A0A060WXE3_ONCMY Loading...

Cell cycle control protein

AlphaFold DB , UniProt , Accession A0A060WXE3, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), 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	40.4	Very low	63.1	Low	248 Å²	248	166.6 Å²	166.6	100%	1.222	82%	0.823	S	S	*	*				0	92.1	0	-138.4	176.7	-166.7	0	0	106.8
2	M	45.3	Very low	64.8	Low	190 Å²	190	160.8 Å²	160.8	94%	0.936	81%	0.807	S	S	*	*			trans	-77.9	122.6	169.6	-89.4	-163.9	-63.2	0	0	107.1	E4	M2-E4 PolarHBondContact O-N 3.37Å
3	K	52	Low	66.6	Low	201 Å²	201	157.2 Å²	157.2	87%	0.874	79%	0.792	S	S	*	*			trans	-74.1	116.4	169.6	-114	177.1	173.7	179.6	0	107	E5	K3-E5 PolarHBondContact O-N 2.99Å
4	E	57.2	Low	68.1	Low	196 Å²	196	153.9 Å²	153.9	92%	0.916	78%	0.778	S	S	*	*			trans	-64.2	115.2	163.4	-86.2	176.4	143.4	0	0	108.2	M2	M2-E4 PolarHBondContact O-N 3.37Å
5	E	61.5	Low	69.7	Low	137 Å²	137	148.3 Å²	148.3	64%	0.64	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-81.9	129.9	171.9	-76.7	-165.9	166.8	0	0	109.6	K3 E7 R11	K3-E5 PolarHBondContact O-N 2.99Å; E5-E7 PolarHBondContact O-N 3.15Å; E5-R11 IonicContact OE2-CZ 3.94Å; E5-R11 IonicContact OE2-NH1 2.74Å; E5-R11 PolarHBondContact OE2-NH1 3.34Å; E5-R11 IonicContact OE2-NH2 3.22Å; E5-R11 PolarHBondContact OE2-NH2 3.49Å
6	L	64.9	Low	70.9	Confident	158 Å²	158	142.2 Å²	142.2	83%	0.827	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-63.7	121.6	171.9	-102.3	109.3	0	0	0	110.6
7	E	60.8	Low	72.2	Confident	193 Å²	193	142.9 Å²	142.9	90%	0.902	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-69.7	126.6	169.5	-77.9	-168	149.4	0	0	110.8	E5	E5-E7 PolarHBondContact O-N 3.15Å
8	T	72.1	Confident	73.2	Confident	91 Å²	91	138.5 Å²	138.5	56%	0.558	71%	0.711	S	S	*	*			trans	-106.7	137.3	176.4	37.6	0	0	0	0	109.6	N10 R11	T8-N10 PolarHBondContact O-N 3.13Å; T8-R11 WeakPolarHBondContact O-CB 3.45Å; T8-R11 PolarHBondContact O-N 3.47Å
9	T	76	Confident	74.3	Confident	149 Å²	149	134.4 Å²	134.4	91%	0.914	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.7	-18.9	-166.6	-13.7	0	0	0	0	115.4
10	N	83.1	Confident	75.1	Confident	158 Å²	158	136.9 Å²	136.9	85%	0.845	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	14.2	-179.8	-64.9	-29.7	0	0	0	112.7	T8 P12	T8-N10 PolarHBondContact O-N 3.13Å; N10-P12 WeakPolarHBondContact O-CD 3.49Å
11	R	80.6	Confident	76	Confident	112 Å²	112	138.9 Å²	138.9	42%	0.423	70%	0.696	S	S	.	*	P	Polyproline II helix	trans	-75	122.1	177.5	-169.7	173.6	-176.9	-179.2	-1.1	108.6	E5 T8	E5-R11 IonicContact OE2-CZ 3.94Å; E5-R11 IonicContact OE2-NH1 2.74Å; E5-R11 PolarHBondContact OE2-NH1 3.34Å; E5-R11 IonicContact OE2-NH2 3.22Å; E5-R11 PolarHBondContact OE2-NH2 3.49Å; T8-R11 WeakPolarHBondContact O-CB 3.45Å; T8-R11 PolarHBondContact O-N 3.47Å
12	P	83.6	Confident	78.6	Confident	96 Å²	96	131.9 Å²	131.9	62%	0.623	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-64.9	144.5	175.9	24.8	-31.1	0	0	0	110.4	N10 N14	N10-P12 WeakPolarHBondContact O-CD 3.49Å; P12-N14 PolarHBondContact O-N 3Å
13	D	88	Confident	81	Confident	114 Å²	114	129 Å²	129	61%	0.61	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-50.4	130.1	179.3	-72.5	-13.6	0	0	0	111.2	T15 T18 Q19	D13-T15 VanDerWaalsContact C-N 3.3Å; D13-T15 HydrophobicContact CB-CG2 4.45Å; D13-T15 PolarHBondContact O-N 3.27Å; D13-T18 HydrophobicContact CB-CG2 4.01Å; D13-T18 WeakPolarHBondContact O-CB 3.31Å; D13-T18 PolarHBondContact O-OG1 2.98Å; D13-Q19 PolarHBondContact O-NE2 3.01Å
14	N	88.4	Confident	82.9	Confident	112 Å²	112	123 Å²	123	60%	0.599	65%	0.647	S	S	*	*			trans	-95	49.8	-178.6	-167.3	18.6	0	0	0	111.6	P12	P12-N14 PolarHBondContact O-N 3Å
15	T	91	Very high	84.7	Confident	69 Å²	69	124.5 Å²	124.5	42%	0.423	64%	0.644	S	S	.	*			trans	-93.8	155.8	174.4	74.9	0	0	0	0	110.8	D13 F17 T18 Q19	D13-T15 VanDerWaalsContact C-N 3.3Å; D13-T15 HydrophobicContact CB-CG2 4.45Å; D13-T15 PolarHBondContact O-N 3.27Å; T15-F17 PolarHBondContact O-N 2.98Å; T15-F17 VanDerWaalsContact O-N 3.17Å; T15-T18 PolarHBondContact N-OG1 3.26Å; T15-T18 VanDerWaalsContact N-OG1 3.09Å; T15-T18 PolarHBondContact O-N 2.98Å; T15-T18 PolarHBondContact O-OG1 3.3Å; T15-T18 WeakPolarHBondContact OG1-CG2 3.3Å; T15-T18 PolarHBondContact OG1-N 3.35Å; T15-T18 VanDerWaalsContact OG1-N 3.16Å; T15-T18 PolarHBondContact OG1-OG1 3.4Å; T15-Q19 WeakPolarHBondContact O-CB 3.36Å; T15-Q19 WeakPolarHBondContact O-CG 3.45Å; T15-Q19 PolarHBondContact O-N 3.32Å
16	A	89.8	Confident	86.1	Confident	51 Å²	51	125.7 Å²	125.7	42%	0.421	65%	0.649	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.7	-29.2	177.4	0	0	0	0	0	113	Q20 R21 L22	A16-Q20 PolarHBondContact O-N 3Å; A16-R21 CarbonylContact O-C 3.55Å; A16-R21 PolarHBondContact O-N 2.79Å; A16-L22 HydrophobicContact CB-CD2 4.16Å; A16-L22 PolarHBondContact O-N 3.49Å
17	F	92.6	Very high	87.2	Confident	154 Å²	154	121.4 Å²	121.4	68%	0.675	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	-53.9	175.9	179.6	-104.8	0	0	0	111.8	T15 Q19 Q20 L22	T15-F17 PolarHBondContact O-N 2.98Å; T15-F17 VanDerWaalsContact O-N 3.17Å; F17-Q19 PolarHBondContact O-N 2.93Å; F17-Q20 PolarHBondContact O-N 2.83Å; F17-Q20 VanDerWaalsContact O-N 3.1Å; F17-L22 HydrophobicContact CD2-CD1 4.06Å
18	T	90.3	Very high	88.6	Confident	64 Å²	64	119.9 Å²	119.9	39%	0.393	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.4	-27.1	-177.4	50.8	0	0	0	0	112.7	D13 T15	D13-T18 HydrophobicContact CB-CG2 4.01Å; D13-T18 WeakPolarHBondContact O-CB 3.31Å; D13-T18 PolarHBondContact O-OG1 2.98Å; T15-T18 PolarHBondContact N-OG1 3.26Å; T15-T18 VanDerWaalsContact N-OG1 3.09Å; T15-T18 PolarHBondContact O-N 2.98Å; T15-T18 PolarHBondContact O-OG1 3.3Å; T15-T18 WeakPolarHBondContact OG1-CG2 3.3Å; T15-T18 PolarHBondContact OG1-N 3.35Å; T15-T18 VanDerWaalsContact OG1-N 3.16Å; T15-T18 PolarHBondContact OG1-OG1 3.4Å
19	Q	93.5	Very high	89.5	Confident	61 Å²	61	122.4 Å²	122.4	29%	0.285	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.3	2.9	177.1	-59.1	-61.3	-36.2	0	0	113.8	D13 T15 F17 R21	D13-Q19 PolarHBondContact O-NE2 3.01Å; T15-Q19 WeakPolarHBondContact O-CB 3.36Å; T15-Q19 WeakPolarHBondContact O-CG 3.45Å; T15-Q19 PolarHBondContact O-N 3.32Å; F17-Q19 PolarHBondContact O-N 2.93Å; Q19-R21 VanDerWaalsContact C-N 3.28Å; Q19-R21 HydrophobicContact CB-CG 4.26Å; Q19-R21 WeakPolarHBondContact O-CG 3.35Å; Q19-R21 PolarHBondContact O-N 3.27Å
20	Q	91.8	Very high	90.2	Very high	183 Å²	183	118.1 Å²	118.1	86%	0.855	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	56.4	36.6	-179.5	-54.6	-179.8	9.4	0	0	114.1	A16 F17	A16-Q20 PolarHBondContact O-N 3Å; F17-Q20 PolarHBondContact O-N 2.83Å; F17-Q20 VanDerWaalsContact O-N 3.1Å
21	R	93.8	Very high	90.6	Very high	179 Å²	179	112.2 Å²	112.2	68%	0.675	59%	0.585	S	S	*	*			trans	-112.3	28	178.7	-56	-179	-165.7	174	3.5	112.1	A16 Q19	A16-R21 CarbonylContact O-C 3.55Å; A16-R21 PolarHBondContact O-N 2.79Å; Q19-R21 VanDerWaalsContact C-N 3.28Å; Q19-R21 HydrophobicContact CB-CG 4.26Å; Q19-R21 WeakPolarHBondContact O-CG 3.35Å; Q19-R21 PolarHBondContact O-N 3.27Å
22	L	95.2	Very high	91	Very high	102 Å²	102	109.5 Å²	109.5	53%	0.534	59%	0.591	S	S	.	*			trans	-59.2	140	173.4	-75.8	178.5	0	0	0	109.6	A16 F17 A24	A16-L22 HydrophobicContact CB-CD2 4.16Å; A16-L22 PolarHBondContact O-N 3.49Å; F17-L22 HydrophobicContact CD2-CD1 4.06Å; L22-A24 PolarHBondContact O-N 2.88Å; L22-A24 VanDerWaalsContact O-N 3.11Å
23	P	93.9	Very high	91.4	Very high	129 Å²	129	110.1 Å²	110.1	84%	0.838	59%	0.588	S	S	*	*			trans	-60.1	120	172.7	26.2	-32.9	0	0	0	108.5
24	A	93.8	Very high	91.7	Very high	75 Å²	75	106.2 Å²	106.2	62%	0.62	57%	0.568	S	S	*	*			trans	-125.7	140.8	-177.9	0	0	0	0	0	110	L22	L22-A24 PolarHBondContact O-N 2.88Å; L22-A24 VanDerWaalsContact O-N 3.11Å
25	W	93.8	Very high	92.1	Very high	227 Å²	227	101.7 Å²	101.7	86%	0.86	54%	0.544	S	S	*	.			trans	-85.1	120.7	167.8	178.2	54.7	0	0	0	109	P27	W25-P27 HydrophobicContact CD2-CB 4.42Å; W25-P27 HydrophobicContact CD2-CG 4.19Å; W25-P27 HydrophobicContact CE3-CG 4.1Å; W25-P27 HydrophobicContact CH2-CB 3.97Å; W25-P27 HydrophobicContact CH2-CG 3.98Å; W25-P27 HydrophobicContact CZ2-CB 3.64Å; W25-P27 HydrophobicContact CZ2-CG 4.05Å; W25-P27 HydrophobicContact CZ3-CB 4.47Å; W25-P27 HydrophobicContact CZ3-CG 4Å; W25-P27 VanDerWaalsContact O-CD 3.28Å; W25-P27 WeakPolarHBondContact O-CD 3.38Å
26	Q	90.3	Very high	92.3	Very high	162 Å²	162	101.5 Å²	101.5	76%	0.757	54%	0.544	S	S	*	.			trans	-115.9	81.4	-178.8	-67	-177.9	-27.6	0	0	109.7	M28	Q26-M28 PolarHBondContact O-N 3.2Å
27	P	88.7	Confident	92.6	Very high	69 Å²	69	100.3 Å²	100.3	45%	0.448	54%	0.537	S	S	.	.			trans	-66.3	118	-179.4	25.2	-31.5	0	0	0	110.6	W25	W25-P27 HydrophobicContact CD2-CB 4.42Å; W25-P27 HydrophobicContact CD2-CG 4.19Å; W25-P27 HydrophobicContact CE3-CG 4.1Å; W25-P27 HydrophobicContact CH2-CB 3.97Å; W25-P27 HydrophobicContact CH2-CG 3.98Å; W25-P27 HydrophobicContact CZ2-CB 3.64Å; W25-P27 HydrophobicContact CZ2-CG 4.05Å; W25-P27 HydrophobicContact CZ3-CB 4.47Å; W25-P27 HydrophobicContact CZ3-CG 4Å; W25-P27 VanDerWaalsContact O-CD 3.28Å; W25-P27 WeakPolarHBondContact O-CD 3.38Å
28	M	89.6	Confident	92.8	Very high	160 Å²	160	96.3 Å²	96.3	79%	0.788	52%	0.519	S	S	*	.			trans	-87.1	110.3	168.2	-69.8	-165.4	170.4	0	0	109.4	Q26 S30	Q26-M28 PolarHBondContact O-N 3.2Å; M28-S30 VanDerWaalsContact C-N 3.26Å; M28-S30 PolarHBondContact O-N 3.48Å
29	L	91.4	Very high	93.2	Very high	145 Å²	145	95.8 Å²	95.8	76%	0.759	52%	0.516	S	S	*	.			trans	-73.4	78.7	178.6	-65	176.1	0	0	0	110.4	V34	L29-V34 HydrophobicContact CB-CG2 3.91Å; L29-V34 HydrophobicContact CD2-CG2 4.28Å
30	S	91.1	Very high	93.4	Very high	59 Å²	59	98.7 Å²	98.7	41%	0.413	53%	0.533	S	S	.	.			trans	-81.7	155.8	175.5	73.2	0	0	0	0	111.7	M28 G32 I33 V34	M28-S30 VanDerWaalsContact C-N 3.26Å; M28-S30 PolarHBondContact O-N 3.48Å; S30-G32 PolarHBondContact O-N 2.98Å; S30-I33 PolarHBondContact O-N 2.91Å; S30-V34 WeakPolarHBondContact O-CG2 3.23Å; S30-V34 PolarHBondContact O-N 2.92Å
31	A	90.8	Very high	93.7	Very high	34 Å²	34	94 Å²	94	28%	0.281	51%	0.513	S	S	.	.	H	α-helix	trans	-55.3	-35	177.7	0	0	0	0	0	112.8	I33 I35 Y330	A31-I33 PolarHBondContact O-N 3.23Å; A31-I35 HydrophobicContact CB-CD1 3.98Å; A31-I35 WeakPolarHBondContact O-CB 3.38Å; A31-I35 VanDerWaalsContact O-CG1 3.32Å; A31-I35 WeakPolarHBondContact O-CG1 3.38Å; A31-I35 PolarHBondContact O-N 3.4Å; A31-Y330 HydrophobicContact CB-CD2 3.36Å; A31-Y330 HydrophobicContact CB-CE2 3.68Å; A31-Y330 HydrophobicContact CB-CG 3.9Å
32	G	88.9	Confident	93.9	Very high	54 Å²	54	85.5 Å²	85.5	56%	0.557	48%	0.481	S	S	*	.	H	α-helix	trans	-65.8	-19.5	177.7	0	0	0	0	0	114.6	S30 P36	S30-G32 PolarHBondContact O-N 2.98Å; G32-P36 WeakPolarHBondContact O-CD 3.43Å; G32-P36 WeakPolarHBondContact O-CG 3.31Å
33	I	92.4	Very high	94	Very high	109 Å²	109	85.6 Å²	85.6	56%	0.559	48%	0.481	S	S	*	.	H	α-helix	trans	-99.2	-45.4	176.2	-61.7	172.1	0	0	0	110.2	S30 A31 G37	S30-I33 PolarHBondContact O-N 2.91Å; A31-I33 PolarHBondContact O-N 3.23Å; I33-G37 PolarHBondContact O-N 3.48Å
34	V	95	Very high	94.2	Very high	32 Å²	32	81.9 Å²	81.9	19%	0.194	46%	0.461	C	S	.	.	H	α-helix	trans	-69.1	-45.3	-173.2	177.9	0	0	0	0	111.6	L29 S30 G37 F38 M326	L29-V34 HydrophobicContact CB-CG2 3.91Å; L29-V34 HydrophobicContact CD2-CG2 4.28Å; S30-V34 WeakPolarHBondContact O-CG2 3.23Å; S30-V34 PolarHBondContact O-N 2.92Å; V34-G37 PolarHBondContact O-N 3.06Å; V34-F38 HydrophobicContact CG1-CD2 3.58Å; V34-F38 HydrophobicContact CG1-CE2 3.61Å; V34-F38 WeakPolarHBondContact O-CD2 3.43Å; V34-F38 PolarHBondContact O-N 3.36Å; V34-M326 HydrophobicContact CG1-SD 4.01Å
35	I	95.4	Very high	94.5	Very high	18 Å²	18	81.4 Å²	81.4	9%	0.092	45%	0.445	C	S	.	.	H	α-helix	trans	-61.4	-52.5	-175.9	-65.6	169.1	0	0	0	111.3	A31 G37 F38 V39 S323 M326 L327 Y330	A31-I35 HydrophobicContact CB-CD1 3.98Å; A31-I35 WeakPolarHBondContact O-CB 3.38Å; A31-I35 VanDerWaalsContact O-CG1 3.32Å; A31-I35 WeakPolarHBondContact O-CG1 3.38Å; A31-I35 PolarHBondContact O-N 3.4Å; I35-G37 VanDerWaalsContact C-N 3.3Å; I35-G37 PolarHBondContact O-N 2.85Å; I35-F38 PolarHBondContact O-N 3.38Å; I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 2.88Å; I35-V39 VanDerWaalsContact O-N 3.13Å; I35-S323 WeakPolarHBondContact CG2-OG 3.33Å; I35-S323 PolarHBondContact O-OG 2.87Å; I35-M326 HydrophobicContact CD1-CB 4.23Å; I35-M326 HydrophobicContact CG1-CB 3.86Å; I35-L327 HydrophobicContact CD1-CB 4.39Å; I35-L327 HydrophobicContact CD1-CD1 4.3Å; I35-L327 HydrophobicContact CG2-CB 4.37Å; I35-L327 HydrophobicContact CG2-CD1 4.37Å; I35-Y330 HydrophobicContact CD1-CG 4.41Å
36	P	96	Very high	94.7	Very high	64 Å²	64	73 Å²	73	42%	0.416	42%	0.416	S	S	.	.	H	α-helix	trans	-61	-38.1	174.9	-23.6	35.2	0	0	0	112.8	G32 F38 V39 L40	G32-P36 WeakPolarHBondContact O-CD 3.43Å; G32-P36 WeakPolarHBondContact O-CG 3.31Å; P36-F38 PolarHBondContact O-N 3.17Å; P36-V39 PolarHBondContact O-N 3.36Å; P36-L40 WeakPolarHBondContact O-CB 3.5Å; P36-L40 VanDerWaalsContact O-CG 3.31Å; P36-L40 WeakPolarHBondContact O-CG 3.44Å; P36-L40 PolarHBondContact O-N 2.84Å
37	G	96.1	Very high	95.1	Very high	27 Å²	27	67.5 Å²	67.5	28%	0.278	40%	0.404	S	S	.	.	H	α-helix	trans	-57.8	-47	176.4	0	0	0	0	0	112.6	I33 V34 I35 L40 I41	I33-G37 PolarHBondContact O-N 3.48Å; V34-G37 PolarHBondContact O-N 3.06Å; I35-G37 VanDerWaalsContact C-N 3.3Å; I35-G37 PolarHBondContact O-N 2.85Å; G37-L40 PolarHBondContact O-N 3.38Å; G37-I41 WeakPolarHBondContact O-CB 3.28Å; G37-I41 VanDerWaalsContact O-CG1 3.29Å; G37-I41 WeakPolarHBondContact O-CG1 3.28Å; G37-I41 PolarHBondContact O-N 3.4Å
38	F	97.2	Very high	95.5	Very high	70 Å²	70	68 Å²	68	31%	0.307	40%	0.402	S	S	.	.	H	α-helix	trans	-64.3	-38.5	176.2	-91.6	-99.9	0	0	0	112.8	V34 I35 P36 G42 C319 M322 M326	V34-F38 HydrophobicContact CG1-CD2 3.58Å; V34-F38 HydrophobicContact CG1-CE2 3.61Å; V34-F38 WeakPolarHBondContact O-CD2 3.43Å; V34-F38 PolarHBondContact O-N 3.36Å; I35-F38 PolarHBondContact O-N 3.38Å; P36-F38 PolarHBondContact O-N 3.17Å; F38-G42 PolarHBondContact O-N 3.47Å; F38-C319 HydrophobicContact CD1-CB 4.14Å; F38-M322 HydrophobicContact CD1-CB 4.46Å; F38-M326 HydrophobicContact CE2-CE 4.4Å; F38-M326 HydrophobicContact CZ-CE 4.34Å
39	V	97.8	Very high	95.9	Very high	52 Å²	52	60.4 Å²	60.4	32%	0.315	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-48.8	174.6	178.6	0	0	0	0	110.8	I35 P36 G42 L43 S323	I35-V39 WeakPolarHBondContact O-CG2 3.4Å; I35-V39 PolarHBondContact O-N 2.88Å; I35-V39 VanDerWaalsContact O-N 3.13Å; P36-V39 PolarHBondContact O-N 3.36Å; V39-G42 PolarHBondContact O-N 3.37Å; V39-L43 HydrophobicContact CG1-CD1 3.88Å; V39-L43 HydrophobicContact CG1-CG 4.24Å; V39-L43 WeakPolarHBondContact O-CG 3.17Å; V39-L43 PolarHBondContact O-N 2.96Å; V39-S323 WeakPolarHBondContact CG2-OG 3.33Å
40	L	97.9	Very high	96.2	Very high	123 Å²	123	56.6 Å²	56.6	64%	0.644	35%	0.347	S	S	*	.	H	α-helix	trans	-62.5	-46.8	-177.5	-71.8	173.8	0	0	0	111.7	P36 G37 G42 A44	P36-L40 WeakPolarHBondContact O-CB 3.5Å; P36-L40 VanDerWaalsContact O-CG 3.31Å; P36-L40 WeakPolarHBondContact O-CG 3.44Å; P36-L40 PolarHBondContact O-N 2.84Å; G37-L40 PolarHBondContact O-N 3.38Å; L40-G42 VanDerWaalsContact C-N 3.33Å; L40-A44 VanDerWaalsContact O-CB 3.32Å; L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 2.93Å
41	I	97.8	Very high	96.4	Very high	85 Å²	85	55.5 Å²	55.5	44%	0.436	35%	0.345	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176	-67.2	168.4	0	0	0	110.3	G37 A44 F45	G37-I41 WeakPolarHBondContact O-CB 3.28Å; G37-I41 VanDerWaalsContact O-CG1 3.29Å; G37-I41 WeakPolarHBondContact O-CG1 3.28Å; G37-I41 PolarHBondContact O-N 3.4Å; I41-A44 PolarHBondContact O-N 3.1Å; I41-F45 HydrophobicContact CG2-CD1 4.26Å; I41-F45 HydrophobicContact CG2-CD2 4.37Å; I41-F45 HydrophobicContact CG2-CE1 4.12Å; I41-F45 HydrophobicContact CG2-CE2 4.22Å; I41-F45 HydrophobicContact CG2-CG 4.39Å; I41-F45 HydrophobicContact CG2-CZ 4.1Å; I41-F45 WeakPolarHBondContact O-CB 3.26Å; I41-F45 WeakPolarHBondContact O-CG 3.44Å; I41-F45 PolarHBondContact O-N 3.3Å
42	G	98.4	Very high	96.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.3	-50.2	178.8	0	0	0	0	0	112.9	F38 V39 L40 F45 I46 G316	F38-G42 PolarHBondContact O-N 3.47Å; V39-G42 PolarHBondContact O-N 3.37Å; L40-G42 VanDerWaalsContact C-N 3.33Å; G42-F45 PolarHBondContact O-N 2.87Å; G42-I46 VanDerWaalsContact O-CG1 3.28Å; G42-I46 WeakPolarHBondContact O-CG1 3.1Å; G42-I46 PolarHBondContact O-N 3.23Å; G42-G316 WeakPolarHBondContact CA-O 3.41Å
43	L	98.1	Very high	97.1	Very high	103 Å²	103	54.9 Å²	54.9	54%	0.539	32%	0.321	S	S	.	.	H	α-helix	trans	-64.1	-40.7	177.8	-69.1	177.9	0	0	0	112.2	V39 I46 G47	V39-L43 HydrophobicContact CG1-CD1 3.88Å; V39-L43 HydrophobicContact CG1-CG 4.24Å; V39-L43 WeakPolarHBondContact O-CG 3.17Å; V39-L43 PolarHBondContact O-N 2.96Å; L43-I46 PolarHBondContact O-N 2.98Å; L43-G47 PolarHBondContact O-N 2.87Å
44	A	98.3	Very high	97.2	Very high	51 Å²	51	54 Å²	54	42%	0.421	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-44.9	175.7	0	0	0	0	0	111.6	L40 I41 G47 I48	L40-A44 VanDerWaalsContact O-CB 3.32Å; L40-A44 WeakPolarHBondContact O-CB 3.35Å; L40-A44 PolarHBondContact O-N 2.93Å; I41-A44 PolarHBondContact O-N 3.1Å; A44-G47 PolarHBondContact O-N 3.25Å; A44-I48 VanDerWaalsContact O-CG1 3.31Å; A44-I48 WeakPolarHBondContact O-CG1 3.31Å; A44-I48 PolarHBondContact O-N 3.47Å
45	F	98.6	Very high	97.2	Very high	65 Å²	65	54.1 Å²	54.1	29%	0.285	32%	0.318	S	S	.	.	H	α-helix	trans	-66.6	-37.4	178.7	-82.1	18.9	0	0	0	112.3	I41 G42 G49 Y312 V315	I41-F45 HydrophobicContact CG2-CD1 4.26Å; I41-F45 HydrophobicContact CG2-CD2 4.37Å; I41-F45 HydrophobicContact CG2-CE1 4.12Å; I41-F45 HydrophobicContact CG2-CE2 4.22Å; I41-F45 HydrophobicContact CG2-CG 4.39Å; I41-F45 HydrophobicContact CG2-CZ 4.1Å; I41-F45 WeakPolarHBondContact O-CB 3.26Å; I41-F45 WeakPolarHBondContact O-CG 3.44Å; I41-F45 PolarHBondContact O-N 3.3Å; G42-F45 PolarHBondContact O-N 2.87Å; F45-G49 WeakPolarHBondContact O-CA 3.5Å; F45-G49 PolarHBondContact O-N 3.3Å; F45-Y312 HydrophobicContact CB-CD1 4.04Å; F45-Y312 HydrophobicContact CD1-CD1 4.03Å; F45-Y312 AromaticContact CD1-CE1 3.97Å; F45-Y312 HydrophobicContact CD1-CE1 3.97Å; F45-Y312 HydrophobicContact CD2-CD1 4.09Å; F45-Y312 HydrophobicContact CD2-CE1 4.39Å; F45-Y312 HydrophobicContact CE1-CE1 4.04Å; F45-Y312 HydrophobicContact CE2-CE1 4.46Å; F45-Y312 AromaticContact CG-CD1 3.79Å; F45-Y312 HydrophobicContact CG-CD1 3.79Å; F45-Y312 HydrophobicContact CG-CE1 4.15Å; F45-Y312 HydrophobicContact CZ-CE1 4.29Å; F45-V315 HydrophobicContact CD2-CB 4.36Å; F45-V315 HydrophobicContact CD2-CG1 3.89Å; F45-V315 HydrophobicContact CE2-CG1 4Å
46	I	98.5	Very high	97.1	Very high	50 Å²	50	53.3 Å²	53.3	26%	0.256	31%	0.313	S	S	.	.	H	α-helix	trans	-62.3	-48.6	173.2	-69.6	165.5	0	0	0	110.1	G42 L43 I48 G49 V50 L313 V320	G42-I46 VanDerWaalsContact O-CG1 3.28Å; G42-I46 WeakPolarHBondContact O-CG1 3.1Å; G42-I46 PolarHBondContact O-N 3.23Å; L43-I46 PolarHBondContact O-N 2.98Å; I46-I48 PolarHBondContact O-N 3.47Å; I46-G49 PolarHBondContact O-N 3.48Å; I46-V50 HydrophobicContact CG2-CG2 4.45Å; I46-V50 WeakPolarHBondContact O-CG2 3.28Å; I46-V50 PolarHBondContact O-N 3.39Å; I46-L313 HydrophobicContact CG2-CD2 4.26Å; I46-V320 HydrophobicContact CD1-CG2 4.15Å
47	G	98.2	Very high	96.9	Very high	48 Å²	48	54.2 Å²	54.2	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-58.2	-47.2	178.3	0	0	0	0	0	112.9	L43 A44 G51	L43-G47 PolarHBondContact O-N 2.87Å; A44-G47 PolarHBondContact O-N 3.25Å; G47-G51 PolarHBondContact O-N 2.87Å
48	I	97.9	Very high	96.8	Very high	79 Å²	79	58.5 Å²	58.5	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-47.9	174.6	-66.9	166.9	0	0	0	110.2	A44 I46 V50 G51 L52 Y312	A44-I48 VanDerWaalsContact O-CG1 3.31Å; A44-I48 WeakPolarHBondContact O-CG1 3.31Å; A44-I48 PolarHBondContact O-N 3.47Å; I46-I48 PolarHBondContact O-N 3.47Å; I48-V50 PolarHBondContact O-N 3.41Å; I48-G51 PolarHBondContact O-N 3.02Å; I48-G51 VanDerWaalsContact O-N 3.14Å; I48-L52 HydrophobicContact CG2-CD1 3.64Å; I48-L52 HydrophobicContact CG2-CG 4.05Å; I48-L52 VanDerWaalsContact O-CG 3.29Å; I48-L52 WeakPolarHBondContact O-CG 3.32Å; I48-L52 PolarHBondContact O-N 3.28Å; I48-Y312 HydrophobicContact CB-CD1 4.34Å; I48-Y312 HydrophobicContact CG2-CD1 4.02Å; I48-Y312 HydrophobicContact CG2-CE1 4.11Å; I48-Y312 HydrophobicContact CG2-CG 4.29Å
49	G	98	Very high	96.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-57.7	-44.1	-178.8	0	0	0	0	0	113.1	F45 I46 L52 F53	F45-G49 WeakPolarHBondContact O-CA 3.5Å; F45-G49 PolarHBondContact O-N 3.3Å; I46-G49 PolarHBondContact O-N 3.48Å; G49-L52 PolarHBondContact O-N 2.92Å; G49-F53 VanDerWaalsContact O-CB 3.27Å; G49-F53 WeakPolarHBondContact O-CB 3.46Å; G49-F53 PolarHBondContact O-N 2.92Å
50	V	97.7	Very high	96.4	Very high	66 Å²	66	55.7 Å²	55.7	40%	0.4	32%	0.317	S	S	.	.	H	α-helix	trans	-60.4	-49.1	174.3	173	0	0	0	0	110.8	I46 I48 L52 F53 I54 L313	I46-V50 HydrophobicContact CG2-CG2 4.45Å; I46-V50 WeakPolarHBondContact O-CG2 3.28Å; I46-V50 PolarHBondContact O-N 3.39Å; I48-V50 PolarHBondContact O-N 3.41Å; V50-L52 PolarHBondContact O-N 3.43Å; V50-F53 PolarHBondContact O-N 3.3Å; V50-I54 HydrophobicContact CG1-CD1 3.67Å; V50-I54 HydrophobicContact CG1-CG1 4.38Å; V50-I54 WeakPolarHBondContact O-CG1 3.5Å; V50-I54 PolarHBondContact O-N 2.96Å; V50-L313 HydrophobicContact CG2-CD2 3.79Å
51	G	96.1	Very high	96.3	Very high	35 Å²	35	52.5 Å²	52.5	36%	0.361	30%	0.303	S	S	.	.	H	α-helix	trans	-59.7	-44.5	179.8	0	0	0	0	0	112.9	G47 I48 T55	G47-G51 PolarHBondContact O-N 2.87Å; I48-G51 PolarHBondContact O-N 3.02Å; I48-G51 VanDerWaalsContact O-N 3.14Å; G51-T55 WeakPolarHBondContact O-CB 3.25Å; G51-T55 PolarHBondContact O-N 3.26Å; G51-T55 PolarHBondContact O-OG1 3.44Å
52	L	96.1	Very high	96.2	Very high	13 Å²	13	50 Å²	50	7%	0.068	29%	0.29	C	S	.	.	H	α-helix	trans	-66.2	-40.5	177.4	-61.9	173.9	0	0	0	111.7	I48 G49 V50 S56 W300 M301 L308 Y312	I48-L52 HydrophobicContact CG2-CD1 3.64Å; I48-L52 HydrophobicContact CG2-CG 4.05Å; I48-L52 VanDerWaalsContact O-CG 3.29Å; I48-L52 WeakPolarHBondContact O-CG 3.32Å; I48-L52 PolarHBondContact O-N 3.28Å; G49-L52 PolarHBondContact O-N 2.92Å; V50-L52 PolarHBondContact O-N 3.43Å; L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.14Å; L52-W300 HydrophobicContact CD2-CH2 3.84Å; L52-W300 HydrophobicContact CD2-CZ2 3.82Å; L52-M301 HydrophobicContact CB-CE 4.25Å; L52-M301 HydrophobicContact CB-SD 4.36Å; L52-M301 HydrophobicContact CD2-CE 4.17Å; L52-M301 HydrophobicContact CD2-SD 3.44Å; L52-M301 WeakPolarHBondContact CD2-SD 3.46Å; L52-M301 HydrophobicContact CG-SD 4.31Å; L52-L308 HydrophobicContact CD1-CD2 4.05Å; L52-L308 HydrophobicContact CD1-CG 4.05Å; L52-Y312 HydrophobicContact CD1-CD2 3.9Å; L52-Y312 HydrophobicContact CD1-CE2 4.17Å; L52-Y312 HydrophobicContact CD1-CG 4.5Å
53	F	96.6	Very high	96.1	Very high	63 Å²	63	54.8 Å²	54.8	28%	0.276	31%	0.312	S	S	.	.	H	α-helix	trans	-64.5	-47.3	179.4	-175.3	-96.3	0	0	0	112	G49 V50 S56 Q57 Q306 I310	G49-F53 VanDerWaalsContact O-CB 3.27Å; G49-F53 WeakPolarHBondContact O-CB 3.46Å; G49-F53 PolarHBondContact O-N 2.92Å; V50-F53 PolarHBondContact O-N 3.3Å; F53-S56 PolarHBondContact O-N 3.24Å; F53-Q57 HydrophobicContact CD1-CG 4.15Å; F53-Q57 HydrophobicContact CE1-CG 3.83Å; F53-Q57 HydrophobicContact CZ-CG 4.19Å; F53-Q57 WeakPolarHBondContact O-CG 3.21Å; F53-Q57 PolarHBondContact O-N 3.02Å; F53-Q306 HydrophobicContact CD2-CB 4.31Å; F53-Q306 HydrophobicContact CD2-CG 4.42Å; F53-Q306 HydrophobicContact CE2-CB 4.21Å; F53-Q306 HydrophobicContact CE2-CG 4.18Å; F53-I310 HydrophobicContact CD2-CG1 4.14Å; F53-I310 HydrophobicContact CE2-CD1 4.4Å; F53-I310 HydrophobicContact CE2-CG1 4.15Å
54	I	95.4	Very high	96	Very high	89 Å²	89	54.1 Å²	54.1	46%	0.456	31%	0.305	S	S	.	.	H	α-helix	trans	-63.2	-46.7	177.9	-66.8	171.1	0	0	0	110.6	V50 S56 Q57 N58	V50-I54 HydrophobicContact CG1-CD1 3.67Å; V50-I54 HydrophobicContact CG1-CG1 4.38Å; V50-I54 WeakPolarHBondContact O-CG1 3.5Å; V50-I54 PolarHBondContact O-N 2.96Å; I54-S56 PolarHBondContact O-N 2.95Å; I54-Q57 PolarHBondContact O-N 3.02Å; I54-Q57 VanDerWaalsContact O-N 3.08Å; I54-N58 PolarHBondContact O-N 2.88Å; I54-N58 VanDerWaalsContact O-N 3.14Å
55	T	94.2	Very high	95.9	Very high	36 Å²	36	55.1 Å²	55.1	22%	0.221	30%	0.303	C	S	.	.	H	α-helix	trans	-56.2	-40.2	178	-58.1	0	0	0	0	111.3	G51	G51-T55 WeakPolarHBondContact O-CB 3.25Å; G51-T55 PolarHBondContact O-N 3.26Å; G51-T55 PolarHBondContact O-OG1 3.44Å
56	S	94.5	Very high	95.8	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71	-34.7	178.1	-168.2	0	0	0	0	113.5	L52 F53 I54 I59 N305	L52-S56 WeakPolarHBondContact O-CB 3.47Å; L52-S56 PolarHBondContact O-N 3.14Å; F53-S56 PolarHBondContact O-N 3.24Å; I54-S56 PolarHBondContact O-N 2.95Å; S56-I59 WeakPolarHBondContact O-CB 3.29Å; S56-I59 PolarHBondContact O-N 2.99Å; S56-N305 WeakPolarHBondContact CB-O 3.13Å; S56-N305 PolarHBondContact OG-N 3.4Å; S56-N305 PolarHBondContact OG-O 3.09Å
57	Q	92.6	Very high	95.7	Very high	84 Å²	84	49.6 Å²	49.6	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-66.9	-35.1	177.1	-76.4	-77.8	21.5	0	0	112.8	F53 I54 I59	F53-Q57 HydrophobicContact CD1-CG 4.15Å; F53-Q57 HydrophobicContact CE1-CG 3.83Å; F53-Q57 HydrophobicContact CZ-CG 4.19Å; F53-Q57 WeakPolarHBondContact O-CG 3.21Å; F53-Q57 PolarHBondContact O-N 3.02Å; I54-Q57 PolarHBondContact O-N 3.02Å; I54-Q57 VanDerWaalsContact O-N 3.08Å; Q57-I59 PolarHBondContact O-N 2.83Å
58	N	92.1	Very high	95.4	Very high	116 Å²	116	47.4 Å²	47.4	62%	0.62	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-11.3	178.1	-68.6	-9.2	0	0	0	113.3	I54 T60	I54-N58 PolarHBondContact O-N 2.88Å; I54-N58 VanDerWaalsContact O-N 3.14Å; N58-T60 PolarHBondContact O-N 2.87Å
59	I	93.5	Very high	95.1	Very high	5 Å²	5	46.8 Å²	46.8	3%	0.026	25%	0.254	C	S	.	.			trans	-76.9	125.2	176.8	-59.9	175.3	0	0	0	109.6	S56 Q57 V61 N297 G302 G303 K304	S56-I59 WeakPolarHBondContact O-CB 3.29Å; S56-I59 PolarHBondContact O-N 2.99Å; Q57-I59 PolarHBondContact O-N 2.83Å; I59-V61 HydrophobicContact CG2-CG2 4.13Å; I59-N297 VanDerWaalsContact CA-OD1 3.27Å; I59-N297 WeakPolarHBondContact CA-OD1 3.23Å; I59-N297 WeakPolarHBondContact CG2-O 3.45Å; I59-N297 WeakPolarHBondContact CG2-OD1 3.23Å; I59-G302 WeakPolarHBondContact CD1-O 3.39Å; I59-G303 VanDerWaalsContact CD1-C 3.47Å; I59-K304 HydrophobicContact CB-CB 4.01Å; I59-K304 HydrophobicContact CB-CG 4.48Å; I59-K304 HydrophobicContact CG2-CB 3.74Å; I59-K304 PolarHBondContact O-NZ 2.05Å
