.49Å; W219-I223 HydrophobicContact CH2-CD1 3.45Å; W219-I223 VanDerWaalsContact CH2-CD1 3.45Å; W219-I223 HydrophobicContact CZ3-CB 3.81Å; W219-I223 HydrophobicContact CZ3-CD1 3.57Å; W219-I223 HydrophobicContact CZ3-CG1 4.28Å; W219-L226 HydrophobicContact CH2-CD1 4.41Å; W219-L226 HydrophobicContact CZ3-CD1 4.24Å; W219-L226 HydrophobicContact CZ3-CD2 4.39Å; W219-F241 AromaticContact CH2-CD2 3.76Å; W219-F241 HydrophobicContact CH2-CD2 3.76Å; W219-F241 AromaticContact CH2-CE2 3.8Å; W219-F241 HydrophobicContact CH2-CE2 3.8Å; W219-F241 HydrophobicContact CZ2-CD2 4.06Å; W219-F241 AromaticContact CZ2-CE2 3.97Å; W219-F241 HydrophobicContact CZ2-CE2 3.97Å
220	P	92.3	Very high	93.5	Very high	103 Å²	103	62.3 Å²	62.3	67%	0.669	34%	0.342	S	S	*	.	S	Bend	trans	-72.3	-34.7	174.2	27.6	-32.9	0	0	0	112
221	K	94.2	Very high	93.2	Very high	116 Å²	116	67.6 Å²	67.6	50%	0.504	38%	0.375	S	S	.	.	S	Bend	trans	-129.3	153	-176.7	-62.1	-177.4	-177.5	-178.6	0	110.3	E225	K221-E225 HydrophobicContact CB-CB 4.32Å
222	P	95.6	Very high	93.1	Very high	18 Å²	18	68.8 Å²	68.8	12%	0.117	37%	0.369	C	S	.	.			trans	-69.5	163.6	172.6	31.1	-35.6	0	0	0	112	K215 Y224 E225	K215-P222 HydrophobicContact CB-CB 4.11Å; P222-Y224 VanDerWaalsContact C-N 3.27Å; P222-Y224 HydrophobicContact CB-CD1 3.96Å; P222-Y224 HydrophobicContact CB-CE1 3.45Å; P222-Y224 VanDerWaalsContact CB-CE1 3.45Å; P222-Y224 HydrophobicContact CB-CE2 4.03Å; P222-Y224 HydrophobicContact CB-CG 4.46Å; P222-Y224 VanDerWaalsContact CB-CZ 3.47Å; P222-Y224 HydrophobicContact CG-CD1 4.39Å; P222-Y224 HydrophobicContact CG-CD2 4.06Å; P222-Y224 HydrophobicContact CG-CE1 3.86Å; P222-Y224 HydrophobicContact CG-CE2 3.44Å; P222-Y224 VanDerWaalsContact CG-CE2 3.44Å; P222-Y224 HydrophobicContact CG-CG 4.49Å; P222-Y224 WeakPolarHBondContact CG-OH 3.33Å; P222-Y224 PolarHBondContact O-N 3.09Å; P222-E225 WeakPolarHBondContact CD-OE2 3.24Å; P222-E225 HydrophobicContact CG-CB 3.99Å; P222-E225 HydrophobicContact CG-CG 3.86Å; P222-E225 PolarHBondContact O-N 3.39Å
223	I	95.4	Very high	93.2	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-57.6	-35.2	-177.1	-170.9	80	0	0	0	113.8	P155 F210 W219 E225 L226 N234 G235 F236 F241	P155-I223 HydrophobicContact CG-CD1 4.42Å; F210-I223 HydrophobicContact CD1-CG2 4.06Å; F210-I223 HydrophobicContact CE1-CG2 3.34Å; F210-I223 HydrophobicContact CE2-CG2 4.28Å; F210-I223 HydrophobicContact CZ-CG2 3.48Å; F210-I223 VanDerWaalsContact CZ-CG2 3.48Å; W219-I223 HydrophobicContact CH2-CB 4.49Å; W219-I223 HydrophobicContact CH2-CD1 3.45Å; W219-I223 VanDerWaalsContact CH2-CD1 3.45Å; W219-I223 HydrophobicContact CZ3-CB 3.81Å; W219-I223 HydrophobicContact CZ3-CD1 3.57Å; W219-I223 HydrophobicContact CZ3-CG1 4.28Å; I223-E225 PolarHBondContact O-N 2.62Å; I223-L226 HydrophobicContact CD1-CD1 3.67Å; I223-L226 HydrophobicContact CG1-CD1 4.49Å; I223-L226 WeakPolarHBondContact O-CG 3.35Å; I223-L226 PolarHBondContact O-N 2.84Å; I223-N234 PolarHBondContact O-OD1 2.84Å; I223-G235 VanDerWaalsContact CG1-C 3.47Å; I223-G235 WeakPolarHBondContact O-CA 3.28Å; I223-G235 PolarHBondContact O-N 3.41Å; I223-F236 HydrophobicContact CD1-CD1 4.07Å; I223-F236 HydrophobicContact CG1-CD1 3.77Å; I223-F236 HydrophobicContact CG1-CE1 4.04Å; I223-F236 HydrophobicContact CG2-CE1 4.34Å; I223-F241 HydrophobicContact CD1-CD1 4.15Å; I223-F241 HydrophobicContact CD1-CD2 4Å; I223-F241 HydrophobicContact CD1-CE1 4.3Å; I223-F241 HydrophobicContact CD1-CE2 4.16Å; I223-F241 HydrophobicContact CD1-CG 3.99Å; I223-F241 HydrophobicContact CD1-CZ 4.3Å
224	Y	93.4	Very high	93.1	Very high	54 Å²	54	67.3 Å²	67.3	21%	0.212	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-80	2	179.8	56.4	-99.2	0	0	0	113.6	I207 F210 P222 N234	I207-Y224 HydrophobicContact CB-CD2 4.24Å; I207-Y224 HydrophobicContact CB-CE2 4.35Å; I207-Y224 HydrophobicContact CD1-CD2 4.48Å; I207-Y224 HydrophobicContact CD1-CE2 3.88Å; I207-Y224 HydrophobicContact CG1-CD2 4.15Å; I207-Y224 HydrophobicContact CG1-CE2 3.76Å; F210-Y224 HydrophobicContact CB-CD1 3.85Å; F210-Y224 HydrophobicContact CB-CE1 3.63Å; F210-Y224 HydrophobicContact CD1-CD1 4.14Å; F210-Y224 HydrophobicContact CD1-CE1 4.47Å; F210-Y224 AromaticContact CD2-CD1 3.39Å; F210-Y224 HydrophobicContact CD2-CD1 3.39Å; F210-Y224 HydrophobicContact CD2-CE1 4.1Å; F210-Y224 HydrophobicContact CD2-CG 4.13Å; F210-Y224 AromaticContact CE2-CD1 3.94Å; F210-Y224 HydrophobicContact CE2-CD1 3.94Å; F210-Y224 HydrophobicContact CE2-CG 4.47Å; F210-Y224 AromaticContact CG-CD1 3.51Å; F210-Y224 HydrophobicContact CG-CD1 3.51Å; F210-Y224 AromaticContact CG-CE1 3.82Å; F210-Y224 HydrophobicContact CG-CE1 3.82Å; P222-Y224 VanDerWaalsContact C-N 3.27Å; P222-Y224 HydrophobicContact CB-CD1 3.96Å; P222-Y224 HydrophobicContact CB-CE1 3.45Å; P222-Y224 VanDerWaalsContact CB-CE1 3.45Å; P222-Y224 HydrophobicContact CB-CE2 4.03Å; P222-Y224 HydrophobicContact CB-CG 4.46Å; P222-Y224 VanDerWaalsContact CB-CZ 3.47Å; P222-Y224 HydrophobicContact CG-CD1 4.39Å; P222-Y224 HydrophobicContact CG-CD2 4.06Å; P222-Y224 HydrophobicContact CG-CE1 3.86Å; P222-Y224 HydrophobicContact CG-CE2 3.44Å; P222-Y224 VanDerWaalsContact CG-CE2 3.44Å; P222-Y224 HydrophobicContact CG-CG 4.49Å; P222-Y224 WeakPolarHBondContact CG-OH 3.33Å; P222-Y224 PolarHBondContact O-N 3.09Å; Y224-N234 VanDerWaalsContact C-OD1 3.29Å; Y224-N234 PolarHBondContact O-ND2 2.83Å; Y224-N234 PolarHBondContact O-OD1 2.82Å
225	E	94.9	Very high	93.1	Very high	75 Å²	75	62.5 Å²	62.5	35%	0.35	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-120.1	14.6	175	-70.8	175.9	-160.3	0	0	112.4	K221 P222 I223	K221-E225 HydrophobicContact CB-CB 4.32Å; P222-E225 WeakPolarHBondContact CD-OE2 3.24Å; P222-E225 HydrophobicContact CG-CB 3.99Å; P222-E225 HydrophobicContact CG-CG 3.86Å; P222-E225 PolarHBondContact O-N 3.39Å; I223-E225 PolarHBondContact O-N 2.62Å
226	L	92.9	Very high	93.1	Very high	54 Å²	54	59.4 Å²	59.4	28%	0.283	32%	0.317	S	S	.	.	S	Bend	trans	-66.7	-40.2	177.9	-72.2	-174.3	0	0	0	111.8	W219 I223 N234 N238 F241	W219-L226 HydrophobicContact CH2-CD1 4.41Å; W219-L226 HydrophobicContact CZ3-CD1 4.24Å; W219-L226 HydrophobicContact CZ3-CD2 4.39Å; I223-L226 HydrophobicContact CD1-CD1 3.67Å; I223-L226 HydrophobicContact CG1-CD1 4.49Å; I223-L226 WeakPolarHBondContact O-CG 3.35Å; I223-L226 PolarHBondContact O-N 2.84Å; L226-N234 PolarHBondContact N-OD1 2.98Å; L226-N238 HydrophobicContact CB-CB 4.42Å; L226-N238 HydrophobicContact CD1-CB 4.02Å; L226-F241 HydrophobicContact CD1-CB 4.2Å
227	D	91.5	Very high	93.1	Very high	30 Å²	30	60.6 Å²	60.6	16%	0.16	32%	0.322	C	S	.	.			trans	-138.6	103.2	173.6	-167.9	-18.2	0	0	0	110.1	T229 D230 N233 N234	D227-T229 VanDerWaalsContact C-N 3.31Å; D227-T229 WeakPolarHBondContact OD1-CB 3.43Å; D227-T229 PolarHBondContact OD1-N 3.35Å; D227-T229 PolarHBondContact OD1-OG1 2.7Å; D227-D230 PolarHBondContact OD1-N 2.72Å; D227-D230 VanDerWaalsContact OD1-N 3.16Å; D227-N233 VanDerWaalsContact CB-O 3.29Å; D227-N233 WeakPolarHBondContact CB-O 3.36Å; D227-N233 PolarHBondContact OD2-ND2 3.11Å; D227-N234 PolarHBondContact N-OD1 3.45Å; D227-N234 VanDerWaalsContact O-CB 3.23Å; D227-N234 WeakPolarHBondContact O-CB 3.46Å; D227-N234 PolarHBondContact O-ND2 2.86Å; D227-N234 PolarHBondContact O-OD1 2.89Å
228	T	89	Confident	93.3	Very high	117 Å²	117	56.8 Å²	56.8	72%	0.718	30%	0.299	S	S	*	.	S	Bend	trans	-85.7	-6.6	177.8	57.1	0	0	0	0	112.8
229	T	89.5	Confident	93.4	Very high	129 Å²	129	52.5 Å²	52.5	79%	0.791	28%	0.276	S	S	*	.	S	Bend	trans	-91.1	-33.2	-176	65.8	0	0	0	0	112.1	D227	D227-T229 VanDerWaalsContact C-N 3.31Å; D227-T229 WeakPolarHBondContact OD1-CB 3.43Å; D227-T229 PolarHBondContact OD1-N 3.35Å; D227-T229 PolarHBondContact OD1-OG1 2.7Å
230	D	89.5	Confident	93.5	Very high	27 Å²	27	53.4 Å²	53.4	14%	0.144	28%	0.281	C	S	.	.			trans	-125.6	112.5	180	-169.3	-12.2	0	0	0	111.3	K186 D227 Y232 N233	K186-D230 VanDerWaalsContact CE-OD2 3.29Å; K186-D230 WeakPolarHBondContact CE-OD2 3.46Å; K186-D230 IonicContact NZ-OD2 2.68Å; K186-D230 PolarHBondContact NZ-OD2 3.28Å; D227-D230 PolarHBondContact OD1-N 2.72Å; D227-D230 VanDerWaalsContact OD1-N 3.16Å; D230-Y232 PolarHBondContact O-N 3.35Å; D230-Y232 WeakPolarHBondContact OD1-CB 3.24Å; D230-Y232 PolarHBondContact OD1-N 3.08Å; D230-N233 HydrophobicContact CB-CB 4.06Å; D230-N233 PolarHBondContact O-N 3.32Å
231	V	87.9	Confident	93.7	Very high	119 Å²	119	48.5 Å²	48.5	72%	0.721	25%	0.25	S	C	*	.	G	3₁₀ helix	trans	-60.3	-31.6	178	-179.1	0	0	0	0	111.6	N233	V231-N233 PolarHBondContact O-N 2.89Å
232	Y	90.3	Very high	93.9	Very high	170 Å²	170	43 Å²	43	67%	0.667	23%	0.226	S	C	*	.	G	3₁₀ helix	trans	-79.6	-6.6	179.3	-58.2	-73.6	0	0	0	112.8	Y194 D230 I237	Y194-Y232 WeakPolarHBondContact CE2-O 3.44Å; Y194-Y232 PolarHBondContact OH-O 2.83Å; D230-Y232 PolarHBondContact O-N 3.35Å; D230-Y232 WeakPolarHBondContact OD1-CB 3.24Å; D230-Y232 PolarHBondContact OD1-N 3.08Å; Y232-I237 WeakPolarHBondContact O-CD1 3.4Å
233	N	93.3	Very high	94	Very high	15 Å²	15	42.9 Å²	42.9	8%	0.08	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-119.6	26.9	177.6	-168.4	39.1	0	0	0	112.4	D227 D230 V231 N238 Q239	D227-N233 VanDerWaalsContact CB-O 3.29Å; D227-N233 WeakPolarHBondContact CB-O 3.36Å; D227-N233 PolarHBondContact OD2-ND2 3.11Å; D230-N233 HydrophobicContact CB-CB 4.06Å; D230-N233 PolarHBondContact O-N 3.32Å; V231-N233 PolarHBondContact O-N 2.89Å; N233-N238 WeakPolarHBondContact O-CA 3.47Å; N233-N238 WeakPolarHBondContact O-CB 3.36Å; N233-N238 PolarHBondContact O-ND2 2.96Å; N233-Q239 WeakPolarHBondContact OD1-CB 3.4Å; N233-Q239 WeakPolarHBondContact OD1-CG 3.21Å; N233-Q239 PolarHBondContact OD1-N 3.22Å
234	N	94.1	Very high	94.1	Very high	20 Å²	20	43 Å²	43	11%	0.107	23%	0.225	C	C	.	.	S	Bend	trans	-122.7	159	-175.4	-162.3	16.9	0	0	0	112.8	N200 I223 Y224 L226 D227 I237	N200-N234 PolarHBondContact ND2-O 2.78Å; I223-N234 PolarHBondContact O-OD1 2.84Å; Y224-N234 VanDerWaalsContact C-OD1 3.29Å; Y224-N234 PolarHBondContact O-ND2 2.83Å; Y224-N234 PolarHBondContact O-OD1 2.82Å; L226-N234 PolarHBondContact N-OD1 2.98Å; D227-N234 PolarHBondContact N-OD1 3.45Å; D227-N234 VanDerWaalsContact O-CB 3.23Å; D227-N234 WeakPolarHBondContact O-CB 3.46Å; D227-N234 PolarHBondContact O-ND2 2.86Å; D227-N234 PolarHBondContact O-OD1 2.89Å; N234-I237 WeakPolarHBondContact O-CG1 3.17Å
