G4VND4_SCHMA Loading...

Elongator complex protein 5

AlphaFold DB , UniProt , Accession G4VND4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 324 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	45.1	Very low	80.4	Confident	243 Å²	243	65.7 Å²	65.7	100%	1.197	32%	0.323	S	S	*	.				0	122.1	0	-98.3	170.8	149.5	0	0	107.8	K3	M1-K3 PolarHBondContact O-N 3.13Å
2	V	56.3	Low	81.3	Confident	98 Å²	98	62.2 Å²	62.2	59%	0.594	31%	0.307	S	S	*	.			trans	-67.6	128	171.3	179.8	0	0	0	0	107	Q4	V2-Q4 PolarHBondContact O-N 3.02Å
3	K	68.7	Low	81.9	Confident	154 Å²	154	68.4 Å²	68.4	67%	0.67	33%	0.331	S	S	*	.			trans	-64.1	124.1	174.8	-73.7	-176.3	179.3	178.1	0	108	M1 H5	M1-K3 PolarHBondContact O-N 3.13Å; K3-H5 PolarHBondContact O-N 3.31Å
4	Q	79.2	Confident	82.5	Confident	78 Å²	78	65.2 Å²	65.2	36%	0.364	32%	0.316	S	S	.	.			trans	-93.5	81.3	177.4	-71.6	173.3	-26.6	0	0	108	V2 C6 L7 D8 Y244	V2-Q4 PolarHBondContact O-N 3.02Å; Q4-C6 PolarHBondContact O-N 3.15Å; Q4-L7 PolarHBondContact O-N 3.34Å; Q4-D8 PolarHBondContact O-N 3.14Å; Q4-Y244 HydrophobicContact CB-CD1 4.42Å; Q4-Y244 HydrophobicContact CG-CD1 4.43Å; Q4-Y244 PolarHBondContact NE2-O 3.49Å
5	H	86.7	Confident	83	Confident	46 Å²	46	64.9 Å²	64.9	21%	0.213	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-27.8	-175.5	-60.4	-66.4	0	0	0	111.8	K3 D8 L9 I14 F226 E228	K3-H5 PolarHBondContact O-N 3.31Å; H5-D8 PolarHBondContact O-N 2.94Å; H5-L9 VanDerWaalsContact O-CB 3.28Å; H5-L9 WeakPolarHBondContact O-CB 3.4Å; H5-L9 PolarHBondContact O-N 2.8Å; H5-I14 HydrophobicContact CB-CD1 3.87Å; H5-F226 HydrophobicContact CB-CD2 3.94Å; H5-F226 HydrophobicContact CB-CE1 4.22Å; H5-F226 HydrophobicContact CB-CE2 3.39Å; H5-F226 HydrophobicContact CB-CZ 3.55Å; H5-E228 WeakPolarHBondContact CB-OE1 2.82Å; H5-E228 IonicContact CD2-OE1 3.4Å; H5-E228 PolarHBondContact CD2-OE1 3.22Å; H5-E228 IonicContact CG-OE1 3.2Å; H5-E228 PolarHBondContact N-OE1 2.86Å; H5-E228 PolarHBondContact N-OE2 2.87Å
6	C	89.5	Confident	83.7	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.014	30%	0.302	C	S	.	.	H	α-helix	trans	-56.8	-56.8	173.6	-178	0	0	0	0	113.3	Q4 D8 L9 L10 L201 E228 Y244	Q4-C6 PolarHBondContact O-N 3.15Å; C6-D8 VanDerWaalsContact C-N 3.29Å; C6-D8 PolarHBondContact O-N 3.3Å; C6-L9 PolarHBondContact O-N 3.47Å; C6-L9 VanDerWaalsContact O-N 3.14Å; C6-L10 WeakPolarHBondContact O-CG 3.45Å; C6-L10 PolarHBondContact O-N 3.03Å; C6-L201 VanDerWaalsContact CA-CD2 3.49Å; C6-L201 HydrophobicContact CB-CD2 3.84Å; C6-E228 VanDerWaalsContact CB-OE2 3.29Å; C6-E228 WeakPolarHBondContact CB-OE2 3.33Å; C6-E228 PolarHBondContact N-OE2 2.83Å; C6-Y244 HydrophobicContact CB-CD1 3.73Å; C6-Y244 HydrophobicContact CB-CD2 4.38Å; C6-Y244 HydrophobicContact CB-CE1 3.41Å; C6-Y244 VanDerWaalsContact CB-CE1 3.41Å; C6-Y244 HydrophobicContact CB-CE2 4.15Å; C6-Y244 HydrophobicContact CB-CG 4.18Å
7	L	91.3	Very high	84.3	Confident	18 Å²	18	57.6 Å²	57.6	9%	0.094	29%	0.285	C	S	.	.	H	α-helix	trans	-63.5	-39.2	178.7	-68.1	-175.8	0	0	0	111.5	Q4 L9 L10 F11 I232 I241	Q4-L7 PolarHBondContact O-N 3.34Å; L7-L9 VanDerWaalsContact C-N 3.25Å; L7-L9 PolarHBondContact O-N 3.03Å; L7-L10 PolarHBondContact O-N 3.08Å; L7-F11 HydrophobicContact CB-CD2 4.09Å; L7-F11 HydrophobicContact CB-CE2 4.08Å; L7-F11 HydrophobicContact CD2-CE2 4Å; L7-F11 HydrophobicContact CG-CE2 4.45Å; L7-F11 WeakPolarHBondContact O-CB 3.23Å; L7-F11 WeakPolarHBondContact O-CD2 3.47Å; L7-F11 WeakPolarHBondContact O-CG 3.48Å; L7-F11 PolarHBondContact O-N 3.42Å; L7-I232 HydrophobicContact CD2-CD1 4.45Å; L7-I241 HydrophobicContact CD2-CG2 3.61Å
8	D	91.7	Very high	85	Confident	40 Å²	40	54.4 Å²	54.4	21%	0.214	27%	0.269	C	S	.	.	H	α-helix	trans	-62.4	-34.1	177.3	-69.7	-19.7	0	0	0	111.7	Q4 H5 C6 N12 K13 I14	Q4-D8 PolarHBondContact O-N 3.14Å; H5-D8 PolarHBondContact O-N 2.94Å; C6-D8 VanDerWaalsContact C-N 3.29Å; C6-D8 PolarHBondContact O-N 3.3Å; D8-N12 PolarHBondContact O-N 3.44Å; D8-K13 HydrophobicContact CB-CB 4.07Å; D8-K13 HydrophobicContact CB-CD 4.35Å; D8-K13 WeakPolarHBondContact O-CA 3.4Å; D8-K13 WeakPolarHBondContact O-CB 3.39Å; D8-K13 PolarHBondContact O-N 3.02Å; D8-K13 VanDerWaalsContact OD1-CD 3.31Å; D8-K13 WeakPolarHBondContact OD1-CD 3.47Å; D8-K13 IonicContact OD1-NZ 2.73Å; D8-K13 PolarHBondContact OD1-NZ 3.14Å; D8-I14 HydrophobicContact CB-CD1 3.92Å; D8-I14 HydrophobicContact CB-CG1 3.97Å; D8-I14 PolarHBondContact O-N 3Å