60	T	93.6	Very high	94.7	Very high	58 Å²	58	53.1 Å²	53.1	36%	0.356	28%	0.284	S	S	.	.			trans	-94.1	134.2	175.2	54	0	0	0	0	109.5	N58 F98 S296 N297	N58-T60 PolarHBondContact O-N 2.87Å; T60-F98 VanDerWaalsContact O-CZ 3.23Å; T60-F98 WeakPolarHBondContact O-CZ 3.41Å; T60-F98 WeakPolarHBondContact OG1-CE1 3.36Å; T60-F98 WeakPolarHBondContact OG1-CZ 3.17Å; T60-S296 WeakPolarHBondContact O-CA 3.39Å; T60-N297 PolarHBondContact N-OD1 2.87Å; T60-N297 PolarHBondContact O-N 3.32Å; T60-N297 PolarHBondContact O-OD1 3.26Å; T60-N297 PolarHBondContact OG1-ND2 2.93Å; T60-N297 PolarHBondContact OG1-OD1 3.48Å
61	V	95.5	Very high	94.1	Very high	57 Å²	57	55.2 Å²	55.2	35%	0.345	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	126.8	179.7	-175.8	0	0	0	0	108.3	I59 V294 F295 K304	I59-V61 HydrophobicContact CG2-CG2 4.13Å; V61-V294 HydrophobicContact CG1-CG1 3.68Å; V61-F295 CarbonylContact C-O 3.53Å; V61-F295 WeakPolarHBondContact CA-O 3.36Å; V61-K304 HydrophobicContact CG2-CB 3.69Å; V61-K304 HydrophobicContact CG2-CD 3.95Å; V61-K304 HydrophobicContact CG2-CG 4.47Å
62	L	96.2	Very high	93.7	Very high	32 Å²	32	58.8 Å²	58.8	17%	0.168	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	118.9	169.2	175.4	69.1	0	0	0	108.3	K64 F92 L94 F98 V294 F295	L62-K64 HydrophobicContact CD1-CG 4.49Å; L62-F92 HydrophobicContact CD2-CD2 3.39Å; L62-F92 HydrophobicContact CD2-CE2 3.45Å; L62-F92 VanDerWaalsContact CD2-CE2 3.45Å; L62-F92 HydrophobicContact CD2-CG 4.06Å; L62-F92 HydrophobicContact CD2-CZ 4.18Å; L62-L94 HydrophobicContact CD2-CD2 3.85Å; L62-F98 HydrophobicContact CB-CE2 4.18Å; L62-V294 CarbonylContact O-C 3.57Å; L62-V294 VanDerWaalsContact O-CA 3.29Å; L62-V294 WeakPolarHBondContact O-CA 3.48Å; L62-F295 HydrophobicContact CB-CB 4.32Å; L62-F295 HydrophobicContact CD2-CD2 4.14Å; L62-F295 PolarHBondContact N-O 3.41Å; L62-F295 PolarHBondContact O-N 3.49Å
63	E	96.8	Very high	93.3	Very high	100 Å²	100	59.8 Å²	59.8	47%	0.467	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	132.6	176.1	-180	169.7	124	0	0	109.7	K292 V293 V294	E63-K292 HydrophobicContact CG-CB 4.35Å; E63-K292 HydrophobicContact CG-CD 4.06Å; E63-K292 WeakPolarHBondContact OE1-CD 3.36Å; E63-K292 WeakPolarHBondContact OE1-CE 3.39Å; E63-K292 IonicContact OE1-NZ 2.73Å; E63-K292 PolarHBondContact OE1-NZ 3.46Å; E63-V293 WeakPolarHBondContact CA-O 3.48Å; E63-V294 HydrophobicContact CB-CG2 4.36Å; E63-V294 HydrophobicContact CG-CG2 4.05Å
64	K	96.3	Very high	92.9	Very high	89 Å²	89	61.2 Å²	61.2	39%	0.387	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	127.4	175.7	-66.3	-68.4	-178.9	175.1	0	110.2	L62 L90 K292 V293	L62-K64 HydrophobicContact CD1-CG 4.49Å; K64-L90 HydrophobicContact CB-CD1 4.39Å; K64-K292 CarbonylContact O-C 3.55Å; K64-K292 VanDerWaalsContact O-CA 3.29Å; K64-K292 WeakPolarHBondContact O-CA 3.47Å; K64-V293 HydrophobicContact CB-CG2 3.86Å; K64-V293 PolarHBondContact N-O 2.94Å; K64-V293 PolarHBondContact O-N 2.98Å
65	D	96.5	Very high	92.8	Very high	72 Å²	72	57 Å²	57	39%	0.385	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	136.7	171	-165.9	-58.7	0	0	0	109.5	T67 K292	D65-T67 WeakPolarHBondContact OD1-CB 3.45Å; D65-T67 PolarHBondContact OD1-N 2.88Å; D65-T67 PolarHBondContact OD1-OG1 3.26Å; D65-T67 PolarHBondContact OD2-OG1 2.86Å; D65-K292 HydrophobicContact CB-CG 4.47Å
66	Y	96.1	Very high	92.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.318	C	S	.	.			trans	-131.9	18.8	178.3	73.3	-86	0	0	0	112.8	G68 C75 L90 F164 D166 F168 I278 Y280 K291 K292 V293	Y66-G68 PolarHBondContact O-N 3.47Å; Y66-C75 VanDerWaalsContact O-CB 3.32Å; Y66-C75 WeakPolarHBondContact O-CB 3.39Å; Y66-L90 HydrophobicContact CG-CD1 4.39Å; Y66-F164 WeakPolarHBondContact OH-CZ 3.49Å; Y66-D166 WeakPolarHBondContact CE2-OD2 3.47Å; Y66-D166 PolarHBondContact OH-OD2 3.2Å; Y66-D166 VanDerWaalsContact OH-OD2 3.13Å; Y66-F168 HydrophobicContact CE1-CE1 4.37Å; Y66-F168 HydrophobicContact CE1-CZ 4.49Å; Y66-F168 HydrophobicContact CE2-CE1 4.41Å; Y66-I278 HydrophobicContact CD1-CD1 4.38Å; Y66-I278 HydrophobicContact CD2-CD1 3.7Å; Y66-I278 HydrophobicContact CD2-CG2 4.1Å; Y66-I278 HydrophobicContact CE2-CD1 4.3Å; Y66-I278 HydrophobicContact CE2-CG2 3.89Å; Y66-I278 HydrophobicContact CG-CD1 3.75Å; Y66-Y280 HydrophobicContact CD2-CD2 4.13Å; Y66-Y280 HydrophobicContact CD2-CE2 4.1Å; Y66-Y280 HydrophobicContact CE2-CD2 4.29Å; Y66-Y280 HydrophobicContact CE2-CE2 4.32Å; Y66-Y280 WeakPolarHBondContact O-CE2 3.5Å; Y66-K291 HydrophobicContact CD1-CB 4.08Å; Y66-K291 WeakPolarHBondContact CD1-O 3.37Å; Y66-K291 HydrophobicContact CD2-CB 4.38Å; Y66-K291 HydrophobicContact CE1-CB 3.54Å; Y66-K291 HydrophobicContact CE2-CB 3.88Å; Y66-K291 HydrophobicContact CE2-CD 4.01Å; Y66-K291 HydrophobicContact CG-CB 4.46Å; Y66-K291 VanDerWaalsContact CZ-CB 3.42Å; Y66-K291 PolarHBondContact N-O 2.89Å; Y66-K292 VanDerWaalsContact CE1-C 3.47Å; Y66-V293 HydrophobicContact CD1-CG1 3.8Å; Y66-V293 HydrophobicContact CE1-CG1 3.58Å
67	T	95.4	Very high	92.5	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.344	C	S	.	.	S	Bend	trans	-63.1	-26.1	-177.4	-44	0	0	0	0	112.4	D65 V69 Y280 V284 L285 R290 K291	D65-T67 WeakPolarHBondContact OD1-CB 3.45Å; D65-T67 PolarHBondContact OD1-N 2.88Å; D65-T67 PolarHBondContact OD1-OG1 3.26Å; D65-T67 PolarHBondContact OD2-OG1 2.86Å; T67-V69 HydrophobicContact CG2-CG2 3.88Å; T67-Y280 PolarHBondContact O-OH 3.33Å; T67-V284 HydrophobicContact CG2-CG2 3.67Å; T67-L285 HydrophobicContact CG2-CD2 3.66Å; T67-L285 HydrophobicContact CG2-CG 4.31Å; T67-R290 WeakPolarHBondContact OG1-CA 3.19Å; T67-K291 PolarHBondContact OG1-N 2.87Å; T67-K291 PolarHBondContact OG1-O 3.45Å
68	G	92.8	Very high	92.4	Very high	2 Å²	2	62.5 Å²	62.5	2%	0.021	33%	0.327	C	S	.	.			trans	72.9	47.4	-179.6	0	0	0	0	0	112.9	Y66 Y76 S79	Y66-G68 PolarHBondContact O-N 3.47Å; G68-Y76 VanDerWaalsContact O-CD2 3.28Å; G68-Y76 WeakPolarHBondContact O-CD2 3.27Å; G68-S79 WeakPolarHBondContact O-CB 3.26Å
69	V	90.6	Very high	92.1	Very high	65 Å²	65	58.2 Å²	58.2	39%	0.394	31%	0.306	S	S	.	.			trans	-86	-40.5	-179.2	-179.6	0	0	0	0	111.1	T67 L285 R290	T67-V69 HydrophobicContact CG2-CG2 3.88Å; V69-L285 HydrophobicContact CG2-CD2 4.02Å; V69-R290 VanDerWaalsContact CG2-CZ 3.4Å
70	E	89.9	Confident	91.6	Very high	134 Å²	134	62 Å²	62	63%	0.626	33%	0.326	S	S	*	.	S	Bend	trans	-85.3	137.6	178.6	-61.5	176.5	-170.1	0	0	109.7	T72 S73 Y76	E70-T72 WeakPolarHBondContact CB-OG1 3.42Å; E70-T72 PolarHBondContact O-N 3.22Å; E70-T72 VanDerWaalsContact O-N 3.13Å; E70-T72 PolarHBondContact OE2-OG1 3.35Å; E70-S73 VanDerWaalsContact O-CB 3.28Å; E70-S73 WeakPolarHBondContact O-CB 3.34Å; E70-S73 PolarHBondContact O-N 3.47Å; E70-Y76 WeakPolarHBondContact O-CB 3.44Å; E70-Y76 WeakPolarHBondContact O-CD2 3.3Å
71	T	85.4	Confident	90.8	Very high	110 Å²	110	64.6 Å²	64.6	68%	0.675	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-19.5	178.6	51.4	0	0	0	0	113.4	S73 Y76	T71-S73 VanDerWaalsContact C-N 3.32Å; T71-Y76 HydrophobicContact CG2-CD1 4.46Å; T71-Y76 HydrophobicContact CG2-CD2 4.36Å; T71-Y76 HydrophobicContact CG2-CE1 3.97Å; T71-Y76 HydrophobicContact CG2-CE2 3.85Å
72	T	86.8	Confident	89.9	Confident	110 Å²	110	66.4 Å²	66.4	68%	0.675	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-15.2	175.8	50.3	0	0	0	0	113	E70	E70-T72 WeakPolarHBondContact CB-OG1 3.42Å; E70-T72 PolarHBondContact O-N 3.22Å; E70-T72 VanDerWaalsContact O-N 3.13Å; E70-T72 PolarHBondContact OE2-OG1 3.35Å
73	S	89.2	Confident	89.1	Confident	33 Å²	33	69 Å²	69	23%	0.231	37%	0.374	C	S	.	.	S	Bend	trans	-78.5	133.7	-178.8	-177.9	0	0	0	0	111.2	E70 T71 C75 Y76	E70-S73 VanDerWaalsContact O-CB 3.28Å; E70-S73 WeakPolarHBondContact O-CB 3.34Å; E70-S73 PolarHBondContact O-N 3.47Å; T71-S73 VanDerWaalsContact C-N 3.32Å; S73-C75 PolarHBondContact O-N 3.48Å; S73-C75 PolarHBondContact OG-N 2.83Å; S73-Y76 WeakPolarHBondContact O-CB 3.37Å; S73-Y76 PolarHBondContact O-N 3.22Å
74	D	88.3	Confident	88.2	Confident	93 Å²	93	73.4 Å²	73.4	50%	0.497	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-23	172.9	-73.8	-26.7	0	0	0	113.5	K77 K89	D74-K77 WeakPolarHBondContact O-CE 3.35Å; D74-K77 WeakPolarHBondContact O-CG 3.08Å; D74-K89 WeakPolarHBondContact CB-O 3.37Å
75	C	92.3	Very high	87.6	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	41%	0.409	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-4.7	177.4	-60.8	0	0	0	0	113.6	Y66 S73 K77 C78 S79 C88	Y66-C75 VanDerWaalsContact O-CB 3.32Å; Y66-C75 WeakPolarHBondContact O-CB 3.39Å; S73-C75 PolarHBondContact O-N 3.48Å; S73-C75 PolarHBondContact OG-N 2.83Å; C75-K77 VanDerWaalsContact C-N 3.32Å; C75-K77 PolarHBondContact O-N 3.14Å; C75-C78 WeakPolarHBondContact O-CB 3.28Å; C75-C78 PolarHBondContact O-N 3.08Å; C75-S79 PolarHBondContact O-N 3Å; C75-C88 HydrophobicContact CB-CB 3.71Å; C75-C88 WeakPolarHBondContact CB-SG 3.42Å; C75-C88 WeakPolarHBondContact SG-CB 3.27Å; C75-C88 CovalentContact SG-SG 2.05Å; C75-C88 PolarHBondContact SG-SG 3.38Å
76	Y	92.1	Very high	87.5	Confident	104 Å²	104	73.4 Å²	73.4	41%	0.408	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-58.3	-42.5	179	-177.9	-99.1	0	0	0	112.4	G68 E70 T71 S73 C78 S79	G68-Y76 VanDerWaalsContact O-CD2 3.28Å; G68-Y76 WeakPolarHBondContact O-CD2 3.27Å; E70-Y76 WeakPolarHBondContact O-CB 3.44Å; E70-Y76 WeakPolarHBondContact O-CD2 3.3Å; T71-Y76 HydrophobicContact CG2-CD1 4.46Å; T71-Y76 HydrophobicContact CG2-CD2 4.36Å; T71-Y76 HydrophobicContact CG2-CE1 3.97Å; T71-Y76 HydrophobicContact CG2-CE2 3.85Å; S73-Y76 WeakPolarHBondContact O-CB 3.37Å; S73-Y76 PolarHBondContact O-N 3.22Å; Y76-C78 PolarHBondContact O-N 3.33Å; Y76-C78 VanDerWaalsContact O-N 3.15Å; Y76-S79 WeakPolarHBondContact O-CB 3.47Å; Y76-S79 PolarHBondContact O-N 3.23Å; Y76-S79 PolarHBondContact O-OG 3.06Å
77	K	90.1	Very high	87.4	Confident	127 Å²	127	77.9 Å²	77.9	55%	0.552	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-57.1	-29.9	174.4	54.4	179	174.6	-177.7	0	113.5	D74 C75 S79	D74-K77 WeakPolarHBondContact O-CE 3.35Å; D74-K77 WeakPolarHBondContact O-CG 3.08Å; C75-K77 VanDerWaalsContact C-N 3.32Å; C75-K77 PolarHBondContact O-N 3.14Å; K77-S79 VanDerWaalsContact C-N 3.33Å
78	C	90.3	Very high	87.3	Confident	5 Å²	5	78 Å²	78	3%	0.034	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-87.3	-3.7	178.5	-59.9	0	0	0	0	113.4	C75 Y76 N80 C86 Y280	C75-C78 WeakPolarHBondContact O-CB 3.28Å; C75-C78 PolarHBondContact O-N 3.08Å; Y76-C78 PolarHBondContact O-N 3.33Å; Y76-C78 VanDerWaalsContact O-N 3.15Å; C78-N80 PolarHBondContact O-N 3.29Å; C78-C86 WeakPolarHBondContact CA-SG 3.43Å; C78-C86 HydrophobicContact CB-CB 3.59Å; C78-C86 WeakPolarHBondContact CB-SG 3.48Å; C78-C86 WeakPolarHBondContact SG-CB 3.48Å; C78-C86 CovalentContact SG-SG 2.03Å; C78-C86 PolarHBondContact SG-SG 3.19Å; C78-Y280 HydrophobicContact CB-CD1 4Å; C78-Y280 HydrophobicContact CB-CD2 4.1Å; C78-Y280 HydrophobicContact CB-CG 3.69Å; C78-Y280 VanDerWaalsContact O-CD1 3.26Å; C78-Y280 WeakPolarHBondContact O-CD1 3.15Å; C78-Y280 VanDerWaalsContact O-CE1 3.29Å; C78-Y280 WeakPolarHBondContact O-CE1 3.4Å
79	S	86	Confident	87.4	Confident	27 Å²	27	82.5 Å²	82.5	19%	0.189	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-75.1	-18.8	-179.4	89.9	0	0	0	0	112.1	G68 C75 Y76 K77 P81	G68-S79 WeakPolarHBondContact O-CB 3.26Å; C75-S79 PolarHBondContact O-N 3Å; Y76-S79 WeakPolarHBondContact O-CB 3.47Å; Y76-S79 PolarHBondContact O-N 3.23Å; Y76-S79 PolarHBondContact O-OG 3.06Å; K77-S79 VanDerWaalsContact C-N 3.33Å; S79-P81 WeakPolarHBondContact O-CD 3.23Å
80	N	84.4	Confident	87.6	Confident	83 Å²	83	80.4 Å²	80.4	44%	0.444	43%	0.431	S	S	.	.	S	Bend	trans	-79.3	121.7	178.3	-168.3	-7.3	0	0	0	110.7	C78 S82 D83	C78-N80 PolarHBondContact O-N 3.29Å; N80-S82 PolarHBondContact O-N 2.97Å; N80-S82 PolarHBondContact OD1-N 3.05Å; N80-D83 PolarHBondContact O-N 3.14Å
81	P	75.8	Confident	87.9	Confident	114 Å²	114	80.5 Å²	80.5	74%	0.74	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.4	-179.6	-23.6	33.6	0	0	0	115.1	S79 D83	S79-P81 WeakPolarHBondContact O-CD 3.23Å; P81-D83 VanDerWaalsContact C-N 3.33Å
82	S	77.4	Confident	88.4	Confident	94 Å²	94	76 Å²	76	66%	0.657	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-25.4	179	-61.2	0	0	0	0	113.6	N80 K84	N80-S82 PolarHBondContact O-N 2.97Å; N80-S82 PolarHBondContact OD1-N 3.05Å; S82-K84 PolarHBondContact O-N 2.76Å; S82-K84 VanDerWaalsContact O-N 3.13Å
83	D	78.9	Confident	88.8	Confident	87 Å²	87	74.7 Å²	74.7	47%	0.465	40%	0.398	S	S	.	.			trans	-86	87	-175	-69.5	-48.9	0	0	0	111.4	N80 P81 C86	N80-D83 PolarHBondContact O-N 3.14Å; P81-D83 VanDerWaalsContact C-N 3.33Å; D83-C86 HydrophobicContact CB-CB 4.24Å
84	K	76.8	Confident	89.1	Confident	192 Å²	192	74 Å²	74	84%	0.835	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	136.8	174.9	-64.5	-175.7	-178.5	178.5	0	110.4	S82	S82-K84 PolarHBondContact O-N 2.76Å; S82-K84 VanDerWaalsContact O-N 3.13Å
85	N	85.4	Confident	89.4	Confident	141 Å²	141	74.5 Å²	74.5	75%	0.754	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.7	36.3	-179.9	-53.5	-29.8	0	0	0	114.2
86	C	92.6	Very high	89.4	Confident	20 Å²	20	80.4 Å²	80.4	14%	0.135	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	138.7	176.7	-165	0	0	0	0	111.7	C78 D83 Y280	C78-C86 WeakPolarHBondContact CA-SG 3.43Å; C78-C86 HydrophobicContact CB-CB 3.59Å; C78-C86 WeakPolarHBondContact CB-SG 3.48Å; C78-C86 WeakPolarHBondContact SG-CB 3.48Å; C78-C86 CovalentContact SG-SG 2.03Å; C78-C86 PolarHBondContact SG-SG 3.19Å; D83-C86 HydrophobicContact CB-CB 4.24Å; C86-Y280 PolarHBondContact O-N 2.64Å
87	T	94	Very high	89.5	Confident	94 Å²	94	79.6 Å²	79.6	58%	0.577	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.4	173.6	55.4	0	0	0	0	110.1	I278 A279	T87-I278 CarbonylContact C-O 3.46Å; T87-I278 VanDerWaalsContact CA-O 3.23Å; T87-I278 WeakPolarHBondContact CA-O 3.33Å; T87-A279 HydrophobicContact CG2-CB 4.38Å
88	C	94.7	Very high	89.7	Confident	2 Å²	2	74.1 Å²	74.1	1%	0.014	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	162.8	173	69	0	0	0	0	111	C75 I278	C75-C88 HydrophobicContact CB-CB 3.71Å; C75-C88 WeakPolarHBondContact CB-SG 3.42Å; C75-C88 WeakPolarHBondContact SG-CB 3.27Å; C75-C88 CovalentContact SG-SG 2.05Å; C75-C88 PolarHBondContact SG-SG 3.38Å; C88-I278 PolarHBondContact N-O 3.43Å; C88-I278 PolarHBondContact O-N 2.93Å
89	K	94.8	Very high	89.8	Confident	98 Å²	98	79.7 Å²	79.7	43%	0.426	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	140.1	-177.9	-62.3	-177	177.7	165.1	0	108.5	D74 L276 E277	D74-K89 WeakPolarHBondContact CB-O 3.37Å; K89-L276 CarbonylContact C-O 3.56Å; K89-L276 WeakPolarHBondContact CA-O 3.48Å; K89-E277 WeakPolarHBondContact CE-OE1 3.38Å; K89-E277 HydrophobicContact CG-CG 4.25Å; K89-E277 IonicContact NZ-OE1 3.98Å
90	L	95.2	Very high	89.9	Confident	21 Å²	21	79.9 Å²	79.9	11%	0.11	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.6	167.2	-61.8	176.5	0	0	0	108.3	K64 Y66 S275 L276 I278 V293	K64-L90 HydrophobicContact CB-CD1 4.39Å; Y66-L90 HydrophobicContact CG-CD1 4.39Å; L90-S275 WeakPolarHBondContact O-CA 3.46Å; L90-L276 HydrophobicContact CB-CB 4.33Å; L90-L276 HydrophobicContact CD1-CD2 4.29Å; L90-L276 PolarHBondContact N-O 2.9Å; L90-L276 PolarHBondContact O-N 3.31Å; L90-I278 HydrophobicContact CD1-CD1 3.6Å; L90-I278 HydrophobicContact CG-CD1 3.87Å; L90-V293 HydrophobicContact CD1-CG2 4.01Å
91	E	95.3	Very high	90.3	Very high	135 Å²	135	78.7 Å²	78.7	63%	0.631	44%	0.44	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.7	174.4	-61.4	-169.9	158.5	0	0	109.9	Y274	E91-Y274 WeakPolarHBondContact CA-O 3.5Å
92	F	95.6	Very high	91.2	Very high	16 Å²	16	73.3 Å²	73.3	7%	0.07	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	153.7	177.1	61.3	-90.6	0	0	0	111.1	L62 L94 L170 Y274 L276 F295	L62-F92 HydrophobicContact CD2-CD2 3.39Å; L62-F92 HydrophobicContact CD2-CE2 3.45Å; L62-F92 VanDerWaalsContact CD2-CE2 3.45Å; L62-F92 HydrophobicContact CD2-CG 4.06Å; L62-F92 HydrophobicContact CD2-CZ 4.18Å; F92-L94 HydrophobicContact CD2-CD2 4.28Å; F92-L94 HydrophobicContact CD2-CG 4.48Å; F92-L94 HydrophobicContact CE2-CD2 4.29Å; F92-L94 HydrophobicContact CE2-CG 4.38Å; F92-L170 HydrophobicContact CE1-CD1 4.25Å; F92-L170 HydrophobicContact CZ-CD1 3.89Å; F92-Y274 HydrophobicContact CE2-CD2 4.26Å; F92-Y274 HydrophobicContact CE2-CG 4.02Å; F92-Y274 HydrophobicContact CZ-CG 4.29Å; F92-Y274 PolarHBondContact N-O 2.98Å; F92-Y274 PolarHBondContact O-N 3.45Å; F92-L276 HydrophobicContact CE1-CB 4.22Å; F92-F295 HydrophobicContact CE1-CE2 4.22Å; F92-F295 HydrophobicContact CZ-CD2 4.41Å; F92-F295 AromaticContact CZ-CE2 3.8Å; F92-F295 HydrophobicContact CZ-CE2 3.8Å; F92-F295 HydrophobicContact CZ-CZ 4.15Å
93	S	95.9	Very high	92.1	Very high	83 Å²	83	70.3 Å²	70.3	58%	0.58	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.3	137.3	178	60	0	0	0	0	110.9	G272 N273	S93-G272 CarbonylContact C-O 3.54Å; S93-G272 WeakPolarHBondContact CA-O 3.43Å; S93-N273 VanDerWaalsContact CB-OD1 3.23Å; S93-N273 WeakPolarHBondContact CB-OD1 3.24Å
94	L	95.7	Very high	93	Very high	18 Å²	18	66.1 Å²	66.1	9%	0.094	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	120	169.6	-59.8	-179.1	0	0	0	108.6	L62 F92 F98 L269 A271 G272 Y274	L62-L94 HydrophobicContact CD2-CD2 3.85Å; F92-L94 HydrophobicContact CD2-CD2 4.28Å; F92-L94 HydrophobicContact CD2-CG 4.48Å; F92-L94 HydrophobicContact CE2-CD2 4.29Å; F92-L94 HydrophobicContact CE2-CG 4.38Å; L94-F98 HydrophobicContact CD1-CB 4.16Å; L94-F98 HydrophobicContact CD2-CD2 4.32Å; L94-L269 HydrophobicContact CD1-CB 3.75Å; L94-L269 HydrophobicContact CD1-CD1 4.27Å; L94-A271 CarbonylContact O-C 3.57Å; L94-A271 VanDerWaalsContact O-CA 3.31Å; L94-A271 WeakPolarHBondContact O-CA 3.48Å; L94-G272 PolarHBondContact N-O 2.81Å; L94-G272 PolarHBondContact O-N 2.91Å; L94-Y274 HydrophobicContact CB-CE2 4.4Å; L94-Y274 HydrophobicContact CD1-CD2 3.95Å; L94-Y274 HydrophobicContact CD1-CE2 3.56Å; L94-Y274 HydrophobicContact CG-CD2 4Å; L94-Y274 HydrophobicContact CG-CE2 3.98Å
95	S	93.4	Very high	94.1	Very high	104 Å²	104	58.4 Å²	58.4	73%	0.727	32%	0.324	S	S	*	.	S	Bend	trans	-75.2	-35.6	-179.3	56.8	0	0	0	0	112.8	A271	S95-A271 WeakPolarHBondContact O-CB 3.39Å
96	N	92.6	Very high	94.7	Very high	124 Å²	124	52 Å²	52	66%	0.663	29%	0.289	S	S	*	.	S	Bend	trans	-123.3	164.6	-178.8	-62.9	-41.3	0	0	0	109.9	F98	N96-F98 PolarHBondContact O-N 2.9Å
97	L	94.2	Very high	94.9	Very high	87 Å²	87	51.4 Å²	51.4	46%	0.455	29%	0.286	S	S	.	.			trans	-55.7	124	169.1	177.6	67.2	0	0	0	109.5	E99	L97-E99 PolarHBondContact O-N 3Å
98	F	94.3	Very high	95.1	Very high	12 Å²	12	47 Å²	47	5%	0.053	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	95.5	171.5	-161	-64.4	0	0	0	107.7	T60 L62 L94 N96 G100 V102 G268 L269 F295 N297	T60-F98 VanDerWaalsContact O-CZ 3.23Å; T60-F98 WeakPolarHBondContact O-CZ 3.41Å; T60-F98 WeakPolarHBondContact OG1-CE1 3.36Å; T60-F98 WeakPolarHBondContact OG1-CZ 3.17Å; L62-F98 HydrophobicContact CB-CE2 4.18Å; L94-F98 HydrophobicContact CD1-CB 4.16Å; L94-F98 HydrophobicContact CD2-CD2 4.32Å; N96-F98 PolarHBondContact O-N 2.9Å; F98-G100 PolarHBondContact O-N 2.82Å; F98-V102 HydrophobicContact CD1-CB 4.46Å; F98-V102 HydrophobicContact CD1-CG1 4.08Å; F98-V102 HydrophobicContact CD1-CG2 3.58Å; F98-V102 HydrophobicContact CE1-CG1 3.95Å; F98-V102 HydrophobicContact CE1-CG2 4.09Å; F98-G268 CarbonylContact O-C 3.57Å; F98-G268 WeakPolarHBondContact O-CA 3.18Å; F98-L269 HydrophobicContact CB-CB 4.03Å; F98-L269 PolarHBondContact N-O 2.61Å; F98-L269 PolarHBondContact O-N 2.8Å; F98-F295 HydrophobicContact CE2-CB 4.35Å; F98-F295 HydrophobicContact CZ-CB 4.21Å; F98-F295 WeakPolarHBondContact CZ-O 3.26Å; F98-N297 HydrophobicContact CE1-CB 4.13Å
99	E	92.8	Very high	95.3	Very high	122 Å²	122	47.9 Å²	47.9	57%	0.57	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-55.8	131.1	-171.9	-64.5	-176.9	171.6	0	0	112.8	L97 N297	L97-E99 PolarHBondContact O-N 3Å; E99-N297 VanDerWaalsContact O-CB 3.29Å; E99-N297 WeakPolarHBondContact O-CB 3.49Å
100	G	87.8	Confident	95.4	Very high	30 Å²	30	46.1 Å²	46.1	31%	0.309	26%	0.261	S	S	.	.	S	Bend	trans	-79.3	165.9	178.5	0	0	0	0	0	113.7	F98 S267	F98-G100 PolarHBondContact O-N 2.82Å; G100-S267 PolarHBondContact N-O 3.41Å
101	P	92.5	Very high	95.5	Very high	59 Å²	59	46.2 Å²	46.2	38%	0.383	26%	0.26	S	S	.	.	S	Bend	cis	-72	135.3	-1.9	28.2	-34	0	0	0	112.5	F103 T261	P101-F103 HydrophobicContact CB-CE2 4.08Å; P101-F103 HydrophobicContact CB-CZ 4.43Å; P101-F103 HydrophobicContact CG-CE2 3.95Å; P101-F103 HydrophobicContact CG-CZ 4.38Å; P101-T261 HydrophobicContact CB-CG2 3.72Å
102	V	95.6	Very high	95.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	130.7	-179.3	-175.8	0	0	0	0	110.2	F98 I260 L269 F295	F98-V102 HydrophobicContact CD1-CB 4.46Å; F98-V102 HydrophobicContact CD1-CG1 4.08Å; F98-V102 HydrophobicContact CD1-CG2 3.58Å; 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 4.27Å; V102-I260 PolarHBondContact O-N 3.13Å; V102-L269 HydrophobicContact CG1-CD1 4.09Å; V102-L269 HydrophobicContact CG1-CG 4.48Å; V102-L269 HydrophobicContact CG2-CG 4.33Å; V102-F295 HydrophobicContact CG1-CB 4.41Å; V102-F295 HydrophobicContact CG1-CD1 4.38Å
103	F	96.9	Very high	95.6	Very high	31 Å²	31	44.1 Å²	44.1	14%	0.136	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.6	176.8	-63.1	-92.7	0	0	0	109.7	P101 Y105 L256 R259 F295 S296 V298	P101-F103 HydrophobicContact CB-CE2 4.08Å; P101-F103 HydrophobicContact CB-CZ 4.43Å; P101-F103 HydrophobicContact CG-CE2 3.95Å; P101-F103 HydrophobicContact CG-CZ 4.38Å; F103-Y105 HydrophobicContact CB-CD2 4.25Å; F103-Y105 HydrophobicContact CB-CE2 3.35Å; F103-Y105 WeakPolarHBondContact CB-OH 3.07Å; F103-Y105 HydrophobicContact CG-CE2 4.48Å; F103-L256 HydrophobicContact CB-CD1 3.9Å; F103-L256 HydrophobicContact CD1-CD1 3.8Å; F103-L256 HydrophobicContact CD1-CD2 4.19Å; F103-L256 HydrophobicContact CG-CD1 4.34Å; F103-R259 HydrophobicContact CD1-CG 3.77Å; F103-R259 HydrophobicContact CE1-CG 3.77Å; F103-F295 WeakPolarHBondContact O-CA 3.29Å; F103-S296 PolarHBondContact N-O 3.13Å; F103-S296 PolarHBondContact O-N 2.88Å; F103-V298 HydrophobicContact CD2-CB 4.45Å; F103-V298 HydrophobicContact CD2-CG1 3.76Å; F103-V298 HydrophobicContact CD2-CG2 4Å; F103-V298 HydrophobicContact CE2-CB 4.27Å; F103-V298 HydrophobicContact CE2-CG1 4.01Å; F103-V298 HydrophobicContact CE2-CG2 3.36Å; F103-V298 HydrophobicContact CG-CG1 4.48Å; F103-V298 HydrophobicContact CZ-CG2 4.04Å
104	F	97.8	Very high	95.6	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.9	178.6	174.9	-124.5	0	0	0	109.8	F168 F183 Y257 R258 L276 V293 F295	F104-F168 HydrophobicContact CE1-CB 3.65Å; F104-F168 HydrophobicContact CE1-CD1 4.37Å; F104-F168 AromaticContact CE1-CD2 3.71Å; F104-F168 HydrophobicContact CE1-CD2 3.71Å; F104-F168 HydrophobicContact CE1-CE2 4.45Å; F104-F168 AromaticContact CE1-CG 3.66Å; F104-F168 HydrophobicContact CE1-CG 3.66Å; F104-F168 HydrophobicContact CZ-CB 3.9Å; F104-F168 AromaticContact CZ-CD1 3.88Å; F104-F168 HydrophobicContact CZ-CD1 3.88Å; F104-F168 AromaticContact CZ-CD2 3.95Å; F104-F168 HydrophobicContact CZ-CD2 3.95Å; F104-F168 HydrophobicContact CZ-CE1 4.4Å; F104-F168 HydrophobicContact CZ-CE2 4.45Å; F104-F168 AromaticContact CZ-CG 3.64Å; F104-F168 HydrophobicContact CZ-CG 3.64Å; F104-F183 HydrophobicContact CD1-CE1 4.35Å; F104-F183 AromaticContact CD1-CE2 3.94Å; F104-F183 HydrophobicContact CD1-CE2 3.94Å; F104-F183 AromaticContact CD1-CZ 3.7Å; F104-F183 HydrophobicContact CD1-CZ 3.7Å; F104-F183 AromaticContact CE1-CE2 3.92Å; F104-F183 HydrophobicContact CE1-CE2 3.92Å; F104-F183 AromaticContact CE1-CZ 3.92Å; F104-F183 HydrophobicContact CE1-CZ 3.92Å; F104-F183 HydrophobicContact CG-CZ 4.31Å; F104-Y257 AromaticContact CD1-CD1 3.54Å; F104-Y257 HydrophobicContact CD1-CD1 3.54Å; F104-Y257 HydrophobicContact CD1-CG 4.19Å; F104-Y257 AromaticContact CE1-CD1 3.41Å; F104-Y257 HydrophobicContact CE1-CD1 3.41Å; F104-Y257 VanDerWaalsContact CE1-CD1 3.41Å; F104-Y257 HydrophobicContact CE1-CE1 4.14Å; F104-Y257 HydrophobicContact CE1-CG 4.1Å; F104-Y257 WeakPolarHBondContact O-CA 3.37Å; F104-Y257 WeakPolarHBondContact O-CB 3.41Å; F104-Y257 PolarHBondContact O-N 2.86Å; F104-R258 HydrophobicContact CD1-CB 4.42Å; F104-R258 PolarHBondContact N-O 3.12Å; F104-R258 PolarHBondContact O-N 3.31Å; F104-R258 VanDerWaalsContact O-N 3.09Å; F104-L276 HydrophobicContact CE2-CD2 4.48Å; F104-L276 HydrophobicContact CZ-CD1 4.33Å; F104-L276 HydrophobicContact CZ-CD2 4.37Å; F104-V293 HydrophobicContact CE2-CB 3.83Å; F104-V293 HydrophobicContact CE2-CG1 3.99Å; F104-V293 HydrophobicContact CZ-CB 4.36Å; F104-V293 HydrophobicContact CZ-CG1 4Å; F104-F295 HydrophobicContact CB-CD1 4.13Å; F104-F295 HydrophobicContact CB-CE1 4.02Å; F104-F295 AromaticContact CD2-CD1 3.68Å; F104-F295 HydrophobicContact CD2-CD1 3.68Å; F104-F295 HydrophobicContact CD2-CD2 4.27Å; F104-F295 AromaticContact CD2-CE1 3.22Å; F104-F295 HydrophobicContact CD2-CE1 3.22Å; F104-F295 AromaticContact CD2-CE2 3.88Å; F104-F295 HydrophobicContact CD2-CE2 3.88Å; F104-F295 HydrophobicContact CD2-CG 4.19Å; F104-F295 AromaticContact CD2-CZ 3.33Å; F104-F295 HydrophobicContact CD2-CZ 3.33Å; F104-F295 AromaticContact CE2-CE1 3.81Å; F104-F295 HydrophobicContact CE2-CE1 3.81Å; F104-F295 AromaticContact CE2-CE2 3.82Å; F104-F295 HydrophobicContact CE2-CE2 3.82Å; F104-F295 AromaticContact CE2-CZ 3.4Å; F104-F295 HydrophobicContact CE2-CZ 3.4Å; F104-F295 HydrophobicContact CG-CD1 4.27Å; F104-F295 AromaticContact CG-CE1 3.79Å; F104-F295 HydrophobicContact CG-CE1 3.79Å; F104-F295 HydrophobicContact CG-CZ 4.25Å; F104-F295 HydrophobicContact CZ-CZ 4.41Å