235	G	95.1	Very high	94.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	73.3	-146.6	-176.4	0	0	0	0	0	112.6	N200 I223 I237 N238	N200-G235 WeakPolarHBondContact OD1-CA 3.45Å; I223-G235 VanDerWaalsContact CG1-C 3.47Å; I223-G235 WeakPolarHBondContact O-CA 3.28Å; I223-G235 PolarHBondContact O-N 3.41Å; G235-I237 PolarHBondContact O-N 3.48Å; G235-N238 VanDerWaalsContact O-CB 3.29Å; G235-N238 WeakPolarHBondContact O-CB 3.47Å; G235-N238 PolarHBondContact O-N 3.24Å
236	F	96.4	Very high	94.4	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-69.7	-15.3	-179.2	-62.6	-45	0	0	0	114.2	Q126 L127 F134 V154 P155 R199 N200 F210 I223 F241 L242	Q126-F236 WeakPolarHBondContact O-CE2 3.44Å; L127-F236 HydrophobicContact CD2-CD1 4.09Å; L127-F236 HydrophobicContact CD2-CE1 4.21Å; F134-F236 AromaticContact CE1-CE2 3.86Å; F134-F236 HydrophobicContact CE1-CE2 3.86Å; F134-F236 HydrophobicContact CE1-CZ 4.16Å; F134-F236 AromaticContact CZ-CE2 3.54Å; F134-F236 HydrophobicContact CZ-CE2 3.54Å; F134-F236 AromaticContact CZ-CZ 3.89Å; F134-F236 HydrophobicContact CZ-CZ 3.89Å; V154-F236 HydrophobicContact CG1-CE1 4.12Å; V154-F236 HydrophobicContact CG1-CZ 3.53Å; P155-F236 HydrophobicContact CB-CE1 3.98Å; P155-F236 HydrophobicContact CG-CE1 4.41Å; R199-F236 WeakPolarHBondContact O-CD2 3.41Å; N200-F236 PolarHBondContact OD1-N 2.98Å; F210-F236 HydrophobicContact CE1-CZ 4.05Å; F210-F236 HydrophobicContact CZ-CE2 4.35Å; F210-F236 HydrophobicContact CZ-CZ 4.25Å; I223-F236 HydrophobicContact CD1-CD1 4.07Å; I223-F236 HydrophobicContact CG1-CD1 3.77Å; I223-F236 HydrophobicContact CG1-CE1 4.04Å; I223-F236 HydrophobicContact CG2-CE1 4.34Å; F236-F241 HydrophobicContact CD1-CE1 4.15Å; F236-F241 HydrophobicContact CD1-CZ 4.49Å; F236-L242 VanDerWaalsContact O-CD2 3.26Å; F236-L242 WeakPolarHBondContact O-CD2 3.36Å
237	I	96.3	Very high	94.6	Very high	25 Å²	25	45.1 Å²	45.1	13%	0.128	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-91	1.5	175.8	64	172.1	0	0	0	112.9	Y194 Y232 N234 G235 Q239	Y194-I237 HydrophobicContact CD2-CB 4.19Å; Y194-I237 WeakPolarHBondContact CD2-O 3.48Å; Y194-I237 HydrophobicContact CE2-CB 4.02Å; Y194-I237 HydrophobicContact CE2-CD1 4.37Å; Y194-I237 HydrophobicContact CE2-CG1 4.45Å; Y194-I237 WeakPolarHBondContact CE2-O 2.97Å; Y232-I237 WeakPolarHBondContact O-CD1 3.4Å; N234-I237 WeakPolarHBondContact O-CG1 3.17Å; G235-I237 PolarHBondContact O-N 3.48Å; I237-Q239 PolarHBondContact O-N 2.99Å
238	N	97.2	Very high	94.8	Very high	5 Å²	5	44.5 Å²	44.5	3%	0.027	23%	0.225	C	C	.	.			trans	-56.1	125	175	174.3	-91.6	0	0	0	110.5	L226 N233 G235 D240 F241 L242	L226-N238 HydrophobicContact CB-CB 4.42Å; L226-N238 HydrophobicContact CD1-CB 4.02Å; N233-N238 WeakPolarHBondContact O-CA 3.47Å; N233-N238 WeakPolarHBondContact O-CB 3.36Å; N233-N238 PolarHBondContact O-ND2 2.96Å; G235-N238 VanDerWaalsContact O-CB 3.29Å; G235-N238 WeakPolarHBondContact O-CB 3.47Å; G235-N238 PolarHBondContact O-N 3.24Å; N238-D240 VanDerWaalsContact C-N 3.34Å; N238-D240 PolarHBondContact O-N 2.7Å; N238-D240 WeakPolarHBondContact OD1-CB 3.47Å; N238-D240 PolarHBondContact OD1-N 3.47Å; N238-F241 HydrophobicContact CB-CB 4.07Å; N238-F241 WeakPolarHBondContact O-CB 3.16Å; N238-F241 PolarHBondContact O-N 2.82Å; N238-F241 VanDerWaalsContact O-N 3.14Å; N238-F241 PolarHBondContact OD1-N 3.34Å; N238-L242 WeakPolarHBondContact O-CG 3.31Å; N238-L242 PolarHBondContact O-N 3.38Å
239	Q	96.8	Very high	95.2	Very high	14 Å²	14	42.8 Å²	42.8	7%	0.065	22%	0.223	C	C	.	.	H	α-helix	trans	-64.1	-37.1	-169.5	-67.7	-90.5	-25.3	0	0	112.9	I188 N233 I237 L242 V243	I188-Q239 HydrophobicContact CD1-CB 3.85Å; I188-Q239 HydrophobicContact CG1-CB 3.59Å; I188-Q239 HydrophobicContact CG1-CG 4.45Å; I188-Q239 VanDerWaalsContact N-OE1 3.11Å; N233-Q239 WeakPolarHBondContact OD1-CB 3.4Å; N233-Q239 WeakPolarHBondContact OD1-CG 3.21Å; N233-Q239 PolarHBondContact OD1-N 3.22Å; I237-Q239 PolarHBondContact O-N 2.99Å; Q239-L242 PolarHBondContact O-N 3.37Å; Q239-V243 WeakPolarHBondContact O-CG2 3.45Å; Q239-V243 PolarHBondContact O-N 3.22Å
240	D	97.2	Very high	95.6	Very high	31 Å²	31	42.2 Å²	42.2	17%	0.166	21%	0.214	C	C	.	.	H	α-helix	trans	-65.2	-42.3	175.8	-75.5	-43.6	0	0	0	111.5	M163 N238 V243 W244 R258	M163-D240 HydrophobicContact CE-CB 3.99Å; N238-D240 VanDerWaalsContact C-N 3.34Å; N238-D240 PolarHBondContact O-N 2.7Å; N238-D240 WeakPolarHBondContact OD1-CB 3.47Å; N238-D240 PolarHBondContact OD1-N 3.47Å; D240-V243 PolarHBondContact O-N 3.07Å; D240-W244 PolarHBondContact O-N 3.1Å; D240-R258 VanDerWaalsContact CG-NH1 3.29Å; D240-R258 IonicContact OD1-CZ 3.43Å; D240-R258 IonicContact OD1-NH1 3.69Å; D240-R258 PolarHBondContact OD1-NH1 3.13Å; D240-R258 IonicContact OD1-NH2 3.39Å; D240-R258 IonicContact OD2-CZ 2.68Å; D240-R258 IonicContact OD2-NH1 2.62Å; D240-R258 PolarHBondContact OD2-NH1 3.1Å; D240-R258 VanDerWaalsContact OD2-NH1 3.13Å; D240-R258 IonicContact OD2-NH2 3.09Å; D240-R258 PolarHBondContact OD2-NH2 2.77Å
241	F	97.6	Very high	95.9	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.7	-47.1	174	176.3	-106.9	0	0	0	111.3	L127 P155 A160 M163 Y198 W219 I223 L226 F236 N238 V243 W244 M245	L127-F241 HydrophobicContact CD2-CE1 3.88Å; L127-F241 HydrophobicContact CD2-CZ 3.64Å; P155-F241 HydrophobicContact CB-CZ 4.25Å; P155-F241 HydrophobicContact CG-CE2 4Å; P155-F241 HydrophobicContact CG-CZ 4.09Å; A160-F241 HydrophobicContact CB-CE2 4.17Å; M163-F241 HydrophobicContact CE-CB 4.03Å; M163-F241 HydrophobicContact SD-CB 4.26Å; M163-F241 HydrophobicContact SD-CD2 3.85Å; Y198-F241 HydrophobicContact CD1-CE1 4.43Å; Y198-F241 HydrophobicContact CE1-CE1 4.44Å; W219-F241 AromaticContact CH2-CD2 3.76Å; W219-F241 HydrophobicContact CH2-CD2 3.76Å; W219-F241 AromaticContact CH2-CE2 3.8Å; W219-F241 HydrophobicContact CH2-CE2 3.8Å; W219-F241 HydrophobicContact CZ2-CD2 4.06Å; W219-F241 AromaticContact CZ2-CE2 3.97Å; W219-F241 HydrophobicContact CZ2-CE2 3.97Å; I223-F241 HydrophobicContact CD1-CD1 4.15Å; I223-F241 HydrophobicContact CD1-CD2 4Å; I223-F241 HydrophobicContact CD1-CE1 4.3Å; I223-F241 HydrophobicContact CD1-CE2 4.16Å; I223-F241 HydrophobicContact CD1-CG 3.99Å; I223-F241 HydrophobicContact CD1-CZ 4.3Å; L226-F241 HydrophobicContact CD1-CB 4.2Å; F236-F241 HydrophobicContact CD1-CE1 4.15Å; F236-F241 HydrophobicContact CD1-CZ 4.49Å; N238-F241 HydrophobicContact CB-CB 4.07Å; N238-F241 WeakPolarHBondContact O-CB 3.16Å; N238-F241 PolarHBondContact O-N 2.82Å; N238-F241 VanDerWaalsContact O-N 3.14Å; N238-F241 PolarHBondContact OD1-N 3.34Å; F241-V243 PolarHBondContact O-N 3.27Å; F241-W244 WeakPolarHBondContact O-CB 3.47Å; F241-W244 PolarHBondContact O-N 3.37Å; F241-W244 VanDerWaalsContact O-N 3.14Å; F241-M245 HydrophobicContact CD1-CG 4.12Å; F241-M245 HydrophobicContact CD2-CG 3.99Å; F241-M245 HydrophobicContact CD2-SD 4.48Å; F241-M245 HydrophobicContact CE1-CG 3.74Å; F241-M245 HydrophobicContact CE2-CG 3.59Å; F241-M245 HydrophobicContact CE2-SD 3.66Å; F241-M245 HydrophobicContact CG-CG 4.24Å; F241-M245 HydrophobicContact CZ-CE 4.16Å; F241-M245 HydrophobicContact CZ-CG 3.46Å; F241-M245 VanDerWaalsContact CZ-CG 3.46Å; F241-M245 HydrophobicContact CZ-SD 3.72Å; F241-M245 VanDerWaalsContact O-CG 3.26Å; F241-M245 WeakPolarHBondContact O-CG 3.4Å; F241-M245 PolarHBondContact O-N 3.29Å
242	L	97.9	Very high	96.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60	-44.7	178.3	-66.2	-178.9	0	0	0	112.6	A189 Y194 Y198 F236 N238 Q239 W244 M245 R246	A189-L242 HydrophobicContact CB-CB 3.67Å; A189-L242 HydrophobicContact CB-CD1 3.87Å; A189-L242 HydrophobicContact CB-CG 4.44Å; Y194-L242 HydrophobicContact CD2-CD1 3.9Å; Y194-L242 HydrophobicContact CG-CD1 4.4Å; Y198-L242 HydrophobicContact CD1-CD2 3.9Å; Y198-L242 HydrophobicContact CD2-CD2 3.24Å; Y198-L242 HydrophobicContact CE1-CD2 4.36Å; Y198-L242 HydrophobicContact CE2-CD2 3.75Å; Y198-L242 HydrophobicContact CG-CD2 3.31Å; F236-L242 VanDerWaalsContact O-CD2 3.26Å; F236-L242 WeakPolarHBondContact O-CD2 3.36Å; N238-L242 WeakPolarHBondContact O-CG 3.31Å; N238-L242 PolarHBondContact O-N 3.38Å; Q239-L242 PolarHBondContact O-N 3.37Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 2.94Å; L242-M245 PolarHBondContact O-N 2.97Å; L242-R246 PolarHBondContact O-N 3.31Å
243	V	98.2	Very high	96.7	Very high	16 Å²	16	34.5 Å²	34.5	10%	0.097	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-39.9	175.9	170.3	0	0	0	0	111	I188 A189 Q239 D240 F241 K255 L256	I188-V243 HydrophobicContact CB-CG2 4.32Å; I188-V243 HydrophobicContact CD1-CG2 4.13Å; I188-V243 HydrophobicContact CG1-CG2 3.93Å; A189-V243 HydrophobicContact CB-CG2 4.29Å; Q239-V243 WeakPolarHBondContact O-CG2 3.45Å; Q239-V243 PolarHBondContact O-N 3.22Å; D240-V243 PolarHBondContact O-N 3.07Å; F241-V243 PolarHBondContact O-N 3.27Å; V243-K255 HydrophobicContact CG1-CB 3.76Å; V243-K255 HydrophobicContact CG1-CD 4.32Å; V243-K255 HydrophobicContact CG1-CG 4.11Å; V243-K255 PolarHBondContact O-NZ 3.19Å; V243-L256 WeakPolarHBondContact CG1-O 3.44Å
244	W	98	Very high	96.9	Very high	1 Å²	1	38.2 Å²	38.2	0%	0.004	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-49	176.8	179.7	-103.9	0	0	0	112.4	Y106 L108 Y111 Y118 L159 S162 M163 F164 D240 F241 L242 R246 F253 K255	Y106-W244 HydrophobicContact CE2-CE3 4.49Å; Y106-W244 HydrophobicContact CE2-CZ3 4.45Å; L108-W244 HydrophobicContact CD1-CH2 4.14Å; L108-W244 HydrophobicContact CD1-CZ3 4Å; Y111-W244 HydrophobicContact CE1-CH2 4.06Å; Y111-W244 HydrophobicContact CE1-CZ2 4.34Å; Y111-W244 AromaticContact CZ-CH2 3.94Å; Y118-W244 WeakPolarHBondContact OH-CZ2 3.36Å; L159-W244 PolarHBondContact O-NE1 3.12Å; S162-W244 WeakPolarHBondContact O-CZ2 3.39Å; M163-W244 HydrophobicContact CB-CG 4.28Å; M163-W244 HydrophobicContact CG-CB 4.24Å; M163-W244 HydrophobicContact CG-CG 4Å; F164-W244 HydrophobicContact CB-CE3 3.77Å; F164-W244 HydrophobicContact CB-CH2 4.45Å; F164-W244 HydrophobicContact CB-CZ3 3.72Å; D240-W244 PolarHBondContact O-N 3.1Å; F241-W244 WeakPolarHBondContact O-CB 3.47Å; F241-W244 PolarHBondContact O-N 3.37Å; F241-W244 VanDerWaalsContact O-N 3.14Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 2.94Å; W244-R246 PolarHBondContact O-N 3.46Å; W244-R246 VanDerWaalsContact O-N 3.09Å; W244-F253 HydrophobicContact CZ3-CZ 4.45Å; W244-K255 HydrophobicContact CE3-CD 3.8Å; W244-K255 HydrophobicContact CZ3-CD 4.27Å; W244-K255 PolarHBondContact O-NZ 3.32Å; W244-K255 VanDerWaalsContact O-NZ 3.09Å