9	L	92.9	Very high	85.7	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-74.4	-47.8	175	-172.4	148.2	0	0	0	112.4	H5 C6 L7 F11 N12 I14 I19 R144 S177 L201 H203 F226	H5-L9 VanDerWaalsContact O-CB 3.28Å; H5-L9 WeakPolarHBondContact O-CB 3.4Å; H5-L9 PolarHBondContact O-N 2.8Å; C6-L9 PolarHBondContact O-N 3.47Å; C6-L9 VanDerWaalsContact O-N 3.14Å; L7-L9 VanDerWaalsContact C-N 3.25Å; L7-L9 PolarHBondContact O-N 3.03Å; L9-F11 VanDerWaalsContact C-N 3.28Å; L9-F11 PolarHBondContact O-N 3.38Å; L9-N12 PolarHBondContact O-N 3.36Å; L9-I14 HydrophobicContact CB-CB 4.3Å; L9-I19 HydrophobicContact CD2-CD1 3.93Å; L9-R144 PolarHBondContact O-NH1 3.3Å; L9-R144 PolarHBondContact O-NH2 3.39Å; L9-S177 WeakPolarHBondContact CD1-OG 3.48Å; L9-L201 HydrophobicContact CB-CD2 4.44Å; L9-L201 HydrophobicContact CD1-CD1 4.11Å; L9-L201 HydrophobicContact CD1-CD2 4.23Å; L9-L201 HydrophobicContact CD2-CD1 4.02Å; L9-H203 HydrophobicContact CD1-CB 3.85Å; L9-F226 HydrophobicContact CD1-CZ 4.03Å
10	L	92.5	Very high	86.3	Confident	3 Å²	3	49 Å²	49	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-38.7	179.3	-66.4	179.2	0	0	0	111.7	C6 L7 N12 L35 L39 R144 I179 I232 I241	C6-L10 WeakPolarHBondContact O-CG 3.45Å; C6-L10 PolarHBondContact O-N 3.03Å; L7-L10 PolarHBondContact O-N 3.08Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 3.23Å; L10-L35 HydrophobicContact CD1-CD1 4.5Å; L10-L39 HydrophobicContact CB-CD1 4.14Å; L10-L39 HydrophobicContact CD2-CD1 4.04Å; L10-R144 PolarHBondContact O-NH1 3.2Å; L10-I179 HydrophobicContact CD2-CD1 3.61Å; L10-I232 HydrophobicContact CD1-CD1 3.83Å; L10-I241 HydrophobicContact CD1-CD1 4.18Å
11	F	91	Very high	86.8	Confident	41 Å²	41	46.7 Å²	46.7	18%	0.18	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	12	177.2	-61.3	-50	0	0	0	114.7	L7 L9 K13 E42 I241	L7-F11 HydrophobicContact CB-CD2 4.09Å; L7-F11 HydrophobicContact CB-CE2 4.08Å; L7-F11 HydrophobicContact CD2-CE2 4Å; L7-F11 HydrophobicContact CG-CE2 4.45Å; L7-F11 WeakPolarHBondContact O-CB 3.23Å; L7-F11 WeakPolarHBondContact O-CD2 3.47Å; L7-F11 WeakPolarHBondContact O-CG 3.48Å; L7-F11 PolarHBondContact O-N 3.42Å; L9-F11 VanDerWaalsContact C-N 3.28Å; L9-F11 PolarHBondContact O-N 3.38Å; F11-K13 VanDerWaalsContact C-N 3.31Å; F11-K13 PolarHBondContact O-N 2.89Å; F11-E42 HydrophobicContact CD1-CB 4.5Å; F11-E42 HydrophobicContact CE1-CB 4.09Å; F11-E42 HydrophobicContact CE1-CG 4.05Å; F11-I241 HydrophobicContact CE1-CB 4.46Å; F11-I241 HydrophobicContact CE1-CD1 4.15Å; F11-I241 HydrophobicContact CZ-CB 3.96Å; F11-I241 HydrophobicContact CZ-CD1 4.29Å; F11-I241 HydrophobicContact CZ-CG2 4.2Å
12	N	90.4	Very high	89.1	Confident	23 Å²	23	35.1 Å²	35.1	12%	0.123	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	31.9	176.7	-167	57.3	0	0	0	115.2	D8 L9 L10 Y47 F103 N143 R144	D8-N12 PolarHBondContact O-N 3.44Å; L9-N12 PolarHBondContact O-N 3.36Å; L10-N12 VanDerWaalsContact C-N 3.32Å; L10-N12 PolarHBondContact O-N 3.23Å; N12-Y47 HydrophobicContact CB-CE2 4.37Å; N12-Y47 PolarHBondContact ND2-OH 2.8Å; N12-Y47 VanDerWaalsContact ND2-OH 3.14Å; N12-F103 HydrophobicContact CB-CE1 4.27Å; N12-F103 HydrophobicContact CB-CZ 3.89Å; N12-N143 PolarHBondContact ND2-ND2 3.37Å; N12-N143 PolarHBondContact OD1-ND2 3.41Å; N12-R144 PolarHBondContact OD1-NH2 3.31Å
13	K	89.1	Confident	90.8	Very high	143 Å²	143	31 Å²	31	62%	0.622	15%	0.149	S	C	*	.	S	Bend	trans	-83.6	-27.9	164.1	-56.5	-178.1	-161.3	157.8	0	112.1	D8 F11	D8-K13 HydrophobicContact CB-CB 4.07Å; D8-K13 HydrophobicContact CB-CD 4.35Å; D8-K13 WeakPolarHBondContact O-CA 3.4Å; D8-K13 WeakPolarHBondContact O-CB 3.39Å; D8-K13 PolarHBondContact O-N 3.02Å; D8-K13 VanDerWaalsContact OD1-CD 3.31Å; D8-K13 WeakPolarHBondContact OD1-CD 3.47Å; D8-K13 IonicContact OD1-NZ 2.73Å; D8-K13 PolarHBondContact OD1-NZ 3.14Å; F11-K13 VanDerWaalsContact C-N 3.31Å; F11-K13 PolarHBondContact O-N 2.89Å
14	I	90.3	Very high	91.8	Very high	24 Å²	24	25.3 Å²	25.3	12%	0.123	12%	0.124	C	C	.	.	S	Bend	trans	-98.8	123.8	164.5	-61.6	172.3	0	0	0	107	H5 D8 L9 R144 F226	H5-I14 HydrophobicContact CB-CD1 3.87Å; D8-I14 HydrophobicContact CB-CD1 3.92Å; D8-I14 HydrophobicContact CB-CG1 3.97Å; D8-I14 PolarHBondContact O-N 3Å; L9-I14 HydrophobicContact CB-CB 4.3Å; I14-R144 PolarHBondContact O-NH2 3.36Å; I14-F226 HydrophobicContact CD1-CE1 4.1Å; I14-F226 HydrophobicContact CD1-CZ 3.92Å