105	Y	98.3	Very high	95.6	Very high	30 Å²	30	47.4 Å²	47.4	12%	0.118	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	148.3	-178.8	-53.3	-99.1	0	0	0	110.6	F103 R254 K255 L256 V294	F103-Y105 HydrophobicContact CB-CD2 4.25Å; F103-Y105 HydrophobicContact CB-CE2 3.35Å; F103-Y105 WeakPolarHBondContact CB-OH 3.07Å; F103-Y105 HydrophobicContact CG-CE2 4.48Å; Y105-R254 HydrophobicContact CD1-CB 4.49Å; Y105-R254 HydrophobicContact CD1-CG 4.16Å; Y105-R254 HydrophobicContact CG-CB 4.49Å; Y105-R254 HydrophobicContact CG-CG 4.39Å; Y105-K255 WeakPolarHBondContact CA-O 3.02Å; Y105-K255 WeakPolarHBondContact CB-O 3.25Å; Y105-L256 VanDerWaalsContact CD1-CA 3.47Å; Y105-L256 HydrophobicContact CD1-CB 4Å; Y105-L256 HydrophobicContact CD1-CD1 4.16Å; Y105-L256 HydrophobicContact CE1-CB 3.83Å; Y105-L256 HydrophobicContact CE1-CD1 3.81Å; Y105-L256 HydrophobicContact CE1-CG 4.39Å; Y105-V294 PolarHBondContact N-O 3.01Å; Y105-V294 PolarHBondContact O-N 3.06Å
106	Y	98.3	Very high	95.6	Very high	7 Å²	7	52.8 Å²	52.8	3%	0.027	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	141.9	156.3	63	-93.2	0	0	0	109.2	F164 W244 R254 K255 Y257 K292	Y106-F164 AromaticContact CD1-CD1 4Å; Y106-F164 HydrophobicContact CD1-CD1 4Å; Y106-F164 AromaticContact CD1-CE1 3.94Å; Y106-F164 HydrophobicContact CD1-CE1 3.94Å; Y106-F164 AromaticContact CD2-CD1 3.99Å; Y106-F164 HydrophobicContact CD2-CD1 3.99Å; Y106-F164 HydrophobicContact CD2-CD2 4.12Å; Y106-F164 HydrophobicContact CD2-CE1 4.05Å; Y106-F164 HydrophobicContact CD2-CE2 4.17Å; Y106-F164 HydrophobicContact CD2-CG 4.01Å; Y106-F164 HydrophobicContact CD2-CZ 4.11Å; Y106-F164 AromaticContact CE1-CD1 3.92Å; Y106-F164 HydrophobicContact CE1-CD1 3.92Å; Y106-F164 HydrophobicContact CE1-CE1 4.33Å; Y106-F164 HydrophobicContact CE2-CB 3.98Å; Y106-F164 AromaticContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD2 4.13Å; Y106-F164 HydrophobicContact CE2-CE1 4.41Å; Y106-F164 AromaticContact CE2-CG 3.71Å; Y106-F164 HydrophobicContact CE2-CG 3.71Å; Y106-F164 HydrophobicContact CG-CD1 4.05Å; Y106-F164 AromaticContact CG-CE1 3.8Å; Y106-F164 HydrophobicContact CG-CE1 3.8Å; Y106-F164 HydrophobicContact CG-CZ 4.05Å; Y106-F164 AromaticContact CZ-CD1 3.85Å; Y106-F164 AromaticContact CZ-CG 4Å; Y106-W244 HydrophobicContact CE2-CE3 4.43Å; Y106-W244 HydrophobicContact CE2-CZ3 4.36Å; Y106-R254 CarbonylContact O-C 3.53Å; Y106-R254 VanDerWaalsContact O-CA 3.23Å; Y106-R254 WeakPolarHBondContact O-CA 3.49Å; Y106-K255 HydrophobicContact CD1-CB 4.5Å; Y106-K255 HydrophobicContact CD2-CB 4.29Å; Y106-K255 HydrophobicContact CE1-CB 3.86Å; Y106-K255 HydrophobicContact CE2-CB 3.63Å; Y106-K255 HydrophobicContact CE2-CD 3.85Å; Y106-K255 HydrophobicContact CE2-CG 4.25Å; Y106-K255 PolarHBondContact N-O 3.42Å; Y106-K255 VanDerWaalsContact N-O 3.09Å; Y106-K255 PolarHBondContact O-N 2.97Å; Y106-K255 WeakPolarHBondContact OH-CB 3.2Å; Y106-K255 WeakPolarHBondContact OH-CD 3.32Å; Y106-Y257 AromaticContact CD1-CD2 4Å; Y106-Y257 HydrophobicContact CD1-CD2 4Å; Y106-Y257 HydrophobicContact CD1-CG 4.36Å; Y106-Y257 HydrophobicContact CE1-CD2 4.15Å; Y106-K292 CarbonylContact C-O 3.56Å; Y106-K292 WeakPolarHBondContact CA-O 3.43Å
107	G	98.1	Very high	95.6	Very high	6 Å²	6	50.8 Å²	50.8	6%	0.062	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.1	176.4	0	0	0	0	0	110.7	F253 K291 K292	G107-F253 CarbonylContact C-O 3.6Å; G107-F253 VanDerWaalsContact CA-O 3.24Å; G107-F253 WeakPolarHBondContact CA-O 3.29Å; G107-K291 WeakPolarHBondContact O-CA 3.25Å; G107-K292 PolarHBondContact N-O 3.17Å; G107-K292 PolarHBondContact O-N 3.02Å
108	L	98.2	Very high	95.7	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	136.2	169.6	-66.1	178.8	0	0	0	108.3	Y111 F164 W244 D252 F253 Y282 V284 R290 K291	L108-Y111 HydrophobicContact CD1-CD2 4.26Å; L108-Y111 HydrophobicContact CD1-CG 4.35Å; L108-F164 HydrophobicContact CD1-CD2 4.28Å; L108-F164 HydrophobicContact CD2-CD2 4.36Å; L108-F164 HydrophobicContact CD2-CE2 4.17Å; L108-W244 HydrophobicContact CD1-CH2 4.04Å; L108-W244 HydrophobicContact CD1-CZ3 3.92Å; L108-D252 WeakPolarHBondContact O-CA 3.1Å; L108-F253 HydrophobicContact CB-CE1 4.24Å; L108-F253 HydrophobicContact CB-CE2 4.16Å; L108-F253 HydrophobicContact CB-CZ 3.89Å; L108-F253 HydrophobicContact CD1-CE2 4.18Å; L108-F253 HydrophobicContact CD1-CZ 3.85Å; L108-F253 HydrophobicContact CG-CE2 4.45Å; L108-F253 HydrophobicContact CG-CZ 4.35Å; L108-F253 PolarHBondContact N-O 3.12Å; L108-F253 PolarHBondContact O-N 2.9Å; L108-Y282 HydrophobicContact CD1-CE1 4.14Å; L108-V284 HydrophobicContact CD2-CG1 4.2Å; L108-R290 WeakPolarHBondContact CA-O 3.4Å; L108-K291 HydrophobicContact CD2-CD 4.36Å; L108-K291 HydrophobicContact CD2-CG 3.82Å
109	S	97.7	Very high	95.6	Very high	20 Å²	20	47.6 Å²	47.6	14%	0.14	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	151.9	173.1	-61.9	0	0	0	0	111.3	Y111 D252 G289 R290	S109-Y111 VanDerWaalsContact C-N 3.26Å; S109-Y111 PolarHBondContact O-N 2.95Å; S109-D252 WeakPolarHBondContact CA-OD1 3.4Å; S109-D252 WeakPolarHBondContact CB-OD1 3.43Å; S109-D252 PolarHBondContact OG-OD1 2.94Å; S109-G289 VanDerWaalsContact O-CA 3.28Å; S109-G289 WeakPolarHBondContact O-CA 3.32Å; S109-R290 PolarHBondContact N-O 2.87Å; S109-R290 PolarHBondContact O-N 3.29Å
110	N	97.1	Very high	95.6	Very high	62 Å²	62	44.3 Å²	44.3	33%	0.332	24%	0.237	S	C	.	.	S	Bend	trans	54.9	42.5	-177.1	-168.1	30.1	0	0	0	112.1	F112 P251 D252 F287 G288	N110-F112 WeakPolarHBondContact OD1-CE2 3.16Å; N110-P251 PolarHBondContact N-O 3.36Å; N110-D252 PolarHBondContact N-OD1 3.15Å; N110-F287 PolarHBondContact ND2-O 3.37Å; N110-G288 PolarHBondContact ND2-O 3Å; N110-G288 VanDerWaalsContact ND2-O 3.13Å
111	Y	97.2	Very high	96	Very high	23 Å²	23	43 Å²	43	9%	0.09	22%	0.223	C	C	.	.			trans	-125.2	106.1	179.6	-167.9	-72.9	0	0	0	111.1	L108 S109 Q113 Y118 S162 W244 P251 F253 Y282 F287	L108-Y111 HydrophobicContact CD1-CD2 4.26Å; L108-Y111 HydrophobicContact CD1-CG 4.35Å; S109-Y111 VanDerWaalsContact C-N 3.26Å; S109-Y111 PolarHBondContact O-N 2.95Å; Y111-Q113 HydrophobicContact CD1-CG 3.62Å; Y111-Q113 HydrophobicContact CE1-CG 3.61Å; Y111-Q113 PolarHBondContact O-N 2.99Å; Y111-Y118 HydrophobicContact CE1-CE1 4.37Å; Y111-Y118 AromaticContact CE1-CZ 3.97Å; Y111-Y118 PolarHBondContact OH-OH 3.37Å; Y111-S162 VanDerWaalsContact OH-CB 3.28Å; Y111-S162 WeakPolarHBondContact OH-CB 3.08Å; Y111-S162 PolarHBondContact OH-OG 3.47Å; Y111-S162 VanDerWaalsContact OH-OG 3.12Å; Y111-W244 HydrophobicContact CE1-CH2 4.04Å; Y111-W244 HydrophobicContact CE1-CZ2 4.28Å; Y111-W244 AromaticContact CZ-CH2 3.94Å; Y111-P251 PolarHBondContact N-O 2.03Å; Y111-P251 WeakPolarHBondContact O-CA 3.34Å; Y111-F253 AromaticContact CD1-CE1 3.77Å; Y111-F253 HydrophobicContact CD1-CE1 3.77Å; Y111-F253 AromaticContact CD1-CZ 3.88Å; Y111-F253 HydrophobicContact CD1-CZ 3.88Å; Y111-F253 HydrophobicContact CG-CE1 4.16Å; Y111-F253 HydrophobicContact CG-CZ 4.3Å; Y111-F253 WeakPolarHBondContact O-CE1 3.43Å; Y111-Y282 HydrophobicContact CE2-CE1 4.25Å; Y111-Y282 VanDerWaalsContact CE2-OH 3.31Å; Y111-Y282 WeakPolarHBondContact CE2-OH 3.2Å; Y111-Y282 PolarHBondContact OH-OH 3.23Å; Y111-F287 AromaticContact CD2-CE2 3.97Å; Y111-F287 HydrophobicContact CD2-CE2 3.97Å; Y111-F287 AromaticContact CD2-CZ 3.76Å; Y111-F287 HydrophobicContact CD2-CZ 3.76Å; Y111-F287 HydrophobicContact CE2-CZ 4.22Å
112	F	96.6	Very high	96.2	Very high	107 Å²	107	41.6 Å²	41.6	47%	0.469	21%	0.211	S	C	.	.			trans	-86.8	73.3	-167.7	-61.2	-89.1	0	0	0	114.1	N110 S114 Q115 P251	N110-F112 WeakPolarHBondContact OD1-CE2 3.16Å; F112-S114 PolarHBondContact O-N 3.01Å; F112-Q115 HydrophobicContact CB-CB 4.37Å; F112-Q115 WeakPolarHBondContact O-CB 3.02Å; F112-Q115 PolarHBondContact O-N 2.89Å; F112-P251 HydrophobicContact CD1-CB 3.73Å; F112-P251 HydrophobicContact CD1-CG 4.41Å; F112-P251 HydrophobicContact CE1-CB 3.6Å; F112-P251 HydrophobicContact CE1-CG 4.01Å; F112-P251 HydrophobicContact CG-CB 4.3Å; F112-P251 HydrophobicContact CZ-CB 4.06Å
113	Q	96.4	Very high	96.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.7	173.5	-68	-159.2	-18.2	0	0	113.9	Y111 Q115 Y118 W244 A248 F253	Y111-Q113 HydrophobicContact CD1-CG 3.62Å; Y111-Q113 HydrophobicContact CE1-CG 3.61Å; Y111-Q113 PolarHBondContact O-N 2.99Å; Q113-Q115 VanDerWaalsContact C-N 3.34Å; Q113-Y118 HydrophobicContact CB-CD1 4.45Å; Q113-Y118 HydrophobicContact CB-CE1 4.07Å; Q113-Y118 HydrophobicContact CG-CE1 3.9Å; Q113-W244 VanDerWaalsContact NE2-CH2 3.32Å; Q113-A248 HydrophobicContact CB-CB 4.34Å; Q113-F253 HydrophobicContact CG-CE1 3.77Å; Q113-F253 HydrophobicContact CG-CZ 3.85Å
114	S	95.2	Very high	96.2	Very high	59 Å²	59	45.7 Å²	45.7	41%	0.413	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-7.8	179.4	53.4	0	0	0	0	114	F112 R116 A249	F112-S114 PolarHBondContact O-N 3.01Å; S114-R116 PolarHBondContact O-N 3.3Å; S114-A249 VanDerWaalsContact CB-O 3.3Å; S114-A249 WeakPolarHBondContact CB-O 3.45Å; S114-A249 PolarHBondContact OG-O 2.93Å
115	Q	95.7	Very high	96.2	Very high	111 Å²	111	51.7 Å²	51.7	52%	0.519	25%	0.254	S	S	.	.			trans	-56.7	127.9	174.5	-175.5	68.7	12.8	0	0	110.1	F112 Q113 S117 Y118 G119	F112-Q115 HydrophobicContact CB-CB 4.37Å; F112-Q115 WeakPolarHBondContact O-CB 3.02Å; F112-Q115 PolarHBondContact O-N 2.89Å; Q113-Q115 VanDerWaalsContact C-N 3.34Å; Q115-S117 PolarHBondContact O-N 3.4Å; Q115-Y118 PolarHBondContact O-N 2.79Å; Q115-G119 PolarHBondContact O-N 2.05Å
116	R	94.1	Very high	96.1	Very high	216 Å²	216	50.2 Å²	50.2	82%	0.815	25%	0.248	S	C	*	.	H	α-helix	trans	-53.9	-49.6	-171.4	-179.6	-179.5	174	-172.5	-1.1	113	S114 A120	S114-R116 PolarHBondContact O-N 3.3Å; R116-A120 WeakPolarHBondContact O-CB 3.29Å; R116-A120 PolarHBondContact O-N 3.01Å
117	S	93.4	Very high	96	Very high	82 Å²	82	50.2 Å²	50.2	57%	0.573	25%	0.248	S	C	*	.	H	α-helix	trans	-64.5	-45.9	-179.2	50.2	0	0	0	0	111.8	Q115 G119 S121	Q115-S117 PolarHBondContact O-N 3.4Å; S117-G119 PolarHBondContact O-N 2.64Å; S117-S121 WeakPolarHBondContact O-CB 3.21Å; S117-S121 PolarHBondContact O-N 2.84Å; S117-S121 VanDerWaalsContact O-N 3.12Å
118	Y	95.3	Very high	95.9	Very high	32 Å²	32	52.1 Å²	52.1	13%	0.125	26%	0.261	C	S	.	.	H	α-helix	trans	-59.1	-48.9	177	179.6	-95.3	0	0	0	111.6	Y111 Q113 Q115 S121 L159 S162 W244	Y111-Y118 HydrophobicContact CE1-CE1 4.37Å; Y111-Y118 AromaticContact CE1-CZ 3.97Å; Y111-Y118 PolarHBondContact OH-OH 3.37Å; Q113-Y118 HydrophobicContact CB-CD1 4.45Å; Q113-Y118 HydrophobicContact CB-CE1 4.07Å; Q113-Y118 HydrophobicContact CG-CE1 3.9Å; Q115-Y118 PolarHBondContact O-N 2.79Å; Y118-S121 PolarHBondContact O-N 2.73Å; Y118-L159 HydrophobicContact CD1-CD1 4.42Å; Y118-L159 HydrophobicContact CE1-CD1 3.52Å; Y118-S162 VanDerWaalsContact CE2-OG 3.28Å; Y118-S162 WeakPolarHBondContact CE2-OG 3.29Å; Y118-S162 PolarHBondContact OH-OG 3.19Å; Y118-W244 WeakPolarHBondContact OH-CZ2 3.44Å
119	G	91.8	Very high	95.8	Very high	1 Å²	1	52.6 Å²	52.6	1%	0.01	27%	0.266	C	S	.	.	H	α-helix	trans	-77.9	-22.5	-174	0	0	0	0	0	115.3	Q115 S117 R247	Q115-G119 PolarHBondContact O-N 2.05Å; S117-G119 PolarHBondContact O-N 2.64Å; G119-R247 PolarHBondContact O-NH1 3.34Å
120	A	93.9	Very high	95.7	Very high	53 Å²	53	54.5 Å²	54.5	44%	0.438	28%	0.275	S	S	.	.	H	α-helix	trans	-82.6	-17.6	171.1	0	0	0	0	0	112.7	R116 K122	R116-A120 WeakPolarHBondContact O-CB 3.29Å; R116-A120 PolarHBondContact O-N 3.01Å; A120-K122 VanDerWaalsContact C-N 3.35Å; A120-K122 PolarHBondContact O-N 2.99Å
121	S	96.8	Very high	95.6	Very high	2 Å²	2	54.5 Å²	54.5	1%	0.014	27%	0.274	C	S	.	.			trans	-78.7	79.2	-175.6	-171.2	0	0	0	0	112.1	S117 Y118 A140 C141 G157 S158 L159	S117-S121 WeakPolarHBondContact O-CB 3.21Å; S117-S121 PolarHBondContact O-N 2.84Å; S117-S121 VanDerWaalsContact O-N 3.12Å; Y118-S121 PolarHBondContact O-N 2.73Å; S121-A140 VanDerWaalsContact CA-O 3.32Å; S121-A140 WeakPolarHBondContact CA-O 3.33Å; S121-C141 PolarHBondContact OG-O 2.79Å; S121-G157 CarbonylContact O-C 3.56Å; S121-G157 VanDerWaalsContact O-CA 3.28Å; S121-G157 WeakPolarHBondContact O-CA 3.42Å; S121-G157 WeakPolarHBondContact OG-CA 3.25Å; S121-S158 WeakPolarHBondContact CB-OG 3.5Å; S121-S158 PolarHBondContact O-N 3.31Å; S121-S158 PolarHBondContact OG-N 3Å; S121-S158 PolarHBondContact OG-OG 3.35Å; S121-S158 VanDerWaalsContact OG-OG 3.08Å; S121-L159 PolarHBondContact O-N 3.17Å
122	K	95.8	Very high	95.5	Very high	30 Å²	30	58.6 Å²	58.6	13%	0.13	30%	0.298	C	S	.	.	S	Bend	trans	-161.4	160.8	175.1	60	172.4	-172.7	154.7	0	110.3	A120 E124 L127 C141 L159 M245	A120-K122 VanDerWaalsContact C-N 3.35Å; A120-K122 PolarHBondContact O-N 2.99Å; K122-E124 VanDerWaalsContact CE-OE1 3.26Å; K122-E124 WeakPolarHBondContact CE-OE1 3.33Å; K122-E124 IonicContact NZ-OE1 2.7Å; K122-E124 PolarHBondContact NZ-OE1 2.84Å; K122-L127 HydrophobicContact CB-CD1 4.29Å; K122-C141 VanDerWaalsContact CA-SG 3.55Å; K122-L159 HydrophobicContact CD-CD2 4.37Å; K122-M245 HydrophobicContact CB-CE 4.41Å
123	D	97.3	Very high	95.5	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	29%	0.288	C	S	.	.			trans	-114.6	111.1	173.2	-172	-31.5	0	0	0	109.8	Y125 Q126 L127 V138 C141 C156	D123-Y125 PolarHBondContact OD1-N 3.47Å; D123-Q126 HydrophobicContact CB-CB 3.72Å; D123-Q126 PolarHBondContact OD1-N 2.82Å; D123-L127 WeakPolarHBondContact O-CB 3.3Å; D123-L127 VanDerWaalsContact O-CD1 3.28Å; D123-L127 WeakPolarHBondContact O-CD1 3.38Å; D123-L127 WeakPolarHBondContact O-CG 3.45Å; D123-L127 PolarHBondContact O-N 2.99Å; D123-L127 VanDerWaalsContact O-N 3.12Å; D123-V138 HydrophobicContact CB-CG2 3.75Å; D123-V138 PolarHBondContact OD2-N 2.71Å; D123-C141 PolarHBondContact N-SG 2.89Å; D123-C141 VanDerWaalsContact N-SG 3.4Å; D123-C156 WeakPolarHBondContact CB-SG 3.29Å
124	E	96.3	Very high	95.4	Very high	116 Å²	116	57 Å²	57	54%	0.542	29%	0.289	S	S	.	.	H	α-helix	trans	-70.9	-32.1	-176.8	-58.9	-166.6	155.6	0	0	112.5	K122 L127 S128	K122-E124 VanDerWaalsContact CE-OE1 3.26Å; K122-E124 WeakPolarHBondContact CE-OE1 3.33Å; K122-E124 IonicContact NZ-OE1 2.7Å; K122-E124 PolarHBondContact NZ-OE1 2.84Å; E124-L127 PolarHBondContact O-N 3.47Å; E124-S128 WeakPolarHBondContact O-CB 3.32Å; E124-S128 PolarHBondContact O-N 2.94Å
125	Y	96.8	Very high	95.4	Very high	125 Å²	125	61 Å²	61	49%	0.49	30%	0.299	S	S	.	.	H	α-helix	trans	-71.7	-42.1	179	-61	-72.5	0	0	0	110.8	D123 L127 S128 G129 D130 Y133	D123-Y125 PolarHBondContact OD1-N 3.47Å; Y125-L127 VanDerWaalsContact C-N 3.34Å; Y125-L127 PolarHBondContact O-N 2.86Å; Y125-S128 WeakPolarHBondContact CA-OG 3.33Å; Y125-S128 PolarHBondContact O-N 3.36Å; Y125-S128 VanDerWaalsContact O-N 3.14Å; Y125-S128 PolarHBondContact O-OG 3.04Å; Y125-G129 PolarHBondContact O-N 3.37Å; Y125-D130 WeakPolarHBondContact O-CB 3.29Å; Y125-D130 PolarHBondContact O-N 3.2Å; Y125-D130 VanDerWaalsContact O-N 3.15Å; Y125-Y133 VanDerWaalsContact CB-CG 3.46Å; Y125-Y133 HydrophobicContact CD1-CE2 4.19Å; Y125-Y133 HydrophobicContact CD2-CD1 4.04Å; Y125-Y133 AromaticContact CD2-CE1 3.48Å; Y125-Y133 HydrophobicContact CD2-CE1 3.48Å; Y125-Y133 VanDerWaalsContact CD2-CE1 3.48Å; Y125-Y133 HydrophobicContact CD2-CE2 4.04Å; Y125-Y133 AromaticContact CD2-CZ 3.47Å; Y125-Y133 VanDerWaalsContact CD2-CZ 3.47Å; Y125-Y133 HydrophobicContact CE2-CE1 4.23Å; Y125-Y133 HydrophobicContact CG-CD1 4.27Å; Y125-Y133 HydrophobicContact CG-CD2 4.03Å; Y125-Y133 AromaticContact CG-CE1 3.94Å; Y125-Y133 HydrophobicContact CG-CE1 3.94Å; Y125-Y133 AromaticContact CG-CE2 3.67Å; Y125-Y133 HydrophobicContact CG-CE2 3.67Å; Y125-Y133 HydrophobicContact CG-CG 4.3Å; Y125-Y133 AromaticContact CG-CZ 3.61Å
126	Q	96.2	Very high	95.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-57.4	-47.7	171.7	-170.4	-173.6	68.8	0	0	111.3	D123 S128 G129 F134 I153 V154 F236	D123-Q126 HydrophobicContact CB-CB 3.72Å; D123-Q126 PolarHBondContact OD1-N 2.82Å; Q126-S128 PolarHBondContact O-N 3.05Å; Q126-G129 PolarHBondContact O-N 3.29Å; Q126-F134 HydrophobicContact CG-CD1 3.72Å; Q126-F134 HydrophobicContact CG-CE1 3.75Å; Q126-F134 WeakPolarHBondContact O-CE1 3.33Å; Q126-I153 PolarHBondContact NE2-O 3.21Å; Q126-I153 VanDerWaalsContact NE2-O 3.11Å; Q126-V154 HydrophobicContact CG-CG1 4.05Å; Q126-F236 WeakPolarHBondContact O-CE2 3.48Å
127	L	97	Very high	95.3	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-68.2	-19	179.4	-67.2	166.6	0	0	0	113.6	K122 D123 E124 Y125 G129 P155 Y198 R199 F236 F241 M245	K122-L127 HydrophobicContact CB-CD1 4.29Å; D123-L127 WeakPolarHBondContact O-CB 3.3Å; D123-L127 VanDerWaalsContact O-CD1 3.28Å; D123-L127 WeakPolarHBondContact O-CD1 3.38Å; D123-L127 WeakPolarHBondContact O-CG 3.45Å; D123-L127 PolarHBondContact O-N 2.99Å; D123-L127 VanDerWaalsContact O-N 3.12Å; E124-L127 PolarHBondContact O-N 3.47Å; Y125-L127 VanDerWaalsContact C-N 3.34Å; Y125-L127 PolarHBondContact O-N 2.86Å; L127-G129 VanDerWaalsContact C-N 3.31Å; L127-P155 HydrophobicContact CD2-CB 4.02Å; L127-Y198 HydrophobicContact CB-CD1 3.82Å; L127-Y198 HydrophobicContact CB-CE1 3.91Å; L127-Y198 HydrophobicContact CD1-CE1 3.93Å; L127-Y198 HydrophobicContact CD2-CD1 4.26Å; L127-Y198 HydrophobicContact CD2-CE1 4.1Å; L127-Y198 HydrophobicContact CG-CD1 4.45Å; L127-Y198 HydrophobicContact CG-CE1 4.19Å; L127-Y198 WeakPolarHBondContact O-CA 3.4Å; L127-R199 PolarHBondContact O-N 2.86Å; L127-R199 VanDerWaalsContact O-N 3.13Å; L127-F236 HydrophobicContact CD2-CD1 4.38Å; L127-F241 HydrophobicContact CD2-CE1 3.84Å; L127-F241 HydrophobicContact CD2-CZ 3.63Å; L127-M245 HydrophobicContact CD1-CE 3.5Å; L127-M245 HydrophobicContact CD2-CE 4.19Å
128	S	96.2	Very high	95.5	Very high	47 Å²	47	48.4 Å²	48.4	33%	0.329	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	0.5	170.8	78	0	0	0	0	113.9	E124 Y125 Q126 R199	E124-S128 WeakPolarHBondContact O-CB 3.32Å; E124-S128 PolarHBondContact O-N 2.94Å; Y125-S128 WeakPolarHBondContact CA-OG 3.33Å; Y125-S128 PolarHBondContact O-N 3.36Å; Y125-S128 VanDerWaalsContact O-N 3.14Å; Y125-S128 PolarHBondContact O-OG 3.04Å; Q126-S128 PolarHBondContact O-N 3.05Å; S128-R199 CarbonylContact C-O 3.48Å; S128-R199 WeakPolarHBondContact O-CB 3.42Å
129	G	95.2	Very high	95.5	Very high	12 Å²	12	51.6 Å²	51.6	12%	0.124	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	16	175.8	0	0	0	0	0	115.1	Y125 Q126 L127 L131 R199	Y125-G129 PolarHBondContact O-N 3.37Å; Q126-G129 PolarHBondContact O-N 3.29Å; L127-G129 VanDerWaalsContact C-N 3.31Å; G129-L131 PolarHBondContact O-N 3.18Å; G129-R199 WeakPolarHBondContact CA-O 3.47Å; G129-R199 PolarHBondContact N-O 2.92Å
130	D	95.9	Very high	95.6	Very high	59 Å²	59	54.1 Å²	54.1	32%	0.316	30%	0.298	S	S	.	.			trans	-75.9	118.6	176.2	-169.5	-22.7	0	0	0	110.9	Y125 D132 Y133 F134	Y125-D130 WeakPolarHBondContact O-CB 3.29Å; Y125-D130 PolarHBondContact O-N 3.2Å; Y125-D130 VanDerWaalsContact O-N 3.15Å; D130-D132 VanDerWaalsContact C-N 3.31Å; D130-D132 PolarHBondContact O-N 2.91Å; D130-D132 PolarHBondContact OD1-N 3.26Å; D130-Y133 HydrophobicContact CB-CD2 3.97Å; D130-Y133 PolarHBondContact O-N 2.88Å; D130-F134 WeakPolarHBondContact O-CD1 3.45Å
131	L	95.4	Very high	95.7	Very high	63 Å²	63	51.6 Å²	51.6	33%	0.33	28%	0.277	S	S	.	.	S	Bend	trans	-72.8	-19.8	-175.1	-64.5	176.7	0	0	0	113.6	G129 Y133 F134 P201 V203 A209	G129-L131 PolarHBondContact O-N 3.18Å; L131-Y133 VanDerWaalsContact C-N 3.32Å; L131-F134 HydrophobicContact CD2-CD2 4.26Å; L131-F134 HydrophobicContact CD2-CE2 4.35Å; L131-F134 HydrophobicContact CD2-CG 4.46Å; L131-F134 WeakPolarHBondContact O-CB 3.44Å; L131-F134 PolarHBondContact O-N 2.83Å; L131-P201 HydrophobicContact CD2-CB 3.65Å; L131-P201 HydrophobicContact CD2-CG 4.24Å; L131-P201 HydrophobicContact CG-CB 4.24Å; L131-V203 HydrophobicContact CD1-CG2 3.84Å; L131-A209 HydrophobicContact CD2-CB 4.07Å
132	D	95.2	Very high	95.6	Very high	108 Å²	108	54.9 Å²	54.9	58%	0.578	30%	0.3	S	S	*	.	H	α-helix	trans	-69.6	-36.9	177.4	-72	-25	0	0	0	110.6	D130 F134 K135 T136	D130-D132 VanDerWaalsContact C-N 3.31Å; D130-D132 PolarHBondContact O-N 2.91Å; D130-D132 PolarHBondContact OD1-N 3.26Å; D132-F134 VanDerWaalsContact C-N 3.25Å; D132-F134 PolarHBondContact O-N 2.85Å; D132-K135 PolarHBondContact O-N 2.8Å; D132-T136 PolarHBondContact O-N 2.86Å; D132-T136 VanDerWaalsContact O-N 3.16Å
133	Y	95.4	Very high	95.5	Very high	69 Å²	69	57.8 Å²	57.8	27%	0.271	32%	0.322	S	S	.	.	H	α-helix	trans	-77.2	-7.5	175.5	-67.8	-93.1	0	0	0	113.7	Y125 D130 L131 V138	Y125-Y133 VanDerWaalsContact CB-CG 3.46Å; Y125-Y133 HydrophobicContact CD1-CE2 4.19Å; Y125-Y133 HydrophobicContact CD2-CD1 4.04Å; Y125-Y133 AromaticContact CD2-CE1 3.48Å; Y125-Y133 HydrophobicContact CD2-CE1 3.48Å; Y125-Y133 VanDerWaalsContact CD2-CE1 3.48Å; Y125-Y133 HydrophobicContact CD2-CE2 4.04Å; Y125-Y133 AromaticContact CD2-CZ 3.47Å; Y125-Y133 VanDerWaalsContact CD2-CZ 3.47Å; Y125-Y133 HydrophobicContact CE2-CE1 4.23Å; Y125-Y133 HydrophobicContact CG-CD1 4.27Å; Y125-Y133 HydrophobicContact CG-CD2 4.03Å; Y125-Y133 AromaticContact CG-CE1 3.94Å; Y125-Y133 HydrophobicContact CG-CE1 3.94Å; Y125-Y133 AromaticContact CG-CE2 3.67Å; Y125-Y133 HydrophobicContact CG-CE2 3.67Å; Y125-Y133 HydrophobicContact CG-CG 4.3Å; Y125-Y133 AromaticContact CG-CZ 3.61Å; D130-Y133 HydrophobicContact CB-CD2 3.97Å; D130-Y133 PolarHBondContact O-N 2.88Å; L131-Y133 VanDerWaalsContact C-N 3.32Å; Y133-V138 HydrophobicContact CD1-CG1 3.91Å; Y133-V138 HydrophobicContact CE1-CG1 3.77Å
134	F	95.3	Very high	95.4	Very high	4 Å²	4	61.2 Å²	61.2	2%	0.018	34%	0.336	C	S	.	.	H	α-helix	trans	-75.7	-29	168	-79.8	42	0	0	0	111.3	Q126 D130 L131 D132 P152 V154 P201 A209 F210 T213 F236	Q126-F134 HydrophobicContact CG-CD1 3.72Å; Q126-F134 HydrophobicContact CG-CE1 3.75Å; Q126-F134 WeakPolarHBondContact O-CE1 3.33Å; D130-F134 WeakPolarHBondContact O-CD1 3.45Å; L131-F134 HydrophobicContact CD2-CD2 4.26Å; L131-F134 HydrophobicContact CD2-CE2 4.35Å; L131-F134 HydrophobicContact CD2-CG 4.46Å; L131-F134 WeakPolarHBondContact O-CB 3.44Å; L131-F134 PolarHBondContact O-N 2.83Å; D132-F134 VanDerWaalsContact C-N 3.25Å; D132-F134 PolarHBondContact O-N 2.85Å; F134-P152 WeakPolarHBondContact O-CB 3.35Å; F134-P152 WeakPolarHBondContact O-CG 3.32Å; F134-V154 HydrophobicContact CB-CG2 4.29Å; F134-V154 HydrophobicContact CD1-CG1 4.43Å; F134-V154 HydrophobicContact CD2-CG1 3.97Å; F134-V154 HydrophobicContact CD2-CG2 4.1Å; F134-V154 HydrophobicContact CE1-CG1 4.26Å; F134-V154 HydrophobicContact CE2-CG1 3.78Å; F134-V154 HydrophobicContact CG-CG1 4.3Å; F134-V154 HydrophobicContact CG-CG2 4.13Å; F134-V154 HydrophobicContact CZ-CG1 3.94Å; F134-P201 HydrophobicContact CE2-CG 4.47Å; F134-P201 HydrophobicContact CZ-CG 4.23Å; F134-A209 WeakPolarHBondContact CD2-O 3.4Å; F134-F210 AromaticContact CE2-CD1 4Å; F134-F210 HydrophobicContact CE2-CD1 4Å; F134-F210 HydrophobicContact CE2-CD2 4.31Å; F134-F210 AromaticContact CE2-CE1 3.86Å; F134-F210 HydrophobicContact CE2-CE1 3.86Å; F134-F210 HydrophobicContact CE2-CE2 4.15Å; F134-F210 HydrophobicContact CE2-CG 4.22Å; F134-F210 AromaticContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CZ-CE1 4.37Å; F134-F210 HydrophobicContact CZ-CZ 4.22Å; F134-T213 HydrophobicContact CB-CG2 4.28Å; F134-T213 HydrophobicContact CD2-CG2 4.48Å; F134-F236 AromaticContact CE1-CE2 3.88Å; F134-F236 HydrophobicContact CE1-CE2 3.88Å; F134-F236 HydrophobicContact CE1-CZ 4.28Å; F134-F236 AromaticContact CZ-CE2 3.53Å; F134-F236 HydrophobicContact CZ-CE2 3.53Å; F134-F236 AromaticContact CZ-CZ 3.83Å; F134-F236 HydrophobicContact CZ-CZ 3.83Å
135	K	93.8	Very high	95.4	Very high	144 Å²	144	57.1 Å²	57.1	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-86.6	-41.9	178.4	-61.4	171.9	-173	162.6	0	111.2	D132	D132-K135 PolarHBondContact O-N 2.8Å
136	T	95.1	Very high	95.4	Very high	97 Å²	97	54.9 Å²	54.9	60%	0.595	31%	0.308	S	S	*	.	S	Bend	trans	-128.4	83.6	-176	-48	0	0	0	0	110.5	D132	D132-T136 PolarHBondContact O-N 2.86Å; D132-T136 VanDerWaalsContact O-N 3.16Å
137	P	94.3	Very high	95.3	Very high	5 Å²	5	57.7 Å²	57.7	3%	0.032	32%	0.323	C	S	.	.			trans	-67.7	148	179.4	-17.8	31.1	0	0	0	112.6	Q145 P152 C156	P137-Q145 HydrophobicContact CB-CB 4.49Å; P137-Q145 HydrophobicContact CB-CG 4.47Å; P137-Q145 PolarHBondContact O-NE2 3.46Å; P137-P152 HydrophobicContact CG-CB 3.89Å; P137-C156 HydrophobicContact CB-CB 4.28Å
138	V	96	Very high	95.2	Very high	42 Å²	42	61.7 Å²	61.7	26%	0.255	36%	0.357	S	S	.	.			trans	-61.5	149.6	179.6	-61.2	0	0	0	0	113.5	D123 Y133 A140 C141 Q145	D123-V138 HydrophobicContact CB-CG2 3.75Å; D123-V138 PolarHBondContact OD2-N 2.71Å; Y133-V138 HydrophobicContact CD1-CG1 3.91Å; Y133-V138 HydrophobicContact CE1-CG1 3.77Å; V138-A140 HydrophobicContact CG2-CB 4.04Å; V138-A140 PolarHBondContact O-N 3Å; V138-A140 VanDerWaalsContact O-N 3.12Å; V138-C141 WeakPolarHBondContact O-CB 3.35Å; V138-C141 PolarHBondContact O-N 3.19Å; V138-C141 VanDerWaalsContact O-N 3.09Å; V138-Q145 VanDerWaalsContact C-NE2 3.28Å; V138-Q145 VanDerWaalsContact O-CD 3.32Å; V138-Q145 WeakPolarHBondContact O-CG 3.45Å; V138-Q145 PolarHBondContact O-NE2 3.31Å
139	S	95	Very high	95.1	Very high	100 Å²	100	65.4 Å²	65.4	70%	0.699	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-60	-23.4	179.3	58.7	0	0	0	0	114.4	C141 S142	S139-C141 PolarHBondContact O-N 3.08Å; S139-S142 VanDerWaalsContact O-CB 3.29Å; S139-S142 WeakPolarHBondContact O-CB 3.39Å; S139-S142 PolarHBondContact O-N 2.97Å; S139-S142 VanDerWaalsContact O-N 3.09Å
140	A	95.4	Very high	95	Very high	53 Å²	53	71.7 Å²	71.7	44%	0.438	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-60.2	-27.2	175.6	0	0	0	0	0	112.8	S121 V138 S142	S121-A140 VanDerWaalsContact CA-O 3.32Å; S121-A140 WeakPolarHBondContact CA-O 3.33Å; V138-A140 HydrophobicContact CG2-CB 4.04Å; V138-A140 PolarHBondContact O-N 3Å; V138-A140 VanDerWaalsContact O-N 3.12Å; A140-S142 PolarHBondContact O-N 3.38Å
141	C	95.5	Very high	95	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	41%	0.407	C	S	.	.	G	3₁₀ helix	trans	-72.1	-6.5	177.2	-89.9	0	0	0	0	114.3	S121 K122 D123 V138 S139 Y144 Q145 C156 G157	S121-C141 PolarHBondContact OG-O 2.79Å; K122-C141 VanDerWaalsContact CA-SG 3.55Å; D123-C141 PolarHBondContact N-SG 2.89Å; D123-C141 VanDerWaalsContact N-SG 3.4Å; V138-C141 WeakPolarHBondContact O-CB 3.35Å; V138-C141 PolarHBondContact O-N 3.19Å; V138-C141 VanDerWaalsContact O-N 3.09Å; S139-C141 PolarHBondContact O-N 3.08Å; C141-Y144 CarbonylContact O-C 3.6Å; C141-Y144 WeakPolarHBondContact O-CA 3.45Å; C141-Y144 PolarHBondContact O-N 3.24Å; C141-Q145 HydrophobicContact CB-CG 3.45Å; C141-Q145 VanDerWaalsContact CB-CG 3.45Å; C141-C156 HydrophobicContact CB-CB 3.62Å; C141-C156 WeakPolarHBondContact CB-SG 3.49Å; C141-C156 WeakPolarHBondContact SG-CB 3.48Å; C141-C156 PolarHBondContact SG-O 2.92Å; C141-C156 CovalentContact SG-SG 2.05Å; C141-C156 PolarHBondContact SG-SG 3.37Å; C141-G157 PolarHBondContact SG-N 2.95Å