245	M	97.7	Very high	97	Very high	5 Å²	5	37.9 Å²	37.9	3%	0.025	19%	0.192	C	C	.	.	H	α-helix	trans	-62.6	-19	-177.1	-68.8	-60.7	-72.9	0	0	113.6	K122 L127 L159 A160 Y198 F241 L242 R247	K122-M245 HydrophobicContact CB-CE 4.28Å; K122-M245 HydrophobicContact CD-CE 4.41Å; L127-M245 HydrophobicContact CD1-CE 3.52Å; L127-M245 HydrophobicContact CD2-CE 4.2Å; L159-M245 HydrophobicContact CD2-CE 3.88Å; L159-M245 HydrophobicContact CD2-SD 4.03Å; L159-M245 HydrophobicContact CG-CE 4.24Å; L159-M245 HydrophobicContact CG-SD 3.85Å; A160-M245 HydrophobicContact CB-CE 4.47Å; A160-M245 HydrophobicContact CB-SD 4Å; Y198-M245 HydrophobicContact CE1-CB 4.36Å; Y198-M245 HydrophobicContact CE1-CG 4.47Å; Y198-M245 VanDerWaalsContact OH-CB 3.28Å; Y198-M245 WeakPolarHBondContact OH-CB 3.27Å; F241-M245 HydrophobicContact CD1-CG 4.12Å; F241-M245 HydrophobicContact CD2-CG 3.99Å; F241-M245 HydrophobicContact CD2-SD 4.48Å; F241-M245 HydrophobicContact CE1-CG 3.74Å; F241-M245 HydrophobicContact CE2-CG 3.59Å; F241-M245 HydrophobicContact CE2-SD 3.66Å; F241-M245 HydrophobicContact CG-CG 4.24Å; F241-M245 HydrophobicContact CZ-CE 4.16Å; F241-M245 HydrophobicContact CZ-CG 3.46Å; F241-M245 VanDerWaalsContact CZ-CG 3.46Å; F241-M245 HydrophobicContact CZ-SD 3.72Å; F241-M245 VanDerWaalsContact O-CG 3.26Å; F241-M245 WeakPolarHBondContact O-CG 3.4Å; F241-M245 PolarHBondContact O-N 3.29Å; L242-M245 PolarHBondContact O-N 2.97Å; M245-R247 PolarHBondContact O-N 3.33Å; M245-R247 VanDerWaalsContact O-N 3.16Å
246	R	97	Very high	97.2	Very high	93 Å²	93	39.1 Å²	39.1	35%	0.351	20%	0.198	S	C	.	.	S	Bend	trans	-75.1	99.5	168.3	-175.9	173.7	-70.7	-145	-2.4	111	W190 D193 L242 W244 A248 K255	W190-R246 VanDerWaalsContact CB-NH2 3.31Å; W190-R246 VanDerWaalsContact CD1-NH2 3.26Å; D193-R246 VanDerWaalsContact CG-NH2 3.26Å; D193-R246 IonicContact OD1-NH2 3.58Å; D193-R246 PolarHBondContact OD1-NH2 3.42Å; D193-R246 IonicContact OD2-CZ 2.8Å; D193-R246 VanDerWaalsContact OD2-CZ 3.28Å; D193-R246 IonicContact OD2-NE 3.28Å; D193-R246 PolarHBondContact OD2-NE 2.85Å; D193-R246 VanDerWaalsContact OD2-NE 3.09Å; D193-R246 IonicContact OD2-NH2 2.72Å; D193-R246 PolarHBondContact OD2-NH2 3.36Å; L242-R246 PolarHBondContact O-N 3.31Å; W244-R246 PolarHBondContact O-N 3.46Å; W244-R246 VanDerWaalsContact O-N 3.09Å; R246-A248 PolarHBondContact O-N 3.48Å; R246-K255 PolarHBondContact O-NZ 2.99Å
247	R	95.6	Very high	97.3	Very high	130 Å²	130	40.1 Å²	40.1	49%	0.491	20%	0.202	S	C	.	.			trans	-55.1	136.8	-179.4	-60.5	179.3	-63.8	172.2	-3.3	112.9	G119 L159 M245	G119-R247 WeakPolarHBondContact O-CD 3.34Å; G119-R247 PolarHBondContact O-NH1 3.35Å; L159-R247 HydrophobicContact CD1-CG 4.19Å; L159-R247 HydrophobicContact CD2-CG 4Å; M245-R247 PolarHBondContact O-N 3.33Å; M245-R247 VanDerWaalsContact O-N 3.16Å
248	A	97.3	Very high	97.3	Very high	18 Å²	18	40.6 Å²	40.6	15%	0.149	20%	0.202	C	C	.	.			trans	-77.4	146.1	166.4	0	0	0	0	0	111.3	Q113 R246 F253	Q113-A248 HydrophobicContact CB-CB 4.33Å; R246-A248 PolarHBondContact O-N 3.48Å; A248-F253 HydrophobicContact CB-CB 3.49Å; A248-F253 VanDerWaalsContact CB-CB 3.49Å; A248-F253 HydrophobicContact CB-CD1 3.48Å; A248-F253 VanDerWaalsContact CB-CD1 3.48Å; A248-F253 HydrophobicContact CB-CD2 3.95Å; A248-F253 HydrophobicContact CB-CE1 4.13Å; A248-F253 HydrophobicContact CB-CG 3.35Å
249	A	96.6	Very high	97.2	Very high	81 Å²	81	44.1 Å²	44.1	67%	0.669	22%	0.215	S	C	*	.	S	Bend	trans	-82.1	-24.7	179.1	0	0	0	0	0	113.4	N114	N114-A249 PolarHBondContact ND2-O 2.95Å
250	L	97.1	Very high	97.1	Very high	117 Å²	117	43.4 Å²	43.4	61%	0.613	21%	0.212	S	C	*	.	S	Bend	trans	-118.6	156.1	-175.7	-65	175.6	0	0	0	110.5	D252 F253	L250-D252 VanDerWaalsContact C-N 3.26Å; L250-D252 PolarHBondContact O-N 3.18Å; L250-F253 WeakPolarHBondContact O-CD1 3.42Å
251	P	96.8	Very high	96.6	Very high	34 Å²	34	43.4 Å²	43.4	22%	0.221	21%	0.213	C	C	.	.	S	Bend	trans	-67.8	-27.1	178.2	26	-34.2	0	0	0	113.8	N110 Y111 F112	N110-P251 PolarHBondContact N-O 3.36Å; Y111-P251 PolarHBondContact N-O 2.89Å; Y111-P251 WeakPolarHBondContact O-CA 3.47Å; F112-P251 HydrophobicContact CD1-CB 3.73Å; F112-P251 HydrophobicContact CD1-CG 4.33Å; F112-P251 HydrophobicContact CE1-CB 3.56Å; F112-P251 HydrophobicContact CE1-CG 3.88Å; F112-P251 HydrophobicContact CE2-CB 4.4Å; F112-P251 HydrophobicContact CG-CB 4.22Å; F112-P251 HydrophobicContact CZ-CB 3.91Å; F112-P251 HydrophobicContact CZ-CG 4.41Å
252	D	97.2	Very high	96	Very high	94 Å²	94	48 Å²	48	50%	0.503	23%	0.234	S	C	.	.	S	Bend	trans	-102.4	112.9	174.3	-64	-11.9	0	0	0	108	L108 T109 N110 L250	L108-D252 WeakPolarHBondContact O-CA 3.41Å; T109-D252 WeakPolarHBondContact CA-OD1 3.36Å; T109-D252 WeakPolarHBondContact CB-OD1 3.36Å; T109-D252 HydrophobicContact CG2-CB 4.32Å; N110-D252 PolarHBondContact N-OD1 3.46Å; L250-D252 VanDerWaalsContact C-N 3.26Å; L250-D252 PolarHBondContact O-N 3.18Å
253	F	97.3	Very high	95.4	Very high	25 Å²	25	53.7 Å²	53.7	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	161.2	-176.4	64.4	-94.5	0	0	0	111.4	G107 L108 Y111 Q113 W244 A248 L250 K255	G107-F253 CarbonylContact C-O 3.53Å; G107-F253 WeakPolarHBondContact CA-O 3.26Å; L108-F253 HydrophobicContact CB-CE1 4.22Å; L108-F253 HydrophobicContact CB-CE2 4.2Å; L108-F253 HydrophobicContact CB-CZ 3.9Å; L108-F253 HydrophobicContact CD1-CE2 4.21Å; L108-F253 HydrophobicContact CD1-CZ 3.84Å; L108-F253 HydrophobicContact CG-CE2 4.45Å; L108-F253 HydrophobicContact CG-CZ 4.33Å; L108-F253 PolarHBondContact N-O 3.37Å; L108-F253 PolarHBondContact O-N 2.76Å; Y111-F253 AromaticContact CD1-CE1 3.78Å; Y111-F253 HydrophobicContact CD1-CE1 3.78Å; Y111-F253 AromaticContact CD1-CZ 3.94Å; Y111-F253 HydrophobicContact CD1-CZ 3.94Å; Y111-F253 HydrophobicContact CG-CE1 4.15Å; Y111-F253 HydrophobicContact CG-CZ 4.33Å; Y111-F253 WeakPolarHBondContact O-CE1 3.43Å; Q113-F253 HydrophobicContact CG-CE1 3.84Å; Q113-F253 HydrophobicContact CG-CZ 3.92Å; W244-F253 HydrophobicContact CZ3-CZ 4.45Å; A248-F253 HydrophobicContact CB-CB 3.49Å; A248-F253 VanDerWaalsContact CB-CB 3.49Å; A248-F253 HydrophobicContact CB-CD1 3.48Å; A248-F253 VanDerWaalsContact CB-CD1 3.48Å; A248-F253 HydrophobicContact CB-CD2 3.95Å; A248-F253 HydrophobicContact CB-CE1 4.13Å; A248-F253 HydrophobicContact CB-CG 3.35Å; L250-F253 WeakPolarHBondContact O-CD1 3.42Å; F253-K255 HydrophobicContact CD2-CD 4.26Å; F253-K255 HydrophobicContact CD2-CG 4.01Å; F253-K255 HydrophobicContact CE2-CD 3.83Å; F253-K255 HydrophobicContact CE2-CG 4.09Å
254	R	97	Very high	94.8	Very high	93 Å²	93	58.2 Å²	58.2	35%	0.351	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.5	170	66	-177.9	176.6	-170	-2.2	110.2	Y105 Y106	Y105-R254 HydrophobicContact CD1-CG 4.2Å; Y105-R254 HydrophobicContact CG-CG 4.38Å; Y106-R254 CarbonylContact O-C 3.6Å; Y106-R254 VanDerWaalsContact O-CA 3.23Å; Y106-R254 WeakPolarHBondContact O-CA 3.47Å
255	K	98	Very high	94.5	Very high	13 Å²	13	58.4 Å²	58.4	6%	0.057	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140	178.8	-79.3	177.2	-177.9	-68.9	0	109	Y105 Y106 V243 W244 R246 F253 Y257	Y105-K255 WeakPolarHBondContact CA-O 3.24Å; Y105-K255 WeakPolarHBondContact CB-O 3.48Å; Y106-K255 HydrophobicContact CD2-CB 4.28Å; Y106-K255 HydrophobicContact CE1-CB 3.9Å; Y106-K255 HydrophobicContact CE2-CB 3.62Å; Y106-K255 HydrophobicContact CE2-CD 3.84Å; Y106-K255 HydrophobicContact CE2-CG 4.25Å; Y106-K255 PolarHBondContact N-O 3.4Å; Y106-K255 VanDerWaalsContact N-O 3.08Å; Y106-K255 PolarHBondContact O-N 3.01Å; Y106-K255 WeakPolarHBondContact OH-CB 3.21Å; Y106-K255 WeakPolarHBondContact OH-CD 3.36Å; V243-K255 HydrophobicContact CG1-CB 3.76Å; V243-K255 HydrophobicContact CG1-CD 4.32Å; V243-K255 HydrophobicContact CG1-CG 4.11Å; V243-K255 PolarHBondContact O-NZ 3.19Å; W244-K255 HydrophobicContact CE3-CD 3.8Å; W244-K255 HydrophobicContact CZ3-CD 4.27Å; W244-K255 PolarHBondContact O-NZ 3.32Å; W244-K255 VanDerWaalsContact O-NZ 3.09Å; R246-K255 PolarHBondContact O-NZ 2.99Å; F253-K255 HydrophobicContact CD2-CD 4.26Å; F253-K255 HydrophobicContact CD2-CG 4.01Å; F253-K255 HydrophobicContact CE2-CD 3.83Å; F253-K255 HydrophobicContact CE2-CG 4.09Å; K255-Y257 PolarHBondContact O-N 3.47Å
256	L	97.9	Very high	94.1	Very high	26 Å²	26	61.1 Å²	61.1	14%	0.136	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.7	-177.9	-178.9	60.3	0	0	0	108.7	F103 Y105 I188 V243 R259	F103-L256 HydrophobicContact CB-CD1 3.86Å; F103-L256 HydrophobicContact CD1-CD1 3.75Å; F103-L256 HydrophobicContact CD1-CD2 4.2Å; F103-L256 HydrophobicContact CG-CD1 4.28Å; Y105-L256 HydrophobicContact CD1-CB 4.05Å; Y105-L256 HydrophobicContact CD1-CD1 4.17Å; Y105-L256 HydrophobicContact CE1-CB 3.86Å; Y105-L256 HydrophobicContact CE1-CD1 3.79Å; Y105-L256 HydrophobicContact CE1-CG 4.4Å; I188-L256 HydrophobicContact CB-CD2 3.7Å; I188-L256 HydrophobicContact CB-CG 3.93Å; I188-L256 HydrophobicContact CG2-CD2 3.83Å; I188-L256 HydrophobicContact CG2-CG 3.95Å; V243-L256 WeakPolarHBondContact CG1-O 3.44Å; L256-R259 HydrophobicContact CD2-CG 4.47Å