15	P	90.7	Very high	91.8	Very high	61 Å²	61	22.6 Å²	22.6	40%	0.396	11%	0.114	S	C	.	.			trans	-66.3	136.5	178.7	28.4	-34.4	0	0	0	110	H203 Q208	P15-H203 PolarHBondContact O-CE1 3.26Å; P15-Q208 HydrophobicContact CB-CG 4.47Å; P15-Q208 HydrophobicContact CG-CG 4.33Å; P15-Q208 WeakPolarHBondContact O-CG 3.36Å
16	S	93.8	Very high	90.9	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.007	13%	0.127	C	C	.	.			trans	-153.8	108.8	173.5	-177.5	0	0	0	0	107.8	I19 R144 T176 S177	S16-I19 VanDerWaalsContact OG-CG1 3.25Å; S16-I19 WeakPolarHBondContact OG-CG1 3.42Å; S16-R144 WeakPolarHBondContact O-CG 3.33Å; S16-R144 PolarHBondContact O-NE 3.19Å; S16-R144 VanDerWaalsContact O-NE 3.09Å; S16-T176 PolarHBondContact OG-OG1 2.8Å; S16-S177 WeakPolarHBondContact CB-OG 3.34Å; S16-S177 WeakPolarHBondContact OG-CB 3.42Å; S16-S177 PolarHBondContact OG-OG 2.79Å
17	N	94.4	Very high	89.3	Confident	4 Å²	4	29.2 Å²	29.2	2%	0.021	15%	0.146	C	C	.	.	S	Bend	trans	-76.6	-40.3	-175.2	-75.3	50.6	0	0	0	111.6	S137 R144 V145 T176 Q208 C211	N17-S137 PolarHBondContact ND2-O 3.37Å; N17-S137 VanDerWaalsContact ND2-O 3.09Å; N17-S137 VanDerWaalsContact O-CB 3.32Å; N17-S137 WeakPolarHBondContact O-CB 3.11Å; N17-R144 CarbonylContact O-C 3.56Å; N17-R144 VanDerWaalsContact O-CA 3.32Å; N17-R144 WeakPolarHBondContact O-CA 3.31Å; N17-V145 PolarHBondContact O-N 2.78Å; N17-T176 PolarHBondContact N-OG1 2.85Å; N17-Q208 PolarHBondContact OD1-NE2 2.85Å; N17-C211 HydrophobicContact CB-CB 4.46Å
18	F	97.1	Very high	87.3	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	112.9	-176.8	-166.6	-118.5	0	0	0	110.7	I130 L133 F134 V145 C147 A175 T176 S177	F18-I130 HydrophobicContact CE1-CG2 4Å; F18-I130 HydrophobicContact CZ-CG2 4.15Å; F18-L133 HydrophobicContact CE2-CB 3.9Å; F18-L133 HydrophobicContact CZ-CB 4.22Å; F18-F134 HydrophobicContact CB-CD2 3.69Å; F18-F134 HydrophobicContact CB-CE2 4.21Å; F18-F134 HydrophobicContact CD1-CB 4.25Å; F18-F134 AromaticContact CD1-CD2 3.85Å; F18-F134 HydrophobicContact CD1-CD2 3.85Å; F18-F134 HydrophobicContact CE1-CB 4.42Å; F18-F134 HydrophobicContact CG-CB 4.37Å; F18-F134 AromaticContact CG-CD2 3.83Å; F18-F134 HydrophobicContact CG-CD2 3.83Å; F18-V145 WeakPolarHBondContact CA-O 3.28Å; F18-V145 HydrophobicContact CD2-CB 3.95Å; F18-V145 HydrophobicContact CD2-CG1 4.03Å; F18-V145 HydrophobicContact CE2-CB 4.35Å; F18-V145 HydrophobicContact CE2-CG1 3.9Å; F18-C147 VanDerWaalsContact CE2-SG 3.56Å; F18-A175 HydrophobicContact CD1-CB 4.3Å; F18-T176 PolarHBondContact N-OG1 3.01Å; F18-T176 PolarHBondContact O-N 3.5Å; F18-T176 PolarHBondContact O-OG1 2.87Å; F18-S177 PolarHBondContact O-N 3.39Å
19	I	97.7	Very high	85.1	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.2	-178.9	-58.4	-176.1	0	0	0	109.5	L9 S16 R144 V145 V146 C147 S177 I179	L9-I19 HydrophobicContact CD2-CD1 3.93Å; S16-I19 VanDerWaalsContact OG-CG1 3.25Å; S16-I19 WeakPolarHBondContact OG-CG1 3.42Å; I19-R144 HydrophobicContact CD1-CG 4.33Å; I19-V145 PolarHBondContact N-O 2.79Å; I19-V146 HydrophobicContact CB-CB 4.45Å; I19-V146 HydrophobicContact CB-CG1 4.05Å; I19-V146 HydrophobicContact CB-CG2 4.23Å; I19-V146 HydrophobicContact CD1-CG2 4.43Å; I19-V146 HydrophobicContact CG2-CG1 4.04Å; I19-V146 CarbonylContact O-C 3.58Å; I19-V146 WeakPolarHBondContact O-CA 3.37Å; I19-C147 PolarHBondContact O-N 3.4Å; I19-S177 CarbonylContact C-O 3.51Å; I19-S177 VanDerWaalsContact CA-O 3.3Å; I19-S177 WeakPolarHBondContact CA-O 3.22Å; I19-I179 HydrophobicContact CG2-CD1 3.65Å; I19-I179 HydrophobicContact CG2-CG1 4.15Å
20	A	97.8	Very high	83	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121.2	164.7	0	0	0	0	0	109.2	L171 A175 S177 V178 I179	A20-L171 HydrophobicContact CB-CB 3.93Å; A20-L171 HydrophobicContact CB-CD1 4.4Å; A20-L171 HydrophobicContact CB-CD2 4.1Å; A20-L171 HydrophobicContact CB-CG 4.37Å; A20-A175 HydrophobicContact CB-CB 3.86Å; A20-S177 PolarHBondContact N-O 3.06Å; A20-V178 HydrophobicContact CB-CG1 4.27Å; A20-V178 HydrophobicContact CB-CG2 4.36Å; A20-V178 CarbonylContact O-C 3.47Å; A20-V178 WeakPolarHBondContact O-CA 3.43Å; A20-I179 PolarHBondContact O-N 3.04Å