142	S	93.6	Very high	95.1	Very high	71 Å²	71	71.9 Å²	71.9	50%	0.497	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	137.7	-178.9	-176.3	0	0	0	0	111.8	S139 A140	S139-S142 VanDerWaalsContact O-CB 3.29Å; S139-S142 WeakPolarHBondContact O-CB 3.39Å; S139-S142 PolarHBondContact O-N 2.97Å; S139-S142 VanDerWaalsContact O-N 3.09Å; A140-S142 PolarHBondContact O-N 3.38Å
143	P	94.2	Very high	95.2	Very high	92 Å²	92	67 Å²	67	60%	0.597	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	cis	-86.3	-1.4	2.7	35.1	-36.5	0	0	0	114.8	Q145	P143-Q145 PolarHBondContact O-N 2.91Å; P143-Q145 VanDerWaalsContact O-N 3.13Å
144	Y	96.5	Very high	95.3	Very high	72 Å²	72	63.8 Å²	63.8	28%	0.282	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	36.1	-172.3	-55	-76.1	0	0	0	113.6	C141 C156 G157 S158 N161	C141-Y144 CarbonylContact O-C 3.6Å; C141-Y144 WeakPolarHBondContact O-CA 3.45Å; C141-Y144 PolarHBondContact O-N 3.24Å; Y144-C156 WeakPolarHBondContact O-CA 3.29Å; Y144-C156 VanDerWaalsContact O-CB 3.23Å; Y144-C156 WeakPolarHBondContact O-CB 3.31Å; Y144-G157 PolarHBondContact O-N 3Å; Y144-S158 VanDerWaalsContact CD2-OG 3.3Å; Y144-S158 WeakPolarHBondContact CD2-OG 3.19Å; Y144-S158 WeakPolarHBondContact CE2-OG 3.37Å; Y144-N161 HydrophobicContact CD1-CB 4.42Å; Y144-N161 WeakPolarHBondContact CE1-ND2 3.47Å
145	Q	96.4	Very high	95.4	Very high	30 Å²	30	63.6 Å²	63.6	14%	0.14	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-39.7	174.2	-70.2	172	-88.6	0	0	111.7	P137 V138 C141 P143 P152 I153	P137-Q145 HydrophobicContact CB-CB 4.49Å; P137-Q145 HydrophobicContact CB-CG 4.47Å; P137-Q145 PolarHBondContact O-NE2 3.46Å; V138-Q145 VanDerWaalsContact C-NE2 3.28Å; V138-Q145 VanDerWaalsContact O-CD 3.32Å; V138-Q145 WeakPolarHBondContact O-CG 3.45Å; V138-Q145 PolarHBondContact O-NE2 3.31Å; C141-Q145 HydrophobicContact CB-CG 3.45Å; C141-Q145 VanDerWaalsContact CB-CG 3.45Å; P143-Q145 PolarHBondContact O-N 2.91Å; P143-Q145 VanDerWaalsContact O-N 3.13Å; Q145-P152 WeakPolarHBondContact O-CA 3.37Å; Q145-I153 PolarHBondContact O-N 3.13Å
146	Y	96.2	Very high	95.6	Very high	78 Å²	78	56.9 Å²	56.9	31%	0.306	33%	0.328	S	S	.	.	B	Isolated β-bridge	trans	-134.2	148.2	-173.9	-57.8	-84.2	0	0	0	110	K151 P152 I153	Y146-K151 CarbonylContact C-O 3.55Å; Y146-K151 VanDerWaalsContact CA-O 3.26Å; Y146-K151 WeakPolarHBondContact CA-O 3.09Å; Y146-P152 HydrophobicContact CD1-CB 4.17Å; Y146-P152 HydrophobicContact CE1-CB 4.04Å; Y146-I153 VanDerWaalsContact C-CD1 3.48Å; Y146-I153 WeakPolarHBondContact O-CD1 3.37Å
147	D	94.8	Very high	95.7	Very high	59 Å²	59	52.3 Å²	52.3	32%	0.316	30%	0.3	S	S	.	.			trans	-79.4	174	169.5	-178.7	31.7	0	0	0	111	N149 Q150 K151 I153 V214	D147-N149 PolarHBondContact O-N 2.89Å; D147-Q150 PolarHBondContact O-N 3.19Å; D147-K151 PolarHBondContact N-O 3.39Å; D147-I153 HydrophobicContact CB-CG1 4.37Å; D147-V214 HydrophobicContact CB-CG2 3.79Å
148	A	93.2	Very high	95.8	Very high	90 Å²	90	53 Å²	53	74%	0.744	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-28.5	178.9	0	0	0	0	0	113.7	Q150	A148-Q150 VanDerWaalsContact C-N 3.32Å; A148-Q150 PolarHBondContact O-N 2.83Å
149	N	93.8	Very high	95.8	Very high	125 Å²	125	51.1 Å²	51.1	67%	0.668	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	16.2	177.9	-60.7	-59.9	0	0	0	113.9	D147 K151	D147-N149 PolarHBondContact O-N 2.89Å; N149-K151 PolarHBondContact O-N 2.98Å; N149-K151 VanDerWaalsContact O-N 3.17Å
150	Q	93.5	Very high	95.9	Very high	145 Å²	145	46.3 Å²	46.3	68%	0.678	26%	0.26	S	S	*	.	S	Bend	trans	58.4	25.1	-177.1	-61.9	-65.3	-24.9	0	0	114.6	D147 A148	D147-Q150 PolarHBondContact O-N 3.19Å; A148-Q150 VanDerWaalsContact C-N 3.32Å; A148-Q150 PolarHBondContact O-N 2.83Å
151	K	95.9	Very high	96	Very high	109 Å²	109	44 Å²	44	47%	0.474	24%	0.241	S	C	.	.	P	Polyproline II helix	trans	-88.7	135.6	172.2	-69.9	-171	177.8	-177.4	0	110.4	Y146 D147 N149 I153 V214	Y146-K151 CarbonylContact C-O 3.55Å; Y146-K151 VanDerWaalsContact CA-O 3.26Å; Y146-K151 WeakPolarHBondContact CA-O 3.09Å; D147-K151 PolarHBondContact N-O 3.39Å; N149-K151 PolarHBondContact O-N 2.98Å; N149-K151 VanDerWaalsContact O-N 3.17Å; K151-I153 PolarHBondContact O-N 3.11Å; K151-V214 HydrophobicContact CB-CG1 3.84Å; K151-V214 HydrophobicContact CB-CG2 4.11Å; K151-V214 HydrophobicContact CD-CG1 3.84Å; K151-V214 HydrophobicContact CG-CG1 4.5Å
152	P	97.2	Very high	96	Very high	17 Å²	17	45 Å²	45	11%	0.11	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-66.6	134.1	-178.7	27.4	-34.4	0	0	0	111.3	F134 P137 Q145 Y146 T213 V214	F134-P152 WeakPolarHBondContact O-CB 3.35Å; F134-P152 WeakPolarHBondContact O-CG 3.32Å; P137-P152 HydrophobicContact CG-CB 3.89Å; Q145-P152 WeakPolarHBondContact O-CA 3.37Å; Y146-P152 HydrophobicContact CD1-CB 4.17Å; Y146-P152 HydrophobicContact CE1-CB 4.04Å; P152-T213 HydrophobicContact CG-CG2 4.19Å; P152-T213 WeakPolarHBondContact O-CA 3.29Å; P152-T213 WeakPolarHBondContact O-CB 3.31Å; P152-V214 WeakPolarHBondContact O-CG2 3.45Å; P152-V214 PolarHBondContact O-N 3.18Å
153	I	97.9	Very high	96.2	Very high	4 Å²	4	42.8 Å²	42.8	2%	0.021	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-85.7	132.7	177.9	-64.5	167.8	0	0	0	109.2	Q126 Q145 Y146 D147 K151 C156 V214 P216	Q126-I153 PolarHBondContact NE2-O 3.21Å; Q126-I153 VanDerWaalsContact NE2-O 3.11Å; Q145-I153 PolarHBondContact O-N 3.13Å; Y146-I153 VanDerWaalsContact C-CD1 3.48Å; Y146-I153 WeakPolarHBondContact O-CD1 3.37Å; D147-I153 HydrophobicContact CB-CG1 4.37Å; K151-I153 PolarHBondContact O-N 3.11Å; I153-C156 WeakPolarHBondContact O-CB 3.24Å; I153-C156 PolarHBondContact O-N 2.92Å; I153-V214 CarbonylContact C-O 3.53Å; I153-V214 WeakPolarHBondContact CA-O 3.2Å; I153-V214 HydrophobicContact CB-CG2 4.47Å; I153-V214 HydrophobicContact CG1-CG2 3.77Å; I153-P216 HydrophobicContact CG2-CB 4.22Å; I153-P216 HydrophobicContact CG2-CG 4.07Å
154	V	97.3	Very high	96.3	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.012	20%	0.204	C	C	.	.	S	Bend	trans	-134.6	117.6	177.7	-172.1	0	0	0	0	110.1	Q126 F134 F210 T213 V214 F236	Q126-V154 HydrophobicContact CG-CG1 4.05Å; F134-V154 HydrophobicContact CB-CG2 4.29Å; F134-V154 HydrophobicContact CD1-CG1 4.43Å; F134-V154 HydrophobicContact CD2-CG1 3.97Å; F134-V154 HydrophobicContact CD2-CG2 4.1Å; F134-V154 HydrophobicContact CE1-CG1 4.26Å; F134-V154 HydrophobicContact CE2-CG1 3.78Å; F134-V154 HydrophobicContact CG-CG1 4.3Å; F134-V154 HydrophobicContact CG-CG2 4.13Å; F134-V154 HydrophobicContact CZ-CG1 3.94Å; V154-F210 HydrophobicContact CB-CD1 4.03Å; V154-F210 HydrophobicContact CB-CE1 4.11Å; V154-F210 HydrophobicContact CG1-CD1 3.78Å; V154-F210 HydrophobicContact CG1-CE1 3.42Å; V154-F210 VanDerWaalsContact CG1-CE1 3.42Å; V154-F210 HydrophobicContact CG1-CZ 4.43Å; V154-T213 HydrophobicContact CG2-CG2 3.7Å; V154-V214 PolarHBondContact N-O 3.31Å; V154-F236 HydrophobicContact CG1-CE1 4.26Å; V154-F236 HydrophobicContact CG1-CZ 3.57Å
155	P	97.8	Very high	96.3	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.006	20%	0.204	C	C	.	.	S	Bend	cis	-75	139	-5.1	30	-34.4	0	0	0	113	L127 A160 P216 W219 F236 F241	L127-P155 HydrophobicContact CD2-CB 4.02Å; P155-A160 HydrophobicContact CB-CB 3.92Å; P155-A160 HydrophobicContact CG-CB 3.71Å; P155-P216 HydrophobicContact CG-CG 4.17Å; P155-P216 WeakPolarHBondContact O-CG 3.39Å; P155-W219 HydrophobicContact CG-CH2 3.53Å; P155-W219 HydrophobicContact CG-CZ2 3.81Å; P155-W219 HydrophobicContact CG-CZ3 4.17Å; P155-F236 HydrophobicContact CB-CE1 3.96Å; P155-F236 HydrophobicContact CG-CE1 4.23Å; P155-F241 HydrophobicContact CB-CZ 4.34Å; P155-F241 HydrophobicContact CG-CE2 4.08Å; P155-F241 HydrophobicContact CG-CZ 4.08Å
156	C	97.4	Very high	96.3	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.014	20%	0.198	C	C	.	.			trans	-79.4	162.1	178.4	72.1	0	0	0	0	112.8	D123 P137 C141 Y144 I153	D123-C156 WeakPolarHBondContact CB-SG 3.29Å; P137-C156 HydrophobicContact CB-CB 4.28Å; C141-C156 HydrophobicContact CB-CB 3.62Å; C141-C156 WeakPolarHBondContact CB-SG 3.49Å; C141-C156 WeakPolarHBondContact SG-CB 3.48Å; C141-C156 PolarHBondContact SG-O 2.92Å; C141-C156 CovalentContact SG-SG 2.05Å; C141-C156 PolarHBondContact SG-SG 3.37Å; Y144-C156 WeakPolarHBondContact O-CA 3.29Å; Y144-C156 VanDerWaalsContact O-CB 3.23Å; Y144-C156 WeakPolarHBondContact O-CB 3.31Å; I153-C156 WeakPolarHBondContact O-CB 3.24Å; I153-C156 PolarHBondContact O-N 2.92Å
157	G	97.3	Very high	96.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.01	20%	0.203	C	C	.	.	S	Bend	trans	100.2	158.3	168.8	0	0	0	0	0	115.3	S121 C141 Y144 L159 A160 N161	S121-G157 CarbonylContact O-C 3.56Å; S121-G157 VanDerWaalsContact O-CA 3.28Å; S121-G157 WeakPolarHBondContact O-CA 3.42Å; S121-G157 WeakPolarHBondContact OG-CA 3.25Å; C141-G157 PolarHBondContact SG-N 2.95Å; Y144-G157 PolarHBondContact O-N 3Å; G157-L159 VanDerWaalsContact C-N 3.28Å; G157-L159 PolarHBondContact O-N 2.61Å; G157-A160 PolarHBondContact O-N 2.86Å; G157-N161 VanDerWaalsContact O-CB 3.31Å; G157-N161 WeakPolarHBondContact O-CB 3.46Å; G157-N161 PolarHBondContact O-N 2.92Å
158	S	96.4	Very high	96.4	Very high	21 Å²	21	34 Å²	34	15%	0.147	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-37.2	-174.3	-52.2	0	0	0	0	112.1	S121 Y144 S162	S121-S158 WeakPolarHBondContact CB-OG 3.5Å; S121-S158 PolarHBondContact O-N 3.31Å; S121-S158 PolarHBondContact OG-N 3Å; S121-S158 PolarHBondContact OG-OG 3.35Å; S121-S158 VanDerWaalsContact OG-OG 3.08Å; Y144-S158 VanDerWaalsContact CD2-OG 3.3Å; Y144-S158 WeakPolarHBondContact CD2-OG 3.19Å; Y144-S158 WeakPolarHBondContact CE2-OG 3.37Å; S158-S162 WeakPolarHBondContact O-CB 3.02Å; S158-S162 PolarHBondContact O-N 3.02Å; S158-S162 PolarHBondContact O-OG 3.4Å
159	L	96.4	Very high	96.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-51.1	-178.5	-178.7	62.4	0	0	0	110.8	Y118 S121 K122 G157 S162 W244 M245 R247	Y118-L159 HydrophobicContact CD1-CD1 4.42Å; Y118-L159 HydrophobicContact CE1-CD1 3.52Å; S121-L159 PolarHBondContact O-N 3.17Å; K122-L159 HydrophobicContact CD-CD2 4.37Å; G157-L159 VanDerWaalsContact C-N 3.28Å; G157-L159 PolarHBondContact O-N 2.61Å; L159-S162 PolarHBondContact O-OG 3.13Å; L159-W244 PolarHBondContact O-NE1 3.18Å; L159-M245 HydrophobicContact CD2-CE 3.87Å; L159-M245 HydrophobicContact CD2-SD 4Å; L159-M245 HydrophobicContact CG-CE 4.22Å; L159-M245 HydrophobicContact CG-SD 3.8Å; L159-R247 HydrophobicContact CD1-CG 4.15Å; L159-R247 HydrophobicContact CD2-CG 4Å
160	A	97.1	Very high	96.8	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-70.5	-42.9	179.9	0	0	0	0	0	111.8	P155 G157 S162 M163 W219 F241 M245	P155-A160 HydrophobicContact CB-CB 3.92Å; P155-A160 HydrophobicContact CG-CB 3.71Å; G157-A160 PolarHBondContact O-N 2.86Å; A160-S162 PolarHBondContact O-N 3.31Å; A160-M163 WeakPolarHBondContact O-CB 3.42Å; A160-M163 PolarHBondContact O-N 2.95Å; A160-M163 VanDerWaalsContact O-N 3.14Å; A160-W219 HydrophobicContact CB-CZ2 4.5Å; A160-W219 PolarHBondContact O-NE1 2.69Å; A160-F241 HydrophobicContact CB-CE2 4.12Å; A160-M245 HydrophobicContact CB-CE 4.38Å; A160-M245 HydrophobicContact CB-SD 3.94Å
161	N	97.2	Very high	97	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.027	12%	0.122	C	C	.	.	H	α-helix	trans	-57.7	-36	-178.4	-174.7	44.1	0	0	0	112.9	Y144 G157 M163 P216 S217 F218	Y144-N161 HydrophobicContact CD1-CB 4.42Å; Y144-N161 WeakPolarHBondContact CE1-ND2 3.47Å; G157-N161 VanDerWaalsContact O-CB 3.31Å; G157-N161 WeakPolarHBondContact O-CB 3.46Å; G157-N161 PolarHBondContact O-N 2.92Å; N161-M163 VanDerWaalsContact C-N 3.29Å; N161-M163 PolarHBondContact O-N 3.42Å; N161-P216 HydrophobicContact CB-CB 4.12Å; N161-P216 VanDerWaalsContact OD1-CB 3.32Å; N161-P216 WeakPolarHBondContact OD1-CB 3.28Å; N161-S217 PolarHBondContact OD1-N 3.39Å; N161-F218 WeakPolarHBondContact ND2-CD2 3.43Å; N161-F218 WeakPolarHBondContact O-CB 3.44Å; N161-F218 PolarHBondContact OD1-N 2.87Å; N161-F218 VanDerWaalsContact OD1-N 3.07Å
162	S	96.6	Very high	97	Very high	19 Å²	19	20 Å²	20	13%	0.133	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	21.2	-178.6	56.6	0	0	0	0	114.7	Y111 Y118 S158 L159 A160 F164 W244 Y282	Y111-S162 VanDerWaalsContact OH-CB 3.28Å; Y111-S162 WeakPolarHBondContact OH-CB 3.08Å; Y111-S162 PolarHBondContact OH-OG 3.47Å; Y111-S162 VanDerWaalsContact OH-OG 3.12Å; Y118-S162 VanDerWaalsContact CE2-OG 3.28Å; Y118-S162 WeakPolarHBondContact CE2-OG 3.29Å; Y118-S162 PolarHBondContact OH-OG 3.19Å; S158-S162 WeakPolarHBondContact O-CB 3.02Å; S158-S162 PolarHBondContact O-N 3.02Å; S158-S162 PolarHBondContact O-OG 3.4Å; L159-S162 PolarHBondContact O-OG 3.13Å; A160-S162 PolarHBondContact O-N 3.31Å; S162-F164 PolarHBondContact O-N 3.05Å; S162-W244 WeakPolarHBondContact O-CZ2 3.26Å; S162-Y282 WeakPolarHBondContact O-CE2 3.43Å; S162-Y282 PolarHBondContact O-OH 2.99Å
163	M	97.3	Very high	96.9	Very high	26 Å²	26	21.6 Å²	21.6	13%	0.128	11%	0.11	C	C	.	.			trans	-51.5	132.4	179.4	-175.6	177.4	174.5	0	0	112.9	A160 N161 W219 D240 F241 W244 Y282	A160-M163 WeakPolarHBondContact O-CB 3.42Å; A160-M163 PolarHBondContact O-N 2.95Å; A160-M163 VanDerWaalsContact O-N 3.14Å; N161-M163 VanDerWaalsContact C-N 3.29Å; N161-M163 PolarHBondContact O-N 3.42Å; M163-W219 HydrophobicContact CB-CZ2 4.22Å; M163-W219 HydrophobicContact SD-CH2 4.31Å; M163-W219 HydrophobicContact SD-CZ2 3.88Å; M163-D240 HydrophobicContact CE-CB 4.04Å; M163-F241 HydrophobicContact CE-CB 3.95Å; M163-F241 HydrophobicContact SD-CB 4.22Å; M163-F241 HydrophobicContact SD-CD2 3.78Å; M163-W244 HydrophobicContact CB-CG 4.34Å; M163-W244 HydrophobicContact CG-CB 4.28Å; M163-W244 HydrophobicContact CG-CG 4.04Å; M163-Y282 WeakPolarHBondContact O-CE2 3.28Å
164	F	97.3	Very high	96.7	Very high	14 Å²	14	24.4 Å²	24.4	6%	0.061	13%	0.128	C	C	.	.			trans	-61.7	132.3	175.5	-174.9	-95.4	0	0	0	111.5	Y66 Y106 L108 S162 D166 F168 W244 Y282 K291	Y66-F164 WeakPolarHBondContact OH-CZ 3.49Å; Y106-F164 AromaticContact CD1-CD1 4Å; Y106-F164 HydrophobicContact CD1-CD1 4Å; Y106-F164 AromaticContact CD1-CE1 3.94Å; Y106-F164 HydrophobicContact CD1-CE1 3.94Å; Y106-F164 AromaticContact CD2-CD1 3.99Å; Y106-F164 HydrophobicContact CD2-CD1 3.99Å; Y106-F164 HydrophobicContact CD2-CD2 4.12Å; Y106-F164 HydrophobicContact CD2-CE1 4.05Å; Y106-F164 HydrophobicContact CD2-CE2 4.17Å; Y106-F164 HydrophobicContact CD2-CG 4.01Å; Y106-F164 HydrophobicContact CD2-CZ 4.11Å; Y106-F164 AromaticContact CE1-CD1 3.92Å; Y106-F164 HydrophobicContact CE1-CD1 3.92Å; Y106-F164 HydrophobicContact CE1-CE1 4.33Å; Y106-F164 HydrophobicContact CE2-CB 3.98Å; Y106-F164 AromaticContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD1 3.88Å; Y106-F164 HydrophobicContact CE2-CD2 4.13Å; Y106-F164 HydrophobicContact CE2-CE1 4.41Å; Y106-F164 AromaticContact CE2-CG 3.71Å; Y106-F164 HydrophobicContact CE2-CG 3.71Å; Y106-F164 HydrophobicContact CG-CD1 4.05Å; Y106-F164 AromaticContact CG-CE1 3.8Å; Y106-F164 HydrophobicContact CG-CE1 3.8Å; Y106-F164 HydrophobicContact CG-CZ 4.05Å; Y106-F164 AromaticContact CZ-CD1 3.85Å; Y106-F164 AromaticContact CZ-CG 4Å; L108-F164 HydrophobicContact CD1-CD2 4.28Å; L108-F164 HydrophobicContact CD2-CD2 4.36Å; L108-F164 HydrophobicContact CD2-CE2 4.17Å; S162-F164 PolarHBondContact O-N 3.05Å; F164-D166 HydrophobicContact CE1-CB 3.68Å; F164-D166 HydrophobicContact CE2-CB 4.27Å; F164-D166 HydrophobicContact CZ-CB 3.45Å; F164-D166 VanDerWaalsContact CZ-CB 3.45Å; F164-F168 AromaticContact CE1-CE2 3.84Å; F164-F168 HydrophobicContact CE1-CE2 3.84Å; F164-F168 HydrophobicContact CE1-CZ 4.12Å; F164-F168 HydrophobicContact CZ-CE2 4.21Å; F164-F168 HydrophobicContact CZ-CZ 4.02Å; F164-W244 HydrophobicContact CB-CD2 4.49Å; F164-W244 HydrophobicContact CB-CE3 3.76Å; F164-W244 HydrophobicContact CB-CH2 4.44Å; F164-W244 HydrophobicContact CB-CZ3 3.74Å; F164-Y282 AromaticContact CD2-CD1 3.85Å; F164-Y282 HydrophobicContact CD2-CD1 3.85Å; F164-Y282 HydrophobicContact CD2-CD2 4.23Å; F164-Y282 HydrophobicContact CD2-CE1 4.27Å; F164-Y282 AromaticContact CD2-CG 3.81Å; F164-Y282 HydrophobicContact CD2-CG 3.81Å; F164-Y282 HydrophobicContact CE2-CD1 4.18Å; F164-Y282 HydrophobicContact CE2-CG 4.18Å; F164-K291 HydrophobicContact CE2-CD 4.39Å
165	N	95.6	Very high	96.3	Very high	52 Å²	52	32.1 Å²	32.1	28%	0.278	17%	0.169	S	C	.	.			trans	-136.9	14	-169.5	69.6	-5.7	0	0	0	114.8	N281 Y282	N165-N281 PolarHBondContact O-ND2 3.42Å; N165-N281 VanDerWaalsContact OD1-C 3.3Å; N165-N281 VanDerWaalsContact OD1-CB 3.31Å; N165-N281 WeakPolarHBondContact OD1-CB 3.27Å; N165-N281 PolarHBondContact OD1-O 2.82Å; N165-Y282 WeakPolarHBondContact OD1-CB 3.33Å; N165-Y282 WeakPolarHBondContact OD1-CD2 3.19Å; N165-Y282 PolarHBondContact OD1-N 3.2Å
166	D	96.2	Very high	95.9	Very high	3 Å²	3	35.4 Å²	35.4	2%	0.016	20%	0.203	C	C	.	.			trans	-70.6	149.4	166	-62.8	-20.5	0	0	0	109.6	Y66 F164 F168 A279 N281 Y282 K291	Y66-D166 WeakPolarHBondContact CE2-OD2 3.47Å; Y66-D166 PolarHBondContact OH-OD2 3.2Å; Y66-D166 VanDerWaalsContact OH-OD2 3.13Å; F164-D166 HydrophobicContact CE1-CB 3.68Å; F164-D166 HydrophobicContact CE2-CB 4.27Å; F164-D166 HydrophobicContact CZ-CB 3.45Å; F164-D166 VanDerWaalsContact CZ-CB 3.45Å; D166-F168 HydrophobicContact CB-CE2 4.43Å; D166-F168 HydrophobicContact CB-CZ 4.12Å; D166-A279 VanDerWaalsContact CA-O 3.3Å; D166-A279 WeakPolarHBondContact CA-O 3.28Å; D166-A279 WeakPolarHBondContact CB-O 3.33Å; D166-N281 WeakPolarHBondContact OD1-CA 3.37Å; D166-N281 PolarHBondContact OD1-N 3.11Å; D166-Y282 WeakPolarHBondContact OD1-CB 3.21Å; D166-Y282 PolarHBondContact OD1-N 3.25Å; D166-K291 IonicContact OD1-NZ 2.61Å; D166-K291 WeakPolarHBondContact OD2-CD 3.22Å; D166-K291 WeakPolarHBondContact OD2-CE 3.17Å; D166-K291 IonicContact OD2-NZ 3.58Å; D166-K291 PolarHBondContact OD2-NZ 2.85Å
167	T	96.2	Very high	95.7	Very high	67 Å²	67	40 Å²	40	41%	0.411	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	147.5	177.1	66.8	0	0	0	0	110.7	I278 A279	T167-I278 WeakPolarHBondContact O-CA 3.29Å; T167-A279 PolarHBondContact N-O 2.94Å; T167-A279 PolarHBondContact O-N 3.27Å; T167-A279 WeakPolarHBondContact OG1-CB 3.48Å
168	F	97.6	Very high	95.6	Very high	9 Å²	9	44 Å²	44	4%	0.039	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	137.8	-171.4	-56.9	-77.7	0	0	0	111.2	Y66 F104 F164 D166 F183 Y257 L276 E277 I278 V293	Y66-F168 HydrophobicContact CE1-CE1 4.37Å; Y66-F168 HydrophobicContact CE1-CZ 4.49Å; Y66-F168 HydrophobicContact CE2-CE1 4.41Å; F104-F168 HydrophobicContact CE1-CB 3.65Å; F104-F168 HydrophobicContact CE1-CD1 4.37Å; F104-F168 AromaticContact CE1-CD2 3.71Å; F104-F168 HydrophobicContact CE1-CD2 3.71Å; F104-F168 HydrophobicContact CE1-CE2 4.45Å; F104-F168 AromaticContact CE1-CG 3.66Å; F104-F168 HydrophobicContact CE1-CG 3.66Å; F104-F168 HydrophobicContact CZ-CB 3.9Å; F104-F168 AromaticContact CZ-CD1 3.88Å; F104-F168 HydrophobicContact CZ-CD1 3.88Å; F104-F168 AromaticContact CZ-CD2 3.95Å; F104-F168 HydrophobicContact CZ-CD2 3.95Å; F104-F168 HydrophobicContact CZ-CE1 4.4Å; F104-F168 HydrophobicContact CZ-CE2 4.45Å; F104-F168 AromaticContact CZ-CG 3.64Å; F104-F168 HydrophobicContact CZ-CG 3.64Å; F164-F168 AromaticContact CE1-CE2 3.84Å; F164-F168 HydrophobicContact CE1-CE2 3.84Å; F164-F168 HydrophobicContact CE1-CZ 4.12Å; F164-F168 HydrophobicContact CZ-CE2 4.21Å; F164-F168 HydrophobicContact CZ-CZ 4.02Å; D166-F168 HydrophobicContact CB-CE2 4.43Å; D166-F168 HydrophobicContact CB-CZ 4.12Å; F168-F183 HydrophobicContact CB-CE2 4.06Å; F168-Y257 HydrophobicContact CB-CD1 4.46Å; F168-Y257 HydrophobicContact CB-CE1 3.96Å; F168-Y257 AromaticContact CD2-CD1 3.75Å; F168-Y257 HydrophobicContact CD2-CD1 3.75Å; F168-Y257 HydrophobicContact CD2-CD2 4.2Å; F168-Y257 AromaticContact CD2-CE1 3.58Å; F168-Y257 HydrophobicContact CD2-CE1 3.58Å; F168-Y257 HydrophobicContact CD2-CE2 4Å; F168-Y257 HydrophobicContact CD2-CG 4.08Å; F168-Y257 AromaticContact CD2-CZ 3.7Å; F168-Y257 HydrophobicContact CE2-CD2 4.37Å; F168-Y257 HydrophobicContact CE2-CE2 4.37Å; F168-Y257 HydrophobicContact CE2-CG 4.45Å; F168-Y257 HydrophobicContact CG-CE1 4.26Å; F168-L276 HydrophobicContact CB-CD1 4.18Å; F168-L276 HydrophobicContact CD1-CD1 4.5Å; F168-L276 HydrophobicContact CD1-CD2 4.2Å; F168-E277 WeakPolarHBondContact CA-O 3.32Å; F168-I278 HydrophobicContact CD1-CB 4.43Å; F168-I278 HydrophobicContact CD1-CD1 4.41Å; F168-I278 HydrophobicContact CD1-CG1 3.99Å; F168-I278 HydrophobicContact CD1-CG2 4.02Å; F168-I278 HydrophobicContact CE1-CD1 4.24Å; F168-I278 HydrophobicContact CE1-CG1 4.22Å; F168-I278 HydrophobicContact CE1-CG2 3.75Å; F168-V293 HydrophobicContact CD1-CG1 4.17Å; F168-V293 HydrophobicContact CE1-CG1 3.58Å; F168-V293 HydrophobicContact CZ-CG1 4.08Å
169	K	97.5	Very high	95.5	Very high	117 Å²	117	46.9 Å²	46.9	51%	0.509	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	121.5	168.1	-63.6	-178.9	-177.5	176.7	0	109.3	Y171 E277	K169-Y171 HydrophobicContact CB-CE2 3.66Å; K169-E277 HydrophobicContact CB-CB 4.43Å; K169-E277 PolarHBondContact N-O 3.48Å; K169-E277 PolarHBondContact O-N 3.47Å
170	L	97.4	Very high	95.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	133.3	-179.6	179.7	66.7	0	0	0	110.5	F92 V181 F183 I260 Y274 L276 F295	F92-L170 HydrophobicContact CE1-CD1 4.25Å; F92-L170 HydrophobicContact CZ-CD1 3.89Å; L170-V181 HydrophobicContact CB-CB 4.15Å; L170-V181 HydrophobicContact CB-CG2 4.36Å; L170-V181 HydrophobicContact CD2-CB 3.97Å; L170-V181 HydrophobicContact CD2-CG1 4.07Å; L170-V181 HydrophobicContact CD2-CG2 3.89Å; L170-V181 HydrophobicContact CG-CB 4.02Å; L170-V181 HydrophobicContact CG-CG2 3.77Å; L170-V181 PolarHBondContact O-N 3.46Å; L170-F183 HydrophobicContact CB-CE1 3.75Å; L170-F183 HydrophobicContact CB-CE2 4.4Å; L170-F183 HydrophobicContact CB-CZ 3.51Å; L170-F183 HydrophobicContact CD2-CE1 4.03Å; L170-F183 HydrophobicContact CD2-CZ 4.37Å; L170-I260 HydrophobicContact CD2-CD1 4.08Å; L170-Y274 HydrophobicContact CD1-CD1 4.05Å; L170-Y274 HydrophobicContact CD2-CD1 4.47Å; L170-Y274 HydrophobicContact CG-CD1 4.27Å; L170-L276 HydrophobicContact CB-CD1 4.06Å; L170-L276 HydrophobicContact CD1-CB 4.36Å; L170-L276 HydrophobicContact CD1-CD1 4.17Å; L170-F295 HydrophobicContact CD1-CZ 4.27Å; L170-F295 HydrophobicContact CD2-CE1 3.82Å; L170-F295 HydrophobicContact CD2-CZ 4.14Å
171	Y	97.3	Very high	95.5	Very high	39 Å²	39	51.7 Å²	51.7	15%	0.153	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	133.8	177.5	-60.6	-87.7	0	0	0	110.4	K169 K178 K179 L180 Y274 S275 E277	K169-Y171 HydrophobicContact CB-CE2 3.66Å; Y171-K178 HydrophobicContact CD1-CB 4.05Å; Y171-K178 HydrophobicContact CG-CB 4.35Å; Y171-K178 HydrophobicContact CG-CD 4.39Å; Y171-K179 CarbonylContact C-O 3.56Å; Y171-K179 VanDerWaalsContact CA-O 3.24Å; Y171-K179 WeakPolarHBondContact CA-O 3.43Å; Y171-L180 HydrophobicContact CD1-CB 4.2Å; Y171-L180 HydrophobicContact CD1-CD1 4.05Å; Y171-L180 HydrophobicContact CE1-CB 4.06Å; Y171-L180 HydrophobicContact CE1-CD1 3.56Å; Y171-L180 HydrophobicContact CE1-CG 4.41Å; Y171-L180 HydrophobicContact CE2-CD1 4.49Å; Y171-Y274 CarbonylContact O-C 3.46Å; Y171-Y274 VanDerWaalsContact O-CA 3.26Å; Y171-Y274 WeakPolarHBondContact O-CA 3.29Å; Y171-S275 PolarHBondContact N-O 3.24Å; Y171-S275 PolarHBondContact O-N 3.42Å; Y171-E277 HydrophobicContact CD2-CG 4Å; Y171-E277 HydrophobicContact CE2-CB 4.27Å; Y171-E277 HydrophobicContact CE2-CG 3.75Å
172	Q	96.3	Very high	95.4	Very high	20 Å²	20	53.6 Å²	53.6	9%	0.093	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.8	164.3	-170.9	-175.7	27.6	0	0	108.9	V174 K179 V181 Y265 Y274	Q172-V174 HydrophobicContact CG-CG2 3.9Å; Q172-K179 PolarHBondContact N-O 3.03Å; Q172-K179 PolarHBondContact O-N 3.42Å; Q172-V181 HydrophobicContact CB-CG2 4.4Å; Q172-Y265 HydrophobicContact CB-CE1 4.44Å; Q172-Y265 WeakPolarHBondContact CB-OH 3.46Å; Q172-Y265 PolarHBondContact OE1-OH 3.45Å; Q172-Y265 VanDerWaalsContact OE1-OH 3.12Å; Q172-Y274 HydrophobicContact CB-CD1 4.06Å; Q172-Y274 HydrophobicContact CB-CE1 3.64Å; Q172-Y274 HydrophobicContact CG-CD1 4.38Å; Q172-Y274 HydrophobicContact CG-CE1 3.78Å; Q172-Y274 HydrophobicContact CG-CE2 4.43Å; Q172-Y274 PolarHBondContact NE2-OH 3.47Å
173	I	95.9	Very high	95.3	Very high	50 Å²	50	54.9 Å²	54.9	26%	0.256	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	108.6	177.8	-54.6	174.1	0	0	0	108.1	T177 N273	I173-T177 WeakPolarHBondContact CA-O 3.45Å; I173-N273 HydrophobicContact CB-CB 4.18Å; I173-N273 WeakPolarHBondContact CB-O 3.48Å; I173-N273 HydrophobicContact CD1-CB 4.22Å; I173-N273 PolarHBondContact N-O 3.12Å
174	V	92.9	Very high	95	Very high	64 Å²	64	54.5 Å²	54.5	39%	0.388	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.8	179.5	-175.1	0	0	0	0	108.3	Q172 G176 T177	Q172-V174 HydrophobicContact CG-CG2 3.9Å; V174-G176 PolarHBondContact O-N 3.32Å; V174-T177 PolarHBondContact N-O 2.91Å; V174-T177 WeakPolarHBondContact O-CB 3.43Å; V174-T177 PolarHBondContact O-N 2.86Å
175	N	89.9	Confident	94.7	Very high	164 Å²	164	54.6 Å²	54.6	88%	0.877	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	41.5	-178.3	-60.4	-20.8	0	0	0	113.4	T177	N175-T177 PolarHBondContact O-N 3.42Å
176	G	88	Confident	94.4	Very high	70 Å²	70	58.6 Å²	58.6	72%	0.722	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	-4.5	-177.5	0	0	0	0	0	115.3	V174	V174-G176 PolarHBondContact O-N 3.32Å
177	T	93.6	Very high	94.1	Very high	98 Å²	98	60.9 Å²	60.9	60%	0.601	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	135.4	177.7	-53.4	0	0	0	0	111	I173 V174 N175	I173-T177 WeakPolarHBondContact CA-O 3.45Å; V174-T177 PolarHBondContact N-O 2.91Å; V174-T177 WeakPolarHBondContact O-CB 3.43Å; V174-T177 PolarHBondContact O-N 2.86Å; N175-T177 PolarHBondContact O-N 3.42Å