257	Y	97.9	Very high	93.8	Very high	21 Å²	21	60.3 Å²	60.3	8%	0.082	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-61.7	174.1	-172.1	-119.5	0	0	0	108.8	F104 Y106 F168 L183 I188 K255	F104-Y257 AromaticContact CD1-CD1 3.8Å; F104-Y257 HydrophobicContact CD1-CD1 3.8Å; F104-Y257 HydrophobicContact CD1-CG 4.21Å; F104-Y257 AromaticContact CE1-CD1 3.91Å; F104-Y257 HydrophobicContact CE1-CD1 3.91Å; F104-Y257 HydrophobicContact CE1-CG 4.44Å; F104-Y257 HydrophobicContact CG-CD1 4.29Å; F104-Y257 HydrophobicContact CZ-CD1 4.46Å; F104-Y257 WeakPolarHBondContact O-CA 3.28Å; F104-Y257 WeakPolarHBondContact O-CB 3.49Å; F104-Y257 PolarHBondContact O-N 3.13Å; Y106-Y257 HydrophobicContact CD1-CD2 4.08Å; Y106-Y257 HydrophobicContact CD1-CG 4.33Å; Y106-Y257 HydrophobicContact CE1-CD2 4.29Å; F168-Y257 HydrophobicContact CB-CD1 4.38Å; F168-Y257 HydrophobicContact CB-CE1 3.84Å; F168-Y257 AromaticContact CD2-CD1 3.64Å; F168-Y257 HydrophobicContact CD2-CD1 3.64Å; F168-Y257 HydrophobicContact CD2-CD2 4.28Å; F168-Y257 AromaticContact CD2-CE1 3.49Å; F168-Y257 HydrophobicContact CD2-CE1 3.49Å; F168-Y257 VanDerWaalsContact CD2-CE1 3.49Å; F168-Y257 HydrophobicContact CD2-CE2 4.08Å; F168-Y257 HydrophobicContact CD2-CG 4.08Å; F168-Y257 AromaticContact CD2-CZ 3.7Å; F168-Y257 HydrophobicContact CE2-CD1 4.42Å; F168-Y257 HydrophobicContact CE2-CD2 4.48Å; F168-Y257 HydrophobicContact CE2-CE2 4.49Å; F168-Y257 HydrophobicContact CE2-CG 4.45Å; F168-Y257 HydrophobicContact CG-CD1 4.42Å; F168-Y257 HydrophobicContact CG-CE1 4.14Å; L183-Y257 HydrophobicContact CD1-CE1 4.47Å; I188-Y257 VanDerWaalsContact CD1-O 3.27Å; I188-Y257 WeakPolarHBondContact CD1-O 3.43Å; K255-Y257 PolarHBondContact O-N 3.47Å
258	R	96.9	Very high	93.7	Very high	36 Å²	36	54.2 Å²	54.2	14%	0.136	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	158.6	-170.2	-62.2	-72.8	179.5	-85.8	4.6	111.5	F104 L183 D184 G185 D240	F104-R258 HydrophobicContact CB-CB 4.22Å; F104-R258 WeakPolarHBondContact CB-O 3.39Å; F104-R258 PolarHBondContact N-O 3.14Å; F104-R258 PolarHBondContact O-N 3.45Å; F104-R258 VanDerWaalsContact O-N 3.11Å; L183-R258 HydrophobicContact CB-CB 3.83Å; L183-R258 HydrophobicContact CB-CG 3.76Å; L183-R258 HydrophobicContact CD1-CG 4.43Å; L183-R258 HydrophobicContact CD2-CB 4.37Å; D184-R258 VanDerWaalsContact C-CD 3.45Å; D184-R258 CarbonylContact O-C 3.51Å; D184-R258 VanDerWaalsContact O-CA 3.25Å; D184-R258 WeakPolarHBondContact O-CA 3.39Å; D184-R258 VanDerWaalsContact O-CD 3.31Å; D184-R258 WeakPolarHBondContact O-CD 3.47Å; G185-R258 VanDerWaalsContact CA-CD 3.48Å; D240-R258 VanDerWaalsContact CG-NH1 3.29Å; D240-R258 IonicContact OD1-CZ 3.43Å; D240-R258 IonicContact OD1-NH1 3.69Å; D240-R258 PolarHBondContact OD1-NH1 3.13Å; D240-R258 IonicContact OD1-NH2 3.39Å; D240-R258 IonicContact OD2-CZ 2.68Å; D240-R258 IonicContact OD2-NH1 2.62Å; D240-R258 PolarHBondContact OD2-NH1 3.1Å; D240-R258 VanDerWaalsContact OD2-NH1 3.13Å; D240-R258 IonicContact OD2-NH2 3.09Å; D240-R258 PolarHBondContact OD2-NH2 2.77Å
259	R	95.5	Very high	93.5	Very high	78 Å²	78	53.3 Å²	53.3	29%	0.294	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	141.6	172.7	-65.8	171	62.9	-162.9	-4.6	109.2	F103 D184 G187 I188 L256 T261	F103-R259 HydrophobicContact CD1-CG 3.87Å; F103-R259 HydrophobicContact CE1-CG 3.91Å; D184-R259 HydrophobicContact CB-CB 4.44Å; D184-R259 WeakPolarHBondContact CB-O 3.26Å; D184-R259 PolarHBondContact N-O 2.89Å; D184-R259 PolarHBondContact O-N 2.74Å; G187-R259 PolarHBondContact O-NH1 2.98Å; I188-R259 HydrophobicContact CG2-CG 4.12Å; L256-R259 HydrophobicContact CD2-CG 4.47Å; R259-T261 HydrophobicContact CB-CG2 4.4Å
260	I	94.7	Very high	93.4	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	93	176.8	-51.2	173.1	0	0	0	106.2	V102 L170 V181 L183 Y265 L269	V102-I260 HydrophobicContact CB-CB 4.26Å; V102-I260 HydrophobicContact CG1-CD1 4.32Å; V102-I260 PolarHBondContact N-O 3.09Å; V102-I260 PolarHBondContact O-N 3.39Å; L170-I260 HydrophobicContact CD2-CD1 4.1Å; V181-I260 HydrophobicContact CG1-CD1 4.25Å; V181-I260 HydrophobicContact CG1-CG2 3.78Å; L183-I260 HydrophobicContact CD2-CD1 3.92Å; L183-I260 HydrophobicContact CD2-CG1 3.82Å; I260-Y265 HydrophobicContact CG2-CG 4.31Å; I260-L269 HydrophobicContact CD1-CD1 4.33Å; I260-L269 HydrophobicContact CD1-CD2 4.24Å; I260-L269 HydrophobicContact CG2-CD2 4.05Å
261	T	87.1	Confident	93.3	Very high	31 Å²	31	48.7 Å²	48.7	19%	0.19	27%	0.271	C	S	.	.			trans	-137.5	-3.1	-172.1	54.2	0	0	0	0	114.3	P101 R259	P101-T261 HydrophobicContact CB-CG2 3.8Å; R259-T261 HydrophobicContact CB-CG2 4.4Å
262	H	84.3	Confident	93.2	Very high	95 Å²	95	48 Å²	48	44%	0.44	27%	0.27	S	S	.	.	S	Bend	trans	-113.4	169	-173.9	-59.4	-63.5	0	0	0	111.8	D184 Y265	D184-H262 IonicContact OD2-CD2 3.13Å; D184-H262 IonicContact OD2-NE2 3.77Å; D184-H262 PolarHBondContact OD2-NE2 3.14Å; H262-Y265 PolarHBondContact O-N 3.01Å
263	D	85.3	Confident	93.2	Very high	121 Å²	121	48 Å²	48	65%	0.647	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	55.1	-141.7	176.2	-51.9	-38.9	0	0	0	112.7	P182 Y265 A266	P182-D263 HydrophobicContact CG-CB 4.34Å; P182-D263 WeakPolarHBondContact CG-OD2 3.46Å; D263-Y265 PolarHBondContact O-N 3.42Å; D263-A266 PolarHBondContact O-N 3.27Å
264	D	85.8	Confident	93.1	Very high	110 Å²	110	46.8 Å²	46.8	59%	0.588	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-63.6	-6.3	-179.9	-60.5	-15.2	0	0	0	113.8	K179	K179-D264 IonicContact NZ-OD2 2.74Å; K179-D264 PolarHBondContact NZ-OD2 3.08Å
265	Y	91.3	Very high	93.1	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.02	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-109.6	12.2	-177.3	-54	-78.9	0	0	0	113	H172 V181 P182 I260 H262 D263 A267 G268 L269	H172-Y265 HydrophobicContact CB-CE1 4.47Å; H172-Y265 VanDerWaalsContact CB-OH 3.28Å; H172-Y265 WeakPolarHBondContact CB-OH 3.42Å; H172-Y265 AromaticContact ND1-CE1 3.9Å; H172-Y265 PolarHBondContact ND1-OH 3.43Å; V181-Y265 HydrophobicContact CB-CE2 4.29Å; V181-Y265 HydrophobicContact CG1-CD1 4.48Å; V181-Y265 HydrophobicContact CG1-CD2 4.01Å; V181-Y265 HydrophobicContact CG1-CE2 4.06Å; V181-Y265 HydrophobicContact CG1-CG 4.21Å; V181-Y265 HydrophobicContact CG2-CE1 4.18Å; V181-Y265 HydrophobicContact CG2-CE2 4.18Å; P182-Y265 HydrophobicContact CG-CD2 4.08Å; I260-Y265 HydrophobicContact CG2-CG 4.31Å; H262-Y265 PolarHBondContact O-N 3.01Å; D263-Y265 PolarHBondContact O-N 3.42Å; Y265-A267 VanDerWaalsContact C-N 3.28Å; Y265-A267 PolarHBondContact O-N 2.68Å; Y265-G268 WeakPolarHBondContact CA-O 3.27Å; Y265-G268 WeakPolarHBondContact O-CA 3.33Å; Y265-G268 PolarHBondContact O-N 3.09Å; Y265-L269 HydrophobicContact CD1-CD2 3.71Å; Y265-L269 HydrophobicContact CE1-CD2 4.23Å; Y265-L269 HydrophobicContact CG-CD2 4.36Å
266	A	89.4	Confident	93.1	Very high	62 Å²	62	42.6 Å²	42.6	51%	0.512	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-37.9	176.9	0	0	0	0	0	112.9	D263 G268	D263-A266 PolarHBondContact O-N 3.27Å; A266-G268 VanDerWaalsContact C-N 3.26Å; A266-G268 PolarHBondContact O-N 3.45Å
267	A	90.3	Very high	93.1	Very high	76 Å²	76	43.5 Å²	43.5	63%	0.628	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-6.4	175.5	0	0	0	0	0	113.5	G100 Y265	G100-A267 PolarHBondContact N-O 3.43Å; Y265-A267 VanDerWaalsContact C-N 3.28Å; Y265-A267 PolarHBondContact O-N 2.68Å
268	G	93.1	Very high	93	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.021	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	120.8	-166.8	-175.6	0	0	0	0	0	113.7	F98 Y265 A266 P270	F98-G268 CarbonylContact O-C 3.54Å; F98-G268 WeakPolarHBondContact O-CA 3.49Å; Y265-G268 WeakPolarHBondContact CA-O 3.27Å; Y265-G268 WeakPolarHBondContact O-CA 3.33Å; Y265-G268 PolarHBondContact O-N 3.09Å; A266-G268 VanDerWaalsContact C-N 3.26Å; A266-G268 PolarHBondContact O-N 3.45Å; G268-P270 WeakPolarHBondContact O-CD 3.47Å
269	L	94.9	Very high	93	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	117	178	-60.6	172.6	0	0	0	109.8	I94 F98 V102 V181 I260 Y265 Y274 L295	I94-L269 HydrophobicContact CD1-CB 3.97Å; I94-L269 HydrophobicContact CD1-CD1 3.96Å; F98-L269 HydrophobicContact CB-CB 3.91Å; F98-L269 WeakPolarHBondContact CB-O 3.17Å; F98-L269 PolarHBondContact N-O 3.29Å; F98-L269 PolarHBondContact O-N 2.98Å; V102-L269 HydrophobicContact CG1-CD1 4.04Å; V102-L269 HydrophobicContact CG1-CG 4.45Å; V102-L269 HydrophobicContact CG2-CG 4.28Å; V181-L269 HydrophobicContact CG1-CD2 4.13Å; I260-L269 HydrophobicContact CD1-CD1 4.33Å; I260-L269 HydrophobicContact CD1-CD2 4.24Å; I260-L269 HydrophobicContact CG2-CD2 4.05Å; Y265-L269 HydrophobicContact CD1-CD2 3.71Å; Y265-L269 HydrophobicContact CE1-CD2 4.23Å; Y265-L269 HydrophobicContact CG-CD2 4.36Å; L269-Y274 HydrophobicContact CD2-CE1 4.12Å; L269-L295 HydrophobicContact CD1-CD1 4.05Å
270	P	94.6	Very high	93	Very high	45 Å²	45	38.7 Å²	38.7	29%	0.292	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-55.6	159.2	174.6	-26.6	35.2	0	0	0	113.4	G268 G272 Y274	G268-P270 WeakPolarHBondContact O-CD 3.47Å; P270-G272 PolarHBondContact O-N 2.74Å; P270-Y274 WeakPolarHBondContact CD-OH 3.33Å; P270-Y274 WeakPolarHBondContact O-CE2 3.31Å; P270-Y274 PolarHBondContact O-OH 3.13Å; P270-Y274 VanDerWaalsContact O-OH 3.05Å
271	A	94.6	Very high	92.9	Very high	55 Å²	55	41.9 Å²	41.9	46%	0.455	26%	0.26	S	S	.	.	S	Bend	trans	-64.7	134.8	169.5	0	0	0	0	0	109.7	I94	I94-A271 CarbonylContact O-C 3.59Å; I94-A271 WeakPolarHBondContact O-CA 3.39Å; I94-A271 WeakPolarHBondContact O-CB 3.21Å
272	G	94.4	Very high	93.3	Very high	20 Å²	20	41.2 Å²	41.2	21%	0.206	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	159.7	-178.5	-175.3	0	0	0	0	0	114	S93 I94 P270 Y274	S93-G272 WeakPolarHBondContact CA-O 3.48Å; S93-G272 PolarHBondContact OG-O 3.17Å; I94-G272 PolarHBondContact N-O 2.68Å; I94-G272 PolarHBondContact O-N 2.9Å; P270-G272 PolarHBondContact O-N 2.74Å; G272-Y274 WeakPolarHBondContact O-CD2 3.4Å
273	N	96.3	Very high	93.7	Very high	93 Å²	93	40.9 Å²	40.9	50%	0.497	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.1	179.8	-68.6	-21.9	0	0	0	110.7	S93 T173	S93-N273 VanDerWaalsContact CB-OD1 3.23Å; S93-N273 WeakPolarHBondContact CB-OD1 3.4Å; S93-N273 PolarHBondContact OG-OD1 2.86Å; T173-N273 WeakPolarHBondContact CB-O 3.25Å; T173-N273 PolarHBondContact N-O 3.42Å; T173-N273 PolarHBondContact OG1-O 3.48Å