21	Y	96.5	Very high	81.4	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	107.5	173.8	179.2	-85	0	0	0	108	D23 S33 L35 W36 C147 S148 F149 I179 C181	Y21-D23 HydrophobicContact CE1-CB 3.9Å; Y21-S33 PolarHBondContact OH-OG 3.21Å; Y21-L35 HydrophobicContact CE2-CB 4.41Å; Y21-L35 HydrophobicContact CE2-CD2 3.88Å; Y21-L35 HydrophobicContact CE2-CG 3.99Å; Y21-W36 AromaticContact CD1-CE3 3.87Å; Y21-W36 HydrophobicContact CD1-CE3 3.87Å; Y21-W36 HydrophobicContact CD1-CZ3 4.42Å; Y21-W36 HydrophobicContact CD2-CE3 4.39Å; Y21-W36 HydrophobicContact CE1-CB 4.11Å; Y21-W36 HydrophobicContact CE1-CE3 4.23Å; Y21-W36 AromaticContact CG-CE3 3.96Å; Y21-W36 HydrophobicContact CG-CE3 3.96Å; Y21-W36 HydrophobicContact CG-CZ3 4.3Å; Y21-W36 PolarHBondContact OH-N 3.33Å; Y21-C147 PolarHBondContact N-O 3.4Å; Y21-S148 WeakPolarHBondContact CD1-OG 3.25Å; Y21-S148 CarbonylContact O-C 3.55Å; Y21-S148 VanDerWaalsContact O-CA 3.26Å; Y21-S148 WeakPolarHBondContact O-CA 3.32Å; Y21-F149 PolarHBondContact O-N 3.47Å; Y21-I179 HydrophobicContact CD2-CB 4.34Å; Y21-I179 HydrophobicContact CD2-CG2 4.19Å; Y21-I179 HydrophobicContact CE2-CG2 4.46Å; Y21-C181 WeakPolarHBondContact CE2-SG 3.45Å; Y21-C181 VanDerWaalsContact CZ-SG 3.56Å
22	I	94.6	Very high	80.5	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112	-175.6	-59.4	170.7	0	0	0	107.7	E24 F149 P151 I168 L171 V178 I179 Y180 C181	I22-E24 HydrophobicContact CG2-CG 4.2Å; I22-F149 WeakPolarHBondContact CA-O 3.49Å; I22-P151 HydrophobicContact CG2-CG 3.85Å; I22-I168 HydrophobicContact CD1-CG1 4.17Å; I22-I168 HydrophobicContact CD1-CG2 4.16Å; I22-I168 HydrophobicContact CG2-CD1 4.23Å; I22-L171 HydrophobicContact CG1-CD1 4.48Å; I22-V178 HydrophobicContact CD1-CG1 3.71Å; I22-V178 HydrophobicContact CG1-CG1 4.47Å; I22-I179 PolarHBondContact N-O 2.9Å; I22-Y180 HydrophobicContact CB-CD1 3.87Å; I22-Y180 HydrophobicContact CB-CE1 4Å; I22-Y180 HydrophobicContact CD1-CD1 4.19Å; I22-Y180 HydrophobicContact CD1-CE1 3.5Å; I22-Y180 HydrophobicContact CD1-CE2 4.3Å; I22-Y180 HydrophobicContact CG1-CE1 4.35Å; I22-Y180 HydrophobicContact CG2-CD1 3.8Å; I22-Y180 HydrophobicContact CG2-CE1 3.8Å; I22-Y180 CarbonylContact O-C 3.51Å; I22-Y180 WeakPolarHBondContact O-CA 3.43Å; I22-C181 PolarHBondContact O-N 2.85Å
23	D	91.7	Very high	80.1	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.059	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	97.7	-178.9	-157.7	-11.8	0	0	0	110.9	Y21 C25 S33 F149 P151	Y21-D23 HydrophobicContact CE1-CB 3.9Å; D23-C25 PolarHBondContact O-N 2.74Å; D23-C25 WeakPolarHBondContact OD1-CB 3.39Å; D23-C25 PolarHBondContact OD1-N 2.98Å; D23-C25 PolarHBondContact OD1-SG 3.47Å; D23-S33 WeakPolarHBondContact OD2-CB 3.49Å; D23-S33 PolarHBondContact OD2-OG 3.16Å; D23-F149 PolarHBondContact N-O 3.1Å; D23-P151 WeakPolarHBondContact O-CD 3.4Å
24	E	88.5	Confident	80.1	Confident	34 Å²	34	42.2 Å²	42.2	16%	0.159	22%	0.221	C	C	.	.			trans	-83.8	3.1	176.7	-53.1	-171.6	137.9	0	0	112.4	I22 H26 P151 I153 Y160 Y180 C181 Q182	I22-E24 HydrophobicContact CG2-CG 4.2Å; E24-H26 PolarHBondContact O-N 2.94Å; E24-P151 HydrophobicContact CG-CG 4.23Å; E24-I153 HydrophobicContact CB-CD1 3.62Å; E24-I153 HydrophobicContact CG-CD1 3.95Å; E24-Y160 PolarHBondContact OE1-OH 3.34Å; E24-Y180 HydrophobicContact CG-CD1 4.38Å; E24-C181 WeakPolarHBondContact CA-O 3.37Å; E24-C181 VanDerWaalsContact CB-O 3.28Å; E24-C181 WeakPolarHBondContact CB-O 3.39Å; E24-C181 PolarHBondContact N-O 3.35Å; E24-Q182 WeakPolarHBondContact OE2-CG 3.43Å; E24-Q182 PolarHBondContact OE2-NE2 2.95Å
25	C	80.7	Confident	80.1	Confident	22 Å²	22	41.1 Å²	41.1	15%	0.149	22%	0.215	C	C	.	.			trans	-73	97.3	-177.4	-59	0	0	0	0	111	D23 M27 Q182 Q197	D23-C25 PolarHBondContact O-N 2.74Å; D23-C25 WeakPolarHBondContact OD1-CB 3.39Å; D23-C25 PolarHBondContact OD1-N 2.98Å; D23-C25 PolarHBondContact OD1-SG 3.47Å; C25-M27 PolarHBondContact O-N 3.07Å; C25-Q182 PolarHBondContact SG-O 3.4Å; C25-Q197 PolarHBondContact SG-NE2 2.92Å
26	H	66.2	Low	80.3	Confident	105 Å²	105	38.3 Å²	38.3	49%	0.486	20%	0.197	S	C	.	.			trans	-82.5	91.2	167	-84.7	-60.7	0	0	0	110.9	E24	E24-H26 PolarHBondContact O-N 2.94Å
27	M	56.8	Low	80.2	Confident	82 Å²	82	39.1 Å²	39.1	40%	0.404	20%	0.2	S	C	.	.			trans	-105.2	114.8	166.3	-74.6	-64.8	-170.1	0	0	110.5	C25 H29 L184	C25-M27 PolarHBondContact O-N 3.07Å; M27-H29 PolarHBondContact O-N 3.41Å; M27-H29 VanDerWaalsContact O-N 3.15Å; M27-L184 HydrophobicContact CE-CB 4.01Å; M27-L184 WeakPolarHBondContact CE-O 3.4Å
28	P	48.2	Very low	80.1	Confident	107 Å²	107	38.9 Å²	38.9	70%	0.695	20%	0.199	S	C	*	.	S	Bend	trans	-66.6	-16.9	-175	23.5	-32.4	0	0	0	114.5
29	H	45.3	Very low	80	Confident	182 Å²	182	39 Å²	39	84%	0.843	20%	0.2	S	C	*	.	S	Bend	trans	-128.3	-3.7	-169.1	-62.3	-44.4	0	0	0	115.7	M27	M27-H29 PolarHBondContact O-N 3.41Å; M27-H29 VanDerWaalsContact O-N 3.15Å