178	K	94.9	Very high	94.1	Very high	85 Å²	85	58.3 Å²	58.3	37%	0.37	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.8	175.3	-70.1	-172.5	173.5	-159.2	0	110.9	Y171 E277	Y171-K178 HydrophobicContact CD1-CB 4.05Å; Y171-K178 HydrophobicContact CG-CB 4.35Å; Y171-K178 HydrophobicContact CG-CD 4.39Å; K178-E277 IonicContact NZ-OE1 2.86Å; K178-E277 PolarHBondContact NZ-OE1 3.4Å
179	K	95.2	Very high	94.1	Very high	81 Å²	81	58.6 Å²	58.6	35%	0.352	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	124.2	171.3	-176.3	180	-178.6	-179.7	0	109.9	Y171 Q172 D264	Y171-K179 CarbonylContact C-O 3.56Å; Y171-K179 VanDerWaalsContact CA-O 3.24Å; Y171-K179 WeakPolarHBondContact CA-O 3.43Å; Q172-K179 PolarHBondContact N-O 3.03Å; Q172-K179 PolarHBondContact O-N 3.42Å; K179-D264 WeakPolarHBondContact CE-OD2 3.24Å; K179-D264 IonicContact NZ-OD2 3.41Å; K179-D264 PolarHBondContact NZ-OD2 2.82Å
180	L	96.1	Very high	94.1	Very high	100 Å²	100	60.8 Å²	60.8	52%	0.524	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	133.4	178.4	-176.3	69.3	0	0	0	110.6	Y171	Y171-L180 HydrophobicContact CD1-CB 4.2Å; Y171-L180 HydrophobicContact CD1-CD1 4.05Å; Y171-L180 HydrophobicContact CE1-CB 4.06Å; Y171-L180 HydrophobicContact CE1-CD1 3.56Å; Y171-L180 HydrophobicContact CE1-CG 4.41Å; Y171-L180 HydrophobicContact CE2-CD1 4.49Å
181	V	96.1	Very high	94.1	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.018	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-88.2	120.3	169.9	-175.6	0	0	0	0	108	L170 Q172 F183 I260 Y265 L269 Y274	L170-V181 HydrophobicContact CB-CB 4.15Å; L170-V181 HydrophobicContact CB-CG2 4.36Å; L170-V181 HydrophobicContact CD2-CB 3.97Å; L170-V181 HydrophobicContact CD2-CG1 4.07Å; L170-V181 HydrophobicContact CD2-CG2 3.89Å; L170-V181 HydrophobicContact CG-CB 4.02Å; L170-V181 HydrophobicContact CG-CG2 3.77Å; L170-V181 PolarHBondContact O-N 3.46Å; Q172-V181 HydrophobicContact CB-CG2 4.4Å; V181-F183 PolarHBondContact O-N 2.83Å; V181-I260 HydrophobicContact CG1-CD1 4.35Å; V181-I260 HydrophobicContact CG1-CG2 3.68Å; V181-Y265 HydrophobicContact CB-CE2 4.21Å; V181-Y265 HydrophobicContact CG1-CD1 4.37Å; V181-Y265 HydrophobicContact CG1-CD2 3.92Å; V181-Y265 HydrophobicContact CG1-CE1 4.47Å; V181-Y265 HydrophobicContact CG1-CE2 4.02Å; V181-Y265 HydrophobicContact CG1-CG 4.08Å; V181-Y265 HydrophobicContact CG2-CE1 4.02Å; V181-Y265 HydrophobicContact CG2-CE2 4.14Å; V181-L269 HydrophobicContact CG1-CD2 4.13Å; V181-Y274 HydrophobicContact CG2-CD1 4.5Å; V181-Y274 HydrophobicContact CG2-CE1 4.17Å
182	P	94.9	Very high	94.1	Very high	44 Å²	44	70.3 Å²	70.3	29%	0.286	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-67	130.8	179	28.5	-32.8	0	0	0	110	E262 Y265	P182-E262 HydrophobicContact CG-CB 4.33Å; P182-Y265 HydrophobicContact CG-CD2 4.2Å
183	F	94.3	Very high	94.1	Very high	46 Å²	46	69.7 Å²	69.7	20%	0.202	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-103.7	119.9	175.8	-83.5	-6.4	0	0	0	109.6	F104 F168 L170 V181 Y257 R258 I260	F104-F183 HydrophobicContact CD1-CE1 4.35Å; F104-F183 AromaticContact CD1-CE2 3.94Å; F104-F183 HydrophobicContact CD1-CE2 3.94Å; F104-F183 AromaticContact CD1-CZ 3.7Å; F104-F183 HydrophobicContact CD1-CZ 3.7Å; F104-F183 AromaticContact CE1-CE2 3.92Å; F104-F183 HydrophobicContact CE1-CE2 3.92Å; F104-F183 AromaticContact CE1-CZ 3.92Å; F104-F183 HydrophobicContact CE1-CZ 3.92Å; F104-F183 HydrophobicContact CG-CZ 4.31Å; F168-F183 HydrophobicContact CB-CE2 4.06Å; L170-F183 HydrophobicContact CB-CE1 3.75Å; L170-F183 HydrophobicContact CB-CE2 4.4Å; L170-F183 HydrophobicContact CB-CZ 3.51Å; L170-F183 HydrophobicContact CD2-CE1 4.03Å; L170-F183 HydrophobicContact CD2-CZ 4.37Å; V181-F183 PolarHBondContact O-N 2.83Å; F183-Y257 HydrophobicContact CD2-CE1 4.31Å; F183-Y257 HydrophobicContact CE2-CE1 4.36Å; F183-R258 HydrophobicContact CB-CB 3.83Å; F183-R258 HydrophobicContact CB-CG 3.67Å; F183-R258 HydrophobicContact CD1-CB 4.18Å; F183-R258 HydrophobicContact CD2-CB 4.18Å; F183-R258 HydrophobicContact CD2-CG 3.79Å; F183-R258 HydrophobicContact CG-CB 3.82Å; F183-R258 HydrophobicContact CG-CG 3.81Å; F183-I260 HydrophobicContact CD1-CD1 4.35Å; F183-I260 HydrophobicContact CD1-CG1 4.01Å; F183-I260 HydrophobicContact CE1-CD1 3.87Å; F183-I260 HydrophobicContact CE1-CG1 4.04Å
184	D	92.9	Very high	94.1	Very high	19 Å²	19	70.3 Å²	70.3	10%	0.102	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-87.9	117	171.9	178.7	20	0	0	0	109.7	K186 R258 R259	D184-K186 VanDerWaalsContact OD1-CB 3.29Å; D184-K186 WeakPolarHBondContact OD1-CB 3.37Å; D184-K186 PolarHBondContact OD1-N 2.99Å; D184-R258 WeakPolarHBondContact O-CA 3.49Å; D184-R258 WeakPolarHBondContact O-CD 3.32Å; D184-R259 HydrophobicContact CB-CB 4.24Å; D184-R259 PolarHBondContact N-O 2.7Å; D184-R259 PolarHBondContact O-N 2.63Å; D184-R259 IonicContact OD2-CZ 3.18Å; D184-R259 IonicContact OD2-NH1 3.74Å; D184-R259 PolarHBondContact OD2-NH1 2.95Å
185	G	90.4	Very high	94.3	Very high	16 Å²	16	70.4 Å²	70.4	17%	0.165	37%	0.374	C	S	.	.			trans	-95.2	-0.5	175	0	0	0	0	0	114	R258	G185-R258 VanDerWaalsContact CA-CD 3.48Å
186	K	88.9	Confident	94.6	Very high	135 Å²	135	67.1 Å²	67.1	59%	0.587	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	141.2	-178.6	-61.2	179.1	178	179.1	0	110.6	D184 I188 R259	D184-K186 VanDerWaalsContact OD1-CB 3.29Å; D184-K186 WeakPolarHBondContact OD1-CB 3.37Å; D184-K186 PolarHBondContact OD1-N 2.99Å; K186-I188 VanDerWaalsContact C-N 3.3Å; K186-I188 PolarHBondContact O-N 2.92Å; K186-R259 PolarHBondContact O-NH1 2.93Å
187	G	90.6	Very high	95	Very high	52 Å²	52	68.6 Å²	68.6	54%	0.536	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	29.3	176.3	0	0	0	0	0	114.4
188	I	96.3	Very high	95.1	Very high	13 Å²	13	64.1 Å²	64.1	7%	0.067	31%	0.314	C	S	.	.			trans	-86.9	-26	174.1	61.5	174.6	0	0	0	112.2	K186 Q239 V243 L256 Y257 R259	K186-I188 VanDerWaalsContact C-N 3.3Å; K186-I188 PolarHBondContact O-N 2.92Å; I188-Q239 HydrophobicContact CD1-CB 3.82Å; I188-Q239 HydrophobicContact CG1-CB 3.6Å; I188-Q239 HydrophobicContact CG1-CG 4.41Å; I188-Q239 VanDerWaalsContact N-OE1 3.14Å; I188-V243 HydrophobicContact CB-CG2 4.37Å; I188-V243 HydrophobicContact CD1-CG2 4.18Å; I188-V243 HydrophobicContact CG1-CG2 3.98Å; I188-L256 HydrophobicContact CB-CD2 3.73Å; I188-L256 HydrophobicContact CB-CG 3.98Å; I188-L256 HydrophobicContact CG2-CD2 3.83Å; I188-L256 HydrophobicContact CG2-CG 3.99Å; I188-Y257 VanDerWaalsContact CD1-O 3.25Å; I188-Y257 WeakPolarHBondContact CD1-O 3.25Å; I188-R259 HydrophobicContact CG2-CG 4.27Å
189	A	97	Very high	95.2	Very high	14 Å²	14	66.8 Å²	66.8	12%	0.116	32%	0.321	C	S	.	.	S	Bend	trans	-88.1	158.8	173.3	0	0	0	0	0	111.4	Q239 L242 V243	A189-Q239 VanDerWaalsContact CB-OE1 3.24Å; A189-L242 HydrophobicContact CB-CB 3.66Å; A189-L242 HydrophobicContact CB-CD1 3.89Å; A189-L242 HydrophobicContact CB-CG 4.44Å; A189-V243 HydrophobicContact CB-CG2 4.29Å
190	W	97	Very high	95.3	Very high	163 Å²	163	65 Å²	65	62%	0.617	32%	0.316	S	S	*	.			trans	-66.6	142	175.9	-74.2	82.3	0	0	0	111.1	T192 D193 Y194 R246	W190-T192 PolarHBondContact O-N 2.89Å; W190-D193 HydrophobicContact CB-CB 4.35Å; W190-D193 PolarHBondContact O-N 2.74Å; W190-Y194 PolarHBondContact O-N 3.28Å; W190-R246 VanDerWaalsContact CD1-NE 3.3Å; W190-R246 VanDerWaalsContact CD1-NH1 3.33Å; W190-R246 VanDerWaalsContact CG-CZ 3.47Å
191	W	97.1	Very high	95.2	Very high	171 Å²	171	60.7 Å²	60.7	65%	0.648	29%	0.294	S	S	*	.	H	α-helix	trans	-55.7	-38.6	-179.9	-175.7	94.1	0	0	0	112.7	Y194 N195 I196	W191-Y194 PolarHBondContact O-N 2.91Å; W191-N195 HydrophobicContact CD2-CB 4.31Å; W191-N195 VanDerWaalsContact CE2-ND2 3.27Å; W191-N195 VanDerWaalsContact CG-ND2 3.33Å; W191-N195 HydrophobicContact CH2-CB 4.29Å; W191-N195 HydrophobicContact CZ2-CB 4.03Å; W191-N195 PolarHBondContact NE1-ND2 2.83Å; W191-N195 WeakPolarHBondContact O-CB 3.3Å; W191-N195 PolarHBondContact O-N 3.09Å; W191-N195 PolarHBondContact O-ND2 2.9Å; W191-I196 HydrophobicContact CH2-CD1 4.28Å; W191-I196 HydrophobicContact CH2-CG1 4.48Å; W191-I196 HydrophobicContact CZ3-CD1 3.65Å; W191-I196 HydrophobicContact CZ3-CG1 4.08Å
192	T	97.3	Very high	95	Very high	69 Å²	69	66.6 Å²	66.6	42%	0.423	34%	0.335	S	S	.	.	H	α-helix	trans	-70.5	-34	177.5	51.4	0	0	0	0	113.1	W190 I196 K197	W190-T192 PolarHBondContact O-N 2.89Å; T192-I196 HydrophobicContact CG2-CD1 4.4Å; T192-I196 WeakPolarHBondContact O-CB 3.23Å; T192-I196 PolarHBondContact O-N 3.13Å; T192-I196 VanDerWaalsContact O-N 3.11Å; T192-K197 PolarHBondContact O-N 2.86Å
193	D	96.9	Very high	94.9	Very high	6 Å²	6	66.9 Å²	66.9	3%	0.032	34%	0.336	C	S	.	.	I	π-helix	trans	-66	-45.9	174.3	-72.5	-21	0	0	0	109.6	W190 Y198 R246	W190-D193 HydrophobicContact CB-CB 4.35Å; W190-D193 PolarHBondContact O-N 2.74Å; D193-Y198 HydrophobicContact CB-CD2 4.16Å; D193-Y198 HydrophobicContact CB-CE2 4.22Å; D193-Y198 WeakPolarHBondContact O-CD2 3.47Å; D193-Y198 PolarHBondContact O-N 2.86Å; D193-R246 VanDerWaalsContact CG-NH2 3.28Å; D193-R246 IonicContact OD1-NH2 2.79Å; D193-R246 PolarHBondContact OD1-NH2 2.98Å; D193-R246 IonicContact OD2-CZ 2.64Å; D193-R246 VanDerWaalsContact OD2-CZ 3.25Å; D193-R246 IonicContact OD2-NE 2.95Å; D193-R246 PolarHBondContact OD2-NE 2.98Å; D193-R246 IonicContact OD2-NH2 3.36Å; D193-R246 PolarHBondContact OD2-NH2 2.86Å
194	Y	96.7	Very high	94.7	Very high	63 Å²	63	70.7 Å²	70.7	25%	0.247	36%	0.363	C	S	.	.	I	π-helix	trans	-72.8	-41.3	-177.1	-177	-98	0	0	0	114.3	W190 W191 S232 V237 L242	W190-Y194 PolarHBondContact O-N 3.28Å; W191-Y194 PolarHBondContact O-N 2.91Å; Y194-S232 PolarHBondContact OH-O 2.74Å; Y194-V237 HydrophobicContact CD2-CB 4.18Å; Y194-V237 WeakPolarHBondContact CD2-O 3.2Å; Y194-V237 HydrophobicContact CE2-CB 4Å; Y194-V237 HydrophobicContact CE2-CG2 4.45Å; Y194-V237 WeakPolarHBondContact CE2-O 3.46Å; Y194-L242 HydrophobicContact CD2-CD1 3.89Å; Y194-L242 HydrophobicContact CG-CD1 4.41Å
195	N	95.7	Very high	94.6	Very high	67 Å²	67	74 Å²	74	36%	0.358	39%	0.386	S	S	.	.	I	π-helix	trans	-99.3	-23.1	-171.5	-63	-78.2	0	0	0	114.6	W191	W191-N195 HydrophobicContact CD2-CB 4.31Å; W191-N195 VanDerWaalsContact CE2-ND2 3.27Å; W191-N195 VanDerWaalsContact CG-ND2 3.33Å; W191-N195 HydrophobicContact CH2-CB 4.29Å; W191-N195 HydrophobicContact CZ2-CB 4.03Å; W191-N195 PolarHBondContact NE1-ND2 2.83Å; W191-N195 WeakPolarHBondContact O-CB 3.3Å; W191-N195 PolarHBondContact O-N 3.09Å; W191-N195 PolarHBondContact O-ND2 2.9Å
196	I	95.8	Very high	94.7	Very high	95 Å²	95	74.8 Å²	74.8	49%	0.487	39%	0.386	S	S	.	.	I	π-helix	trans	-115.5	-58.6	-171.8	-57.9	-178.1	0	0	0	110.8	W191 T192 R199	W191-I196 HydrophobicContact CH2-CD1 4.28Å; W191-I196 HydrophobicContact CH2-CG1 4.48Å; W191-I196 HydrophobicContact CZ3-CD1 3.65Å; W191-I196 HydrophobicContact CZ3-CG1 4.08Å; T192-I196 HydrophobicContact CG2-CD1 4.4Å; T192-I196 WeakPolarHBondContact O-CB 3.23Å; T192-I196 PolarHBondContact O-N 3.13Å; T192-I196 VanDerWaalsContact O-N 3.11Å; I196-R199 PolarHBondContact O-NE 3.09Å
197	K	96.7	Very high	95	Very high	100 Å²	100	74 Å²	74	44%	0.435	38%	0.382	S	S	.	.	I	π-helix	trans	-77.3	-43.3	-163.2	-177.1	176.1	174.7	178	0	114.1	T192	T192-K197 PolarHBondContact O-N 2.86Å
198	Y	97.2	Very high	95.2	Very high	5 Å²	5	76 Å²	76	2%	0.02	38%	0.381	C	S	.	.			trans	-107	139.7	-179.6	-64.6	-97.3	0	0	0	109.7	L127 D193 F241 L242 M245	L127-Y198 HydrophobicContact CB-CD1 3.82Å; L127-Y198 HydrophobicContact CB-CE1 3.91Å; L127-Y198 HydrophobicContact CD1-CE1 3.93Å; L127-Y198 HydrophobicContact CD2-CD1 4.26Å; L127-Y198 HydrophobicContact CD2-CE1 4.1Å; L127-Y198 HydrophobicContact CG-CD1 4.45Å; L127-Y198 HydrophobicContact CG-CE1 4.19Å; L127-Y198 WeakPolarHBondContact O-CA 3.4Å; D193-Y198 HydrophobicContact CB-CD2 4.16Å; D193-Y198 HydrophobicContact CB-CE2 4.22Å; D193-Y198 WeakPolarHBondContact O-CD2 3.47Å; D193-Y198 PolarHBondContact O-N 2.86Å; Y198-F241 HydrophobicContact CD1-CE1 4.4Å; Y198-F241 HydrophobicContact CE1-CE1 4.4Å; Y198-L242 HydrophobicContact CD1-CD2 3.85Å; Y198-L242 HydrophobicContact CD2-CD2 3.26Å; Y198-L242 HydrophobicContact CE1-CD2 4.32Å; Y198-L242 HydrophobicContact CE2-CD2 3.78Å; Y198-L242 HydrophobicContact CG-CD2 3.3Å; Y198-M245 HydrophobicContact CE1-CB 4.33Å; Y198-M245 HydrophobicContact CE1-CG 4.43Å; Y198-M245 VanDerWaalsContact OH-CB 3.29Å; Y198-M245 WeakPolarHBondContact OH-CB 3.47Å
199	R	96.6	Very high	95.1	Very high	140 Å²	140	76 Å²	76	53%	0.528	38%	0.383	S	S	.	.			trans	-147.7	146.2	179.9	-61.5	-178.8	178.6	-175.1	-5	110.8	L127 S128 G129 I196 F236	L127-R199 PolarHBondContact O-N 2.86Å; L127-R199 VanDerWaalsContact O-N 3.13Å; S128-R199 CarbonylContact C-O 3.48Å; S128-R199 WeakPolarHBondContact O-CB 3.42Å; G129-R199 WeakPolarHBondContact CA-O 3.47Å; G129-R199 PolarHBondContact N-O 2.92Å; I196-R199 PolarHBondContact O-NE 3.09Å; R199-F236 WeakPolarHBondContact O-CD2 3.31Å
200	N	96.1	Very high	95	Very high	44 Å²	44	75.8 Å²	75.8	24%	0.235	38%	0.379	C	S	.	.			trans	-78.1	148.5	166.6	-74.5	-27.6	0	0	0	110.1	L206 N234 G235 F236	N200-L206 HydrophobicContact CB-CD1 3.98Å; N200-N234 PolarHBondContact ND2-O 2.68Å; N200-G235 WeakPolarHBondContact OD1-CA 3.36Å; N200-F236 PolarHBondContact OD1-N 3.37Å
201	P	94.9	Very high	94.8	Very high	10 Å²	10	75 Å²	75	7%	0.065	39%	0.387	C	S	.	.			trans	-61.6	151.1	170.6	25.6	-33.5	0	0	0	111.1	L131 F134 V203 L206 A209	L131-P201 HydrophobicContact CD2-CB 3.65Å; L131-P201 HydrophobicContact CD2-CG 4.24Å; L131-P201 HydrophobicContact CG-CB 4.24Å; F134-P201 HydrophobicContact CE2-CG 4.47Å; F134-P201 HydrophobicContact CZ-CG 4.23Å; P201-V203 PolarHBondContact O-N 3.13Å; P201-L206 HydrophobicContact CG-CD1 3.9Å; P201-A209 HydrophobicContact CB-CB 4.03Å; P201-A209 HydrophobicContact CG-CB 3.34Å
202	S	91.5	Very high	94.7	Very high	126 Å²	126	69.1 Å²	69.1	88%	0.881	38%	0.379	S	S	*	.	S	Bend	trans	-70.5	3.4	-176.6	-51.4	0	0	0	0	115.2
203	V	92.4	Very high	94.6	Very high	51 Å²	51	67 Å²	67	31%	0.309	37%	0.367	S	S	.	.			trans	-83.2	130.2	-175.5	-177.7	0	0	0	0	110.5	L131 P201 P205 N208 A209	L131-V203 HydrophobicContact CD1-CG2 3.84Å; P201-V203 PolarHBondContact O-N 3.13Å; V203-P205 CarbonylContact O-C 3.53Å; V203-N208 HydrophobicContact CG1-CB 3.86Å; V203-A209 HydrophobicContact CB-CB 4.06Å; V203-A209 HydrophobicContact CG2-CB 4.41Å
204	T	89.8	Confident	94.6	Very high	126 Å²	126	68.3 Å²	68.3	77%	0.773	38%	0.375	S	S	*	.	S	Bend	trans	-120.2	135.4	177.3	51.9	0	0	0	0	111.1
205	P	91.8	Very high	94.6	Very high	88 Å²	88	69.3 Å²	69.3	57%	0.571	38%	0.38	S	S	*	.	S	Bend	cis	-60.1	149.3	-12.3	-22.5	34	0	0	0	113.5	V203 K207 N208	V203-P205 CarbonylContact O-C 3.53Å; P205-K207 PolarHBondContact O-N 3.42Å; P205-N208 WeakPolarHBondContact O-CB 3.23Å; P205-N208 PolarHBondContact O-N 3Å
206	L	93	Very high	94.7	Very high	32 Å²	32	66.2 Å²	66.2	17%	0.168	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-52.2	-36.5	-176.2	-179.2	61.7	0	0	0	113	N200 P201 N208 A209 F210	N200-L206 HydrophobicContact CB-CD1 3.98Å; P201-L206 HydrophobicContact CG-CD1 3.9Å; L206-N208 PolarHBondContact O-N 3.03Å; L206-N208 VanDerWaalsContact O-N 3.15Å; L206-A209 VanDerWaalsContact O-CB 3.27Å; L206-A209 WeakPolarHBondContact O-CB 3.42Å; L206-A209 PolarHBondContact O-N 3.49Å; L206-F210 HydrophobicContact CD1-CE2 3.94Å; L206-F210 HydrophobicContact CG-CE2 4.03Å; L206-F210 WeakPolarHBondContact O-CD2 3.46Å
207	K	94.3	Very high	94.6	Very high	118 Å²	118	64.9 Å²	64.9	51%	0.513	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-52.1	-35.1	176.5	-178.9	169.3	-176.8	168.9	0	113.4	P205 A209 F210 Y224	P205-K207 PolarHBondContact O-N 3.42Å; K207-A209 PolarHBondContact O-N 2.89Å; K207-F210 PolarHBondContact O-N 3.13Å; K207-F210 VanDerWaalsContact O-N 3.13Å; K207-Y224 HydrophobicContact CB-CD2 3.89Å; K207-Y224 HydrophobicContact CB-CE2 4.09Å; K207-Y224 HydrophobicContact CB-CG 4.35Å; K207-Y224 HydrophobicContact CD-CD2 4.39Å; K207-Y224 HydrophobicContact CD-CE2 3.88Å; K207-Y224 HydrophobicContact CG-CD2 3.99Å; K207-Y224 HydrophobicContact CG-CE2 3.64Å
208	N	94.6	Very high	94.5	Very high	96 Å²	96	66.8 Å²	66.8	51%	0.513	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-66.8	-27.9	-178.6	-69.3	-7.2	0	0	0	112.4	V203 P205 L206 F210 N211	V203-N208 HydrophobicContact CG1-CB 3.86Å; P205-N208 WeakPolarHBondContact O-CB 3.23Å; P205-N208 PolarHBondContact O-N 3Å; L206-N208 PolarHBondContact O-N 3.03Å; L206-N208 VanDerWaalsContact O-N 3.15Å; N208-F210 PolarHBondContact O-N 3.25Å; N208-N211 WeakPolarHBondContact O-CB 3.34Å; N208-N211 PolarHBondContact O-N 2.7Å
209	A	94	Very high	94.5	Very high	12 Å²	12	67.4 Å²	67.4	10%	0.099	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-63.9	-25.3	175.5	0	0	0	0	0	112.9	L131 F134 P201 V203 L206 K207	L131-A209 HydrophobicContact CD2-CB 4.07Å; F134-A209 WeakPolarHBondContact CD2-O 3.4Å; P201-A209 HydrophobicContact CB-CB 4.03Å; P201-A209 HydrophobicContact CG-CB 3.34Å; V203-A209 HydrophobicContact CB-CB 4.06Å; V203-A209 HydrophobicContact CG2-CB 4.41Å; L206-A209 VanDerWaalsContact O-CB 3.27Å; L206-A209 WeakPolarHBondContact O-CB 3.42Å; L206-A209 PolarHBondContact O-N 3.49Å; K207-A209 PolarHBondContact O-N 2.89Å
210	F	95	Very high	94.3	Very high	10 Å²	10	65.5 Å²	65.5	4%	0.044	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-98	14.8	-177.5	-64.8	-104.4	0	0	0	112.1	F134 V154 L206 K207 N208 G212 T213 A223 Y224 F236	F134-F210 AromaticContact CE2-CD1 4Å; F134-F210 HydrophobicContact CE2-CD1 4Å; F134-F210 HydrophobicContact CE2-CD2 4.31Å; F134-F210 AromaticContact CE2-CE1 3.86Å; F134-F210 HydrophobicContact CE2-CE1 3.86Å; F134-F210 HydrophobicContact CE2-CE2 4.15Å; F134-F210 HydrophobicContact CE2-CG 4.22Å; F134-F210 AromaticContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CE2-CZ 3.92Å; F134-F210 HydrophobicContact CZ-CE1 4.37Å; F134-F210 HydrophobicContact CZ-CZ 4.22Å; V154-F210 HydrophobicContact CB-CD1 4.03Å; V154-F210 HydrophobicContact CB-CE1 4.11Å; V154-F210 HydrophobicContact CG1-CD1 3.78Å; V154-F210 HydrophobicContact CG1-CE1 3.42Å; V154-F210 VanDerWaalsContact CG1-CE1 3.42Å; V154-F210 HydrophobicContact CG1-CZ 4.43Å; L206-F210 HydrophobicContact CD1-CE2 3.94Å; L206-F210 HydrophobicContact CG-CE2 4.03Å; L206-F210 WeakPolarHBondContact O-CD2 3.46Å; K207-F210 PolarHBondContact O-N 3.13Å; K207-F210 VanDerWaalsContact O-N 3.13Å; N208-F210 PolarHBondContact O-N 3.25Å; F210-G212 PolarHBondContact O-N 3.35Å; F210-T213 PolarHBondContact O-N 2.75Å; F210-T213 PolarHBondContact O-OG1 3.44Å; F210-A223 HydrophobicContact CE1-CB 3.96Å; F210-A223 HydrophobicContact CZ-CB 4.07Å; F210-Y224 HydrophobicContact CB-CD1 3.74Å; F210-Y224 HydrophobicContact CB-CE1 3.56Å; F210-Y224 AromaticContact CD1-CD1 3.95Å; F210-Y224 HydrophobicContact CD1-CD1 3.95Å; F210-Y224 HydrophobicContact CD1-CE1 4.28Å; F210-Y224 AromaticContact CD2-CD1 3.48Å; F210-Y224 HydrophobicContact CD2-CD1 3.48Å; F210-Y224 VanDerWaalsContact CD2-CD1 3.48Å; F210-Y224 HydrophobicContact CD2-CE1 4.23Å; F210-Y224 HydrophobicContact CD2-CG 4.26Å; F210-Y224 HydrophobicContact CE1-CD1 4.4Å; F210-Y224 HydrophobicContact CE2-CD1 4.03Å; F210-Y224 AromaticContact CG-CD1 3.46Å; F210-Y224 HydrophobicContact CG-CD1 3.46Å; F210-Y224 VanDerWaalsContact CG-CD1 3.46Å; F210-Y224 AromaticContact CG-CE1 3.8Å; F210-Y224 HydrophobicContact CG-CE1 3.8Å; F210-Y224 HydrophobicContact CZ-CD1 4.46Å; F210-F236 HydrophobicContact CE1-CE1 4.28Å; F210-F236 HydrophobicContact CE1-CZ 4.01Å; F210-F236 HydrophobicContact CZ-CE1 4.25Å; F210-F236 HydrophobicContact CZ-CE2 4.45Å; F210-F236 AromaticContact CZ-CZ 3.97Å; F210-F236 HydrophobicContact CZ-CZ 3.97Å
211	N	94.3	Very high	94.2	Very high	146 Å²	146	68.8 Å²	68.8	78%	0.781	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	133.2	176.4	-167.7	13.6	0	0	0	110.5	N208 T213	N208-N211 WeakPolarHBondContact O-CB 3.34Å; N208-N211 PolarHBondContact O-N 2.7Å; N211-T213 VanDerWaalsContact C-N 3.26Å; N211-T213 PolarHBondContact O-N 3.01Å
212	G	93.1	Very high	94.3	Very high	47 Å²	47	69.1 Å²	69.1	49%	0.485	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	0.2	-175.2	0	0	0	0	0	115	F210	F210-G212 PolarHBondContact O-N 3.35Å
213	T	95.9	Very high	94.5	Very high	26 Å²	26	63.1 Å²	63.1	16%	0.16	35%	0.354	C	S	.	.			trans	-109.1	169	176.7	78.4	0	0	0	0	111.6	F134 P152 V154 F210 N211	F134-T213 HydrophobicContact CB-CG2 4.28Å; F134-T213 HydrophobicContact CD2-CG2 4.48Å; P152-T213 HydrophobicContact CG-CG2 4.19Å; P152-T213 WeakPolarHBondContact O-CA 3.29Å; P152-T213 WeakPolarHBondContact O-CB 3.31Å; V154-T213 HydrophobicContact CG2-CG2 3.7Å; F210-T213 PolarHBondContact O-N 2.75Å; F210-T213 PolarHBondContact O-OG1 3.44Å; N211-T213 VanDerWaalsContact C-N 3.26Å; N211-T213 PolarHBondContact O-N 3.01Å
214	V	97	Very high	94.6	Very high	33 Å²	33	63 Å²	63	20%	0.2	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-128.1	150.5	179.3	-65.7	0	0	0	0	111.1	D147 K151 P152 I153 V154	D147-V214 HydrophobicContact CB-CG2 3.79Å; K151-V214 HydrophobicContact CB-CG1 3.84Å; K151-V214 HydrophobicContact CB-CG2 4.11Å; K151-V214 HydrophobicContact CD-CG1 3.84Å; K151-V214 HydrophobicContact CG-CG1 4.5Å; P152-V214 WeakPolarHBondContact O-CG2 3.45Å; P152-V214 PolarHBondContact O-N 3.18Å; I153-V214 CarbonylContact C-O 3.53Å; I153-V214 WeakPolarHBondContact CA-O 3.2Å; I153-V214 HydrophobicContact CB-CG2 4.47Å; I153-V214 HydrophobicContact CG1-CG2 3.77Å; V154-V214 PolarHBondContact N-O 3.31Å
215	K	96.8	Very high	94.9	Very high	84 Å²	84	60.3 Å²	60.3	37%	0.365	33%	0.328	S	S	.	.			trans	-69	159.2	174.5	66.7	174.5	178.5	65	0	110.9	W219 P222	K215-W219 HydrophobicContact CD-CB 4.42Å; K215-W219 WeakPolarHBondContact CE-O 3.43Å; K215-W219 PolarHBondContact NZ-O 3.42Å; K215-P222 HydrophobicContact CB-CB 4.12Å
216	P	97.3	Very high	95	Very high	1 Å²	1	58.5 Å²	58.5	1%	0.006	31%	0.313	C	S	.	.			trans	-58	149.4	171.8	-22.5	34.4	0	0	0	112.1	I153 P155 N161 F218 W219	I153-P216 HydrophobicContact CG2-CB 4.22Å; I153-P216 HydrophobicContact CG2-CG 4.07Å; P155-P216 HydrophobicContact CG-CG 4.17Å; P155-P216 WeakPolarHBondContact O-CG 3.39Å; N161-P216 HydrophobicContact CB-CB 4.12Å; N161-P216 VanDerWaalsContact OD1-CB 3.32Å; N161-P216 WeakPolarHBondContact OD1-CB 3.28Å; P216-F218 VanDerWaalsContact C-N 3.31Å; P216-F218 PolarHBondContact O-N 2.88Å; P216-W219 HydrophobicContact CB-CB 4.35Å; P216-W219 HydrophobicContact CB-CD2 4.14Å; P216-W219 HydrophobicContact CB-CG 3.78Å; P216-W219 HydrophobicContact CG-CD2 3.64Å; P216-W219 HydrophobicContact CG-CE3 4.12Å; P216-W219 HydrophobicContact CG-CG 3.84Å; P216-W219 HydrophobicContact CG-CZ2 4.29Å; P216-W219 PolarHBondContact O-N 3.22Å; P216-W219 VanDerWaalsContact O-N 3.13Å
217	S	94.7	Very high	95	Very high	68 Å²	68	58.3 Å²	58.3	48%	0.476	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-39.3	-171.8	-49.2	0	0	0	0	113	N161	N161-S217 PolarHBondContact OD1-N 3.39Å
218	F	94.5	Very high	94.8	Very high	139 Å²	139	58.3 Å²	58.3	61%	0.61	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-0.8	-178.6	-60.7	-43.6	0	0	0	114.6	N161 P216	N161-F218 WeakPolarHBondContact ND2-CD2 3.43Å; N161-F218 WeakPolarHBondContact O-CB 3.44Å; N161-F218 PolarHBondContact OD1-N 2.87Å; N161-F218 VanDerWaalsContact OD1-N 3.07Å; P216-F218 VanDerWaalsContact C-N 3.31Å; P216-F218 PolarHBondContact O-N 2.88Å
219	W	96.4	Very high	94.6	Very high	18 Å²	18	58.8 Å²	58.8	7%	0.068	33%	0.332	C	S	.	.			trans	-80.2	138	177.9	-74.2	25.8	0	0	0	110.1	P155 A160 M163 K215 P216 K221 A223 L226 F241	P155-W219 HydrophobicContact CG-CH2 3.53Å; P155-W219 HydrophobicContact CG-CZ2 3.81Å; P155-W219 HydrophobicContact CG-CZ3 4.17Å; A160-W219 HydrophobicContact CB-CZ2 4.5Å; A160-W219 PolarHBondContact O-NE1 2.69Å; M163-W219 HydrophobicContact CB-CZ2 4.22Å; M163-W219 HydrophobicContact SD-CH2 4.31Å; M163-W219 HydrophobicContact SD-CZ2 3.88Å; K215-W219 HydrophobicContact CD-CB 4.42Å; K215-W219 WeakPolarHBondContact CE-O 3.43Å; K215-W219 PolarHBondContact NZ-O 3.42Å; P216-W219 HydrophobicContact CB-CB 4.35Å; P216-W219 HydrophobicContact CB-CD2 4.14Å; P216-W219 HydrophobicContact CB-CG 3.78Å; P216-W219 HydrophobicContact CG-CD2 3.64Å; P216-W219 HydrophobicContact CG-CE3 4.12Å; P216-W219 HydrophobicContact CG-CG 3.84Å; P216-W219 HydrophobicContact CG-CZ2 4.29Å; P216-W219 PolarHBondContact O-N 3.22Å; P216-W219 VanDerWaalsContact O-N 3.13Å; W219-K221 WeakPolarHBondContact CB-O 3.48Å; W219-A223 HydrophobicContact CZ3-CB 3.88Å; W219-L226 HydrophobicContact CH2-CD1 4.29Å; W219-L226 HydrophobicContact CZ3-CD1 4.16Å; W219-L226 HydrophobicContact CZ3-CD2 4.24Å; W219-L226 HydrophobicContact CZ3-CG 4.45Å; W219-F241 AromaticContact CH2-CD2 3.82Å; W219-F241 HydrophobicContact CH2-CD2 3.82Å; W219-F241 AromaticContact CH2-CE2 3.77Å; W219-F241 HydrophobicContact CH2-CE2 3.77Å; W219-F241 AromaticContact CZ2-CD2 3.95Å; W219-F241 HydrophobicContact CZ2-CD2 3.95Å; W219-F241 AromaticContact CZ2-CE2 3.8Å; W219-F241 HydrophobicContact CZ2-CE2 3.8Å
220	S	92.6	Very high	94.5	Very high	100 Å²	100	59.9 Å²	59.9	70%	0.699	34%	0.337	S	S	*	.	S	Bend	trans	-78.5	-34.8	172.6	51.9	0	0	0	0	111.8
221	K	94.6	Very high	94.2	Very high	113 Å²	113	64.7 Å²	64.7	49%	0.491	37%	0.369	S	S	.	.	S	Bend	trans	-124.7	152.3	-179.6	-60.2	179.7	-176.5	-179.1	0	111.2	W219 E225	W219-K221 WeakPolarHBondContact CB-O 3.48Å; K221-E225 HydrophobicContact CB-CB 4.34Å
222	P	96.2	Very high	94.1	Very high	17 Å²	17	60.4 Å²	60.4	11%	0.11	35%	0.35	C	S	.	.			trans	-71.5	165.1	173.2	31.6	-35.9	0	0	0	112.2	K215 Y224 E225	K215-P222 HydrophobicContact CB-CB 4.12Å; P222-Y224 VanDerWaalsContact C-N 3.26Å; P222-Y224 HydrophobicContact CB-CD1 3.9Å; P222-Y224 HydrophobicContact CB-CE1 3.43Å; P222-Y224 VanDerWaalsContact CB-CE1 3.43Å; P222-Y224 HydrophobicContact CB-CE2 4.12Å; P222-Y224 HydrophobicContact CB-CG 4.45Å; P222-Y224 HydrophobicContact CG-CD1 4.24Å; P222-Y224 HydrophobicContact CG-CD2 4.02Å; P222-Y224 HydrophobicContact CG-CE1 3.75Å; P222-Y224 HydrophobicContact CG-CE2 3.44Å; P222-Y224 VanDerWaalsContact CG-CE2 3.44Å; P222-Y224 HydrophobicContact CG-CG 4.38Å; P222-Y224 PolarHBondContact O-N 3.12Å; P222-E225 HydrophobicContact CG-CB 4.08Å; P222-E225 HydrophobicContact CG-CG 4Å; P222-E225 PolarHBondContact O-N 3.25Å