274	Y	96.8	Very high	94.1	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	144.7	179.9	-70.7	-95.5	0	0	0	110.3	T91 F92 I94 L170 S171 H172 V181 L269 P270 G272	T91-Y274 CarbonylContact C-O 3.54Å; T91-Y274 WeakPolarHBondContact CA-O 3.09Å; F92-Y274 HydrophobicContact CE2-CD2 4.47Å; F92-Y274 HydrophobicContact CE2-CG 4.3Å; F92-Y274 VanDerWaalsContact CZ-CB 3.48Å; F92-Y274 HydrophobicContact CZ-CG 4.16Å; F92-Y274 PolarHBondContact N-O 2.9Å; F92-Y274 PolarHBondContact O-N 3.26Å; I94-Y274 HydrophobicContact CB-CD2 4.47Å; I94-Y274 HydrophobicContact CB-CE2 4.26Å; I94-Y274 HydrophobicContact CD1-CD2 3.75Å; I94-Y274 HydrophobicContact CD1-CE2 3.56Å; I94-Y274 HydrophobicContact CG1-CD2 3.8Å; I94-Y274 HydrophobicContact CG1-CE2 3.89Å; L170-Y274 HydrophobicContact CD1-CD1 4.11Å; L170-Y274 HydrophobicContact CG-CD1 4.26Å; S171-Y274 CarbonylContact O-C 3.53Å; S171-Y274 VanDerWaalsContact O-CA 3.29Å; S171-Y274 WeakPolarHBondContact O-CA 3.41Å; H172-Y274 HydrophobicContact CB-CD1 3.89Å; H172-Y274 HydrophobicContact CB-CE1 3.5Å; H172-Y274 AromaticContact CD2-CE1 3.67Å; H172-Y274 AromaticContact CD2-CE2 3.71Å; H172-Y274 AromaticContact CD2-CZ 3.4Å; H172-Y274 VanDerWaalsContact CD2-CZ 3.4Å; H172-Y274 AromaticContact CG-CE1 3.58Å; H172-Y274 AromaticContact CG-CZ 3.67Å; H172-Y274 AromaticContact NE2-CZ 3.87Å; V181-Y274 HydrophobicContact CG2-CD1 4.36Å; V181-Y274 HydrophobicContact CG2-CE1 4.07Å; L269-Y274 HydrophobicContact CD2-CE1 4.12Å; P270-Y274 WeakPolarHBondContact CD-OH 3.33Å; P270-Y274 WeakPolarHBondContact O-CE2 3.31Å; P270-Y274 PolarHBondContact O-OH 3.13Å; P270-Y274 VanDerWaalsContact O-OH 3.05Å; G272-Y274 WeakPolarHBondContact O-CD2 3.4Å
275	T	97.1	Very high	94.4	Very high	15 Å²	15	32.5 Å²	32.5	9%	0.092	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	123.3	172.2	-56.4	0	0	0	0	108.4	M90 T91 S171	M90-T275 CarbonylContact O-C 3.59Å; M90-T275 WeakPolarHBondContact O-CA 3.5Å; T91-T275 HydrophobicContact CG2-CG2 4.3Å; S171-T275 PolarHBondContact N-O 2.94Å; S171-T275 PolarHBondContact O-N 2.54Å
276	L	97.3	Very high	94.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	114.9	173.6	177.8	66.3	0	0	0	108.7	L65 S89 M90 F92 F104 F168 I278 V293	L65-L276 HydrophobicContact CD1-CD2 4.41Å; S89-L276 CarbonylContact C-O 3.55Å; S89-L276 VanDerWaalsContact CA-O 3.27Å; S89-L276 WeakPolarHBondContact CA-O 3.31Å; M90-L276 HydrophobicContact CE-CD2 4.15Å; M90-L276 PolarHBondContact N-O 3.35Å; M90-L276 PolarHBondContact O-N 2.87Å; F92-L276 HydrophobicContact CE1-CB 4.15Å; F104-L276 HydrophobicContact CE2-CD1 3.98Å; F104-L276 HydrophobicContact CZ-CD1 3.99Å; F168-L276 HydrophobicContact CB-CD1 4.16Å; F168-L276 HydrophobicContact CD1-CD1 4.25Å; L276-I278 HydrophobicContact CD2-CD1 3.89Å; L276-I278 HydrophobicContact CD2-CG1 4.1Å; L276-I278 HydrophobicContact CG-CD1 4.15Å; L276-I278 HydrophobicContact CG-CG1 3.84Å; L276-V293 HydrophobicContact CD2-CB 4.04Å; L276-V293 HydrophobicContact CD2-CG1 4.08Å; L276-V293 HydrophobicContact CD2-CG2 3.87Å
277	T	97.2	Very high	94.6	Very high	45 Å²	45	38 Å²	38	28%	0.276	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	129.9	172.8	-62.3	0	0	0	0	109.3	S89 T169	S89-T277 PolarHBondContact OG-OG1 3.45Å; S89-T277 VanDerWaalsContact OG-OG1 3.08Å; T169-T277 PolarHBondContact N-O 3.32Å; T169-T277 PolarHBondContact O-N 3.35Å
278	I	97.2	Very high	94.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.1	-170.3	-49.9	175.9	0	0	0	108.4	Y67 T87 C88 M90 T167 F168 L276	Y67-I278 HydrophobicContact CD1-CD1 4.2Å; Y67-I278 HydrophobicContact CD2-CD1 3.7Å; Y67-I278 HydrophobicContact CD2-CG2 4.01Å; Y67-I278 HydrophobicContact CE2-CD1 4.4Å; Y67-I278 HydrophobicContact CE2-CG2 3.9Å; Y67-I278 HydrophobicContact CG-CD1 3.58Å; T87-I278 VanDerWaalsContact CA-O 3.23Å; T87-I278 WeakPolarHBondContact CA-O 3.32Å; C88-I278 PolarHBondContact N-O 2.77Å; C88-I278 PolarHBondContact O-N 3.39Å; M90-I278 HydrophobicContact CE-CD1 4.17Å; M90-I278 HydrophobicContact SD-CD1 4.5Å; T167-I278 WeakPolarHBondContact O-CA 3.39Å; F168-I278 HydrophobicContact CD1-CB 4.48Å; F168-I278 HydrophobicContact CD1-CG1 4.03Å; F168-I278 HydrophobicContact CD1-CG2 4.1Å; F168-I278 HydrophobicContact CE1-CD1 4.47Å; F168-I278 HydrophobicContact CE1-CG1 4.29Å; F168-I278 HydrophobicContact CE1-CG2 3.86Å; L276-I278 HydrophobicContact CD2-CD1 3.89Å; L276-I278 HydrophobicContact CD2-CG1 4.1Å; L276-I278 HydrophobicContact CG-CD1 4.15Å; L276-I278 HydrophobicContact CG-CG1 3.84Å
279	A	96.2	Very high	94.9	Very high	19 Å²	19	40.3 Å²	40.3	16%	0.157	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	110.5	162.6	0	0	0	0	0	108.6	T87 D166 T167 N281	T87-A279 HydrophobicContact CG2-CB 4.34Å; D166-A279 VanDerWaalsContact CA-O 3.31Å; D166-A279 WeakPolarHBondContact CA-O 3.45Å; D166-A279 WeakPolarHBondContact CB-O 3.49Å; T167-A279 PolarHBondContact N-O 3.11Å; T167-A279 PolarHBondContact O-N 3.21Å; T167-A279 WeakPolarHBondContact OG1-CB 3.44Å; A279-N281 PolarHBondContact O-N 3.29Å
280	Y	94.8	Very high	95	Very high	16 Å²	16	44.3 Å²	44.3	6%	0.063	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	92	-171	-163.1	-74.6	0	0	0	109.8	Y67 T68 C79 C86 H285 K291	Y67-Y280 HydrophobicContact CD2-CD2 4.02Å; Y67-Y280 AromaticContact CD2-CE2 3.98Å; Y67-Y280 HydrophobicContact CD2-CE2 3.98Å; Y67-Y280 HydrophobicContact CE2-CD2 4.27Å; Y67-Y280 HydrophobicContact CE2-CE2 4.28Å; Y67-Y280 WeakPolarHBondContact O-CE2 3.05Å; T68-Y280 PolarHBondContact O-OH 3.28Å; C79-Y280 HydrophobicContact CB-CD1 3.94Å; C79-Y280 HydrophobicContact CB-CD2 4.25Å; C79-Y280 HydrophobicContact CB-CG 3.74Å; C86-Y280 PolarHBondContact O-N 3.29Å; Y280-H285 PolarHBondContact OH-NE2 3.44Å; Y280-K291 VanDerWaalsContact CE1-NZ 3.33Å; Y280-K291 VanDerWaalsContact OH-CE 3.28Å; Y280-K291 WeakPolarHBondContact OH-CE 3.47Å
281	N	93.8	Very high	95.1	Very high	66 Å²	66	42.2 Å²	42.2	35%	0.353	25%	0.245	S	C	.	.			trans	-112.1	-26.3	-176.3	-59.1	-47.2	0	0	0	113.1	N165 D166 A279 P283	N165-N281 PolarHBondContact O-ND2 3.18Å; N165-N281 WeakPolarHBondContact OD1-CB 3.32Å; D166-N281 WeakPolarHBondContact OD1-CA 3.49Å; D166-N281 PolarHBondContact OD1-N 2.79Å; A279-N281 PolarHBondContact O-N 3.29Å; N281-P283 WeakPolarHBondContact O-CD 3.38Å
282	Y	94.5	Very high	95.2	Very high	18 Å²	18	42.4 Å²	42.4	7%	0.071	24%	0.236	C	C	.	.			trans	-92.4	112.7	-171	-159.5	-100.9	0	0	0	111.5	L108 Y111 S162 M163 F164 N165 D166 V284 K291	L108-Y282 HydrophobicContact CD1-CE1 4.05Å; L108-Y282 HydrophobicContact CD2-CD1 4.44Å; L108-Y282 HydrophobicContact CD2-CE1 4.48Å; Y111-Y282 HydrophobicContact CE2-CE1 4.2Å; Y111-Y282 WeakPolarHBondContact CE2-OH 3.49Å; Y111-Y282 PolarHBondContact OH-OH 3.14Å; S162-Y282 VanDerWaalsContact O-CE2 3.28Å; S162-Y282 WeakPolarHBondContact O-CE2 3.28Å; S162-Y282 PolarHBondContact O-OH 3.32Å; M163-Y282 WeakPolarHBondContact O-CE2 3.46Å; F164-Y282 AromaticContact CD2-CD1 3.84Å; F164-Y282 HydrophobicContact CD2-CD1 3.84Å; F164-Y282 HydrophobicContact CD2-CD2 4.17Å; F164-Y282 HydrophobicContact CD2-CE1 4.26Å; F164-Y282 AromaticContact CD2-CG 3.77Å; F164-Y282 HydrophobicContact CD2-CG 3.77Å; F164-Y282 HydrophobicContact CE2-CD1 4.18Å; F164-Y282 HydrophobicContact CE2-CG 4.14Å; N165-Y282 WeakPolarHBondContact OD1-CA 3.44Å; N165-Y282 WeakPolarHBondContact OD1-CB 3.12Å; N165-Y282 WeakPolarHBondContact OD1-CD2 3.38Å; N165-Y282 PolarHBondContact OD1-N 3.19Å; D166-Y282 WeakPolarHBondContact OD1-CB 3.18Å; D166-Y282 PolarHBondContact OD1-N 3.21Å; Y282-V284 HydrophobicContact CD1-CG1 3.92Å; Y282-V284 HydrophobicContact CE1-CG1 4.29Å; Y282-K291 PolarHBondContact O-NZ 3.2Å
283	P	93.1	Very high	95.4	Very high	87 Å²	87	41.5 Å²	41.5	57%	0.565	23%	0.227	S	C	*	.			trans	-80.6	130.4	-177.8	32	-33.6	0	0	0	111.2	N281 F287	N281-P283 WeakPolarHBondContact O-CD 3.38Å; P283-F287 WeakPolarHBondContact O-CE1 3.26Å
284	V	94.1	Very high	95.4	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.006	20%	0.204	C	C	.	.			trans	-123.6	-15.9	176.7	-63.9	0	0	0	0	114.2	T68 L108 Y282 S286 F287 N288 G289 K291	T68-V284 HydrophobicContact CG2-CG2 4.04Å; L108-V284 HydrophobicContact CD2-CG1 4.19Å; Y282-V284 HydrophobicContact CD1-CG1 3.92Å; Y282-V284 HydrophobicContact CE1-CG1 4.29Å; V284-S286 VanDerWaalsContact C-N 3.32Å; V284-S286 PolarHBondContact O-N 2.05Å; V284-F287 HydrophobicContact CB-CE2 4.17Å; V284-F287 HydrophobicContact CB-CZ 3.88Å; V284-F287 HydrophobicContact CG1-CE2 4.4Å; V284-F287 HydrophobicContact CG1-CZ 3.87Å; V284-F287 PolarHBondContact O-N 2.68Å; V284-N288 PolarHBondContact O-N 2.62Å; V284-G289 WeakPolarHBondContact CB-O 3.47Å; V284-G289 WeakPolarHBondContact CG2-O 3.33Å; V284-G289 PolarHBondContact O-N 3.36Å; V284-K291 HydrophobicContact CB-CG 4.26Å; V284-K291 HydrophobicContact CG1-CD 3.76Å; V284-K291 HydrophobicContact CG1-CG 3.53Å; V284-K291 HydrophobicContact CG2-CD 4.18Å; V284-K291 HydrophobicContact CG2-CG 3.76Å
285	H	91	Very high	95.5	Very high	54 Å²	54	37.3 Å²	37.3	25%	0.25	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-65.9	-31.1	-173.9	-75.2	-72.4	0	0	0	113.4	T68 D70 Y280 F287 N288	T68-H285 PolarHBondContact O-NE2 3.38Å; D70-H285 IonicContact OD1-CE1 2.54Å; D70-H285 PolarHBondContact OD1-CE1 2.97Å; Y280-H285 PolarHBondContact OH-NE2 3.44Å; H285-F287 PolarHBondContact O-N 3.46Å; H285-F287 VanDerWaalsContact O-N 3.15Å; H285-N288 PolarHBondContact O-N 3.48Å; H285-N288 VanDerWaalsContact O-N 3.16Å
286	S	91.7	Very high	95.4	Very high	110 Å²	110	36.6 Å²	36.6	77%	0.769	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-62.9	-21.6	-178.9	54	0	0	0	0	113.8	V284	V284-S286 VanDerWaalsContact C-N 3.32Å; V284-S286 PolarHBondContact O-N 2.05Å
287	F	93.2	Very high	95.2	Very high	72 Å²	72	37.1 Å²	37.1	32%	0.316	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-122.8	19.8	177.6	55.1	-94.6	0	0	0	112.4	N110 Y111 P283 V284 H285 G289	N110-F287 PolarHBondContact ND2-O 2.91Å; Y111-F287 AromaticContact CD2-CE2 3.9Å; Y111-F287 HydrophobicContact CD2-CE2 3.9Å; Y111-F287 AromaticContact CD2-CZ 3.7Å; Y111-F287 HydrophobicContact CD2-CZ 3.7Å; Y111-F287 HydrophobicContact CE2-CZ 4.15Å; P283-F287 WeakPolarHBondContact O-CE1 3.26Å; V284-F287 HydrophobicContact CB-CE2 4.17Å; V284-F287 HydrophobicContact CB-CZ 3.88Å; V284-F287 HydrophobicContact CG1-CE2 4.4Å; V284-F287 HydrophobicContact CG1-CZ 3.87Å; V284-F287 PolarHBondContact O-N 2.68Å; H285-F287 PolarHBondContact O-N 3.46Å; H285-F287 VanDerWaalsContact O-N 3.15Å; F287-G289 PolarHBondContact O-N 2.93Å