30	N	50.5	Low	79.8	Confident	64 Å²	64	39 Å²	39	34%	0.342	20%	0.199	S	C	.	.			trans	-151.1	77	178	-164	1.7	0	0	0	109.5	N32	N30-N32 PolarHBondContact O-N 3.01Å; N30-N32 PolarHBondContact OD1-ND2 2.95Å
31	N	59.1	Low	79.7	Confident	95 Å²	95	39.6 Å²	39.6	51%	0.508	20%	0.203	S	C	.	.			trans	-72.8	37.7	-179.1	-153.1	19.4	0	0	0	111.7	S33 Y57	N31-S33 PolarHBondContact O-N 3.25Å; N31-Y57 HydrophobicContact CB-CE1 4.34Å; N31-Y57 WeakPolarHBondContact O-CD1 3.43Å; N31-Y57 WeakPolarHBondContact O-CE1 3.39Å
32	N	71	Confident	79.5	Confident	49 Å²	49	40.6 Å²	40.6	26%	0.262	21%	0.208	S	C	.	.			trans	-88.3	101.5	178.9	-83.1	-42.9	0	0	0	107.9	N30 W34 K37	N30-N32 PolarHBondContact O-N 3.01Å; N30-N32 PolarHBondContact OD1-ND2 2.95Å; N32-W34 HydrophobicContact CB-CD2 3.92Å; N32-W34 VanDerWaalsContact CB-CE2 3.47Å; N32-W34 HydrophobicContact CB-CG 4.3Å; N32-W34 HydrophobicContact CB-CH2 4.34Å; N32-W34 HydrophobicContact CB-CZ2 3.72Å; N32-W34 PolarHBondContact O-N 2.89Å; N32-K37 PolarHBondContact OD1-NZ 3.03Å
33	S	82.8	Confident	79.4	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.028	21%	0.209	C	C	.	.			trans	-66.9	84.1	167.8	-162.6	0	0	0	0	108.8	Y21 D23 N31 W36 K37	Y21-S33 PolarHBondContact OH-OG 3.21Å; D23-S33 WeakPolarHBondContact OD2-CB 3.49Å; D23-S33 PolarHBondContact OD2-OG 3.16Å; N31-S33 PolarHBondContact O-N 3.25Å; S33-W36 WeakPolarHBondContact O-CB 3.23Å; S33-W36 PolarHBondContact O-N 3.2Å; S33-W36 WeakPolarHBondContact OG-CB 3.36Å; S33-K37 PolarHBondContact O-N 3.2Å; S33-K37 VanDerWaalsContact O-N 3.11Å
34	W	88.1	Confident	79.4	Confident	40 Å²	40	40.4 Å²	40.4	15%	0.152	21%	0.207	C	C	.	.	H	α-helix	trans	-68.6	-42.3	-169.8	-69.9	110.5	0	0	0	112.1	N32 W36 K37 C38 I195 L234 T236 L239	N32-W34 HydrophobicContact CB-CD2 3.92Å; N32-W34 VanDerWaalsContact CB-CE2 3.47Å; N32-W34 HydrophobicContact CB-CG 4.3Å; N32-W34 HydrophobicContact CB-CH2 4.34Å; N32-W34 HydrophobicContact CB-CZ2 3.72Å; N32-W34 PolarHBondContact O-N 2.89Å; W34-W36 VanDerWaalsContact C-N 3.29Å; W34-W36 PolarHBondContact O-N 2.9Å; W34-K37 PolarHBondContact O-N 2.93Å; W34-C38 PolarHBondContact O-N 3.27Å; W34-C38 PolarHBondContact O-SG 3.34Å; W34-I195 HydrophobicContact CB-CD1 3.27Å; W34-I195 HydrophobicContact CD2-CD1 4.07Å; W34-I195 HydrophobicContact CG-CD1 3.22Å; W34-L234 HydrophobicContact CB-CD1 4Å; W34-T236 HydrophobicContact CD2-CG2 3.67Å; W34-T236 HydrophobicContact CE3-CG2 3.8Å; W34-T236 HydrophobicContact CG-CG2 4.15Å; W34-T236 HydrophobicContact CH2-CG2 4.3Å; W34-T236 HydrophobicContact CZ2-CG2 4.17Å; W34-T236 HydrophobicContact CZ3-CG2 4.12Å; W34-L239 HydrophobicContact CE3-CD2 4.19Å; W34-L239 HydrophobicContact CZ3-CD2 4.17Å
35	L	91.7	Very high	79.5	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-42.9	175.2	176	59.5	0	0	0	110.7	L10 Y21 K37 C38 L39 I232 L234 I241	L10-L35 HydrophobicContact CD1-CD1 4.5Å; Y21-L35 HydrophobicContact CE2-CB 4.41Å; Y21-L35 HydrophobicContact CE2-CD2 3.88Å; Y21-L35 HydrophobicContact CE2-CG 3.99Å; L35-K37 PolarHBondContact O-N 2.66Å; L35-C38 PolarHBondContact O-N 2.79Å; L35-L39 VanDerWaalsContact O-CB 3.23Å; L35-L39 WeakPolarHBondContact O-CB 3.42Å; L35-L39 PolarHBondContact O-N 2.88Å; L35-I232 HydrophobicContact CD1-CD1 3.68Å; L35-I232 HydrophobicContact CD1-CG2 4.48Å; L35-I232 HydrophobicContact CD2-CG2 4.41Å; L35-L234 HydrophobicContact CB-CD1 3.91Å; L35-L234 HydrophobicContact CD1-CD2 4.03Å; L35-I241 HydrophobicContact CD1-CD1 4.15Å; L35-I241 HydrophobicContact CD1-CG1 4.39Å
36	W	92.9	Very high	79.9	Confident	1 Å²	1	48.2 Å²	48.2	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-55.3	-49.3	174.3	177.2	-102.6	0	0	0	112.4	Y21 S33 W34 L39 I40 L51 Y59 F105 E107 V146	Y21-W36 AromaticContact CD1-CE3 3.87Å; Y21-W36 HydrophobicContact CD1-CE3 3.87Å; Y21-W36 HydrophobicContact CD1-CZ3 4.42Å; Y21-W36 HydrophobicContact CD2-CE3 4.39Å; Y21-W36 HydrophobicContact CE1-CB 4.11Å; Y21-W36 HydrophobicContact CE1-CE3 4.23Å; Y21-W36 AromaticContact CG-CE3 3.96Å; Y21-W36 HydrophobicContact CG-CE3 3.96Å; Y21-W36 HydrophobicContact CG-CZ3 4.3Å; Y21-W36 PolarHBondContact OH-N 3.33Å; S33-W36 WeakPolarHBondContact O-CB 3.23Å; S33-W36 PolarHBondContact O-N 3.2Å; S33-W36 WeakPolarHBondContact OG-CB 3.36Å; W34-W36 VanDerWaalsContact C-N 3.29Å; W34-W36 PolarHBondContact O-N 2.9Å; W36-L39 PolarHBondContact O-N 3.32Å; W36-I40 HydrophobicContact CD2-CD1 4.32Å; W36-I40 HydrophobicContact