223	A	95.4	Very high	94.1	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-55.7	-37.2	-177.9	0	0	0	0	0	114.2	F210 W219 E225 L226 N234 G235 F236	F210-A223 HydrophobicContact CE1-CB 3.96Å; F210-A223 HydrophobicContact CZ-CB 4.07Å; W219-A223 HydrophobicContact CZ3-CB 3.88Å; A223-E225 PolarHBondContact O-N 3.23Å; A223-L226 WeakPolarHBondContact O-CG 3.31Å; A223-L226 PolarHBondContact O-N 2.73Å; A223-N234 PolarHBondContact O-OD1 3.34Å; A223-G235 WeakPolarHBondContact O-CA 3.3Å; A223-G235 PolarHBondContact O-N 2.67Å; A223-G235 VanDerWaalsContact O-N 3.13Å; A223-F236 HydrophobicContact CB-CD1 4.31Å; A223-F236 HydrophobicContact CB-CE1 4.01Å
224	Y	94.6	Very high	94.1	Very high	50 Å²	50	58.9 Å²	58.9	20%	0.196	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-76.7	1.7	179.7	57.1	-97.3	0	0	0	114.3	K207 F210 P222 N234	K207-Y224 HydrophobicContact CB-CD2 3.89Å; K207-Y224 HydrophobicContact CB-CE2 4.09Å; K207-Y224 HydrophobicContact CB-CG 4.35Å; K207-Y224 HydrophobicContact CD-CD2 4.39Å; K207-Y224 HydrophobicContact CD-CE2 3.88Å; K207-Y224 HydrophobicContact CG-CD2 3.99Å; K207-Y224 HydrophobicContact CG-CE2 3.64Å; F210-Y224 HydrophobicContact CB-CD1 3.74Å; F210-Y224 HydrophobicContact CB-CE1 3.56Å; F210-Y224 AromaticContact CD1-CD1 3.95Å; F210-Y224 HydrophobicContact CD1-CD1 3.95Å; F210-Y224 HydrophobicContact CD1-CE1 4.28Å; F210-Y224 AromaticContact CD2-CD1 3.48Å; F210-Y224 HydrophobicContact CD2-CD1 3.48Å; F210-Y224 VanDerWaalsContact CD2-CD1 3.48Å; F210-Y224 HydrophobicContact CD2-CE1 4.23Å; F210-Y224 HydrophobicContact CD2-CG 4.26Å; F210-Y224 HydrophobicContact CE1-CD1 4.4Å; F210-Y224 HydrophobicContact CE2-CD1 4.03Å; F210-Y224 AromaticContact CG-CD1 3.46Å; F210-Y224 HydrophobicContact CG-CD1 3.46Å; F210-Y224 VanDerWaalsContact CG-CD1 3.46Å; F210-Y224 AromaticContact CG-CE1 3.8Å; F210-Y224 HydrophobicContact CG-CE1 3.8Å; F210-Y224 HydrophobicContact CZ-CD1 4.46Å; P222-Y224 VanDerWaalsContact C-N 3.26Å; P222-Y224 HydrophobicContact CB-CD1 3.9Å; P222-Y224 HydrophobicContact CB-CE1 3.43Å; P222-Y224 VanDerWaalsContact CB-CE1 3.43Å; P222-Y224 HydrophobicContact CB-CE2 4.12Å; P222-Y224 HydrophobicContact CB-CG 4.45Å; P222-Y224 HydrophobicContact CG-CD1 4.24Å; P222-Y224 HydrophobicContact CG-CD2 4.02Å; P222-Y224 HydrophobicContact CG-CE1 3.75Å; P222-Y224 HydrophobicContact CG-CE2 3.44Å; P222-Y224 VanDerWaalsContact CG-CE2 3.44Å; P222-Y224 HydrophobicContact CG-CG 4.38Å; P222-Y224 PolarHBondContact O-N 3.12Å; Y224-N234 PolarHBondContact O-ND2 2.98Å; Y224-N234 PolarHBondContact O-OD1 3.25Å
225	E	95.8	Very high	94	Very high	69 Å²	69	57.3 Å²	57.3	32%	0.322	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-124.5	19.2	175.5	-67	176.6	-173.2	0	0	112.1	K221 P222 A223 T228	K221-E225 HydrophobicContact CB-CB 4.34Å; P222-E225 HydrophobicContact CG-CB 4.08Å; P222-E225 HydrophobicContact CG-CG 4Å; P222-E225 PolarHBondContact O-N 3.25Å; A223-E225 PolarHBondContact O-N 3.23Å; E225-T228 HydrophobicContact CB-CG2 4.42Å
226	L	94.5	Very high	94	Very high	49 Å²	49	53.4 Å²	53.4	26%	0.257	30%	0.304	S	S	.	.	S	Bend	trans	-66.5	-40.3	176.7	-72.7	175.5	0	0	0	111.6	W219 A223 N234 N238 F241	W219-L226 HydrophobicContact CH2-CD1 4.29Å; W219-L226 HydrophobicContact CZ3-CD1 4.16Å; W219-L226 HydrophobicContact CZ3-CD2 4.24Å; W219-L226 HydrophobicContact CZ3-CG 4.45Å; A223-L226 WeakPolarHBondContact O-CG 3.31Å; A223-L226 PolarHBondContact O-N 2.73Å; L226-N234 PolarHBondContact N-OD1 3.14Å; L226-N238 HydrophobicContact CB-CB 4.23Å; L226-N238 HydrophobicContact CD1-CB 3.9Å; L226-F241 HydrophobicContact CD1-CB 4.26Å
227	D	92.9	Very high	93.9	Very high	29 Å²	29	54.2 Å²	54.2	16%	0.155	31%	0.309	C	S	.	.			trans	-140.2	103.2	172.4	-166.6	-20.4	0	0	0	110.2	S229 D230 N233 N234	D227-S229 VanDerWaalsContact C-N 3.32Å; D227-S229 WeakPolarHBondContact OD1-CB 3.44Å; D227-S229 PolarHBondContact OD1-N 3.41Å; D227-S229 PolarHBondContact OD1-OG 2.76Å; D227-D230 PolarHBondContact OD1-N 3.14Å; D227-D230 VanDerWaalsContact OD1-N 3.12Å; D227-N233 HydrophobicContact CB-CB 4.42Å; D227-N233 VanDerWaalsContact CB-O 3.28Å; D227-N233 WeakPolarHBondContact CB-O 3.32Å; D227-N233 PolarHBondContact OD2-ND2 3.05Å; D227-N234 HydrophobicContact CB-CB 4.46Å; D227-N234 PolarHBondContact N-OD1 3.35Å; D227-N234 VanDerWaalsContact N-OD1 3.13Å; D227-N234 WeakPolarHBondContact O-CB 3.42Å; D227-N234 PolarHBondContact O-ND2 3.25Å; D227-N234 PolarHBondContact O-OD1 3.33Å
228	T	90.6	Very high	94.1	Very high	118 Å²	118	51.2 Å²	51.2	72%	0.724	29%	0.287	S	S	*	.	S	Bend	trans	-85.3	-9.2	178.1	56.7	0	0	0	0	112.8	E225	E225-T228 HydrophobicContact CB-CG2 4.42Å
229	S	90.9	Very high	94.2	Very high	105 Å²	105	45.3 Å²	45.3	73%	0.734	26%	0.262	S	S	*	.	S	Bend	trans	-88.5	-35	-176.9	67.4	0	0	0	0	112.3	D227	D227-S229 VanDerWaalsContact C-N 3.32Å; D227-S229 WeakPolarHBondContact OD1-CB 3.44Å; D227-S229 PolarHBondContact OD1-N 3.41Å; D227-S229 PolarHBondContact OD1-OG 2.76Å
230	D	90.9	Very high	94.2	Very high	36 Å²	36	45.9 Å²	45.9	19%	0.193	27%	0.266	C	S	.	.			trans	-125.1	106.9	179.7	-170.6	-17	0	0	0	110.9	D227 S232 N233	D227-D230 PolarHBondContact OD1-N 3.14Å; D227-D230 VanDerWaalsContact OD1-N 3.12Å; D230-S232 PolarHBondContact O-N 3.15Å; D230-S232 VanDerWaalsContact O-N 3.17Å; D230-S232 WeakPolarHBondContact OD1-CB 3.3Å; D230-S232 PolarHBondContact OD1-N 3.42Å; D230-S232 PolarHBondContact OD1-OG 2.84Å; D230-S232 PolarHBondContact OD2-OG 2.66Å; D230-N233 HydrophobicContact CB-CB 4.19Å; D230-N233 PolarHBondContact O-N 3Å
231	P	89.2	Confident	94.5	Very high	111 Å²	111	41.1 Å²	41.1	72%	0.721	23%	0.233	S	C	*	.	G	3₁₀ helix	trans	-58.6	-26.5	177.2	-24.7	34.4	0	0	0	114.2	N233	P231-N233 VanDerWaalsContact C-N 3.25Å; P231-N233 PolarHBondContact O-N 3.18Å
232	S	91.3	Very high	94.6	Very high	55 Å²	55	35.8 Å²	35.8	39%	0.385	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-73.3	-19.2	178	73.4	0	0	0	0	112.8	Y194 D230 V237	Y194-S232 PolarHBondContact OH-O 2.74Å; D230-S232 PolarHBondContact O-N 3.15Å; D230-S232 VanDerWaalsContact O-N 3.17Å; D230-S232 WeakPolarHBondContact OD1-CB 3.3Å; D230-S232 PolarHBondContact OD1-N 3.42Å; D230-S232 PolarHBondContact OD1-OG 2.84Å; D230-S232 PolarHBondContact OD2-OG 2.66Å; S232-V237 WeakPolarHBondContact O-CG2 3.17Å
233	N	94.3	Very high	94.7	Very high	22 Å²	22	35.7 Å²	35.7	12%	0.118	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-110.8	25	-179.4	-169.1	41.2	0	0	0	112.8	D227 D230 P231 N238 Q239	D227-N233 HydrophobicContact CB-CB 4.42Å; D227-N233 VanDerWaalsContact CB-O 3.28Å; D227-N233 WeakPolarHBondContact CB-O 3.32Å; D227-N233 PolarHBondContact OD2-ND2 3.05Å; D230-N233 HydrophobicContact CB-CB 4.19Å; D230-N233 PolarHBondContact O-N 3Å; P231-N233 VanDerWaalsContact C-N 3.25Å; P231-N233 PolarHBondContact O-N 3.18Å; N233-N238 WeakPolarHBondContact O-CA 3.39Å; N233-N238 VanDerWaalsContact O-CB 3.29Å; N233-N238 WeakPolarHBondContact O-CB 3.25Å; N233-N238 PolarHBondContact O-ND2 3.21Å; N233-Q239 WeakPolarHBondContact OD1-CB 3.48Å; N233-Q239 WeakPolarHBondContact OD1-CG 3.45Å; N233-Q239 PolarHBondContact OD1-N 3.3Å
234	N	95	Very high	94.9	Very high	20 Å²	20	35.8 Å²	35.8	11%	0.107	21%	0.209	C	C	.	.	S	Bend	trans	-116.9	158.6	-175.5	-162.2	18.1	0	0	0	113	N200 A223 Y224 L226 D227 V237	N200-N234 PolarHBondContact ND2-O 2.68Å; A223-N234 PolarHBondContact O-OD1 3.34Å; Y224-N234 PolarHBondContact O-ND2 2.98Å; Y224-N234 PolarHBondContact O-OD1 3.25Å; L226-N234 PolarHBondContact N-OD1 3.14Å; D227-N234 HydrophobicContact CB-CB 4.46Å; D227-N234 PolarHBondContact N-OD1 3.35Å; D227-N234 VanDerWaalsContact N-OD1 3.13Å; D227-N234 WeakPolarHBondContact O-CB 3.42Å; D227-N234 PolarHBondContact O-ND2 3.25Å; D227-N234 PolarHBondContact O-OD1 3.33Å; N234-V237 WeakPolarHBondContact O-CG2 3.43Å
235	G	95.5	Very high	95	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	72.9	-143	-177.6	0	0	0	0	0	112.8	N200 A223 V237 N238	N200-G235 WeakPolarHBondContact OD1-CA 3.36Å; A223-G235 WeakPolarHBondContact O-CA 3.3Å; A223-G235 PolarHBondContact O-N 2.67Å; A223-G235 VanDerWaalsContact O-N 3.13Å; G235-V237 PolarHBondContact O-N 2.82Å; G235-N238 VanDerWaalsContact O-CB 3.32Å; G235-N238 WeakPolarHBondContact O-CB 3.43Å; G235-N238 PolarHBondContact O-N 3.45Å
236	F	96.6	Very high	95.1	Very high	1 Å²	1	35 Å²	35	0%	0.004	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-75.3	-11.5	-179.1	-59.2	-33.1	0	0	0	114.2	Q126 L127 F134 V154 P155 R199 N200 F210 A223 F241 L242	Q126-F236 WeakPolarHBondContact O-CE2 3.48Å; L127-F236 HydrophobicContact CD2-CD1 4.38Å; F134-F236 AromaticContact CE1-CE2 3.88Å; F134-F236 HydrophobicContact CE1-CE2 3.88Å; F134-F236 HydrophobicContact CE1-CZ 4.28Å; F134-F236 AromaticContact CZ-CE2 3.53Å; F134-F236 HydrophobicContact CZ-CE2 3.53Å; F134-F236 AromaticContact CZ-CZ 3.83Å; F134-F236 HydrophobicContact CZ-CZ 3.83Å; V154-F236 HydrophobicContact CG1-CE1 4.26Å; V154-F236 HydrophobicContact CG1-CZ 3.57Å; P155-F236 HydrophobicContact CB-CE1 3.96Å; P155-F236 HydrophobicContact CG-CE1 4.23Å; R199-F236 WeakPolarHBondContact O-CD2 3.31Å; N200-F236 PolarHBondContact OD1-N 3.37Å; F210-F236 HydrophobicContact CE1-CE1 4.28Å; F210-F236 HydrophobicContact CE1-CZ 4.01Å; F210-F236 HydrophobicContact CZ-CE1 4.25Å; F210-F236 HydrophobicContact CZ-CE2 4.45Å; F210-F236 AromaticContact CZ-CZ 3.97Å; F210-F236 HydrophobicContact CZ-CZ 3.97Å; A223-F236 HydrophobicContact CB-CD1 4.31Å; A223-F236 HydrophobicContact CB-CE1 4.01Å; F236-F241 HydrophobicContact CB-CE1 4.39Å; F236-F241 HydrophobicContact CD1-CE1 4.16Å; F236-L242 VanDerWaalsContact O-CD2 3.25Å; F236-L242 WeakPolarHBondContact O-CD2 3.45Å
237	V	96.4	Very high	95.1	Very high	18 Å²	18	38.6 Å²	38.6	11%	0.109	21%	0.213	C	C	.	.	G	3₁₀ helix	trans	-92.3	2.1	174.1	-58.9	0	0	0	0	112.8	Y194 S232 N234 G235 Q239	Y194-V237 HydrophobicContact CD2-CB 4.18Å; Y194-V237 WeakPolarHBondContact CD2-O 3.2Å; Y194-V237 HydrophobicContact CE2-CB 4Å; Y194-V237 HydrophobicContact CE2-CG2 4.45Å; Y194-V237 WeakPolarHBondContact CE2-O 3.46Å; S232-V237 WeakPolarHBondContact O-CG2 3.17Å; N234-V237 WeakPolarHBondContact O-CG2 3.43Å; G235-V237 PolarHBondContact O-N 2.82Å; V237-Q239 PolarHBondContact O-N 2.97Å
238	N	97.4	Very high	95.3	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.032	21%	0.214	C	C	.	.			trans	-56.6	124.5	174	175.1	-92.2	0	0	0	110.7	L226 N233 G235 D240 F241 L242	L226-N238 HydrophobicContact CB-CB 4.23Å; L226-N238 HydrophobicContact CD1-CB 3.9Å; N233-N238 WeakPolarHBondContact O-CA 3.39Å; N233-N238 VanDerWaalsContact O-CB 3.29Å; N233-N238 WeakPolarHBondContact O-CB 3.25Å; N233-N238 PolarHBondContact O-ND2 3.21Å; G235-N238 VanDerWaalsContact O-CB 3.32Å; G235-N238 WeakPolarHBondContact O-CB 3.43Å; G235-N238 PolarHBondContact O-N 3.45Å; N238-D240 VanDerWaalsContact C-N 3.34Å; N238-D240 PolarHBondContact O-N 3.28Å; N238-D240 WeakPolarHBondContact OD1-CB 3.28Å; N238-D240 PolarHBondContact OD1-N 3.07Å; N238-F241 HydrophobicContact CB-CB 4.06Å; N238-F241 WeakPolarHBondContact O-CB 3.48Å; N238-F241 PolarHBondContact O-N 3.34Å; N238-F241 VanDerWaalsContact O-N 3.14Å; N238-F241 PolarHBondContact OD1-N 3.08Å; N238-L242 WeakPolarHBondContact O-CG 3.28Å; N238-L242 PolarHBondContact O-N 2.88Å
239	Q	97.1	Very high	95.5	Very high	15 Å²	15	36.6 Å²	36.6	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-61.8	-39.3	-170.9	-68.4	-85.7	-30.2	0	0	112.7	I188 A189 N233 V237 L242 V243	I188-Q239 HydrophobicContact CD1-CB 3.82Å; I188-Q239 HydrophobicContact CG1-CB 3.6Å; I188-Q239 HydrophobicContact CG1-CG 4.41Å; I188-Q239 VanDerWaalsContact N-OE1 3.14Å; A189-Q239 VanDerWaalsContact CB-OE1 3.24Å; N233-Q239 WeakPolarHBondContact OD1-CB 3.48Å; N233-Q239 WeakPolarHBondContact OD1-CG 3.45Å; N233-Q239 PolarHBondContact OD1-N 3.3Å; V237-Q239 PolarHBondContact O-N 2.97Å; Q239-L242 PolarHBondContact O-N 3.47Å; Q239-V243 WeakPolarHBondContact O-CG2 3.33Å; Q239-V243 PolarHBondContact O-N 2.67Å
240	D	97.3	Very high	95.8	Very high	29 Å²	29	37.2 Å²	37.2	16%	0.155	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-42.1	176.7	-73.6	-45.6	0	0	0	111.6	M163 N238 V243 W244 R258	M163-D240 HydrophobicContact CE-CB 4.04Å; N238-D240 VanDerWaalsContact C-N 3.34Å; N238-D240 PolarHBondContact O-N 3.28Å; N238-D240 WeakPolarHBondContact OD1-CB 3.28Å; N238-D240 PolarHBondContact OD1-N 3.07Å; D240-V243 PolarHBondContact O-N 3.27Å; D240-W244 PolarHBondContact O-N 3.13Å; D240-R258 VanDerWaalsContact CG-NH1 3.31Å; D240-R258 IonicContact OD1-CZ 2.94Å; D240-R258 IonicContact OD1-NH1 3.31Å; D240-R258 PolarHBondContact OD1-NH1 3.06Å; D240-R258 IonicContact OD1-NH2 2.72Å; D240-R258 IonicContact OD2-CZ 2.68Å; D240-R258 IonicContact OD2-NH1 3.25Å; D240-R258 PolarHBondContact OD2-NH1 3.21Å; D240-R258 IonicContact OD2-NH2 3.66Å; D240-R258 PolarHBondContact OD2-NH2 3.5Å
241	F	97.7	Very high	96.1	Very high	1 Å²	1	37.3 Å²	37.3	0%	0.004	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-46.3	174.1	176.7	-108.6	0	0	0	111.3	L127 P155 A160 M163 Y198 W219 L226 F236 N238 V243 W244 M245	L127-F241 HydrophobicContact CD2-CE1 3.84Å; L127-F241 HydrophobicContact CD2-CZ 3.63Å; P155-F241 HydrophobicContact CB-CZ 4.34Å; P155-F241 HydrophobicContact CG-CE2 4.08Å; P155-F241 HydrophobicContact CG-CZ 4.08Å; A160-F241 HydrophobicContact CB-CE2 4.12Å; M163-F241 HydrophobicContact CE-CB 3.95Å; M163-F241 HydrophobicContact SD-CB 4.22Å; M163-F241 HydrophobicContact SD-CD2 3.78Å; Y198-F241 HydrophobicContact CD1-CE1 4.4Å; Y198-F241 HydrophobicContact CE1-CE1 4.4Å; W219-F241 AromaticContact CH2-CD2 3.82Å; W219-F241 HydrophobicContact CH2-CD2 3.82Å; W219-F241 AromaticContact CH2-CE2 3.77Å; W219-F241 HydrophobicContact CH2-CE2 3.77Å; W219-F241 AromaticContact CZ2-CD2 3.95Å; W219-F241 HydrophobicContact CZ2-CD2 3.95Å; W219-F241 AromaticContact CZ2-CE2 3.8Å; W219-F241 HydrophobicContact CZ2-CE2 3.8Å; L226-F241 HydrophobicContact CD1-CB 4.26Å; F236-F241 HydrophobicContact CB-CE1 4.39Å; F236-F241 HydrophobicContact CD1-CE1 4.16Å; N238-F241 HydrophobicContact CB-CB 4.06Å; N238-F241 WeakPolarHBondContact O-CB 3.48Å; N238-F241 PolarHBondContact O-N 3.34Å; N238-F241 VanDerWaalsContact O-N 3.14Å; N238-F241 PolarHBondContact OD1-N 3.08Å; F241-V243 PolarHBondContact O-N 3.3Å; F241-W244 WeakPolarHBondContact O-CB 2.99Å; F241-W244 PolarHBondContact O-N 3.19Å; F241-W244 VanDerWaalsContact O-N 3.15Å; F241-M245 HydrophobicContact CD1-CG 4.15Å; F241-M245 HydrophobicContact CD2-CG 3.97Å; F241-M245 HydrophobicContact CD2-SD 4.48Å; F241-M245 HydrophobicContact CE1-CG 3.78Å; F241-M245 HydrophobicContact CE2-CG 3.58Å; F241-M245 HydrophobicContact CE2-SD 3.66Å; F241-M245 HydrophobicContact CG-CG 4.25Å; F241-M245 HydrophobicContact CZ-CE 4.16Å; F241-M245 HydrophobicContact CZ-CG 3.48Å; F241-M245 VanDerWaalsContact CZ-CG 3.48Å; F241-M245 HydrophobicContact CZ-SD 3.73Å; F241-M245 VanDerWaalsContact O-CG 3.24Å; F241-M245 WeakPolarHBondContact O-CG 3.28Å; F241-M245 PolarHBondContact O-N 3.23Å
242	L	98	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.8	-44.6	178.2	-66.4	-179.4	0	0	0	112.5	A189 Y194 Y198 F236 N238 Q239 W244 M245 R246	A189-L242 HydrophobicContact CB-CB 3.66Å; A189-L242 HydrophobicContact CB-CD1 3.89Å; A189-L242 HydrophobicContact CB-CG 4.44Å; Y194-L242 HydrophobicContact CD2-CD1 3.89Å; Y194-L242 HydrophobicContact CG-CD1 4.41Å; Y198-L242 HydrophobicContact CD1-CD2 3.85Å; Y198-L242 HydrophobicContact CD2-CD2 3.26Å; Y198-L242 HydrophobicContact CE1-CD2 4.32Å; Y198-L242 HydrophobicContact CE2-CD2 3.78Å; Y198-L242 HydrophobicContact CG-CD2 3.3Å; F236-L242 VanDerWaalsContact O-CD2 3.25Å; F236-L242 WeakPolarHBondContact O-CD2 3.45Å; N238-L242 WeakPolarHBondContact O-CG 3.28Å; N238-L242 PolarHBondContact O-N 2.88Å; Q239-L242 PolarHBondContact O-N 3.47Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 2.89Å; L242-M245 PolarHBondContact O-N 3Å; L242-R246 PolarHBondContact O-N 3.14Å
243	V	98.3	Very high	96.7	Very high	16 Å²	16	35.1 Å²	35.1	10%	0.097	19%	0.186	C	C	.	.	H	α-helix	trans	-60.8	-40.4	175.5	170.5	0	0	0	0	110.9	I188 A189 Q239 D240 F241 K255	I188-V243 HydrophobicContact CB-CG2 4.37Å; I188-V243 HydrophobicContact CD1-CG2 4.18Å; I188-V243 HydrophobicContact CG1-CG2 3.98Å; A189-V243 HydrophobicContact CB-CG2 4.29Å; Q239-V243 WeakPolarHBondContact O-CG2 3.33Å; Q239-V243 PolarHBondContact O-N 2.67Å; D240-V243 PolarHBondContact O-N 3.27Å; F241-V243 PolarHBondContact O-N 3.3Å; V243-K255 HydrophobicContact CG1-CB 3.75Å; V243-K255 HydrophobicContact CG1-CD 4.31Å; V243-K255 HydrophobicContact CG1-CG 4.09Å; V243-K255 PolarHBondContact O-NZ 2.77Å
244	W	98	Very high	96.9	Very high	1 Å²	1	38.8 Å²	38.8	0%	0.004	20%	0.199	C	C	.	.	H	α-helix	trans	-64.9	-48.8	176.8	-179.6	-103.9	0	0	0	112.4	Y106 L108 Y111 Q113 Y118 L159 S162 M163 F164 D240 F241 L242 R246 F253 K255	Y106-W244 HydrophobicContact CE2-CE3 4.43Å; Y106-W244 HydrophobicContact CE2-CZ3 4.36Å; L108-W244 HydrophobicContact CD1-CH2 4.04Å; L108-W244 HydrophobicContact CD1-CZ3 3.92Å; Y111-W244 HydrophobicContact CE1-CH2 4.04Å; Y111-W244 HydrophobicContact CE1-CZ2 4.28Å; Y111-W244 AromaticContact CZ-CH2 3.94Å; Q113-W244 VanDerWaalsContact NE2-CH2 3.32Å; Y118-W244 WeakPolarHBondContact OH-CZ2 3.44Å; L159-W244 PolarHBondContact O-NE1 3.18Å; S162-W244 WeakPolarHBondContact O-CZ2 3.26Å; M163-W244 HydrophobicContact CB-CG 4.34Å; M163-W244 HydrophobicContact CG-CB 4.28Å; M163-W244 HydrophobicContact CG-CG 4.04Å; F164-W244 HydrophobicContact CB-CD2 4.49Å; F164-W244 HydrophobicContact CB-CE3 3.76Å; F164-W244 HydrophobicContact CB-CH2 4.44Å; F164-W244 HydrophobicContact CB-CZ3 3.74Å; D240-W244 PolarHBondContact O-N 3.13Å; F241-W244 WeakPolarHBondContact O-CB 2.99Å; F241-W244 PolarHBondContact O-N 3.19Å; F241-W244 VanDerWaalsContact O-N 3.15Å; L242-W244 VanDerWaalsContact C-N 3.29Å; L242-W244 PolarHBondContact O-N 2.89Å; W244-R246 PolarHBondContact O-N 3.37Å; W244-R246 VanDerWaalsContact O-N 3.14Å; W244-F253 HydrophobicContact CZ3-CE2 4.45Å; W244-F253 HydrophobicContact CZ3-CZ 4.45Å; W244-K255 HydrophobicContact CE3-CD 3.72Å; W244-K255 HydrophobicContact CZ3-CD 4.19Å; W244-K255 PolarHBondContact O-NZ 3.45Å
245	M	97.6	Very high	97	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-64.2	-18.8	-177.1	-68.3	-61.7	-72.7	0	0	113.7	K122 L127 L159 A160 Y198 F241 L242 R247	K122-M245 HydrophobicContact CB-CE 4.41Å; L127-M245 HydrophobicContact CD1-CE 3.5Å; L127-M245 HydrophobicContact CD2-CE 4.19Å; L159-M245 HydrophobicContact CD2-CE 3.87Å; L159-M245 HydrophobicContact CD2-SD 4Å; L159-M245 HydrophobicContact CG-CE 4.22Å; L159-M245 HydrophobicContact CG-SD 3.8Å; A160-M245 HydrophobicContact CB-CE 4.38Å; A160-M245 HydrophobicContact CB-SD 3.94Å; Y198-M245 HydrophobicContact CE1-CB 4.33Å; Y198-M245 HydrophobicContact CE1-CG 4.43Å; Y198-M245 VanDerWaalsContact OH-CB 3.29Å; Y198-M245 WeakPolarHBondContact OH-CB 3.47Å; F241-M245 HydrophobicContact CD1-CG 4.15Å; F241-M245 HydrophobicContact CD2-CG 3.97Å; F241-M245 HydrophobicContact CD2-SD 4.48Å; F241-M245 HydrophobicContact CE1-CG 3.78Å; F241-M245 HydrophobicContact CE2-CG 3.58Å; F241-M245 HydrophobicContact CE2-SD 3.66Å; F241-M245 HydrophobicContact CG-CG 4.25Å; F241-M245 HydrophobicContact CZ-CE 4.16Å; F241-M245 HydrophobicContact CZ-CG 3.48Å; F241-M245 VanDerWaalsContact CZ-CG 3.48Å; F241-M245 HydrophobicContact CZ-SD 3.73Å; F241-M245 VanDerWaalsContact O-CG 3.24Å; F241-M245 WeakPolarHBondContact O-CG 3.28Å; F241-M245 PolarHBondContact O-N 3.23Å; L242-M245 PolarHBondContact O-N 3Å; M245-R247 PolarHBondContact O-N 2.98Å
246	R	96.9	Very high	97.1	Very high	97 Å²	97	39.7 Å²	39.7	37%	0.366	20%	0.203	S	C	.	.	S	Bend	trans	-75.8	100.1	168.6	-176.2	170.3	-75.4	-124.9	-0.8	110.6	W190 D193 L242 W244 K255	W190-R246 VanDerWaalsContact CD1-NE 3.3Å; W190-R246 VanDerWaalsContact CD1-NH1 3.33Å; W190-R246 VanDerWaalsContact CG-CZ 3.47Å; D193-R246 VanDerWaalsContact CG-NH2 3.28Å; D193-R246 IonicContact OD1-NH2 2.79Å; D193-R246 PolarHBondContact OD1-NH2 2.98Å; D193-R246 IonicContact OD2-CZ 2.64Å; D193-R246 VanDerWaalsContact OD2-CZ 3.25Å; D193-R246 IonicContact OD2-NE 2.95Å; D193-R246 PolarHBondContact OD2-NE 2.98Å; D193-R246 IonicContact OD2-NH2 3.36Å; D193-R246 PolarHBondContact OD2-NH2 2.86Å; L242-R246 PolarHBondContact O-N 3.14Å; W244-R246 PolarHBondContact O-N 3.37Å; W244-R246 VanDerWaalsContact O-N 3.14Å; R246-K255 PolarHBondContact O-NZ 3.31Å
247	R	95.4	Very high	97.2	Very high	124 Å²	124	40.6 Å²	40.6	47%	0.468	21%	0.206	S	C	.	.			trans	-56.9	136.8	-177.9	-62.4	-177.1	-66.5	163.9	-9.9	112.9	G119 L159 M245	G119-R247 PolarHBondContact O-NH1 3.34Å; L159-R247 HydrophobicContact CD1-CG 4.15Å; L159-R247 HydrophobicContact CD2-CG 4Å; M245-R247 PolarHBondContact O-N 2.98Å
248	A	96.9	Very high	97.2	Very high	20 Å²	20	41.5 Å²	41.5	17%	0.165	21%	0.208	C	C	.	.			trans	-77.9	147.4	165.8	0	0	0	0	0	111.3	Q113 F253	Q113-A248 HydrophobicContact CB-CB 4.34Å; A248-F253 HydrophobicContact CB-CB 3.47Å; A248-F253 VanDerWaalsContact CB-CB 3.47Å; A248-F253 HydrophobicContact CB-CD1 3.53Å; A248-F253 HydrophobicContact CB-CD2 3.98Å; A248-F253 HydrophobicContact CB-CE1 4.22Å; A248-F253 HydrophobicContact CB-CG 3.37Å
249	A	95.9	Very high	97.2	Very high	85 Å²	85	44.6 Å²	44.6	70%	0.702	22%	0.219	S	C	*	.	S	Bend	trans	-81.7	-30.5	178	0	0	0	0	0	112.9	S114	S114-A249 VanDerWaalsContact CB-O 3.3Å; S114-A249 WeakPolarHBondContact CB-O 3.45Å; S114-A249 PolarHBondContact OG-O 2.93Å
250	L	96.5	Very high	97.1	Very high	119 Å²	119	43.9 Å²	43.9	62%	0.623	22%	0.216	S	C	*	.	S	Bend	trans	-109.9	155.4	-175.9	-64.6	175.4	0	0	0	110.9	D252 F253	L250-D252 VanDerWaalsContact C-N 3.27Å; L250-D252 PolarHBondContact O-N 2.72Å; L250-F253 WeakPolarHBondContact O-CD1 3.2Å
251	P	96.6	Very high	96.8	Very high	37 Å²	37	44.3 Å²	44.3	24%	0.24	22%	0.219	C	C	.	.	S	Bend	trans	-69	-26.1	178	27.2	-34.8	0	0	0	113.7	N110 Y111 F112	N110-P251 PolarHBondContact N-O 3.36Å; Y111-P251 PolarHBondContact N-O 2.03Å; Y111-P251 WeakPolarHBondContact O-CA 3.34Å; F112-P251 HydrophobicContact CD1-CB 3.73Å; F112-P251 HydrophobicContact CD1-CG 4.41Å; F112-P251 HydrophobicContact CE1-CB 3.6Å; F112-P251 HydrophobicContact CE1-CG 4.01Å; F112-P251 HydrophobicContact CG-CB 4.3Å; F112-P251 HydrophobicContact CZ-CB 4.06Å
252	D	97.2	Very high	96.3	Very high	96 Å²	96	49 Å²	49	51%	0.513	24%	0.241	S	C	.	.	S	Bend	trans	-101.3	115	171.7	-60.3	-29.2	0	0	0	108.1	L108 S109 N110 L250	L108-D252 WeakPolarHBondContact O-CA 3.1Å; S109-D252 WeakPolarHBondContact CA-OD1 3.4Å; S109-D252 WeakPolarHBondContact CB-OD1 3.43Å; S109-D252 PolarHBondContact OG-OD1 2.94Å; N110-D252 PolarHBondContact N-OD1 3.15Å; L250-D252 VanDerWaalsContact C-N 3.27Å; L250-D252 PolarHBondContact O-N 2.72Å
253	F	97.3	Very high	95.9	Very high	24 Å²	24	52 Å²	52	11%	0.105	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	161.3	-177.3	63.6	-93.9	0	0	0	111.5	G107 L108 Y111 Q113 W244 A248 L250 K255	G107-F253 CarbonylContact C-O 3.6Å; G107-F253 VanDerWaalsContact CA-O 3.24Å; G107-F253 WeakPolarHBondContact CA-O 3.29Å; L108-F253 HydrophobicContact CB-CE1 4.24Å; L108-F253 HydrophobicContact CB-CE2 4.16Å; L108-F253 HydrophobicContact CB-CZ 3.89Å; L108-F253 HydrophobicContact CD1-CE2 4.18Å; L108-F253 HydrophobicContact CD1-CZ 3.85Å; L108-F253 HydrophobicContact CG-CE2 4.45Å; L108-F253 HydrophobicContact CG-CZ 4.35Å; L108-F253 PolarHBondContact N-O 3.12Å; L108-F253 PolarHBondContact O-N 2.9Å; Y111-F253 AromaticContact CD1-CE1 3.77Å; Y111-F253 HydrophobicContact CD1-CE1 3.77Å; Y111-F253 AromaticContact CD1-CZ 3.88Å; Y111-F253 HydrophobicContact CD1-CZ 3.88Å; Y111-F253 HydrophobicContact CG-CE1 4.16Å; Y111-F253 HydrophobicContact CG-CZ 4.3Å; Y111-F253 WeakPolarHBondContact O-CE1 3.43Å; Q113-F253 HydrophobicContact CG-CE1 3.77Å; Q113-F253 HydrophobicContact CG-CZ 3.85Å; W244-F253 HydrophobicContact CZ3-CE2 4.45Å; W244-F253 HydrophobicContact CZ3-CZ 4.45Å; A248-F253 HydrophobicContact CB-CB 3.47Å; A248-F253 VanDerWaalsContact CB-CB 3.47Å; A248-F253 HydrophobicContact CB-CD1 3.53Å; A248-F253 HydrophobicContact CB-CD2 3.98Å; A248-F253 HydrophobicContact CB-CE1 4.22Å; A248-F253 HydrophobicContact CB-CG 3.37Å; L250-F253 WeakPolarHBondContact O-CD1 3.2Å; F253-K255 HydrophobicContact CD2-CD 4.28Å; F253-K255 HydrophobicContact CD2-CG 4.02Å; F253-K255 HydrophobicContact CE2-CD 3.87Å; F253-K255 HydrophobicContact CE2-CG 4.11Å
254	R	96.9	Very high	95.4	Very high	99 Å²	99	56.4 Å²	56.4	37%	0.374	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	146.3	170.3	65.9	-177	178	-179.2	0.4	110.3	Y105 Y106	Y105-R254 HydrophobicContact CD1-CB 4.49Å; Y105-R254 HydrophobicContact CD1-CG 4.16Å; Y105-R254 HydrophobicContact CG-CB 4.49Å; Y105-R254 HydrophobicContact CG-CG 4.39Å; Y106-R254 CarbonylContact O-C 3.53Å; Y106-R254 VanDerWaalsContact O-CA 3.23Å; Y106-R254 WeakPolarHBondContact O-CA 3.49Å
255	K	97.9	Very high	95.2	Very high	13 Å²	13	56.5 Å²	56.5	6%	0.057	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.1	178.3	-79.1	178.2	-177.1	-68.8	0	109.1	Y105 Y106 V243 W244 R246 F253 Y257	Y105-K255 WeakPolarHBondContact CA-O 3.02Å; Y105-K255 WeakPolarHBondContact CB-O 3.25Å; Y106-K255 HydrophobicContact CD1-CB 4.5Å; Y106-K255 HydrophobicContact CD2-CB 4.29Å; Y106-K255 HydrophobicContact CE1-CB 3.86Å; Y106-K255 HydrophobicContact CE2-CB 3.63Å; Y106-K255 HydrophobicContact CE2-CD 3.85Å; Y106-K255 HydrophobicContact CE2-CG 4.25Å; Y106-K255 PolarHBondContact N-O 3.42Å; Y106-K255 VanDerWaalsContact N-O 3.09Å; Y106-K255 PolarHBondContact O-N 2.97Å; Y106-K255 WeakPolarHBondContact OH-CB 3.2Å; Y106-K255 WeakPolarHBondContact OH-CD 3.32Å; V243-K255 HydrophobicContact CG1-CB 3.75Å; V243-K255 HydrophobicContact CG1-CD 4.31Å; V243-K255 HydrophobicContact CG1-CG 4.09Å; V243-K255 PolarHBondContact O-NZ 2.77Å; W244-K255 HydrophobicContact CE3-CD 3.72Å; W244-K255 HydrophobicContact CZ3-CD 4.19Å; W244-K255 PolarHBondContact O-NZ 3.45Å; R246-K255 PolarHBondContact O-NZ 3.31Å; F253-K255 HydrophobicContact CD2-CD 4.28Å; F253-K255 HydrophobicContact CD2-CG 4.02Å; F253-K255 HydrophobicContact CE2-CD 3.87Å; F253-K255 HydrophobicContact CE2-CG 4.11Å; K255-Y257 PolarHBondContact O-N 2.85Å