288	N	94.8	Very high	95	Very high	126 Å²	126	37.4 Å²	37.4	67%	0.674	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	40.5	-178.6	-165.3	44.6	0	0	0	112.7	N110 V284 H285	N110-N288 PolarHBondContact ND2-O 2.65Å; V284-N288 PolarHBondContact O-N 2.62Å; H285-N288 PolarHBondContact O-N 3.48Å; H285-N288 VanDerWaalsContact O-N 3.16Å
289	G	95.9	Very high	94.8	Very high	2 Å²	2	38.7 Å²	38.7	2%	0.021	21%	0.213	C	C	.	.			trans	-90.3	154.5	173.1	0	0	0	0	0	111.8	T109 V284 F287	T109-G289 VanDerWaalsContact O-CA 3.3Å; T109-G289 WeakPolarHBondContact O-CA 3.37Å; V284-G289 WeakPolarHBondContact CB-O 3.47Å; V284-G289 WeakPolarHBondContact CG2-O 3.33Å; V284-G289 PolarHBondContact O-N 3.36Å; F287-G289 PolarHBondContact O-N 2.93Å
290	K	96.7	Very high	94.5	Very high	84 Å²	84	47.6 Å²	47.6	37%	0.365	24%	0.243	S	C	.	.			trans	-115.8	151.4	172.9	-46.8	-173.5	172.8	-117.6	0	111.8	T68 D70 L108 T109	T68-K290 HydrophobicContact CG2-CB 4.34Å; T68-K290 WeakPolarHBondContact OG1-CA 3.13Å; T68-K290 WeakPolarHBondContact OG1-CB 3.37Å; D70-K290 IonicContact OD2-NZ 2.68Å; D70-K290 PolarHBondContact OD2-NZ 3.32Å; L108-K290 WeakPolarHBondContact CA-O 3.4Å; T109-K290 PolarHBondContact N-O 3.01Å; T109-K290 VanDerWaalsContact OG1-CA 3.28Å; T109-K290 WeakPolarHBondContact OG1-CA 3.38Å; T109-K290 WeakPolarHBondContact OG1-CB 3.14Å; T109-K290 PolarHBondContact OG1-N 3.06Å; T109-K290 PolarHBondContact OG1-O 3.25Å
291	K	96.8	Very high	94.3	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.7	175.9	-57.1	-169.9	-68.7	-176.9	0	110.7	Y67 T68 G107 L108 F164 D166 Y280 Y282 V284	Y67-K291 HydrophobicContact CD1-CB 4.17Å; Y67-K291 WeakPolarHBondContact CD1-O 3.48Å; Y67-K291 HydrophobicContact CD2-CB 4.29Å; Y67-K291 HydrophobicContact CE1-CB 3.61Å; Y67-K291 HydrophobicContact CE2-CB 3.76Å; Y67-K291 HydrophobicContact CE2-CD 3.91Å; Y67-K291 VanDerWaalsContact CE2-CE 3.46Å; Y67-K291 HydrophobicContact CE2-CG 4.46Å; Y67-K291 HydrophobicContact CG-CB 4.47Å; Y67-K291 PolarHBondContact N-O 2.81Å; T68-K291 PolarHBondContact OG1-N 3.48Å; T68-K291 PolarHBondContact OG1-O 3.43Å; G107-K291 WeakPolarHBondContact O-CA 3.22Å; L108-K291 HydrophobicContact CD2-CD 4.34Å; L108-K291 HydrophobicContact CD2-CG 3.8Å; F164-K291 HydrophobicContact CE2-CD 4.38Å; D166-K291 IonicContact OD1-NZ 3.42Å; D166-K291 WeakPolarHBondContact OD2-CD 3.49Å; D166-K291 WeakPolarHBondContact OD2-CE 3.3Å; D166-K291 IonicContact OD2-NZ 3.71Å; D166-K291 PolarHBondContact OD2-NZ 3.14Å; Y280-K291 VanDerWaalsContact CE1-NZ 3.33Å; Y280-K291 VanDerWaalsContact OH-CE 3.28Å; Y280-K291 WeakPolarHBondContact OH-CE 3.47Å; Y282-K291 PolarHBondContact O-NZ 3.2Å; V284-K291 HydrophobicContact CB-CG 4.26Å; V284-K291 HydrophobicContact CG1-CD 3.76Å; V284-K291 HydrophobicContact CG1-CG 3.53Å; V284-K291 HydrophobicContact CG2-CD 4.18Å; V284-K291 HydrophobicContact CG2-CG 3.76Å
292	K	97.3	Very high	94.1	Very high	59 Å²	59	47.6 Å²	47.6	26%	0.257	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	149.3	178.2	20	-179.2	169.2	-177.2	0	111.2	L65 Y67 Y106 G107	L65-K292 CarbonylContact O-C 3.52Å; L65-K292 VanDerWaalsContact O-CA 3.22Å; L65-K292 WeakPolarHBondContact O-CA 3.28Å; Y67-K292 VanDerWaalsContact CE1-C 3.48Å; Y106-K292 CarbonylContact C-O 3.51Å; Y106-K292 WeakPolarHBondContact CA-O 3.43Å; G107-K292 PolarHBondContact N-O 2.95Å; G107-K292 PolarHBondContact O-N 3.33Å
293	V	97.8	Very high	93.9	Very high	2 Å²	2	47.7 Å²	47.7	1%	0.012	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136	165	168.2	0	0	0	0	107.6	E64 L65 Y67 F104 Y105 F168 L276	E64-V293 CarbonylContact C-O 3.49Å; E64-V293 WeakPolarHBondContact CA-O 3.14Å; L65-V293 PolarHBondContact N-O 3.01Å; L65-V293 PolarHBondContact O-N 3.23Å; Y67-V293 HydrophobicContact CD1-CG2 3.95Å; Y67-V293 HydrophobicContact CE1-CG2 3.69Å; F104-V293 HydrophobicContact CD1-CG1 4.21Å; F104-V293 HydrophobicContact CE1-CB 4.34Å; F104-V293 HydrophobicContact CE1-CG1 3.51Å; F104-V293 HydrophobicContact CE1-CG2 3.96Å; F104-V293 HydrophobicContact CE2-CG1 4.06Å; F104-V293 HydrophobicContact CZ-CB 4.35Å; F104-V293 HydrophobicContact CZ-CG1 3.41Å; F104-V293 VanDerWaalsContact CZ-CG1 3.41Å; F104-V293 HydrophobicContact CZ-CG2 3.96Å; Y105-V293 WeakPolarHBondContact O-CA 3.47Å; F168-V293 HydrophobicContact CD1-CG2 3.87Å; F168-V293 HydrophobicContact CE1-CG2 3.41Å; F168-V293 VanDerWaalsContact CE1-CG2 3.41Å; F168-V293 HydrophobicContact CZ-CG2 3.94Å; L276-V293 HydrophobicContact CD2-CB 4.04Å; L276-V293 HydrophobicContact CD2-CG1 4.08Å; L276-V293 HydrophobicContact CD2-CG2 3.87Å
294	V	97.3	Very high	93.9	Very high	3 Å²	3	48 Å²	48	2%	0.018	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	118.9	178.7	-176.9	0	0	0	0	108.7	L62 Q63 E64 Y105	L62-V294 HydrophobicContact CD1-CG1 3.89Å; L62-V294 HydrophobicContact CG-CG1 4.14Å; Q63-V294 CarbonylContact O-C 3.59Å; Q63-V294 WeakPolarHBondContact O-CA 3.45Å; E64-V294 HydrophobicContact CB-CG2 4.39Å; E64-V294 HydrophobicContact CG-CB 4.46Å; E64-V294 HydrophobicContact CG-CG1 4.04Å; E64-V294 HydrophobicContact CG-CG2 3.89Å; Y105-V294 PolarHBondContact N-O 3.26Å; Y105-V294 PolarHBondContact O-N 2.87Å
295	L	96.9	Very high	93.9	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	126.8	166.1	-57.9	175.8	0	0	0	107.5	L62 Q63 F92 F98 V102 F103 F104 L269	L62-L295 WeakPolarHBondContact CA-O 3.34Å; Q63-L295 HydrophobicContact CB-CB 4.33Å; Q63-L295 PolarHBondContact N-O 3.22Å; Q63-L295 PolarHBondContact O-N 3.21Å; F92-L295 HydrophobicContact CE2-CD1 4.02Å; F92-L295 HydrophobicContact CZ-CD1 3.81Å; F98-L295 HydrophobicContact CZ-CB 4.36Å; F98-L295 WeakPolarHBondContact CZ-O 3.4Å; V102-L295 HydrophobicContact CG1-CB 4.46Å; F103-L295 WeakPolarHBondContact O-CA 3.32Å; F104-L295 HydrophobicContact CB-CD2 3.93Å; F104-L295 HydrophobicContact CD2-CD2 3.61Å; F104-L295 HydrophobicContact CE2-CD2 4.3Å; F104-L295 HydrophobicContact CG-CD2 3.84Å; L269-L295 HydrophobicContact CD1-CD1 4.05Å
296	S	95.9	Very high	94.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	142	179.7	-169.7	0	0	0	0	109.6	Q61 F103	Q61-S296 WeakPolarHBondContact O-CA 3.49Å; F103-S296 PolarHBondContact N-O 2.85Å; F103-S296 PolarHBondContact O-N 3.02Å
297	N	94.2	Very high	94.3	Very high	14 Å²	14	53.2 Å²	53.2	8%	0.075	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	172.2	158.9	63.4	-1.1	0	0	0	108.6	I60 Q61 F98 K99	I60-N297 VanDerWaalsContact CA-OD1 3.32Å; I60-N297 WeakPolarHBondContact CA-OD1 3.41Å; I60-N297 WeakPolarHBondContact CG2-O 3.41Å; I60-N297 WeakPolarHBondContact CG2-OD1 3.26Å; Q61-N297 PolarHBondContact N-OD1 2.93Å; Q61-N297 PolarHBondContact O-N 3.09Å; Q61-N297 PolarHBondContact O-OD1 2.93Å; F98-N297 HydrophobicContact CE1-CB 4.03Å; K99-N297 WeakPolarHBondContact O-CB 3.5Å; K99-N297 PolarHBondContact O-ND2 2.86Å
298	V	92.8	Very high	94.4	Very high	51 Å²	51	53.1 Å²	53.1	31%	0.309	27%	0.265	S	S	.	.			trans	-131.3	148	179.2	-57.5	0	0	0	0	109.7	F103 G302	F103-V298 HydrophobicContact CD2-CG1 3.72Å; F103-V298 HydrophobicContact CD2-CG2 4.15Å; F103-V298 HydrophobicContact CE2-CB 4.23Å; F103-V298 HydrophobicContact CE2-CG1 3.85Å; F103-V298 HydrophobicContact CE2-CG2 3.42Å; F103-V298 VanDerWaalsContact CE2-CG2 3.42Å; F103-V298 HydrophobicContact CZ-CG2 4.13Å; V298-G302 WeakPolarHBondContact CA-O 3.5Å
299	S	91.6	Very high	94.5	Very high	27 Å²	27	47.2 Å²	47.2	19%	0.189	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-96.1	-179	165.7	72.4	0	0	0	0	109.9	M301 G302	S299-M301 PolarHBondContact O-N 3.01Å; S299-M301 PolarHBondContact OG-N 3.21Å; S299-G302 PolarHBondContact N-O 2.89Å; S299-G302 PolarHBondContact O-N 2.81Å; S299-G302 PolarHBondContact OG-O 2.92Å
300	W	90.6	Very high	94.6	Very high	205 Å²	205	51 Å²	51	78%	0.777	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.6	171.2	68.1	-91.7	0	0	0	113.3	L53	L53-W300 HydrophobicContact CD2-CH2 3.89Å; L53-W300 HydrophobicContact CD2-CZ2 3.74Å
301	M	89.6	Confident	94.6	Very high	56 Å²	56	48.4 Å²	48.4	28%	0.276	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-1.1	176.9	-174.3	172.8	57.9	0	0	112.6	L53 S299 L308	L53-M301 HydrophobicContact CB-CE 4.29Å; L53-M301 HydrophobicContact CD1-SD 4.43Å; L53-M301 HydrophobicContact CD2-CE 4.21Å; L53-M301 HydrophobicContact CD2-SD 3.67Å; L53-M301 HydrophobicContact CG-SD 4.4Å; S299-M301 PolarHBondContact O-N 3.01Å; S299-M301 PolarHBondContact OG-N 3.21Å; M301-L308 HydrophobicContact SD-CD2 3.78Å
302	G	90.2	Very high	94.7	Very high	26 Å²	26	52.2 Å²	52.2	27%	0.268	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	99.4	-147.7	-176.4	0	0	0	0	0	112.6	I60 V298 S299	I60-G302 WeakPolarHBondContact CD1-O 3.35Å; V298-G302 WeakPolarHBondContact CA-O 3.5Å; S299-G302 PolarHBondContact N-O 2.89Å; S299-G302 PolarHBondContact O-N 2.81Å; S299-G302 PolarHBondContact OG-O 2.92Å
303	G	90.6	Very high	94.8	Very high	20 Å²	20	51.7 Å²	51.7	21%	0.206	26%	0.261	C	S	.	.	S	Bend	trans	-79.6	176.2	-176.9	0	0	0	0	0	113.8	N305	G303-N305 PolarHBondContact O-N 2.81Å
304	K	92.8	Very high	94.8	Very high	93 Å²	93	55.2 Å²	55.2	40%	0.404	28%	0.282	S	S	.	.			trans	-57.3	119.1	-179.8	-173.3	168.5	-175.1	166.6	0	111.7	I60 L62	I60-K304 HydrophobicContact CB-CB 4.05Å; I60-K304 HydrophobicContact CG2-CB 3.78Å; L62-K304 HydrophobicContact CB-CD 4.26Å; L62-K304 HydrophobicContact CD1-CB 4.49Å
305	N	94	Very high	94.8	Very high	93 Å²	93	58.2 Å²	58.2	50%	0.497	30%	0.301	S	S	.	.			trans	-160.1	101.7	174.5	-173.1	-2.2	0	0	0	111	S57 G303 F307	S57-N305 PolarHBondContact OG-N 2.89Å; S57-N305 PolarHBondContact OG-O 3.23Å; G303-N305 PolarHBondContact O-N 2.81Å; N305-F307 PolarHBondContact O-N 3.05Å; N305-F307 WeakPolarHBondContact OD1-CB 3.46Å; N305-F307 PolarHBondContact OD1-N 3.02Å; N305-F307 VanDerWaalsContact OD1-N 3.1Å