CG-CD1 4.36Å; W36-I40 HydrophobicContact CZ2-CD1 4.19Å; W36-I40 VanDerWaalsContact NE1-CD1 3.31Å; W36-I40 WeakPolarHBondContact O-CG1 3.35Å; W36-I40 PolarHBondContact O-N 3.12Å; W36-L51 HydrophobicContact CZ2-CD1 4.27Å; W36-Y59 AromaticContact NE1-CZ 3.85Å; W36-Y59 PolarHBondContact NE1-OH 3.43Å; W36-F105 HydrophobicContact CH2-CB 3.92Å; W36-F105 AromaticContact CH2-CD1 3.92Å; W36-F105 HydrophobicContact CH2-CD1 3.92Å; W36-F105 HydrophobicContact CH2-CG 4.44Å; W36-F105 HydrophobicContact CZ2-CB 3.8Å; W36-F105 HydrophobicContact CZ2-CD1 4.25Å; W36-F105 HydrophobicContact CZ3-CD1 4.21Å; W36-E107 HydrophobicContact CZ2-CB 3.91Å; W36-V146 HydrophobicContact CH2-CB 4.47Å; W36-V146 HydrophobicContact CH2-CG1 4.33Å; W36-V146 HydrophobicContact CZ3-CB 4.26Å; W36-V146 HydrophobicContact CZ3-CG1 3.66Å
37	K	91.9	Very high	81.1	Confident	18 Å²	18	45.1 Å²	45.1	8%	0.078	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-41.8	177.9	-68.8	177.7	177.3	-177.1	0	112.7	N32 S33 W34 L35 L39 I40 N41 Y59 L62 L239	N32-K37 PolarHBondContact OD1-NZ 3.03Å; S33-K37 PolarHBondContact O-N 3.2Å; S33-K37 VanDerWaalsContact O-N 3.11Å; W34-K37 PolarHBondContact O-N 2.93Å; L35-K37 PolarHBondContact O-N 2.66Å; K37-L39 VanDerWaalsContact C-N 3.33Å; K37-I40 PolarHBondContact O-N 2.64Å; K37-N41 WeakPolarHBondContact O-CB 3.29Å; K37-N41 PolarHBondContact O-N 3.08Å; K37-Y59 HydrophobicContact CG-CE1 4.3Å; K37-L62 HydrophobicContact CB-CD1 4.29Å; K37-L62 HydrophobicContact CG-CD1 4.41Å; K37-L239 HydrophobicContact CB-CD2 4.11Å
38	C	93.2	Very high	82.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-39.9	176.7	-63	0	0	0	0	111.2	W34 L35 N41 E42 L234 L239 I241	W34-C38 PolarHBondContact O-N 3.27Å; W34-C38 PolarHBondContact O-SG 3.34Å; L35-C38 PolarHBondContact O-N 2.79Å; C38-N41 PolarHBondContact O-N 3.14Å; C38-E42 WeakPolarHBondContact O-CB 3.49Å; C38-E42 WeakPolarHBondContact O-CG 3.41Å; C38-E42 PolarHBondContact O-N 3.29Å; C38-L234 HydrophobicContact CB-CD2 4.27Å; C38-L239 WeakPolarHBondContact CA-O 3.21Å; C38-I241 HydrophobicContact CB-CG1 4.03Å
39	L	94.3	Very high	85	Confident	2 Å²	2	36.6 Å²	36.6	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-44.5	177.6	-175.6	66.8	0	0	0	111.1	L10 L35 W36 K37 N43 F105 V146	L10-L39 HydrophobicContact CB-CD1 4.14Å; L10-L39 HydrophobicContact CD2-CD1 4.04Å; L35-L39 VanDerWaalsContact O-CB 3.23Å; L35-L39 WeakPolarHBondContact O-CB 3.42Å; L35-L39 PolarHBondContact O-N 2.88Å; W36-L39 PolarHBondContact O-N 3.32Å; K37-L39 VanDerWaalsContact C-N 3.33Å; L39-N43 WeakPolarHBondContact CD1-ND2 3.39Å; L39-N43 WeakPolarHBondContact O-CB 3.27Å; L39-N43 PolarHBondContact O-N 3.09Å; L39-N43 PolarHBondContact O-ND2 3.4Å; L39-F105 HydrophobicContact CD2-CE1 3.97Å; L39-F105 HydrophobicContact CG-CE1 3.96Å; L39-F105 HydrophobicContact CG-CZ 4.47Å; L39-V146 HydrophobicContact CD2-CG1 4.42Å
40	I	94.6	Very high	87.4	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-50.6	174.5	-67.2	165.4	0	0	0	110	W36 K37 E42 N43 C44 L51 Y59 L62 L69 F105	W36-I40 HydrophobicContact CD2-CD1 4.32Å; W36-I40 HydrophobicContact CG-CD1 4.36Å; W36-I40 HydrophobicContact CZ2-CD1 4.19Å; W36-I40 VanDerWaalsContact NE1-CD1 3.31Å; W36-I40 WeakPolarHBondContact O-CG1 3.35Å; W36-I40 PolarHBondContact O-N 3.12Å; K37-I40 PolarHBondContact O-N 2.64Å; I40-E42 PolarHBondContact O-N 2.95Å; I40-N43 PolarHBondContact O-N 3.43Å; I40-C44 WeakPolarHBondContact O-CB 3.45Å; I40-C44 PolarHBondContact O-N 3.35Å; I40-C44 PolarHBondContact O-SG 3.13Å; I40-L51 HydrophobicContact CD1-CD1 3.86Å; I40-L51 HydrophobicContact CD1-CD2 4.41Å; I40-Y59 HydrophobicContact CD1-CE1 3.99Å; I40-L62 HydrophobicContact CG2-CD1 4.47Å; I40-L69 HydrophobicContact CG2-CD1 4.33Å; I40-L69 HydrophobicContact CG2-CD2 4.38Å; I40-F105 HydrophobicContact CD1-CB 4.41Å; I40-F105 HydrophobicContact CD1-CD1 4.48Å; I40-F105 HydrophobicContact CD1-CG 4.41Å; I40-F105 HydrophobicContact CG1-CB 4.26Å; I40-F105 HydrophobicContact CG1-CD1 3.67Å; I40-F105 HydrophobicContact CG1-CD2 4.1Å; I40-F105 HydrophobicContact CG1-CE1 3.96Å; I40-F105 HydrophobicContact CG1-CE2 4.36Å; I40-F105 HydrophobicContact CG1-CG 3.74Å; I40-F105 HydrophobicContact CG1-CZ 4.29Å