256	L	97.9	Very high	95	Very high	26 Å²	26	58.9 Å²	58.9	14%	0.136	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	122.7	-177.8	-179.5	59.7	0	0	0	108.6	F103 Y105 I188	F103-L256 HydrophobicContact CB-CD1 3.9Å; F103-L256 HydrophobicContact CD1-CD1 3.8Å; F103-L256 HydrophobicContact CD1-CD2 4.19Å; F103-L256 HydrophobicContact CG-CD1 4.34Å; Y105-L256 VanDerWaalsContact CD1-CA 3.47Å; Y105-L256 HydrophobicContact CD1-CB 4Å; Y105-L256 HydrophobicContact CD1-CD1 4.16Å; Y105-L256 HydrophobicContact CE1-CB 3.83Å; Y105-L256 HydrophobicContact CE1-CD1 3.81Å; Y105-L256 HydrophobicContact CE1-CG 4.39Å; I188-L256 HydrophobicContact CB-CD2 3.73Å; I188-L256 HydrophobicContact CB-CG 3.98Å; I188-L256 HydrophobicContact CG2-CD2 3.83Å; I188-L256 HydrophobicContact CG2-CG 3.99Å
257	Y	98	Very high	94.7	Very high	21 Å²	21	58.4 Å²	58.4	8%	0.082	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	-62.3	173.6	-168.8	-110.2	0	0	0	108.7	F104 Y106 F168 F183 I188 K255	F104-Y257 AromaticContact CD1-CD1 3.54Å; F104-Y257 HydrophobicContact CD1-CD1 3.54Å; F104-Y257 HydrophobicContact CD1-CG 4.19Å; F104-Y257 AromaticContact CE1-CD1 3.41Å; F104-Y257 HydrophobicContact CE1-CD1 3.41Å; F104-Y257 VanDerWaalsContact CE1-CD1 3.41Å; F104-Y257 HydrophobicContact CE1-CE1 4.14Å; F104-Y257 HydrophobicContact CE1-CG 4.1Å; F104-Y257 WeakPolarHBondContact O-CA 3.37Å; F104-Y257 WeakPolarHBondContact O-CB 3.41Å; F104-Y257 PolarHBondContact O-N 2.86Å; Y106-Y257 AromaticContact CD1-CD2 4Å; Y106-Y257 HydrophobicContact CD1-CD2 4Å; Y106-Y257 HydrophobicContact CD1-CG 4.36Å; Y106-Y257 HydrophobicContact CE1-CD2 4.15Å; F168-Y257 HydrophobicContact CB-CD1 4.46Å; F168-Y257 HydrophobicContact CB-CE1 3.96Å; F168-Y257 AromaticContact CD2-CD1 3.75Å; F168-Y257 HydrophobicContact CD2-CD1 3.75Å; F168-Y257 HydrophobicContact CD2-CD2 4.2Å; F168-Y257 AromaticContact CD2-CE1 3.58Å; F168-Y257 HydrophobicContact CD2-CE1 3.58Å; F168-Y257 HydrophobicContact CD2-CE2 4Å; F168-Y257 HydrophobicContact CD2-CG 4.08Å; F168-Y257 AromaticContact CD2-CZ 3.7Å; F168-Y257 HydrophobicContact CE2-CD2 4.37Å; F168-Y257 HydrophobicContact CE2-CE2 4.37Å; F168-Y257 HydrophobicContact CE2-CG 4.45Å; F168-Y257 HydrophobicContact CG-CE1 4.26Å; F183-Y257 HydrophobicContact CD2-CE1 4.31Å; F183-Y257 HydrophobicContact CE2-CE1 4.36Å; I188-Y257 VanDerWaalsContact CD1-O 3.25Å; I188-Y257 WeakPolarHBondContact CD1-O 3.25Å; K255-Y257 PolarHBondContact O-N 2.85Å
258	R	97.1	Very high	94.7	Very high	36 Å²	36	52.5 Å²	52.5	14%	0.136	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	158.7	-173	-62.2	-70.5	-180	-84.5	4.5	111.7	F104 F183 D184 G185 D240	F104-R258 HydrophobicContact CD1-CB 4.42Å; F104-R258 PolarHBondContact N-O 3.12Å; F104-R258 PolarHBondContact O-N 3.31Å; F104-R258 VanDerWaalsContact O-N 3.09Å; F183-R258 HydrophobicContact CB-CB 3.83Å; F183-R258 HydrophobicContact CB-CG 3.67Å; F183-R258 HydrophobicContact CD1-CB 4.18Å; F183-R258 HydrophobicContact CD2-CB 4.18Å; F183-R258 HydrophobicContact CD2-CG 3.79Å; F183-R258 HydrophobicContact CG-CB 3.82Å; F183-R258 HydrophobicContact CG-CG 3.81Å; D184-R258 WeakPolarHBondContact O-CA 3.49Å; D184-R258 WeakPolarHBondContact O-CD 3.32Å; G185-R258 VanDerWaalsContact CA-CD 3.48Å; D240-R258 VanDerWaalsContact CG-NH1 3.31Å; D240-R258 IonicContact OD1-CZ 2.94Å; D240-R258 IonicContact OD1-NH1 3.31Å; D240-R258 PolarHBondContact OD1-NH1 3.06Å; D240-R258 IonicContact OD1-NH2 2.72Å; D240-R258 IonicContact OD2-CZ 2.68Å; D240-R258 IonicContact OD2-NH1 3.25Å; D240-R258 PolarHBondContact OD2-NH1 3.21Å; D240-R258 IonicContact OD2-NH2 3.66Å; D240-R258 PolarHBondContact OD2-NH2 3.5Å
259	R	96.1	Very high	94.6	Very high	72 Å²	72	51.6 Å²	51.6	27%	0.272	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	146	170	-65.3	167.6	61.7	-137.7	-3.6	108.6	F103 D184 K186 I188	F103-R259 HydrophobicContact CD1-CG 3.77Å; F103-R259 HydrophobicContact CE1-CG 3.77Å; D184-R259 HydrophobicContact CB-CB 4.24Å; D184-R259 PolarHBondContact N-O 2.7Å; D184-R259 PolarHBondContact O-N 2.63Å; D184-R259 IonicContact OD2-CZ 3.18Å; D184-R259 IonicContact OD2-NH1 3.74Å; D184-R259 PolarHBondContact OD2-NH1 2.95Å; K186-R259 PolarHBondContact O-NH1 2.93Å; I188-R259 HydrophobicContact CG2-CG 4.27Å
260	I	95.6	Very high	94.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	94.5	176.2	-51.8	171.7	0	0	0	106.3	V102 L170 V181 F183 Y265 L269 F295	V102-I260 HydrophobicContact CB-CB 4.26Å; V102-I260 HydrophobicContact CG1-CD1 4.27Å; V102-I260 PolarHBondContact O-N 3.13Å; L170-I260 HydrophobicContact CD2-CD1 4.08Å; V181-I260 HydrophobicContact CG1-CD1 4.35Å; V181-I260 HydrophobicContact CG1-CG2 3.68Å; F183-I260 HydrophobicContact CD1-CD1 4.35Å; F183-I260 HydrophobicContact CD1-CG1 4.01Å; F183-I260 HydrophobicContact CE1-CD1 3.87Å; F183-I260 HydrophobicContact CE1-CG1 4.04Å; I260-Y265 HydrophobicContact CG2-CG 4.37Å; I260-L269 HydrophobicContact CD1-CD1 4.22Å; I260-L269 HydrophobicContact CD1-CD2 4.21Å; I260-L269 HydrophobicContact CG2-CD2 4.04Å; I260-F295 HydrophobicContact CD1-CD1 4.32Å; I260-F295 HydrophobicContact CD1-CE1 4.19Å
261	T	90.6	Very high	94.5	Very high	38 Å²	38	46.4 Å²	46.4	23%	0.233	27%	0.269	C	S	.	.			trans	-139.5	3.6	-173.6	51.8	0	0	0	0	113.2	P101 A266	P101-T261 HydrophobicContact CB-CG2 3.72Å; T261-A266 WeakPolarHBondContact O-CA 3.49Å
262	E	88.6	Confident	94.4	Very high	99 Å²	99	45.9 Å²	45.9	46%	0.463	27%	0.269	S	S	.	.	S	Bend	trans	-110.7	153.3	-172.7	-63.5	-173.9	176.2	0	0	112.5	P182 Y265	P182-E262 HydrophobicContact CG-CB 4.33Å; E262-Y265 PolarHBondContact O-N 3.23Å
263	G	87.9	Confident	94.4	Very high	62 Å²	62	45.7 Å²	45.7	64%	0.639	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	60	-137.8	174.8	0	0	0	0	0	113.3	Y265 A266	G263-Y265 PolarHBondContact O-N 2.81Å; G263-A266 WeakPolarHBondContact O-CB 3.31Å; G263-A266 PolarHBondContact O-N 3.02Å; G263-A266 VanDerWaalsContact O-N 3.17Å
264	D	89.3	Confident	94.4	Very high	109 Å²	109	44.6 Å²	44.6	58%	0.583	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-66.5	-4.6	-177.8	-56.3	-42.3	0	0	0	114	K179	K179-D264 WeakPolarHBondContact CE-OD2 3.24Å; K179-D264 IonicContact NZ-OD2 3.41Å; K179-D264 PolarHBondContact NZ-OD2 2.82Å
265	Y	93.7	Very high	94.5	Very high	3 Å²	3	39.9 Å²	39.9	1%	0.012	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-111.4	12.1	-179.2	-48.7	-81	0	0	0	112.7	Q172 V181 P182 I260 E262 G263 S267 G268 L269	Q172-Y265 HydrophobicContact CB-CE1 4.44Å; Q172-Y265 WeakPolarHBondContact CB-OH 3.46Å; Q172-Y265 PolarHBondContact OE1-OH 3.45Å; Q172-Y265 VanDerWaalsContact OE1-OH 3.12Å; V181-Y265 HydrophobicContact CB-CE2 4.21Å; V181-Y265 HydrophobicContact CG1-CD1 4.37Å; V181-Y265 HydrophobicContact CG1-CD2 3.92Å; V181-Y265 HydrophobicContact CG1-CE1 4.47Å; V181-Y265 HydrophobicContact CG1-CE2 4.02Å; V181-Y265 HydrophobicContact CG1-CG 4.08Å; V181-Y265 HydrophobicContact CG2-CE1 4.02Å; V181-Y265 HydrophobicContact CG2-CE2 4.14Å; P182-Y265 HydrophobicContact CG-CD2 4.2Å; I260-Y265 HydrophobicContact CG2-CG 4.37Å; E262-Y265 PolarHBondContact O-N 3.23Å; G263-Y265 PolarHBondContact O-N 2.81Å; Y265-S267 VanDerWaalsContact C-N 3.27Å; Y265-S267 PolarHBondContact O-N 3.19Å; Y265-G268 CarbonylContact C-O 3.59Å; Y265-G268 VanDerWaalsContact CA-O 3.25Å; Y265-G268 WeakPolarHBondContact CA-O 3.3Å; Y265-G268 PolarHBondContact O-N 3.25Å; Y265-L269 HydrophobicContact CD1-CD2 3.82Å; Y265-L269 HydrophobicContact CE1-CD2 4.42Å; Y265-L269 HydrophobicContact CG-CD2 4.4Å
266	A	91.9	Very high	94.4	Very high	57 Å²	57	39.3 Å²	39.3	47%	0.471	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-36.7	179	0	0	0	0	0	113	T261 G263 G268	T261-A266 WeakPolarHBondContact O-CA 3.49Å; G263-A266 WeakPolarHBondContact O-CB 3.31Å; G263-A266 PolarHBondContact O-N 3.02Å; G263-A266 VanDerWaalsContact O-N 3.17Å; A266-G268 VanDerWaalsContact C-N 3.32Å
267	S	92	Very high	94.4	Very high	86 Å²	86	40.5 Å²	40.5	60%	0.601	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.7	175.5	46.5	0	0	0	0	113.8	G100 Y265	G100-S267 PolarHBondContact N-O 3.41Å; Y265-S267 VanDerWaalsContact C-N 3.27Å; Y265-S267 PolarHBondContact O-N 3.19Å
268	G	94	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127	-168	-179	0	0	0	0	0	113.9	F98 Y265 A266 P270	F98-G268 CarbonylContact O-C 3.57Å; F98-G268 WeakPolarHBondContact O-CA 3.18Å; Y265-G268 CarbonylContact C-O 3.59Å; Y265-G268 VanDerWaalsContact CA-O 3.25Å; Y265-G268 WeakPolarHBondContact CA-O 3.3Å; Y265-G268 PolarHBondContact O-N 3.25Å; A266-G268 VanDerWaalsContact C-N 3.32Å; G268-P270 WeakPolarHBondContact O-CD 3.34Å
269	L	95.6	Very high	94.3	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	114.4	175.3	-62.5	172.5	0	0	0	109.7	L94 F98 V102 V181 I260 Y265 Y274 F295	L94-L269 HydrophobicContact CD1-CB 3.75Å; L94-L269 HydrophobicContact CD1-CD1 4.27Å; F98-L269 HydrophobicContact CB-CB 4.03Å; F98-L269 PolarHBondContact N-O 2.61Å; F98-L269 PolarHBondContact O-N 2.8Å; V102-L269 HydrophobicContact CG1-CD1 4.09Å; V102-L269 HydrophobicContact CG1-CG 4.48Å; V102-L269 HydrophobicContact CG2-CG 4.33Å; V181-L269 HydrophobicContact CG1-CD2 4.13Å; I260-L269 HydrophobicContact CD1-CD1 4.22Å; I260-L269 HydrophobicContact CD1-CD2 4.21Å; I260-L269 HydrophobicContact CG2-CD2 4.04Å; Y265-L269 HydrophobicContact CD1-CD2 3.82Å; Y265-L269 HydrophobicContact CE1-CD2 4.42Å; Y265-L269 HydrophobicContact CG-CD2 4.4Å; L269-Y274 HydrophobicContact CD2-CE1 4.13Å; L269-F295 HydrophobicContact CD1-CD1 4.28Å
270	P	95.2	Very high	94.3	Very high	43 Å²	43	36.2 Å²	36.2	28%	0.279	24%	0.237	S	C	.	.			trans	-57.1	156.3	176.9	-25.6	34.4	0	0	0	113.2	G268 G272 Y274	G268-P270 WeakPolarHBondContact O-CD 3.34Å; P270-G272 PolarHBondContact O-N 2.85Å; P270-Y274 WeakPolarHBondContact CD-OH 3.39Å; P270-Y274 WeakPolarHBondContact O-CE2 3.37Å; P270-Y274 PolarHBondContact O-OH 2.99Å
271	A	95.2	Very high	94.2	Very high	53 Å²	53	39.1 Å²	39.1	44%	0.438	25%	0.252	S	S	.	.	S	Bend	trans	-58.2	139.5	169.3	0	0	0	0	0	110.3	L94 S95	L94-A271 CarbonylContact O-C 3.57Å; L94-A271 VanDerWaalsContact O-CA 3.31Å; L94-A271 WeakPolarHBondContact O-CA 3.48Å; S95-A271 WeakPolarHBondContact O-CB 3.39Å
272	G	95.3	Very high	94.4	Very high	25 Å²	25	38.3 Å²	38.3	26%	0.258	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	150.5	-175.5	-177.7	0	0	0	0	0	113.8	S93 L94 P270 Y274	S93-G272 CarbonylContact C-O 3.54Å; S93-G272 WeakPolarHBondContact CA-O 3.43Å; L94-G272 PolarHBondContact N-O 2.81Å; L94-G272 PolarHBondContact O-N 2.91Å; P270-G272 PolarHBondContact O-N 2.85Å; G272-Y274 WeakPolarHBondContact O-CD2 3.39Å
273	N	97.2	Very high	94.7	Very high	93 Å²	93	37.3 Å²	37.3	50%	0.497	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.9	-179.5	-66.3	-22.1	0	0	0	110.7	S93 I173	S93-N273 VanDerWaalsContact CB-OD1 3.23Å; S93-N273 WeakPolarHBondContact CB-OD1 3.24Å; I173-N273 HydrophobicContact CB-CB 4.18Å; I173-N273 WeakPolarHBondContact CB-O 3.48Å; I173-N273 HydrophobicContact CD1-CB 4.22Å; I173-N273 PolarHBondContact N-O 3.12Å
274	Y	97.3	Very high	95	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	147.7	-179.6	-71.8	-94.6	0	0	0	110.2	E91 F92 L94 L170 Y171 Q172 V181 L269 P270 G272	E91-Y274 WeakPolarHBondContact CA-O 3.5Å; F92-Y274 HydrophobicContact CE2-CD2 4.26Å; F92-Y274 HydrophobicContact CE2-CG 4.02Å; F92-Y274 HydrophobicContact CZ-CG 4.29Å; F92-Y274 PolarHBondContact N-O 2.98Å; F92-Y274 PolarHBondContact O-N 3.45Å; L94-Y274 HydrophobicContact CB-CE2 4.4Å; L94-Y274 HydrophobicContact CD1-CD2 3.95Å; L94-Y274 HydrophobicContact CD1-CE2 3.56Å; L94-Y274 HydrophobicContact CG-CD2 4Å; L94-Y274 HydrophobicContact CG-CE2 3.98Å; L170-Y274 HydrophobicContact CD1-CD1 4.05Å; L170-Y274 HydrophobicContact CD2-CD1 4.47Å; L170-Y274 HydrophobicContact CG-CD1 4.27Å; Y171-Y274 CarbonylContact O-C 3.46Å; Y171-Y274 VanDerWaalsContact O-CA 3.26Å; Y171-Y274 WeakPolarHBondContact O-CA 3.29Å; Q172-Y274 HydrophobicContact CB-CD1 4.06Å; Q172-Y274 HydrophobicContact CB-CE1 3.64Å; Q172-Y274 HydrophobicContact CG-CD1 4.38Å; Q172-Y274 HydrophobicContact CG-CE1 3.78Å; Q172-Y274 HydrophobicContact CG-CE2 4.43Å; Q172-Y274 PolarHBondContact NE2-OH 3.47Å; V181-Y274 HydrophobicContact CG2-CD1 4.5Å; V181-Y274 HydrophobicContact CG2-CE1 4.17Å; L269-Y274 HydrophobicContact CD2-CE1 4.13Å; P270-Y274 WeakPolarHBondContact CD-OH 3.39Å; P270-Y274 WeakPolarHBondContact O-CE2 3.37Å; P270-Y274 PolarHBondContact O-OH 2.99Å; G272-Y274 WeakPolarHBondContact O-CD2 3.39Å
275	S	97.2	Very high	95.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	123.2	171.8	177	0	0	0	0	108.6	L90 Y171	L90-S275 WeakPolarHBondContact O-CA 3.46Å; Y171-S275 PolarHBondContact N-O 3.24Å; Y171-S275 PolarHBondContact O-N 3.42Å
276	L	97.7	Very high	95.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	117.8	173.4	-176.4	71.4	0	0	0	108.7	K89 L90 F92 F104 F168 L170 I278 V293	K89-L276 CarbonylContact C-O 3.56Å; K89-L276 WeakPolarHBondContact CA-O 3.48Å; L90-L276 HydrophobicContact CB-CB 4.33Å; L90-L276 HydrophobicContact CD1-CD2 4.29Å; L90-L276 PolarHBondContact N-O 2.9Å; L90-L276 PolarHBondContact O-N 3.31Å; F92-L276 HydrophobicContact CE1-CB 4.22Å; F104-L276 HydrophobicContact CE2-CD2 4.48Å; F104-L276 HydrophobicContact CZ-CD1 4.33Å; F104-L276 HydrophobicContact CZ-CD2 4.37Å; F168-L276 HydrophobicContact CB-CD1 4.18Å; F168-L276 HydrophobicContact CD1-CD1 4.5Å; F168-L276 HydrophobicContact CD1-CD2 4.2Å; L170-L276 HydrophobicContact CB-CD1 4.06Å; L170-L276 HydrophobicContact CD1-CB 4.36Å; L170-L276 HydrophobicContact CD1-CD1 4.17Å; L276-I278 HydrophobicContact CD2-CD1 3.96Å; L276-I278 HydrophobicContact CD2-CG1 4.1Å; L276-I278 HydrophobicContact CG-CD1 4.37Å; L276-I278 HydrophobicContact CG-CG1 4Å; L276-V293 HydrophobicContact CD2-CB 4.22Å; L276-V293 HydrophobicContact CD2-CG1 3.89Å; L276-V293 HydrophobicContact CD2-CG2 3.87Å
277	E	97.2	Very high	95.1	Very high	52 Å²	52	38.6 Å²	38.6	24%	0.243	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	129.3	172.6	-57.2	-168.5	163.1	0	0	109.4	K89 F168 K169 Y171 K178	K89-E277 WeakPolarHBondContact CE-OE1 3.38Å; K89-E277 HydrophobicContact CG-CG 4.25Å; K89-E277 IonicContact NZ-OE1 3.98Å; F168-E277 WeakPolarHBondContact CA-O 3.32Å; K169-E277 HydrophobicContact CB-CB 4.43Å; K169-E277 PolarHBondContact N-O 3.48Å; K169-E277 PolarHBondContact O-N 3.47Å; Y171-E277 HydrophobicContact CD2-CG 4Å; Y171-E277 HydrophobicContact CE2-CB 4.27Å; Y171-E277 HydrophobicContact CE2-CG 3.75Å; K178-E277 IonicContact NZ-OE1 2.86Å; K178-E277 PolarHBondContact NZ-OE1 3.4Å
278	I	97.4	Very high	95.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	121.8	-172.1	-48.5	-178.5	0	0	0	108.6	Y66 T87 C88 L90 T167 F168 L276	Y66-I278 HydrophobicContact CD1-CD1 4.38Å; Y66-I278 HydrophobicContact CD2-CD1 3.7Å; Y66-I278 HydrophobicContact CD2-CG2 4.1Å; Y66-I278 HydrophobicContact CE2-CD1 4.3Å; Y66-I278 HydrophobicContact CE2-CG2 3.89Å; Y66-I278 HydrophobicContact CG-CD1 3.75Å; T87-I278 CarbonylContact C-O 3.46Å; T87-I278 VanDerWaalsContact CA-O 3.23Å; T87-I278 WeakPolarHBondContact CA-O 3.33Å; C88-I278 PolarHBondContact N-O 3.43Å; C88-I278 PolarHBondContact O-N 2.93Å; L90-I278 HydrophobicContact CD1-CD1 3.6Å; L90-I278 HydrophobicContact CG-CD1 3.87Å; T167-I278 WeakPolarHBondContact O-CA 3.29Å; F168-I278 HydrophobicContact CD1-CB 4.43Å; F168-I278 HydrophobicContact CD1-CD1 4.41Å; F168-I278 HydrophobicContact CD1-CG1 3.99Å; F168-I278 HydrophobicContact CD1-CG2 4.02Å; F168-I278 HydrophobicContact CE1-CD1 4.24Å; F168-I278 HydrophobicContact CE1-CG1 4.22Å; F168-I278 HydrophobicContact CE1-CG2 3.75Å; L276-I278 HydrophobicContact CD2-CD1 3.96Å; L276-I278 HydrophobicContact CD2-CG1 4.1Å; L276-I278 HydrophobicContact CG-CD1 4.37Å; L276-I278 HydrophobicContact CG-CG1 4Å
279	A	96.3	Very high	95.4	Very high	21 Å²	21	36.6 Å²	36.6	17%	0.174	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	112.6	163.7	0	0	0	0	0	108.4	T87 D166 T167 N281	T87-A279 HydrophobicContact CG2-CB 4.38Å; D166-A279 VanDerWaalsContact CA-O 3.3Å; D166-A279 WeakPolarHBondContact CA-O 3.28Å; D166-A279 WeakPolarHBondContact CB-O 3.33Å; T167-A279 PolarHBondContact N-O 2.94Å; T167-A279 PolarHBondContact O-N 3.27Å; T167-A279 WeakPolarHBondContact OG1-CB 3.48Å; A279-N281 PolarHBondContact O-N 3.42Å
280	Y	95.1	Very high	95.4	Very high	16 Å²	16	41 Å²	41	6%	0.063	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	96.7	-170.5	-163.8	-73	0	0	0	109.7	Y66 T67 C78 C86 K291	Y66-Y280 HydrophobicContact CD2-CD2 4.13Å; Y66-Y280 HydrophobicContact CD2-CE2 4.1Å; Y66-Y280 HydrophobicContact CE2-CD2 4.29Å; Y66-Y280 HydrophobicContact CE2-CE2 4.32Å; Y66-Y280 WeakPolarHBondContact O-CE2 3.5Å; T67-Y280 PolarHBondContact O-OH 3.33Å; C78-Y280 HydrophobicContact CB-CD1 4Å; C78-Y280 HydrophobicContact CB-CD2 4.1Å; C78-Y280 HydrophobicContact CB-CG 3.69Å; C78-Y280 VanDerWaalsContact O-CD1 3.26Å; C78-Y280 WeakPolarHBondContact O-CD1 3.15Å; C78-Y280 VanDerWaalsContact O-CE1 3.29Å; C78-Y280 WeakPolarHBondContact O-CE1 3.4Å; C86-Y280 PolarHBondContact O-N 2.64Å; Y280-K291 VanDerWaalsContact CE1-NZ 3.29Å; Y280-K291 VanDerWaalsContact OH-CE 3.27Å; Y280-K291 WeakPolarHBondContact OH-CE 3.47Å
281	N	93.9	Very high	95.5	Very high	62 Å²	62	39 Å²	39	33%	0.332	23%	0.232	S	C	.	.			trans	-116.5	-19	-175.4	-61.4	-42.9	0	0	0	113.2	N165 D166 A279 P283	N165-N281 PolarHBondContact O-ND2 3.42Å; N165-N281 VanDerWaalsContact OD1-C 3.3Å; N165-N281 VanDerWaalsContact OD1-CB 3.31Å; N165-N281 WeakPolarHBondContact OD1-CB 3.27Å; N165-N281 PolarHBondContact OD1-O 2.82Å; D166-N281 WeakPolarHBondContact OD1-CA 3.37Å; D166-N281 PolarHBondContact OD1-N 3.11Å; A279-N281 PolarHBondContact O-N 3.42Å; N281-P283 VanDerWaalsContact O-CD 3.3Å; N281-P283 WeakPolarHBondContact O-CD 3.43Å
282	Y	94.6	Very high	95.6	Very high	20 Å²	20	39 Å²	39	8%	0.078	22%	0.223	C	C	.	.			trans	-101.7	104.9	-172	-157.2	-100.2	0	0	0	111.4	L108 Y111 S162 M163 F164 N165 D166 V284 K291	L108-Y282 HydrophobicContact CD1-CE1 4.14Å; Y111-Y282 HydrophobicContact CE2-CE1 4.25Å; Y111-Y282 VanDerWaalsContact CE2-OH 3.31Å; Y111-Y282 WeakPolarHBondContact CE2-OH 3.2Å; Y111-Y282 PolarHBondContact OH-OH 3.23Å; S162-Y282 WeakPolarHBondContact O-CE2 3.43Å; S162-Y282 PolarHBondContact O-OH 2.99Å; M163-Y282 WeakPolarHBondContact O-CE2 3.28Å; F164-Y282 AromaticContact CD2-CD1 3.85Å; F164-Y282 HydrophobicContact CD2-CD1 3.85Å; F164-Y282 HydrophobicContact CD2-CD2 4.23Å; F164-Y282 HydrophobicContact CD2-CE1 4.27Å; F164-Y282 AromaticContact CD2-CG 3.81Å; F164-Y282 HydrophobicContact CD2-CG 3.81Å; F164-Y282 HydrophobicContact CE2-CD1 4.18Å; F164-Y282 HydrophobicContact CE2-CG 4.18Å; N165-Y282 WeakPolarHBondContact OD1-CB 3.33Å; N165-Y282 WeakPolarHBondContact OD1-CD2 3.19Å; N165-Y282 PolarHBondContact OD1-N 3.2Å; D166-Y282 WeakPolarHBondContact OD1-CB 3.21Å; D166-Y282 PolarHBondContact OD1-N 3.25Å; Y282-V284 HydrophobicContact CD1-CG1 3.81Å; Y282-V284 HydrophobicContact CE1-CG1 4.18Å; Y282-K291 WeakPolarHBondContact O-CE 3.43Å; Y282-K291 PolarHBondContact O-NZ 3.11Å
283	P	93.7	Very high	95.8	Very high	79 Å²	79	37.9 Å²	37.9	51%	0.513	21%	0.211	S	C	.	.			trans	-78.5	130.9	-178.6	31.3	-34.1	0	0	0	111.2	N281	N281-P283 VanDerWaalsContact O-CD 3.3Å; N281-P283 WeakPolarHBondContact O-CD 3.43Å
284	V	94.7	Very high	95.8	Very high	2 Å²	2	33.6 Å²	33.6	1%	0.012	19%	0.188	C	C	.	.			trans	-124.6	-16.4	177.4	-57.9	0	0	0	0	114.5	T67 L108 Y282 S286 F287 G288 G289 K291	T67-V284 HydrophobicContact CG2-CG2 3.67Å; L108-V284 HydrophobicContact CD2-CG1 4.2Å; Y282-V284 HydrophobicContact CD1-CG1 3.81Å; Y282-V284 HydrophobicContact CE1-CG1 4.18Å; V284-S286 VanDerWaalsContact C-N 3.28Å; V284-S286 PolarHBondContact O-N 3.2Å; V284-F287 HydrophobicContact CB-CE1 4.28Å; V284-F287 HydrophobicContact CB-CE2 4.16Å; V284-F287 HydrophobicContact CB-CZ 3.71Å; V284-F287 HydrophobicContact CG1-CZ 3.84Å; V284-F287 PolarHBondContact O-N 3.33Å; V284-G288 PolarHBondContact O-N 3.3Å; V284-G289 WeakPolarHBondContact CG2-O 3.26Å; V284-G289 WeakPolarHBondContact O-CA 3.34Å; V284-G289 PolarHBondContact O-N 3.44Å; V284-K291 HydrophobicContact CB-CG 4.28Å; V284-K291 HydrophobicContact CG1-CD 3.82Å; V284-K291 HydrophobicContact CG1-CG 3.6Å; V284-K291 HydrophobicContact CG2-CD 4.26Å; V284-K291 HydrophobicContact CG2-CG 3.68Å
285	L	92.9	Very high	95.8	Very high	65 Å²	65	33.7 Å²	33.7	34%	0.34	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-66.6	-28.9	-173.8	-70.7	-178.5	0	0	0	113.2	T67 V69 F287 G288	T67-L285 HydrophobicContact CG2-CD2 3.66Å; T67-L285 HydrophobicContact CG2-CG 4.31Å; V69-L285 HydrophobicContact CG2-CD2 4.02Å; L285-F287 PolarHBondContact O-N 3.13Å; L285-G288 PolarHBondContact O-N 3.19Å
286	S	91.9	Very high	95.7	Very high	109 Å²	109	33.7 Å²	33.7	76%	0.762	19%	0.188	S	C	*	.	G	3₁₀ helix	trans	-60.8	-26.2	-178.8	53.4	0	0	0	0	113.8	V284	V284-S286 VanDerWaalsContact C-N 3.28Å; V284-S286 PolarHBondContact O-N 3.2Å
287	F	93.1	Very high	95.5	Very high	82 Å²	82	34.4 Å²	34.4	36%	0.36	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-115	15.7	176.1	56.6	-95.7	0	0	0	112.5	N110 Y111 V284 L285 G289	N110-F287 PolarHBondContact ND2-O 3.37Å; Y111-F287 AromaticContact CD2-CE2 3.97Å; Y111-F287 HydrophobicContact CD2-CE2 3.97Å; Y111-F287 AromaticContact CD2-CZ 3.76Å; Y111-F287 HydrophobicContact CD2-CZ 3.76Å; Y111-F287 HydrophobicContact CE2-CZ 4.22Å; V284-F287 HydrophobicContact CB-CE1 4.28Å; V284-F287 HydrophobicContact CB-CE2 4.16Å; V284-F287 HydrophobicContact CB-CZ 3.71Å; V284-F287 HydrophobicContact CG1-CZ 3.84Å; V284-F287 PolarHBondContact O-N 3.33Å; L285-F287 PolarHBondContact O-N 3.13Å; F287-G289 VanDerWaalsContact C-N 3.29Å; F287-G289 PolarHBondContact O-N 2.82Å
288	G	95	Very high	95.3	Very high	43 Å²	43	34.2 Å²	34.2	44%	0.443	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	27.4	-179.1	0	0	0	0	0	113.8	N110 V284 L285	N110-G288 PolarHBondContact ND2-O 3Å; N110-G288 VanDerWaalsContact ND2-O 3.13Å; V284-G288 PolarHBondContact O-N 3.3Å; L285-G288 PolarHBondContact O-N 3.19Å
289	G	96.3	Very high	95	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	20%	0.203	C	C	.	.			trans	-76.7	163.8	175.2	0	0	0	0	0	113.4	S109 V284 F287	S109-G289 VanDerWaalsContact O-CA 3.28Å; S109-G289 WeakPolarHBondContact O-CA 3.32Å; V284-G289 WeakPolarHBondContact CG2-O 3.26Å; V284-G289 WeakPolarHBondContact O-CA 3.34Å; V284-G289 PolarHBondContact O-N 3.44Å; F287-G289 VanDerWaalsContact C-N 3.29Å; F287-G289 PolarHBondContact O-N 2.82Å
290	R	97	Very high	94.7	Very high	94 Å²	94	44.1 Å²	44.1	36%	0.355	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	151	170.1	-58.8	-70.2	-168.1	-128.3	7.7	110.4	T67 V69 L108 S109	T67-R290 WeakPolarHBondContact OG1-CA 3.19Å; V69-R290 VanDerWaalsContact CG2-CZ 3.4Å; L108-R290 WeakPolarHBondContact CA-O 3.4Å; S109-R290 PolarHBondContact N-O 2.87Å; S109-R290 PolarHBondContact O-N 3.29Å
291	K	97.3	Very high	94.4	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.3	173.2	-56.9	-167.8	-67.9	-175.1	0	110.2	Y66 T67 G107 L108 F164 D166 Y280 Y282 V284	Y66-K291 HydrophobicContact CD1-CB 4.08Å; Y66-K291 WeakPolarHBondContact CD1-O 3.37Å; Y66-K291 HydrophobicContact CD2-CB 4.38Å; Y66-K291 HydrophobicContact CE1-CB 3.54Å; Y66-K291 HydrophobicContact CE2-CB 3.88Å; Y66-K291 HydrophobicContact CE2-CD 4.01Å; Y66-K291 HydrophobicContact CG-CB 4.46Å; Y66-K291 VanDerWaalsContact CZ-CB 3.42Å; Y66-K291 PolarHBondContact N-O 2.89Å; T67-K291 PolarHBondContact OG1-N 2.87Å; T67-K291 PolarHBondContact OG1-O 3.45Å; G107-K291 WeakPolarHBondContact O-CA 3.25Å; L108-K291 HydrophobicContact CD2-CD 4.36Å; L108-K291 HydrophobicContact CD2-CG 3.82Å; F164-K291 HydrophobicContact CE2-CD 4.39Å; D166-K291 IonicContact OD1-NZ 2.61Å; D166-K291 WeakPolarHBondContact OD2-CD 3.22Å; D166-K291 WeakPolarHBondContact OD2-CE 3.17Å; D166-K291 IonicContact OD2-NZ 3.58Å; D166-K291 PolarHBondContact OD2-NZ 2.85Å; Y280-K291 VanDerWaalsContact CE1-NZ 3.29Å; Y280-K291 VanDerWaalsContact OH-CE 3.27Å; Y280-K291 WeakPolarHBondContact OH-CE 3.47Å; Y282-K291 WeakPolarHBondContact O-CE 3.43Å; Y282-K291 PolarHBondContact O-NZ 3.11Å; V284-K291 HydrophobicContact CB-CG 4.28Å; V284-K291 HydrophobicContact CG1-CD 3.82Å; V284-K291 HydrophobicContact CG1-CG 3.6Å; V284-K291 HydrophobicContact CG2-CD 4.26Å; V284-K291 HydrophobicContact CG2-CG 3.68Å
292	K	97.4	Very high	94.2	Very high	54 Å²	54	44.3 Å²	44.3	24%	0.235	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	149.8	-178.2	-57.7	180	173.9	-171.3	0	110.1	E63 K64 D65 Y66 Y106 G107	E63-K292 HydrophobicContact CG-CB 4.35Å; E63-K292 HydrophobicContact CG-CD 4.06Å; E63-K292 WeakPolarHBondContact OE1-CD 3.36Å; E63-K292 WeakPolarHBondContact OE1-CE 3.39Å; E63-K292 IonicContact OE1-NZ 2.73Å; E63-K292 PolarHBondContact OE1-NZ 3.46Å; K64-K292 CarbonylContact O-C 3.55Å; K64-K292 VanDerWaalsContact O-CA 3.29Å; K64-K292 WeakPolarHBondContact O-CA 3.47Å; D65-K292 HydrophobicContact CB-CG 4.47Å; Y66-K292 VanDerWaalsContact CE1-C 3.47Å; Y106-K292 CarbonylContact C-O 3.56Å; Y106-K292 WeakPolarHBondContact CA-O 3.43Å; G107-K292 PolarHBondContact N-O 3.17Å; G107-K292 PolarHBondContact O-N 3.02Å
293	V	97.8	Very high	94	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	138	165.9	-70.5	0	0	0	0	108.6	E63 K64 Y66 L90 F104 F168 L276	E63-V293 WeakPolarHBondContact CA-O 3.48Å; K64-V293 HydrophobicContact CB-CG2 3.86Å; K64-V293 PolarHBondContact N-O 2.94Å; K64-V293 PolarHBondContact O-N 2.98Å; Y66-V293 HydrophobicContact CD1-CG1 3.8Å; Y66-V293 HydrophobicContact CE1-CG1 3.58Å; L90-V293 HydrophobicContact CD1-CG2 4.01Å; F104-V293 HydrophobicContact CE2-CB 3.83Å; F104-V293 HydrophobicContact CE2-CG1 3.99Å; F104-V293 HydrophobicContact CZ-CB 4.36Å; F104-V293 HydrophobicContact CZ-CG1 4Å; F168-V293 HydrophobicContact CD1-CG1 4.17Å; F168-V293 HydrophobicContact CE1-CG1 3.58Å; F168-V293 HydrophobicContact CZ-CG1 4.08Å; L276-V293 HydrophobicContact CD2-CB 4.22Å; L276-V293 HydrophobicContact CD2-CG1 3.89Å; L276-V293 HydrophobicContact CD2-CG2 3.87Å