306	D	95.1	Very high	94.9	Very high	37 Å²	37	58.1 Å²	58.1	20%	0.198	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-14.8	-176.5	-66	0.5	0	0	0	112.4	F54 S57 R58 L308 G309 I310	F54-D306 HydrophobicContact CD2-CB 4.16Å; F54-D306 HydrophobicContact CE2-CB 4Å; S57-D306 VanDerWaalsContact CB-OD1 3.31Å; S57-D306 WeakPolarHBondContact CB-OD1 3.45Å; S57-D306 PolarHBondContact OG-N 2.85Å; S57-D306 PolarHBondContact OG-OD1 3.3Å; R58-D306 IonicContact NE-OD2 2.68Å; D306-L308 PolarHBondContact O-N 3.06Å; D306-G309 PolarHBondContact O-N 2.87Å; D306-I310 HydrophobicContact CB-CD1 4.01Å; D306-I310 VanDerWaalsContact O-CG1 3.31Å; D306-I310 WeakPolarHBondContact O-CG1 3.37Å; D306-I310 PolarHBondContact O-N 3.38Å
307	F	96.4	Very high	95	Very high	146 Å²	146	60.6 Å²	60.6	64%	0.64	32%	0.317	S	S	*	.	H	α-helix	trans	-56.6	-46.5	-173.2	175.3	-99.7	0	0	0	112.6	N305 G309 I310 A311	N305-F307 PolarHBondContact O-N 3.05Å; N305-F307 WeakPolarHBondContact OD1-CB 3.46Å; N305-F307 PolarHBondContact OD1-N 3.02Å; N305-F307 VanDerWaalsContact OD1-N 3.1Å; F307-G309 PolarHBondContact O-N 3.46Å; F307-I310 PolarHBondContact O-N 2.95Å; F307-A311 VanDerWaalsContact O-CB 3.31Å; F307-A311 WeakPolarHBondContact O-CB 3.41Å; F307-A311 PolarHBondContact O-N 3.02Å
308	L	95.4	Very high	95.2	Very high	70 Å²	70	65.8 Å²	65.8	37%	0.366	34%	0.343	S	S	.	.	H	α-helix	trans	-65.1	-44.3	-175.9	-168.3	65.7	0	0	0	111	L53 M301 D306 I310 A311 Y312	L53-L308 HydrophobicContact CD1-CD2 3.94Å; L53-L308 HydrophobicContact CD1-CG 3.99Å; M301-L308 HydrophobicContact SD-CD2 3.78Å; D306-L308 PolarHBondContact O-N 3.06Å; L308-I310 PolarHBondContact O-N 3.48Å; L308-A311 PolarHBondContact O-N 2.79Å; L308-Y312 HydrophobicContact CD1-CD2 4.08Å; L308-Y312 HydrophobicContact CD1-CE2 3.79Å; L308-Y312 HydrophobicContact CG-CD2 4.12Å; L308-Y312 HydrophobicContact CG-CE2 4.06Å; L308-Y312 VanDerWaalsContact O-CD2 3.3Å; L308-Y312 WeakPolarHBondContact O-CD2 3.29Å; L308-Y312 PolarHBondContact O-N 2.93Å
309	G	96.6	Very high	95.5	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.01	33%	0.334	C	S	.	.	H	α-helix	trans	-60.1	-46.6	175.6	0	0	0	0	0	112.2	G50 D306 F307 A311 Y312 I313	G50-G309 WeakPolarHBondContact O-CA 3.39Å; D306-G309 PolarHBondContact O-N 2.87Å; F307-G309 PolarHBondContact O-N 3.46Å; G309-A311 PolarHBondContact O-N 3.19Å; G309-Y312 PolarHBondContact O-N 3.28Å; G309-I313 VanDerWaalsContact O-CG1 3.31Å; G309-I313 WeakPolarHBondContact O-CG1 3.49Å; G309-I313 PolarHBondContact O-N 2.94Å; G309-I313 VanDerWaalsContact O-N 3.07Å
310	I	97.8	Very high	95.8	Very high	81 Å²	81	65 Å²	65	42%	0.415	34%	0.338	S	S	.	.	H	α-helix	trans	-61.2	-45.6	177.2	-65.7	166.5	0	0	0	111	F54 D306 F307 L308 Y312 I313 V314	F54-I310 HydrophobicContact CD2-CG1 4.04Å; F54-I310 HydrophobicContact CE2-CD1 4.2Å; F54-I310 HydrophobicContact CE2-CG1 3.93Å; D306-I310 HydrophobicContact CB-CD1 4.01Å; D306-I310 VanDerWaalsContact O-CG1 3.31Å; D306-I310 WeakPolarHBondContact O-CG1 3.37Å; D306-I310 PolarHBondContact O-N 3.38Å; F307-I310 PolarHBondContact O-N 2.95Å; L308-I310 PolarHBondContact O-N 3.48Å; I310-Y312 PolarHBondContact O-N 3.36Å; I310-I313 PolarHBondContact O-N 3.16Å; I310-V314 HydrophobicContact CG2-CG2 4.14Å; I310-V314 WeakPolarHBondContact O-CB 3.4Å; I310-V314 VanDerWaalsContact O-CG2 3.31Å; I310-V314 WeakPolarHBondContact O-CG2 3.47Å; I310-V314 PolarHBondContact O-N 3.24Å
311	A	98.1	Very high	96.1	Very high	30 Å²	30	59.6 Å²	59.6	25%	0.248	33%	0.327	C	S	.	.	H	α-helix	trans	-60	-44.3	-179.9	0	0	0	0	0	111.8	F307 L308 G309 V314 V315	F307-A311 VanDerWaalsContact O-CB 3.31Å; F307-A311 WeakPolarHBondContact O-CB 3.41Å; F307-A311 PolarHBondContact O-N 3.02Å; L308-A311 PolarHBondContact O-N 2.79Å; G309-A311 PolarHBondContact O-N 3.19Å; A311-V314 PolarHBondContact O-N 3.41Å; A311-V315 WeakPolarHBondContact O-CB 3.45Å; A311-V315 VanDerWaalsContact O-CG2 3.3Å; A311-V315 WeakPolarHBondContact O-CG2 3.35Å; A311-V315 PolarHBondContact O-N 3.33Å
312	Y	98.3	Very high	96.5	Very high	81 Å²	81	61 Å²	61	32%	0.318	33%	0.334	S	S	.	.	H	α-helix	trans	-63	-42.4	175.9	-92.1	-98.7	0	0	0	112.4	F46 V49 L53 L308 G309 I310 G316	F46-Y312 HydrophobicContact CB-CD1 4.21Å; F46-Y312 HydrophobicContact CD1-CD1 4.24Å; F46-Y312 HydrophobicContact CD1-CE1 4.21Å; F46-Y312 HydrophobicContact CD2-CD1 4.36Å; F46-Y312 HydrophobicContact CE1-CE1 4.33Å; F46-Y312 HydrophobicContact CG-CD1 4.02Å; F46-Y312 HydrophobicContact CG-CE1 4.38Å; V49-Y312 HydrophobicContact CB-CD1 4.26Å; V49-Y312 HydrophobicContact CG1-CD1 3.98Å; V49-Y312 HydrophobicContact CG1-CE1 4.03Å; L53-Y312 HydrophobicContact CD1-CD2 4.27Å; L53-Y312 HydrophobicContact CD1-CE2 4.45Å; L308-Y312 HydrophobicContact CD1-CD2 4.08Å; L308-Y312 HydrophobicContact CD1-CE2 3.79Å; L308-Y312 HydrophobicContact CG-CD2 4.12Å; L308-Y312 HydrophobicContact CG-CE2 4.06Å; L308-Y312 VanDerWaalsContact O-CD2 3.3Å; L308-Y312 WeakPolarHBondContact O-CD2 3.29Å; L308-Y312 PolarHBondContact O-N 2.93Å; G309-Y312 PolarHBondContact O-N 3.28Å; I310-Y312 PolarHBondContact O-N 3.36Å; Y312-G316 WeakPolarHBondContact O-CA 3.13Å; Y312-G316 PolarHBondContact O-N 3.17Å
313	I	98.4	Very high	96.8	Very high	48 Å²	48	60 Å²	60	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-44.5	177.5	-66.9	167	0	0	0	111.1	V51 F54 G309 I310 S317	V51-I313 HydrophobicContact CG2-CD1 4.11Å; V51-I313 HydrophobicContact CG2-CG1 4.32Å; F54-I313 HydrophobicContact CB-CD1 4.48Å; G309-I313 VanDerWaalsContact O-CG1 3.31Å; G309-I313 WeakPolarHBondContact O-CG1 3.49Å; G309-I313 PolarHBondContact O-N 2.94Å; G309-I313 VanDerWaalsContact O-N 3.07Å; I310-I313 PolarHBondContact O-N 3.16Å; I313-S317 WeakPolarHBondContact O-CB 3.49Å; I313-S317 PolarHBondContact O-N 3.07Å; I313-S317 PolarHBondContact O-OG 2.84Å
314	V	98.4	Very high	97.1	Very high	75 Å²	75	62.5 Å²	62.5	46%	0.455	33%	0.333	S	S	.	.	H	α-helix	trans	-64.1	-53	179.8	170.3	0	0	0	0	110.5	I310 A311 G316 S317 M318	I310-V314 HydrophobicContact CG2-CG2 4.14Å; I310-V314 WeakPolarHBondContact O-CB 3.4Å; I310-V314 VanDerWaalsContact O-CG2 3.31Å; I310-V314 WeakPolarHBondContact O-CG2 3.47Å; I310-V314 PolarHBondContact O-N 3.24Å; A311-V314 PolarHBondContact O-N 3.41Å; V314-G316 VanDerWaalsContact C-N 3.33Å; V314-G316 PolarHBondContact O-N 3.49Å; V314-S317 PolarHBondContact O-N 3.33Å; V314-M318 HydrophobicContact CG1-SD 4.22Å; V314-M318 WeakPolarHBondContact O-CG 3.31Å; V314-M318 PolarHBondContact O-N 3.27Å
315	V	98.3	Very high	97.3	Very high	67 Å²	67	61.3 Å²	61.3	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-62.6	-42.3	179.5	175.4	0	0	0	0	110.7	F46 A311 S317 M318 C319	F46-V315 HydrophobicContact CD2-CB 4.44Å; F46-V315 HydrophobicContact CD2-CG1 3.95Å; F46-V315 HydrophobicContact CE2-CG1 4.08Å; A311-V315 WeakPolarHBondContact O-CB 3.45Å; A311-V315 VanDerWaalsContact O-CG2 3.3Å; A311-V315 WeakPolarHBondContact O-CG2 3.35Å; A311-V315 PolarHBondContact O-N 3.33Å; V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 3.47Å; V315-M318 PolarHBondContact O-N 3.32Å; V315-C319 PolarHBondContact O-N 3.45Å; V315-C319 PolarHBondContact O-SG 2.91Å; V315-C319 VanDerWaalsContact O-SG 3.38Å
316	G	98.4	Very high	97.3	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-60.8	-42	176.5	0	0	0	0	0	112.7	G43 Y312 V314 C319 V320	G43-G316 WeakPolarHBondContact CA-O 3.29Å; Y312-G316 WeakPolarHBondContact O-CA 3.13Å; Y312-G316 PolarHBondContact O-N 3.17Å; V314-G316 VanDerWaalsContact C-N 3.33Å; V314-G316 PolarHBondContact O-N 3.49Å; G316-C319 WeakPolarHBondContact O-CB 3.16Å; G316-C319 PolarHBondContact O-N 3.16Å; G316-V320 WeakPolarHBondContact O-CG2 3.1Å; G316-V320 PolarHBondContact O-N 3.42Å
317	S	98.3	Very high	97.3	Very high	51 Å²	51	62.3 Å²	62.3	36%	0.357	34%	0.337	S	S	.	.	H	α-helix	trans	-66.9	-40.3	176.2	-64.4	0	0	0	0	112	I313 V314 V315 C319 V320 V321	I313-S317 WeakPolarHBondContact O-CB 3.49Å; I313-S317 PolarHBondContact O-N 3.07Å; I313-S317 PolarHBondContact O-OG 2.84Å; V314-S317 PolarHBondContact O-N 3.33Å; V315-S317 VanDerWaalsContact C-N 3.34Å; V315-S317 PolarHBondContact O-N 3.47Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 2.64Å; S317-V320 PolarHBondContact O-N 3.3Å; S317-V321 WeakPolarHBondContact O-CG2 3.46Å; S317-V321 PolarHBondContact O-N 2.88Å
318	M	98.2	Very high	97.2	Very high	124 Å²	124	60.1 Å²	60.1	61%	0.611	33%	0.331	S	S	*	.	H	α-helix	trans	-61	-40.4	172.5	-69.3	-179.5	90.2	0	0	111.5	V314 V315 V321 M322	V314-M318 HydrophobicContact CG1-SD 4.22Å; V314-M318 WeakPolarHBondContact O-CG 3.31Å; V314-M318 PolarHBondContact O-N 3.27Å; V315-M318 PolarHBondContact O-N 3.32Å; M318-V321 PolarHBondContact O-N 3.07Å; M318-M322 WeakPolarHBondContact O-CB 3.4Å; M318-M322 VanDerWaalsContact O-CG 3.29Å; M318-M322 WeakPolarHBondContact O-CG 3.29Å; M318-M322 PolarHBondContact O-N 2.89Å
319	C	98	Very high	97.2	Very high	20 Å²	20	60 Å²	60	14%	0.135	33%	0.334	C	S	.	.	H	α-helix	trans	-62	-42.8	175	-72	0	0	0	0	112.6	F39 V315 G316 S317 M322 S323	F39-C319 HydrophobicContact CD1-CB 4.23Å; V315-C319 PolarHBondContact O-N 3.45Å; V315-C319 PolarHBondContact O-SG 2.91Å; V315-C319 VanDerWaalsContact O-SG 3.38Å; G316-C319 WeakPolarHBondContact O-CB 3.16Å; G316-C319 PolarHBondContact O-N 3.16Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 2.64Å; C319-M322 PolarHBondContact O-N 2.68Å; C319-S323 WeakPolarHBondContact O-CB 3.48Å; C319-S323 PolarHBondContact O-N 3.12Å
320	V	98	Very high	97	Very high	42 Å²	42	63.8 Å²	63.8	26%	0.255	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-45.5	176.9	174.8	0	0	0	0	110.9	L40 I47 G316 S317 M322 S323 V324	L40-V320 HydrophobicContact CD1-CG1 4.33Å; I47-V320 HydrophobicContact CD1-CG2 4.09Å; G316-V320 WeakPolarHBondContact O-CG2 3.1Å; G316-V320 PolarHBondContact O-N 3.42Å; S317-V320 PolarHBondContact O-N 3.3Å; V320-M322 VanDerWaalsContact C-N 3.33Å; V320-M322 PolarHBondContact O-N 2.86Å; V320-S323 WeakPolarHBondContact O-CB 3.49Å; V320-S323 PolarHBondContact O-N 3.14Å; V320-V324 WeakPolarHBondContact O-CG2 3.49Å; V320-V324 PolarHBondContact O-N 2.94Å
321	V	98	Very high	96.7	Very high	90 Å²	90	61.5 Å²	61.5	55%	0.545	34%	0.341	S	S	.	.	H	α-helix	trans	-59.7	-45.3	176.4	171.5	0	0	0	0	110.8	S317 M318 S323 V324 V325	S317-V321 WeakPolarHBondContact O-CG2 3.46Å; S317-V321 PolarHBondContact O-N 2.88Å; M318-V321 PolarHBondContact O-N 3.07Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 3.02Å; V321-V324 PolarHBondContact O-N 2.82Å; V321-V325 WeakPolarHBondContact O-CG2 3.4Å; V321-V325 PolarHBondContact O-N 3.26Å