41	N	94.5	Very high	89.5	Confident	13 Å²	13	24.9 Å²	24.9	7%	0.07	12%	0.117	C	C	.	.	H	α-helix	trans	-55.4	-52.6	-177.4	-169	53.5	0	0	0	112.6	K37 C38 N43 C44 E45 L62 H66 A238 L239	K37-N41 WeakPolarHBondContact O-CB 3.29Å; K37-N41 PolarHBondContact O-N 3.08Å; C38-N41 PolarHBondContact O-N 3.14Å; N41-N43 VanDerWaalsContact C-N 3.31Å; N41-N43 PolarHBondContact O-N 3.43Å; N41-C44 PolarHBondContact O-N 2.91Å; N41-E45 PolarHBondContact O-N 3.08Å; N41-L62 HydrophobicContact CB-CD2 3.65Å; N41-H66 PolarHBondContact OD1-NE2 3.37Å; N41-A238 PolarHBondContact ND2-O 2.91Å; N41-L239 HydrophobicContact CB-CB 3.99Å; N41-L239 WeakPolarHBondContact CB-O 3.34Å; N41-L239 PolarHBondContact ND2-O 2.78Å
42	E	92.6	Very high	91.2	Very high	23 Å²	23	20.3 Å²	20.3	11%	0.107	9%	0.093	C	C	.	.	H	α-helix	trans	-64.8	-33.3	-178	-72.7	-75.3	161.6	0	0	112.6	F11 C38 I40 K240	F11-E42 HydrophobicContact CD1-CB 4.5Å; F11-E42 HydrophobicContact CE1-CB 4.09Å; F11-E42 HydrophobicContact CE1-CG 4.05Å; C38-E42 WeakPolarHBondContact O-CB 3.49Å; C38-E42 WeakPolarHBondContact O-CG 3.41Å; C38-E42 PolarHBondContact O-N 3.29Å; I40-E42 PolarHBondContact O-N 2.95Å; E42-K240 WeakPolarHBondContact OE1-CB 3.47Å; E42-K240 WeakPolarHBondContact OE1-CD 3.24Å; E42-K240 WeakPolarHBondContact OE1-CG 3.34Å; E42-K240 IonicContact OE1-NZ 3.84Å
43	N	93.1	Very high	92.3	Very high	4 Å²	4	18.1 Å²	18.1	2%	0.021	8%	0.082	C	C	.	.	H	α-helix	trans	-78.5	-32.3	176.5	-76.2	-79.6	0	0	0	112.2	L39 I40 N41 E45 K46 Y47 F103 F105	L39-N43 WeakPolarHBondContact CD1-ND2 3.39Å; L39-N43 WeakPolarHBondContact O-CB 3.27Å; L39-N43 PolarHBondContact O-N 3.09Å; L39-N43 PolarHBondContact O-ND2 3.4Å; I40-N43 PolarHBondContact O-N 3.43Å; N41-N43 VanDerWaalsContact C-N 3.31Å; N41-N43 PolarHBondContact O-N 3.43Å; N43-E45 PolarHBondContact O-N 3.29Å; N43-K46 PolarHBondContact O-N 2.91Å; N43-K46 VanDerWaalsContact O-N 3.13Å; N43-Y47 HydrophobicContact CB-CD2 4.22Å; N43-Y47 WeakPolarHBondContact O-CD2 3.38Å; N43-Y47 PolarHBondContact O-N 2.77Å; N43-F103 HydrophobicContact CB-CD1 4.28Å; N43-F103 VanDerWaalsContact OD1-CE1 3.27Å; N43-F103 WeakPolarHBondContact OD1-CE1 3.36Å; N43-F105 HydrophobicContact CB-CE2 4.35Å; N43-F105 HydrophobicContact CB-CZ 4.03Å
44	C	92.3	Very high	92.6	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.02	9%	0.088	C	C	.	.	H	α-helix	trans	-64	-25.6	175.8	-69.2	0	0	0	0	113.1	I40 N41 K46 C49 H66 S68	I40-C44 WeakPolarHBondContact O-CB 3.45Å; I40-C44 PolarHBondContact O-N 3.35Å; I40-C44 PolarHBondContact O-SG 3.13Å; N41-C44 PolarHBondContact O-N 2.91Å; C44-K46 PolarHBondContact O-N 2.96Å; C44-C49 VanDerWaalsContact SG-CB 3.52Å; C44-C49 VanDerWaalsContact SG-SG 3.65Å; C44-H66 HydrophobicContact CB-CB 3.9Å; C44-H66 VanDerWaalsContact CB-CG 3.49Å; C44-S68 PolarHBondContact O-OG 2.93Å
45	E	89.6	Confident	92.3	Very high	95 Å²	95	22.7 Å²	22.7	44%	0.444	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.2	175.1	-69.3	-173.1	176.7	0	0	112.8	N41 N43 K240	N41-E45 PolarHBondContact O-N 3.08Å; N43-E45 PolarHBondContact O-N 3.29Å; E45-K240 IonicContact OE1-NZ 2.74Å; E45-K240 PolarHBondContact OE1-NZ 3.04Å; E45-K240 IonicContact OE2-NZ 3.66Å
46	K	89.1	Confident	91.7	Very high	125 Å²	125	28.8 Å²	28.8	54%	0.543	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-27.5	-172.9	-66.4	176	-175	165	0	114.2	N43 C44	N43-K46 PolarHBondContact O-N 2.91Å; N43-K46 VanDerWaalsContact O-N 3.13Å; C44-K46 PolarHBondContact O-N 2.96Å
47	Y	91.4	Very high	91.2	Very high	40 Å²	40	29.7 Å²	29.7	16%	0.157	14%	0.142	C	C	.	.	S	Bend	trans	-125.9	157.6	-170.8	-52.7	-70.9	0	0	0	110.9	N12 N43 C49 Q101 F103	N12-Y47 HydrophobicContact CB-CE2 4.37Å; N12-Y47 PolarHBondContact ND2-OH 2.8Å; N12-Y47 VanDerWaalsContact ND2-OH 3.14Å; N43-Y47 HydrophobicContact CB-CD2 4.22Å; N43-Y47 WeakPolarHBondContact O-CD2 3.38Å; N43-Y47 PolarHBondContact O-N 2.77Å; Y47-C49 PolarHBondContact O-N 2.85Å; Y47-Q101 HydrophobicContact CD1-CB 4.13Å; Y47-F103 HydrophobicContact CD1-CD2 4.24Å; Y47-F103 AromaticContact CD1-CE2 3.72Å; Y47-F103 HydrophobicContact CD1-CE2 3.72Å; Y47-F103 HydrophobicContact CD1-CZ 4.35Å; Y47-F103 HydrophobicContact CD2-CD1 4.49Å; Y47-F103 HydrophobicContact CD2-CD2 4.14Å; Y47-F103 HydrophobicContact CD2-CE1 4.11Å; Y47-F103 AromaticContact CD2-CE2 3.74Å; Y47-F103 HydrophobicContact CD2-CE2 3.74Å; Y47-F103 AromaticContact CD2-CZ 3.73Å; Y47-F103 HydrophobicContact CD2-CZ 3.73Å; Y47-F103 AromaticContact CE1-CE2 3.99Å; Y47-F103 HydrophobicContact CE1-CE2 3.99Å; Y47-F103 HydrophobicContact CE1-CZ 4.3Å; Y47-F103 HydrophobicContact CE2-CE1 4.23Å; Y47-F103 HydrophobicContact CE2-CE2 4.03Å; Y47-F103 AromaticContact CE2-CZ 3.68Å; Y47-F103 HydrophobicContact CE2-CZ 3.68Å; Y47-F103 AromaticContact CG-CD2 3.81Å; Y47-F103 HydrophobicContact CG-CD2 3.81Å; Y47-F103 AromaticContact CG-CE2 3.58Å; Y47-F103 HydrophobicContact CG-CE2 3.58Å; Y47-F103 HydrophobicContact CG-CG 4.49Å; Y47-F103 HydrophobicContact CG-CZ 4.07Å; Y47-F103 AromaticContact CZ-CZ 3.98Å