294	V	97.6	Very high	93.9	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.024	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	121.6	-176.1	-172.1	0	0	0	0	109.4	V61 L62 E63 Y105	V61-V294 HydrophobicContact CG1-CG1 3.68Å; L62-V294 CarbonylContact O-C 3.57Å; L62-V294 VanDerWaalsContact O-CA 3.29Å; L62-V294 WeakPolarHBondContact O-CA 3.48Å; E63-V294 HydrophobicContact CB-CG2 4.36Å; E63-V294 HydrophobicContact CG-CG2 4.05Å; Y105-V294 PolarHBondContact N-O 3.01Å; Y105-V294 PolarHBondContact O-N 3.06Å
295	F	97.1	Very high	93.9	Very high	3 Å²	3	49.3 Å²	49.3	1%	0.013	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	129.7	165.6	-60.2	-91.7	0	0	0	107.8	V61 L62 F92 F98 V102 F103 F104 L170 I260 L269	V61-F295 CarbonylContact C-O 3.53Å; V61-F295 WeakPolarHBondContact CA-O 3.36Å; L62-F295 HydrophobicContact CB-CB 4.32Å; L62-F295 HydrophobicContact CD2-CD2 4.14Å; L62-F295 PolarHBondContact N-O 3.41Å; L62-F295 PolarHBondContact O-N 3.49Å; F92-F295 HydrophobicContact CE1-CE2 4.22Å; F92-F295 HydrophobicContact CZ-CD2 4.41Å; F92-F295 AromaticContact CZ-CE2 3.8Å; F92-F295 HydrophobicContact CZ-CE2 3.8Å; F92-F295 HydrophobicContact CZ-CZ 4.15Å; F98-F295 HydrophobicContact CE2-CB 4.35Å; F98-F295 HydrophobicContact CZ-CB 4.21Å; F98-F295 WeakPolarHBondContact CZ-O 3.26Å; V102-F295 HydrophobicContact CG1-CB 4.41Å; V102-F295 HydrophobicContact CG1-CD1 4.38Å; F103-F295 WeakPolarHBondContact O-CA 3.29Å; F104-F295 HydrophobicContact CB-CD1 4.13Å; F104-F295 HydrophobicContact CB-CE1 4.02Å; F104-F295 AromaticContact CD2-CD1 3.68Å; F104-F295 HydrophobicContact CD2-CD1 3.68Å; F104-F295 HydrophobicContact CD2-CD2 4.27Å; F104-F295 AromaticContact CD2-CE1 3.22Å; F104-F295 HydrophobicContact CD2-CE1 3.22Å; F104-F295 AromaticContact CD2-CE2 3.88Å; F104-F295 HydrophobicContact CD2-CE2 3.88Å; F104-F295 HydrophobicContact CD2-CG 4.19Å; F104-F295 AromaticContact CD2-CZ 3.33Å; F104-F295 HydrophobicContact CD2-CZ 3.33Å; F104-F295 AromaticContact CE2-CE1 3.81Å; F104-F295 HydrophobicContact CE2-CE1 3.81Å; F104-F295 AromaticContact CE2-CE2 3.82Å; F104-F295 HydrophobicContact CE2-CE2 3.82Å; F104-F295 AromaticContact CE2-CZ 3.4Å; F104-F295 HydrophobicContact CE2-CZ 3.4Å; F104-F295 HydrophobicContact CG-CD1 4.27Å; F104-F295 AromaticContact CG-CE1 3.79Å; F104-F295 HydrophobicContact CG-CE1 3.79Å; F104-F295 HydrophobicContact CG-CZ 4.25Å; F104-F295 HydrophobicContact CZ-CZ 4.41Å; L170-F295 HydrophobicContact CD1-CZ 4.27Å; L170-F295 HydrophobicContact CD2-CE1 3.82Å; L170-F295 HydrophobicContact CD2-CZ 4.14Å; I260-F295 HydrophobicContact CD1-CD1 4.32Å; I260-F295 HydrophobicContact CD1-CE1 4.19Å; L269-F295 HydrophobicContact CD1-CD1 4.28Å
296	S	95.9	Very high	93.9	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	139.3	-179.2	-170.5	0	0	0	0	109.3	T60 F103	T60-S296 WeakPolarHBondContact O-CA 3.39Å; F103-S296 PolarHBondContact N-O 3.13Å; F103-S296 PolarHBondContact O-N 2.88Å
297	N	93.8	Very high	94.2	Very high	14 Å²	14	51.1 Å²	51.1	8%	0.075	26%	0.256	C	S	.	.			trans	-82.2	167.9	157.3	65.5	-6.2	0	0	0	108.2	I59 T60 F98 E99	I59-N297 VanDerWaalsContact CA-OD1 3.27Å; I59-N297 WeakPolarHBondContact CA-OD1 3.23Å; I59-N297 WeakPolarHBondContact CG2-O 3.45Å; I59-N297 WeakPolarHBondContact CG2-OD1 3.23Å; T60-N297 PolarHBondContact N-OD1 2.87Å; T60-N297 PolarHBondContact O-N 3.32Å; T60-N297 PolarHBondContact O-OD1 3.26Å; T60-N297 PolarHBondContact OG1-ND2 2.93Å; T60-N297 PolarHBondContact OG1-OD1 3.48Å; F98-N297 HydrophobicContact CE1-CB 4.13Å; E99-N297 VanDerWaalsContact O-CB 3.29Å; E99-N297 WeakPolarHBondContact O-CB 3.49Å
298	V	92.2	Very high	94.3	Very high	49 Å²	49	50.7 Å²	50.7	30%	0.297	26%	0.257	S	S	.	.			trans	-131.3	146.5	177.6	-57.3	0	0	0	0	109.5	F103	F103-V298 HydrophobicContact CD2-CB 4.45Å; F103-V298 HydrophobicContact CD2-CG1 3.76Å; F103-V298 HydrophobicContact CD2-CG2 4Å; F103-V298 HydrophobicContact CE2-CB 4.27Å; F103-V298 HydrophobicContact CE2-CG1 4.01Å; F103-V298 HydrophobicContact CE2-CG2 3.36Å; F103-V298 HydrophobicContact CG-CG1 4.48Å; F103-V298 HydrophobicContact CZ-CG2 4.04Å
299	S	90.8	Very high	94.3	Very high	27 Å²	27	48.7 Å²	48.7	19%	0.189	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-94.7	178.9	166.9	71.6	0	0	0	0	110.1	M301 G302	S299-M301 PolarHBondContact O-N 2.93Å; S299-M301 VanDerWaalsContact O-N 3.13Å; S299-M301 PolarHBondContact OG-N 3.27Å; S299-G302 PolarHBondContact N-O 3.09Å; S299-G302 PolarHBondContact O-N 2.85Å; S299-G302 PolarHBondContact OG-O 3.21Å; S299-G302 VanDerWaalsContact OG-O 3.11Å
300	W	90	Very high	94.4	Very high	202 Å²	202	52.3 Å²	52.3	77%	0.765	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-23.3	171.2	67.6	-92.1	0	0	0	113.5	L52	L52-W300 HydrophobicContact CD2-CH2 3.84Å; L52-W300 HydrophobicContact CD2-CZ2 3.82Å
301	M	89.3	Confident	94.4	Very high	55 Å²	55	49.3 Å²	49.3	27%	0.271	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	0.3	177	-172.1	175.8	55.9	0	0	112.6	L52 S299 L308	L52-M301 HydrophobicContact CB-CE 4.25Å; L52-M301 HydrophobicContact CB-SD 4.36Å; L52-M301 HydrophobicContact CD2-CE 4.17Å; L52-M301 HydrophobicContact CD2-SD 3.44Å; L52-M301 WeakPolarHBondContact CD2-SD 3.46Å; L52-M301 HydrophobicContact CG-SD 4.31Å; S299-M301 PolarHBondContact O-N 2.93Å; S299-M301 VanDerWaalsContact O-N 3.13Å; S299-M301 PolarHBondContact OG-N 3.27Å; M301-L308 HydrophobicContact SD-CD2 3.85Å
302	G	89.8	Confident	94.5	Very high	28 Å²	28	53 Å²	53	29%	0.289	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	98	-147.8	-175.5	0	0	0	0	0	112.7	I59 S299	I59-G302 WeakPolarHBondContact CD1-O 3.39Å; S299-G302 PolarHBondContact N-O 3.09Å; S299-G302 PolarHBondContact O-N 2.85Å; S299-G302 PolarHBondContact OG-O 3.21Å; S299-G302 VanDerWaalsContact OG-O 3.11Å
303	G	90.3	Very high	94.5	Very high	19 Å²	19	52.7 Å²	52.7	20%	0.196	27%	0.265	C	S	.	.	S	Bend	trans	-81.6	-179.6	-174.6	0	0	0	0	0	114.3	I59 N305	I59-G303 VanDerWaalsContact CD1-C 3.47Å; G303-N305 PolarHBondContact O-N 3.45Å; G303-N305 VanDerWaalsContact O-N 3.08Å
304	K	92.3	Very high	94.6	Very high	90 Å²	90	56.4 Å²	56.4	39%	0.391	29%	0.288	S	S	.	.	S	Bend	trans	-60.6	111	-179.6	-170.2	167.4	-167.3	153.6	0	111.2	I59 V61	I59-K304 HydrophobicContact CB-CB 4.01Å; I59-K304 HydrophobicContact CB-CG 4.48Å; I59-K304 HydrophobicContact CG2-CB 3.74Å; I59-K304 PolarHBondContact O-NZ 2.05Å; V61-K304 HydrophobicContact CG2-CB 3.69Å; V61-K304 HydrophobicContact CG2-CD 3.95Å; V61-K304 HydrophobicContact CG2-CG 4.47Å
305	N	93.6	Very high	94.6	Very high	96 Å²	96	59.4 Å²	59.4	51%	0.513	31%	0.306	S	S	.	.			trans	-154.1	115.9	172.9	-173.3	-9.1	0	0	0	109.7	S56 G303 F307	S56-N305 WeakPolarHBondContact CB-O 3.13Å; S56-N305 PolarHBondContact OG-N 3.4Å; S56-N305 PolarHBondContact OG-O 3.09Å; G303-N305 PolarHBondContact O-N 3.45Å; G303-N305 VanDerWaalsContact O-N 3.08Å; N305-F307 WeakPolarHBondContact OD1-CB 3.46Å; N305-F307 PolarHBondContact OD1-N 3.12Å
306	Q	94.6	Very high	94.7	Very high	62 Å²	62	59.2 Å²	59.2	29%	0.29	31%	0.305	S	S	.	.			trans	-90	-13	-176.7	-66.7	172.9	-22.2	0	0	112.8	F53 L308 G309 I310	F53-Q306 HydrophobicContact CD2-CB 4.31Å; F53-Q306 HydrophobicContact CD2-CG 4.42Å; F53-Q306 HydrophobicContact CE2-CB 4.21Å; F53-Q306 HydrophobicContact CE2-CG 4.18Å; Q306-L308 VanDerWaalsContact C-N 3.34Å; Q306-L308 PolarHBondContact O-N 2.98Å; Q306-G309 PolarHBondContact O-N 2.88Å; Q306-I310 HydrophobicContact CB-CD1 4Å; Q306-I310 WeakPolarHBondContact O-CG1 3.35Å; Q306-I310 PolarHBondContact O-N 3.34Å
307	F	96.3	Very high	94.8	Very high	151 Å²	151	62.1 Å²	62.1	66%	0.662	33%	0.325	S	S	*	.	H	α-helix	trans	-55.1	-47.6	-173.3	174	-99.4	0	0	0	112.3	N305 G309 I310 A311	N305-F307 WeakPolarHBondContact OD1-CB 3.46Å; N305-F307 PolarHBondContact OD1-N 3.12Å; F307-G309 PolarHBondContact O-N 3.11Å; F307-I310 PolarHBondContact O-N 2.83Å; F307-A311 WeakPolarHBondContact O-CB 3.04Å; F307-A311 PolarHBondContact O-N 3.12Å
308	L	95.3	Very high	95	Very high	73 Å²	73	66.3 Å²	66.3	38%	0.382	35%	0.347	S	S	.	.	H	α-helix	trans	-63.2	-45.9	-177.2	-167.5	65.4	0	0	0	111.2	L52 M301 Q306 I310 A311 Y312	L52-L308 HydrophobicContact CD1-CD2 4.05Å; L52-L308 HydrophobicContact CD1-CG 4.05Å; M301-L308 HydrophobicContact SD-CD2 3.85Å; Q306-L308 VanDerWaalsContact C-N 3.34Å; Q306-L308 PolarHBondContact O-N 2.98Å; L308-I310 PolarHBondContact O-N 3.31Å; L308-A311 PolarHBondContact O-N 3.27Å; L308-Y312 HydrophobicContact CD1-CD2 4.12Å; L308-Y312 HydrophobicContact CD1-CE2 3.83Å; L308-Y312 HydrophobicContact CG-CD2 4.05Å; L308-Y312 HydrophobicContact CG-CE2 4Å; L308-Y312 WeakPolarHBondContact O-CD2 3.47Å; L308-Y312 PolarHBondContact O-N 2.99Å
309	G	96.6	Very high	95.3	Very high	1 Å²	1	64.9 Å²	64.9	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-58.9	-47	175.8	0	0	0	0	0	112.2	Q306 F307 A311 Y312 L313	Q306-G309 PolarHBondContact O-N 2.88Å; F307-G309 PolarHBondContact O-N 3.11Å; G309-A311 PolarHBondContact O-N 3.14Å; G309-Y312 PolarHBondContact O-N 3.44Å; G309-L313 VanDerWaalsContact O-CG 3.3Å; G309-L313 WeakPolarHBondContact O-CG 3.42Å; G309-L313 PolarHBondContact O-N 3.42Å
310	I	97.7	Very high	95.6	Very high	75 Å²	75	65.4 Å²	65.4	39%	0.385	34%	0.341	S	S	.	.	H	α-helix	trans	-62	-43.1	177.5	-65.2	167.5	0	0	0	111.1	F53 Q306 F307 L308 Y312 L313 V314	F53-I310 HydrophobicContact CD2-CG1 4.14Å; F53-I310 HydrophobicContact CE2-CD1 4.4Å; F53-I310 HydrophobicContact CE2-CG1 4.15Å; Q306-I310 HydrophobicContact CB-CD1 4Å; Q306-I310 WeakPolarHBondContact O-CG1 3.35Å; Q306-I310 PolarHBondContact O-N 3.34Å; F307-I310 PolarHBondContact O-N 2.83Å; L308-I310 PolarHBondContact O-N 3.31Å; I310-Y312 PolarHBondContact O-N 3.34Å; I310-L313 PolarHBondContact O-N 3.1Å; I310-V314 HydrophobicContact CG2-CG2 4.16Å; I310-V314 WeakPolarHBondContact O-CB 3.4Å; I310-V314 VanDerWaalsContact O-CG2 3.31Å; I310-V314 WeakPolarHBondContact O-CG2 3.4Å; I310-V314 PolarHBondContact O-N 3.31Å
311	A	98.1	Very high	96	Very high	32 Å²	32	59.3 Å²	59.3	26%	0.264	33%	0.326	S	S	.	.	H	α-helix	trans	-61.2	-44.7	179	0	0	0	0	0	111.8	F307 L308 G309 V314 V315	F307-A311 WeakPolarHBondContact O-CB 3.04Å; F307-A311 PolarHBondContact O-N 3.12Å; L308-A311 PolarHBondContact O-N 3.27Å; G309-A311 PolarHBondContact O-N 3.14Å; A311-V314 PolarHBondContact O-N 3.32Å; A311-V315 WeakPolarHBondContact O-CB 3.13Å; A311-V315 VanDerWaalsContact O-CG2 3.3Å; A311-V315 WeakPolarHBondContact O-CG2 3.45Å; A311-V315 PolarHBondContact O-N 3.17Å
312	Y	98.3	Very high	96.3	Very high	77 Å²	77	60.8 Å²	60.8	30%	0.302	33%	0.334	S	S	.	.	H	α-helix	trans	-62.8	-41.5	175.1	-90.9	-86.4	0	0	0	112.4	F45 I48 L52 L308 G309 I310 G316	F45-Y312 HydrophobicContact CB-CD1 4.04Å; F45-Y312 HydrophobicContact CD1-CD1 4.03Å; F45-Y312 AromaticContact CD1-CE1 3.97Å; F45-Y312 HydrophobicContact CD1-CE1 3.97Å; F45-Y312 HydrophobicContact CD2-CD1 4.09Å; F45-Y312 HydrophobicContact CD2-CE1 4.39Å; F45-Y312 HydrophobicContact CE1-CE1 4.04Å; F45-Y312 HydrophobicContact CE2-CE1 4.46Å; F45-Y312 AromaticContact CG-CD1 3.79Å; F45-Y312 HydrophobicContact CG-CD1 3.79Å; F45-Y312 HydrophobicContact CG-CE1 4.15Å; F45-Y312 HydrophobicContact CZ-CE1 4.29Å; I48-Y312 HydrophobicContact CB-CD1 4.34Å; I48-Y312 HydrophobicContact CG2-CD1 4.02Å; I48-Y312 HydrophobicContact CG2-CE1 4.11Å; I48-Y312 HydrophobicContact CG2-CG 4.29Å; L52-Y312 HydrophobicContact CD1-CD2 3.9Å; L52-Y312 HydrophobicContact CD1-CE2 4.17Å; L52-Y312 HydrophobicContact CD1-CG 4.5Å; L308-Y312 HydrophobicContact CD1-CD2 4.12Å; L308-Y312 HydrophobicContact CD1-CE2 3.83Å; L308-Y312 HydrophobicContact CG-CD2 4.05Å; L308-Y312 HydrophobicContact CG-CE2 4Å; L308-Y312 WeakPolarHBondContact O-CD2 3.47Å; L308-Y312 PolarHBondContact O-N 2.99Å; G309-Y312 PolarHBondContact O-N 3.44Å; I310-Y312 PolarHBondContact O-N 3.34Å; Y312-G316 WeakPolarHBondContact O-CA 3.28Å; Y312-G316 PolarHBondContact O-N 3.03Å
313	L	98.4	Very high	96.7	Very high	47 Å²	47	59.7 Å²	59.7	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-62.5	-48.4	175.8	-70.2	172.1	0	0	0	111.5	I46 V50 G309 I310 G316 S317	I46-L313 HydrophobicContact CG2-CD2 4.26Å; V50-L313 HydrophobicContact CG2-CD2 3.79Å; G309-L313 VanDerWaalsContact O-CG 3.3Å; G309-L313 WeakPolarHBondContact O-CG 3.42Å; G309-L313 PolarHBondContact O-N 3.42Å; I310-L313 PolarHBondContact O-N 3.1Å; L313-G316 PolarHBondContact O-N 2.97Å; L313-S317 WeakPolarHBondContact O-CB 3.46Å; L313-S317 PolarHBondContact O-N 3.06Å; L313-S317 PolarHBondContact O-OG 3.46Å
314	V	98.4	Very high	96.9	Very high	79 Å²	79	63.9 Å²	63.9	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-62.4	-50.8	-179.6	170.5	0	0	0	0	111	I310 A311 G316 S317 L318	I310-V314 HydrophobicContact CG2-CG2 4.16Å; I310-V314 WeakPolarHBondContact O-CB 3.4Å; I310-V314 VanDerWaalsContact O-CG2 3.31Å; I310-V314 WeakPolarHBondContact O-CG2 3.4Å; I310-V314 PolarHBondContact O-N 3.31Å; A311-V314 PolarHBondContact O-N 3.32Å; V314-G316 VanDerWaalsContact C-N 3.35Å; V314-G316 PolarHBondContact O-N 3.13Å; V314-S317 PolarHBondContact O-N 2.95Å; V314-L318 HydrophobicContact CG1-CD1 4.01Å; V314-L318 WeakPolarHBondContact O-CB 3.42Å; V314-L318 VanDerWaalsContact O-CG 3.28Å; V314-L318 WeakPolarHBondContact O-CG 3.43Å; V314-L318 PolarHBondContact O-N 3.41Å
315	V	98.3	Very high	97.1	Very high	67 Å²	67	63 Å²	63	41%	0.406	34%	0.339	S	S	.	.	H	α-helix	trans	-64.6	-41.7	179.9	176.4	0	0	0	0	110.7	F45 A311 L318 C319	F45-V315 HydrophobicContact CD2-CB 4.36Å; F45-V315 HydrophobicContact CD2-CG1 3.89Å; F45-V315 HydrophobicContact CE2-CG1 4Å; A311-V315 WeakPolarHBondContact O-CB 3.13Å; A311-V315 VanDerWaalsContact O-CG2 3.3Å; A311-V315 WeakPolarHBondContact O-CG2 3.45Å; A311-V315 PolarHBondContact O-N 3.17Å; V315-L318 PolarHBondContact O-N 3.19Å; V315-C319 PolarHBondContact O-N 2.98Å; V315-C319 PolarHBondContact O-SG 2.74Å; V315-C319 VanDerWaalsContact O-SG 3.36Å
316	G	98.5	Very high	97.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-45.5	176.7	0	0	0	0	0	112.7	G42 Y312 L313 V314 C319 V320	G42-G316 WeakPolarHBondContact CA-O 3.41Å; Y312-G316 WeakPolarHBondContact O-CA 3.28Å; Y312-G316 PolarHBondContact O-N 3.03Å; L313-G316 PolarHBondContact O-N 2.97Å; V314-G316 VanDerWaalsContact C-N 3.35Å; V314-G316 PolarHBondContact O-N 3.13Å; G316-C319 WeakPolarHBondContact O-CB 3.11Å; G316-C319 PolarHBondContact O-N 3.29Å; G316-V320 WeakPolarHBondContact O-CG2 3.47Å; G316-V320 PolarHBondContact O-N 2.99Å; G316-V320 VanDerWaalsContact O-N 3.14Å
317	S	98.1	Very high	97.2	Very high	60 Å²	60	62.7 Å²	62.7	42%	0.42	34%	0.338	S	S	.	.	H	α-helix	trans	-62.9	-42.2	174.6	-64.3	0	0	0	0	112.2	L313 V314 C319 V320 V321	L313-S317 WeakPolarHBondContact O-CB 3.46Å; L313-S317 PolarHBondContact O-N 3.06Å; L313-S317 PolarHBondContact O-OG 3.46Å; V314-S317 PolarHBondContact O-N 2.95Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 2.97Å; S317-V320 PolarHBondContact O-N 3.5Å; S317-V321 WeakPolarHBondContact O-CG2 3.22Å; S317-V321 PolarHBondContact O-N 2.94Å
318	L	98.3	Very high	97.2	Very high	103 Å²	103	61.2 Å²	61.2	54%	0.539	34%	0.335	S	S	.	.	H	α-helix	trans	-61	-40.4	175.1	-73.5	172	0	0	0	111.7	V314 V315 V320 V321 M322	V314-L318 HydrophobicContact CG1-CD1 4.01Å; V314-L318 WeakPolarHBondContact O-CB 3.42Å; V314-L318 VanDerWaalsContact O-CG 3.28Å; V314-L318 WeakPolarHBondContact O-CG 3.43Å; V314-L318 PolarHBondContact O-N 3.41Å; V315-L318 PolarHBondContact O-N 3.19Å; L318-V320 PolarHBondContact O-N 3.36Å; L318-V321 PolarHBondContact O-N 3.28Å; L318-M322 WeakPolarHBondContact O-CB 3.37Å; L318-M322 VanDerWaalsContact O-CG 3.25Å; L318-M322 WeakPolarHBondContact O-CG 3.46Å; L318-M322 PolarHBondContact O-N 3.02Å
319	C	97.9	Very high	97.1	Very high	18 Å²	18	61 Å²	61	12%	0.122	34%	0.337	C	S	.	.	H	α-helix	trans	-61.3	-42.7	175.6	-74.2	0	0	0	0	112.5	F38 V315 G316 S317 S323	F38-C319 HydrophobicContact CD1-CB 4.14Å; V315-C319 PolarHBondContact O-N 2.98Å; V315-C319 PolarHBondContact O-SG 2.74Å; V315-C319 VanDerWaalsContact O-SG 3.36Å; G316-C319 WeakPolarHBondContact O-CB 3.11Å; G316-C319 PolarHBondContact O-N 3.29Å; S317-C319 VanDerWaalsContact C-N 3.32Å; S317-C319 PolarHBondContact O-N 2.97Å; C319-S323 WeakPolarHBondContact O-CB 3.44Å; C319-S323 PolarHBondContact O-N 3.16Å
320	V	97.6	Very high	96.9	Very high	38 Å²	38	65.2 Å²	65.2	23%	0.23	35%	0.353	C	S	.	.	H	α-helix	trans	-66.4	-44.8	177.5	176.1	0	0	0	0	111.1	I46 G316 S317 L318 S323 M324	I46-V320 HydrophobicContact CD1-CG2 4.15Å; G316-V320 WeakPolarHBondContact O-CG2 3.47Å; G316-V320 PolarHBondContact O-N 2.99Å; G316-V320 VanDerWaalsContact O-N 3.14Å; S317-V320 PolarHBondContact O-N 3.5Å; L318-V320 PolarHBondContact O-N 3.36Å; V320-S323 WeakPolarHBondContact O-CB 3.44Å; V320-S323 PolarHBondContact O-N 3.3Å; V320-M324 PolarHBondContact O-N 3.15Å
321	V	97.8	Very high	96.6	Very high	74 Å²	74	63.5 Å²	63.5	45%	0.448	35%	0.35	S	S	.	.	H	α-helix	trans	-61.2	-46.6	176.7	172.1	0	0	0	0	111	S317 L318 S323 M324 V325	S317-V321 WeakPolarHBondContact O-CG2 3.22Å; S317-V321 PolarHBondContact O-N 2.94Å; L318-V321 PolarHBondContact O-N 3.28Å; V321-S323 VanDerWaalsContact C-N 3.29Å; V321-S323 PolarHBondContact O-N 2.6Å; V321-M324 HydrophobicContact CG2-CE 4.2Å; V321-M324 WeakPolarHBondContact O-CB 3.18Å; V321-M324 PolarHBondContact O-N 3.09Å; V321-V325 WeakPolarHBondContact O-CG2 3.14Å; V321-V325 PolarHBondContact O-N 3.26Å
322	M	96.8	Very high	96.3	Very high	87 Å²	87	69.4 Å²	69.4	43%	0.429	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-38	176.9	-74.7	-58.9	-60	0	0	112.1	F38 L318 V325 M326	F38-M322 HydrophobicContact CD1-CB 4.46Å; L318-M322 WeakPolarHBondContact O-CB 3.37Å; L318-M322 VanDerWaalsContact O-CG 3.25Å; L318-M322 WeakPolarHBondContact O-CG 3.46Å; L318-M322 PolarHBondContact O-N 3.02Å; M322-V325 PolarHBondContact O-N 2.98Å; M322-M326 HydrophobicContact CE-CE 4.13Å; M322-M326 WeakPolarHBondContact O-CB 3.43Å; M322-M326 VanDerWaalsContact O-CG 3.29Å; M322-M326 WeakPolarHBondContact O-CG 3.46Å; M322-M326 PolarHBondContact O-N 3.33Å
323	S	96.9	Very high	95.8	Very high	4 Å²	4	73.6 Å²	73.6	3%	0.028	39%	0.39	C	S	.	.	H	α-helix	trans	-62.9	-42.6	174.7	-171.7	0	0	0	0	112.2	I35 V39 C319 V320 V321 V325 M326 L327	I35-S323 WeakPolarHBondContact CG2-OG 3.33Å; I35-S323 PolarHBondContact O-OG 2.87Å; V39-S323 WeakPolarHBondContact CG2-OG 3.33Å; C319-S323 WeakPolarHBondContact O-CB 3.44Å; C319-S323 PolarHBondContact O-N 3.16Å; V320-S323 WeakPolarHBondContact O-CB 3.44Å; V320-S323 PolarHBondContact O-N 3.3Å; V321-S323 VanDerWaalsContact C-N 3.29Å; V321-S323 PolarHBondContact O-N 2.6Å; S323-V325 PolarHBondContact O-N 3.42Å; S323-M326 PolarHBondContact O-N 2.69Å; S323-L327 WeakPolarHBondContact O-CB 3.43Å; S323-L327 PolarHBondContact O-N 3.17Å
324	M	96.1	Very high	95.3	Very high	108 Å²	108	76.8 Å²	76.8	53%	0.532	40%	0.402	S	S	.	.	H	α-helix	trans	-61.6	-43.9	174.6	-69.3	-169.7	-69.1	0	0	111.9	V320 V321 L327 I328	V320-M324 PolarHBondContact O-N 3.15Å; V321-M324 HydrophobicContact CG2-CE 4.2Å; V321-M324 WeakPolarHBondContact O-CB 3.18Å; V321-M324 PolarHBondContact O-N 3.09Å; M324-L327 PolarHBondContact O-N 3.28Å; M324-I328 VanDerWaalsContact O-CG1 3.31Å; M324-I328 WeakPolarHBondContact O-CG1 3.44Å; M324-I328 PolarHBondContact O-N 3.43Å
325	V	96.2	Very high	94.6	Very high	71 Å²	71	80 Å²	80	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-62.1	-47.2	176.5	174.3	0	0	0	0	111	V321 M322 S323 L327 I328 V329	V321-V325 WeakPolarHBondContact O-CG2 3.14Å; V321-V325 PolarHBondContact O-N 3.26Å; M322-V325 PolarHBondContact O-N 2.98Å; S323-V325 PolarHBondContact O-N 3.42Å; V325-L327 VanDerWaalsContact C-N 3.28Å; V325-L327 PolarHBondContact O-N 3.15Å; V325-I328 PolarHBondContact O-N 3.28Å; V325-V329 HydrophobicContact CG1-CG2 4.49Å; V325-V329 WeakPolarHBondContact O-CG2 3.43Å; V325-V329 PolarHBondContact O-N 3.13Å
326	M	95.1	Very high	93.4	Very high	58 Å²	58	81 Å²	81	29%	0.286	42%	0.417	S	S	.	.	H	α-helix	trans	-60.7	-37.6	176.6	-72	-179.9	-171.9	0	0	112	V34 I35 F38 M322 S323 V329 Y330	V34-M326 HydrophobicContact CG1-SD 4.01Å; I35-M326 HydrophobicContact CD1-CB 4.23Å; I35-M326 HydrophobicContact CG1-CB 3.86Å; F38-M326 HydrophobicContact CE2-CE 4.4Å; F38-M326 HydrophobicContact CZ-CE 4.34Å; M322-M326 HydrophobicContact CE-CE 4.13Å; M322-M326 WeakPolarHBondContact O-CB 3.43Å; M322-M326 VanDerWaalsContact O-CG 3.29Å; M322-M326 WeakPolarHBondContact O-CG 3.46Å; M322-M326 PolarHBondContact O-N 3.33Å; S323-M326 PolarHBondContact O-N 2.69Å; M326-V329 PolarHBondContact O-N 3.34Å; M326-Y330 WeakPolarHBondContact O-CB 3.37Å; M326-Y330 PolarHBondContact O-N 3.04Å
327	L	95.6	Very high	92.3	Very high	94 Å²	94	89.4 Å²	89.4	49%	0.492	46%	0.457	S	S	.	.	H	α-helix	trans	-65.7	-43.8	176.5	-175.1	68.5	0	0	0	111.9	I35 S323 M324 V325 Y330 A331	I35-L327 HydrophobicContact CD1-CB 4.39Å; I35-L327 HydrophobicContact CD1-CD1 4.3Å; I35-L327 HydrophobicContact CG2-CB 4.37Å; I35-L327 HydrophobicContact CG2-CD1 4.37Å; S323-L327 WeakPolarHBondContact O-CB 3.43Å; S323-L327 PolarHBondContact O-N 3.17Å; M324-L327 PolarHBondContact O-N 3.28Å; V325-L327 VanDerWaalsContact C-N 3.28Å; V325-L327 PolarHBondContact O-N 3.15Å; L327-Y330 PolarHBondContact O-N 3.02Å; L327-A331 WeakPolarHBondContact O-CB 3.44Å; L327-A331 PolarHBondContact O-N 3.19Å
328	I	94.6	Very high	90.6	Very high	119 Å²	119	94.3 Å²	94.3	61%	0.61	48%	0.478	S	S	*	.	H	α-helix	trans	-60.9	-47.6	175.6	-67.6	163.7	0	0	0	110.4	M324 V325 A331 K332	M324-I328 VanDerWaalsContact O-CG1 3.31Å; M324-I328 WeakPolarHBondContact O-CG1 3.44Å; M324-I328 PolarHBondContact O-N 3.43Å; V325-I328 PolarHBondContact O-N 3.28Å; I328-A331 PolarHBondContact O-N 2.93Å; I328-K332 PolarHBondContact O-N 3.15Å
329	V	93.8	Very high	88.4	Confident	69 Å²	69	100 Å²	100	42%	0.418	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-45.4	178.4	172.7	0	0	0	0	110.8	V325 M326 A331 K332 F333	V325-V329 HydrophobicContact CG1-CG2 4.49Å; V325-V329 WeakPolarHBondContact O-CG2 3.43Å; V325-V329 PolarHBondContact O-N 3.13Å; M326-V329 PolarHBondContact O-N 3.34Å; V329-A331 PolarHBondContact O-N 3.43Å; V329-K332 PolarHBondContact O-N 2.99Å; V329-F333 HydrophobicContact CG1-CD2 3.72Å; V329-F333 HydrophobicContact CG1-CE2 3.73Å; V329-F333 VanDerWaalsContact O-CD2 3.26Å; V329-F333 WeakPolarHBondContact O-CD2 3.42Å; V329-F333 PolarHBondContact O-N 3.45Å; V329-F333 VanDerWaalsContact O-N 3.1Å
330	Y	93.3	Very high	87.9	Confident	89 Å²	89	104.2 Å²	104.2	35%	0.349	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-43.6	177.2	176.8	-107.3	0	0	0	112.1	A31 I35 M326 L327 F333 K334	A31-Y330 HydrophobicContact CB-CD2 3.36Å; A31-Y330 HydrophobicContact CB-CE2 3.68Å; A31-Y330 HydrophobicContact CB-CG 3.9Å; I35-Y330 HydrophobicContact CD1-CG 4.41Å; M326-Y330 WeakPolarHBondContact O-CB 3.37Å; M326-Y330 PolarHBondContact O-N 3.04Å; L327-Y330 PolarHBondContact O-N 3.02Å; Y330-F333 PolarHBondContact O-N 2.98Å; Y330-K334 HydrophobicContact CE1-CD 3.73Å; Y330-K334 HydrophobicContact CE2-CD 4.36Å; Y330-K334 VanDerWaalsContact O-CB 3.23Å; Y330-K334 WeakPolarHBondContact O-CB 3.27Å; Y330-K334 PolarHBondContact O-N 3.16Å; Y330-K334 WeakPolarHBondContact OH-CD 3.44Å; Y330-K334 PolarHBondContact OH-NZ 3Å
331	A	91.4	Very high	87.4	Confident	39 Å²	39	107.6 Å²	107.6	32%	0.322	55%	0.545	S	S	.	.	H	α-helix	trans	-60.9	-45.7	176.6	0	0	0	0	0	111.3	L327 I328 V329 F333 K334 F335	L327-A331 WeakPolarHBondContact O-CB 3.44Å; L327-A331 PolarHBondContact O-N 3.19Å; I328-A331 PolarHBondContact O-N 2.93Å; V329-A331 PolarHBondContact O-N 3.43Å; A331-F333 PolarHBondContact O-N 3.33Å; A331-K334 PolarHBondContact O-N 2.95Å; A331-F335 PolarHBondContact O-N 2.79Å
332	K	91.4	Very high	86.8	Confident	157 Å²	157	109.5 Å²	109.5	68%	0.683	55%	0.55	S	S	*	.	H	α-helix	trans	-58.1	-43.1	177.7	-175.4	-178.7	179.5	177.5	0	113	I328 V329	I328-K332 PolarHBondContact O-N 3.15Å; V329-K332 PolarHBondContact O-N 2.99Å
333	F	88	Confident	86.2	Confident	164 Å²	164	110.8 Å²	110.8	72%	0.719	56%	0.557	S	S	*	*	H	α-helix	trans	-81.6	-23.7	-178.5	-77.8	-69.8	0	0	0	113.7	V329 Y330 A331	V329-F333 HydrophobicContact CG1-CD2 3.72Å; V329-F333 HydrophobicContact CG1-CE2 3.73Å; V329-F333 VanDerWaalsContact O-CD2 3.26Å; V329-F333 WeakPolarHBondContact O-CD2 3.42Å; V329-F333 PolarHBondContact O-N 3.45Å; V329-F333 VanDerWaalsContact O-N 3.1Å; Y330-F333 PolarHBondContact O-N 2.98Å; A331-F333 PolarHBondContact O-N 3.33Å
334	K	86.7	Confident	85.6	Confident	114 Å²	114	117.5 Å²	117.5	50%	0.496	59%	0.59	S	S	.	*	H	α-helix	trans	-84.9	-35.4	179.1	-174.2	174.9	-170.7	175	0	112.9	Y330 A331 P336	Y330-K334 HydrophobicContact CE1-CD 3.73Å; Y330-K334 HydrophobicContact CE2-CD 4.36Å; Y330-K334 VanDerWaalsContact O-CB 3.23Å; Y330-K334 WeakPolarHBondContact O-CB 3.27Å; Y330-K334 PolarHBondContact O-N 3.16Å; Y330-K334 WeakPolarHBondContact OH-CD 3.44Å; Y330-K334 PolarHBondContact OH-NZ 3Å; A331-K334 PolarHBondContact O-N 2.95Å; K334-P336 VanDerWaalsContact O-CD 3.3Å; K334-P336 WeakPolarHBondContact O-CD 3.4Å
335	F	83.6	Confident	84.9	Confident	148 Å²	148	118.1 Å²	118.1	65%	0.649	59%	0.594	S	S	*	*	S	Bend	trans	-116.9	73.3	176.9	-52.6	-72.6	0	0	0	108.1	A331 E337	A331-F335 PolarHBondContact O-N 2.79Å; F335-E337 PolarHBondContact O-N 3.35Å
336	P	74.4	Confident	84	Confident	86 Å²	86	121.5 Å²	121.5	56%	0.558	61%	0.606	S	S	*	*			trans	-57.8	134.5	167.9	25.9	-30.8	0	0	0	107.8	K334 D338	K334-P336 VanDerWaalsContact O-CD 3.3Å; K334-P336 WeakPolarHBondContact O-CD 3.4Å; P336-D338 PolarHBondContact O-N 3.27Å; P336-D338 VanDerWaalsContact O-N 3.15Å
337	E	74	Confident	83.2	Confident	177 Å²	177	126.4 Å²	126.4	83%	0.827	63%	0.63	S	S	*	*			trans	-60.4	118.3	166.7	-73.5	175.1	153.4	0	0	106.3	F335 D339	F335-E337 PolarHBondContact O-N 3.35Å; E337-D339 VanDerWaalsContact C-N 3.29Å; E337-D339 PolarHBondContact O-N 3.44Å
338	D	63.8	Low	82.2	Confident	164 Å²	164	129.1 Å²	129.1	88%	0.877	64%	0.642	S	S	*	*			trans	-68	93.7	168.6	-72.9	-35	0	0	0	106.4	P336	P336-D338 PolarHBondContact O-N 3.27Å; P336-D338 VanDerWaalsContact O-N 3.15Å
339	D	50.9	Low	81	Confident	223 Å²	223	130 Å²	130	100%	1.193	65%	0.645	S	S	*	*			trans	-72.3	0	166	-88.8	-24.9	0	0	0	111.3	E337	E337-D339 VanDerWaalsContact C-N 3.29Å; E337-D339 PolarHBondContact O-N 3.44Å

Retrieved 339 of 339 residues in 401.2 ms (Link to these results)

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