322	M	96.9	Very high	96.4	Very high	86 Å²	86	69.2 Å²	69.2	42%	0.424	36%	0.364	S	S	.	.	H	α-helix	trans	-63	-38.5	176.6	-73.4	-55.7	-61.6	0	0	112.4	F39 M318 C319 V320 V324 V325 M326	F39-M322 HydrophobicContact CD1-CB 4.33Å; M318-M322 WeakPolarHBondContact O-CB 3.4Å; M318-M322 VanDerWaalsContact O-CG 3.29Å; M318-M322 WeakPolarHBondContact O-CG 3.29Å; M318-M322 PolarHBondContact O-N 2.89Å; C319-M322 PolarHBondContact O-N 2.68Å; V320-M322 VanDerWaalsContact C-N 3.33Å; V320-M322 PolarHBondContact O-N 2.86Å; M322-V324 PolarHBondContact O-N 2.92Å; M322-V325 PolarHBondContact O-N 3.46Å; M322-M326 HydrophobicContact CE-CE 4.19Å; M322-M326 WeakPolarHBondContact O-CB 3.26Å; M322-M326 VanDerWaalsContact O-CG 3.27Å; M322-M326 WeakPolarHBondContact O-CG 3.16Å; M322-M326 PolarHBondContact O-N 3.06Å
323	S	96.9	Very high	95.8	Very high	5 Å²	5	72.3 Å²	72.3	4%	0.035	38%	0.379	C	S	.	.	H	α-helix	trans	-59.9	-44.4	173.8	-175.7	0	0	0	0	111.6	I36 C319 V320 V321 M326 L327	I36-S323 WeakPolarHBondContact CG2-OG 3.44Å; I36-S323 PolarHBondContact O-OG 3.19Å; C319-S323 WeakPolarHBondContact O-CB 3.48Å; C319-S323 PolarHBondContact O-N 3.12Å; V320-S323 WeakPolarHBondContact O-CB 3.49Å; V320-S323 PolarHBondContact O-N 3.14Å; V321-S323 VanDerWaalsContact C-N 3.33Å; V321-S323 PolarHBondContact O-N 3.02Å; S323-M326 PolarHBondContact O-N 3.16Å; S323-L327 WeakPolarHBondContact O-CB 3.38Å; S323-L327 PolarHBondContact O-N 3.23Å
324	V	96.6	Very high	95.2	Very high	72 Å²	72	74.7 Å²	74.7	44%	0.436	39%	0.388	S	S	.	.	H	α-helix	trans	-63.2	-44.6	176.3	174	0	0	0	0	111.4	V320 V321 M322 L327 I328	V320-V324 WeakPolarHBondContact O-CG2 3.49Å; V320-V324 PolarHBondContact O-N 2.94Å; V321-V324 PolarHBondContact O-N 2.82Å; M322-V324 PolarHBondContact O-N 2.92Å; V324-L327 WeakPolarHBondContact O-CB 3.47Å; V324-L327 PolarHBondContact O-N 3.43Å; V324-I328 HydrophobicContact CG1-CD1 4.01Å; V324-I328 WeakPolarHBondContact O-CG1 3.47Å; V324-I328 PolarHBondContact O-N 3.27Å
325	V	96.3	Very high	94	Very high	68 Å²	68	77.7 Å²	77.7	41%	0.412	40%	0.395	S	S	.	.	H	α-helix	trans	-62	-47.3	177.1	172.7	0	0	0	0	111	V321 M322 L327 I328 V329	V321-V325 WeakPolarHBondContact O-CG2 3.4Å; V321-V325 PolarHBondContact O-N 3.26Å; M322-V325 PolarHBondContact O-N 3.46Å; V325-L327 VanDerWaalsContact C-N 3.28Å; V325-L327 PolarHBondContact O-N 3.28Å; V325-I328 PolarHBondContact O-N 3.07Å; V325-V329 HydrophobicContact CG1-CG2 4.5Å; V325-V329 WeakPolarHBondContact O-CG2 3.45Å; V325-V329 PolarHBondContact O-N 2.67Å
326	M	95.1	Very high	92.6	Very high	59 Å²	59	77.5 Å²	77.5	29%	0.291	40%	0.4	S	S	.	.	H	α-helix	trans	-60.5	-38.3	176.6	-72.1	178.9	-174.2	0	0	111.8	V35 I36 F39 M322 S323 V329 Y330	V35-M326 HydrophobicContact CG1-SD 3.94Å; I36-M326 HydrophobicContact CD1-CB 4.35Å; I36-M326 HydrophobicContact CG1-CB 3.85Å; F39-M326 HydrophobicContact CE2-CE 4.43Å; F39-M326 HydrophobicContact CZ-CE 4.35Å; M322-M326 HydrophobicContact CE-CE 4.19Å; M322-M326 WeakPolarHBondContact O-CB 3.26Å; M322-M326 VanDerWaalsContact O-CG 3.27Å; M322-M326 WeakPolarHBondContact O-CG 3.16Å; M322-M326 PolarHBondContact O-N 3.06Å; S323-M326 PolarHBondContact O-N 3.16Å; M326-V329 PolarHBondContact O-N 2.95Å; M326-Y330 VanDerWaalsContact O-CB 3.23Å; M326-Y330 WeakPolarHBondContact O-CB 3.4Å; M326-Y330 PolarHBondContact O-N 2.79Å
327	L	95.6	Very high	90.7	Very high	92 Å²	92	85.5 Å²	85.5	48%	0.482	44%	0.438	S	S	.	.	H	α-helix	trans	-64.6	-43.5	176	-176.7	66.9	0	0	0	112	I36 S323 V324 V325 Y330 A331	I36-L327 HydrophobicContact CD1-CB 4.39Å; I36-L327 HydrophobicContact CD1-CD1 4.29Å; I36-L327 HydrophobicContact CG2-CB 4.29Å; I36-L327 HydrophobicContact CG2-CD1 4.4Å; S323-L327 WeakPolarHBondContact O-CB 3.38Å; S323-L327 PolarHBondContact O-N 3.23Å; V324-L327 WeakPolarHBondContact O-CB 3.47Å; V324-L327 PolarHBondContact O-N 3.43Å; V325-L327 VanDerWaalsContact C-N 3.28Å; V325-L327 PolarHBondContact O-N 3.28Å; L327-Y330 PolarHBondContact O-N 3.21Å; L327-A331 VanDerWaalsContact O-CB 3.31Å; L327-A331 WeakPolarHBondContact O-CB 3.28Å; L327-A331 PolarHBondContact O-N 3.26Å
328	I	94.7	Very high	88.7	Confident	100 Å²	100	89 Å²	89	51%	0.513	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-46.6	175.8	-67.8	164.7	0	0	0	110.4	V324 V325 A331 R332	V324-I328 HydrophobicContact CG1-CD1 4.01Å; V324-I328 WeakPolarHBondContact O-CG1 3.47Å; V324-I328 PolarHBondContact O-N 3.27Å; V325-I328 PolarHBondContact O-N 3.07Å; I328-A331 PolarHBondContact O-N 3.32Å; I328-R332 VanDerWaalsContact O-CG 3.31Å; I328-R332 WeakPolarHBondContact O-CG 3.23Å; I328-R332 PolarHBondContact O-N 2.92Å
329	V	93.9	Very high	86.3	Confident	68 Å²	68	91.7 Å²	91.7	41%	0.412	48%	0.475	S	S	.	.	H	α-helix	trans	-63.7	-46.3	178.9	173	0	0	0	0	110.9	V325 M326 A331 R332 F333	V325-V329 HydrophobicContact CG1-CG2 4.5Å; V325-V329 WeakPolarHBondContact O-CG2 3.45Å; V325-V329 PolarHBondContact O-N 2.67Å; M326-V329 PolarHBondContact O-N 2.95Å; V329-A331 PolarHBondContact O-N 3.35Å; V329-R332 WeakPolarHBondContact O-CB 3.43Å; V329-R332 PolarHBondContact O-N 2.94Å; V329-F333 HydrophobicContact CG1-CD2 3.68Å; V329-F333 HydrophobicContact CG1-CE2 3.64Å; V329-F333 VanDerWaalsContact O-CD2 3.29Å; V329-F333 WeakPolarHBondContact O-CD2 3.39Å; V329-F333 PolarHBondContact O-N 3.41Å
330	Y	92.7	Very high	85.7	Confident	81 Å²	81	95.3 Å²	95.3	32%	0.318	49%	0.492	S	S	.	.	H	α-helix	trans	-59.9	-44.8	177.3	176	-108.2	0	0	0	112	A32 I36 M326 L327 R332 F333 K334	A32-Y330 HydrophobicContact CB-CD2 3.41Å; A32-Y330 VanDerWaalsContact CB-CD2 3.41Å; A32-Y330 HydrophobicContact CB-CE2 3.84Å; A32-Y330 HydrophobicContact CB-CG 3.9Å; I36-Y330 HydrophobicContact CD1-CD1 4.46Å; I36-Y330 HydrophobicContact CD1-CG 4.32Å; M326-Y330 VanDerWaalsContact O-CB 3.23Å; M326-Y330 WeakPolarHBondContact O-CB 3.4Å; M326-Y330 PolarHBondContact O-N 2.79Å; L327-Y330 PolarHBondContact O-N 3.21Å; Y330-R332 VanDerWaalsContact C-N 3.34Å; Y330-R332 PolarHBondContact O-N 3.06Å; Y330-F333 PolarHBondContact O-N 2.95Å; Y330-K334 HydrophobicContact CE1-CD 4.05Å; Y330-K334 VanDerWaalsContact O-CB 3.31Å; Y330-K334 WeakPolarHBondContact O-CB 3.43Å; Y330-K334 PolarHBondContact O-N 3.3Å; Y330-K334 PolarHBondContact OH-NZ 3.17Å
331	A	91.1	Very high	85	Confident	32 Å²	32	98.1 Å²	98.1	26%	0.264	51%	0.505	S	S	.	.	H	α-helix	trans	-59.9	-45	175.1	0	0	0	0	0	111.2	L327 I328 V329 F333 K334 F335	L327-A331 VanDerWaalsContact O-CB 3.31Å; L327-A331 WeakPolarHBondContact O-CB 3.28Å; L327-A331 PolarHBondContact O-N 3.26Å; I328-A331 PolarHBondContact O-N 3.32Å; V329-A331 PolarHBondContact O-N 3.35Å; A331-F333 PolarHBondContact O-N 3.36Å; A331-K334 PolarHBondContact O-N 3.07Å; A331-F335 HydrophobicContact CB-CD2 4.06Å; A331-F335 HydrophobicContact CB-CE2 3.95Å; A331-F335 WeakPolarHBondContact O-CB 3.4Å; A331-F335 WeakPolarHBondContact O-CD2 3.39Å; A331-F335 WeakPolarHBondContact O-CG 3.28Å; A331-F335 PolarHBondContact O-N 2.97Å
332	R	91.6	Very high	84.3	Confident	192 Å²	192	98.5 Å²	98.5	73%	0.725	50%	0.503	S	S	*	.	H	α-helix	trans	-58.5	-46.4	178	-76.6	-71.7	-171.2	174.8	1.4	112.9	I328 V329 Y330 A336	I328-R332 VanDerWaalsContact O-CG 3.31Å; I328-R332 WeakPolarHBondContact O-CG 3.23Å; I328-R332 PolarHBondContact O-N 2.92Å; V329-R332 WeakPolarHBondContact O-CB 3.43Å; V329-R332 PolarHBondContact O-N 2.94Å; Y330-R332 VanDerWaalsContact C-N 3.34Å; Y330-R332 PolarHBondContact O-N 3.06Å; R332-A336 WeakPolarHBondContact O-CB 3.39Å; R332-A336 PolarHBondContact O-N 3.28Å
333	F	87.4	Confident	83.6	Confident	147 Å²	147	99.2 Å²	99.2	65%	0.645	51%	0.507	S	S	*	.	H	α-helix	trans	-72	-40.4	-179.3	-79.7	-71.3	0	0	0	112.5	V329 Y330 A331 A336 E337	V329-F333 HydrophobicContact CG1-CD2 3.68Å; V329-F333 HydrophobicContact CG1-CE2 3.64Å; V329-F333 VanDerWaalsContact O-CD2 3.29Å; V329-F333 WeakPolarHBondContact O-CD2 3.39Å; V329-F333 PolarHBondContact O-N 3.41Å; Y330-F333 PolarHBondContact O-N 2.95Å; A331-F333 PolarHBondContact O-N 3.36Å; F333-A336 PolarHBondContact O-N 3.07Å; F333-E337 PolarHBondContact O-N 3.37Å
334	K	84.1	Confident	82.7	Confident	98 Å²	98	105.1 Å²	105.1	43%	0.426	54%	0.537	S	S	.	.	H	α-helix	trans	-65.2	-48.3	179.4	-170.6	176.9	-173.1	173.3	0	112.3	Y330 A331 A336 E337	Y330-K334 HydrophobicContact CE1-CD 4.05Å; Y330-K334 VanDerWaalsContact O-CB 3.31Å; Y330-K334 WeakPolarHBondContact O-CB 3.43Å; Y330-K334 PolarHBondContact O-N 3.3Å; Y330-K334 PolarHBondContact OH-NZ 3.17Å; A331-K334 PolarHBondContact O-N 3.07Å; K334-A336 PolarHBondContact O-N 3.06Å; K334-E337 PolarHBondContact O-N 3.14Å
335	F	73.2	Confident	81.8	Confident	137 Å²	137	107.3 Å²	107.3	60%	0.601	54%	0.544	S	S	*	.	H	α-helix	trans	-74.7	-12.5	179.8	-64.5	-58.9	0	0	0	113.7	A331	A331-F335 HydrophobicContact CB-CD2 4.06Å; A331-F335 HydrophobicContact CB-CE2 3.95Å; A331-F335 WeakPolarHBondContact O-CB 3.4Å; A331-F335 WeakPolarHBondContact O-CD2 3.39Å; A331-F335 WeakPolarHBondContact O-CG 3.28Å; A331-F335 PolarHBondContact O-N 2.97Å
336	A	68.9	Low	80.8	Confident	63 Å²	63	110.1 Å²	110.1	52%	0.521	55%	0.553	S	S	.	*	H	α-helix	trans	-83.8	-20.7	172.7	0	0	0	0	0	113	R332 F333 K334	R332-A336 WeakPolarHBondContact O-CB 3.39Å; R332-A336 PolarHBondContact O-N 3.28Å; F333-A336 PolarHBondContact O-N 3.07Å; K334-A336 PolarHBondContact O-N 3.06Å
337	E	59.7	Low	79.7	Confident	169 Å²	169	114.1 Å²	114.1	79%	0.79	57%	0.573	S	S	*	*	H	α-helix	trans	-81.7	-20.9	172.1	-73.5	179.4	160.1	0	0	112.5	F333 K334 V339	F333-E337 PolarHBondContact O-N 3.37Å; K334-E337 PolarHBondContact O-N 3.14Å; E337-V339 VanDerWaalsContact C-N 3.35Å
338	D	55.8	Low	78.3	Confident	123 Å²	123	115.9 Å²	115.9	66%	0.658	58%	0.581	S	S	*	*			trans	-87.6	5.8	-179.1	-68.9	-33.8	0	0	0	113.9
339	V	47	Very low	76.8	Confident	181 Å²	181	117.4 Å²	117.4	100%	1.097	59%	0.587	S	S	*	*			trans	-121.4	0	179	179.6	0	0	0	0	110.7	E337	E337-V339 VanDerWaalsContact C-N 3.35Å

Retrieved 339 of 339 residues in 343 ms (Link to these results)

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