48	T	92.6	Very high	90.8	Very high	9 Å²	9	33.7 Å²	33.7	6%	0.055	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.8	164.9	-66.9	0	0	0	0	108	V94 Q100 Q101 T102 F103	T48-V94 HydrophobicContact CG2-CB 4.5Å; T48-V94 HydrophobicContact CG2-CG1 3.73Å; T48-V94 HydrophobicContact CG2-CG2 3.9Å; T48-Q100 PolarHBondContact OG1-OE1 2.73Å; T48-Q101 PolarHBondContact N-O 2.99Å; T48-T102 WeakPolarHBondContact O-CA 3.3Å; T48-F103 PolarHBondContact O-N 2.79Å
49	C	94.5	Very high	90.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139.4	-177.5	-65.5	0	0	0	0	110.8	C44 Y47 S68 L69 K70 F103 F105	C44-C49 VanDerWaalsContact SG-CB 3.52Å; C44-C49 VanDerWaalsContact SG-SG 3.65Å; Y47-C49 PolarHBondContact O-N 2.85Å; C49-S68 PolarHBondContact N-O 3.41Å; C49-L69 HydrophobicContact CB-CD1 3.86Å; C49-L69 CarbonylContact O-C 3.6Å; C49-L69 WeakPolarHBondContact O-CA 3.4Å; C49-K70 PolarHBondContact O-N 3.33Å; C49-F103 CarbonylContact C-O 3.57Å; C49-F103 VanDerWaalsContact CA-O 3.3Å; C49-F103 WeakPolarHBondContact CA-O 3.37Å; C49-F105 HydrophobicContact CB-CD2 4.34Å; C49-F105 HydrophobicContact CB-CE2 4.22Å
50	I	94.9	Very high	90.2	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.2	170.5	-56	175.4	0	0	0	107	K70 L72 L87 L90 T102 F103 I104 F105	I50-K70 CarbonylContact C-O 3.46Å; I50-K70 VanDerWaalsContact CA-O 3.3Å; I50-K70 WeakPolarHBondContact CA-O 3.46Å; I50-K70 HydrophobicContact CG1-CB 4.48Å; I50-L72 HydrophobicContact CG2-CD1 3.87Å; I50-L72 HydrophobicContact CG2-CG 4.07Å; I50-L87 HydrophobicContact CG2-CD2 3.7Å; I50-L90 HydrophobicContact CD1-CB 3.96Å; I50-T102 HydrophobicContact CD1-CG2 3.77Å; I50-T102 HydrophobicContact CG1-CG2 4.03Å; I50-F103 PolarHBondContact N-O 2.82Å; I50-I104 HydrophobicContact CB-CG1 4.47Å; I50-I104 CarbonylContact O-C 3.54Å; I50-I104 WeakPolarHBondContact O-CA 3.43Å; I50-F105 PolarHBondContact O-N 3.14Å
51	L	95.4	Very high	89.8	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.8	175.4	174	64.1	0	0	0	109.4	W36 I40 Y59 L69 K70 V71 L72 F105 E107	W36-L51 HydrophobicContact CZ2-CD1 4.27Å; I40-L51 HydrophobicContact CD1-CD1 3.86Å; I40-L51 HydrophobicContact CD1-CD2 4.41Å; L51-Y59 HydrophobicContact CD2-CD1 3.51Å; L51-Y59 HydrophobicContact CD2-CD2 3.72Å; L51-Y59 HydrophobicContact CD2-CE1 3.82Å; L51-Y59 HydrophobicContact CD2-CE2 3.99Å; L51-Y59 HydrophobicContact CD2-CG 3.47Å; L51-Y59 VanDerWaalsContact CD2-CG 3.47Å; L51-L69 HydrophobicContact CB-CD1 3.9Å; L51-K70 PolarHBondContact N-O 3.31Å; L51-V71 CarbonylContact O-C 3.46Å; L51-V71 WeakPolarHBondContact O-CA 3.48Å; L51-L72 PolarHBondContact O-N 3.09Å; L51-F105 CarbonylContact C-O 3.51Å; L51-F105 WeakPolarHBondContact CA-O 3.3Å; L51-F105 HydrophobicContact CD1-CB 3.83Å; L51-E107 HydrophobicContact CD1-CB 4.31Å
52	V	95.5	Very high	89.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	118.7	169.9	179.7	0	0	0	0	108	L72 T74 L83 L87 F105 I106 E107 F112	V52-L72 WeakPolarHBondContact CA-O 3.23Å; V52-T74 HydrophobicContact CG1-CG2 3.8Å; V52-L83 HydrophobicContact CG1-CD2 3.84Å; V52-L87 HydrophobicContact CG2-CD1 4.03Å; V52-L87 HydrophobicContact CG2-CD2 3.76Å; V52-L87 HydrophobicContact CG2-CG 4.41Å; V52-F105 PolarHBondContact N-O 3.23Å; V52-I106 HydrophobicContact CB-CG1 4.36Å; V52-I106 HydrophobicContact CG2-CG1 4.38Å; V52-E107 WeakPolarHBondContact O-CB 3.37Å; V52-E107 PolarHBondContact O-N 3.5Å; V52-F112 HydrophobicContact CG1-CE2 4.3Å; V52-F112 HydrophobicContact CG1-CZ 4.3Å
53	T	93.8	Very high	89.4	Confident	3 Å²	3	48 Å²	48	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	151	-177.5	-175.5	0	0	0	0	112.6	E55 Y59 V71 L72 H73 T74 E107	T53-E55 VanDerWaalsContact C-N 3.33Å; T53-E55 PolarHBondContact OG1-N 2.84Å; T53-E55 VanDerWaalsContact OG1-N 3.11Å; T53-Y59 HydrophobicContact CG2-CD2 4.28Å; T53-Y59 WeakPolarHBondContact OG1-CE2 3.46Å; T53-V71 HydrophobicContact CG2-CG1 3.77Å; T53-L72 PolarHBondContact N-O 3.39Å; T53-H73 WeakPolarHBondContact O-CA 3.09Å; T53-T74 PolarHBondContact O-N 3.06Å; T53-E107 WeakPolarHBondContact CA-OE2 3.23Å; T53-E107 WeakPolarHBondContact CB-OE2 3.27Å; T53-E107 PolarHBondContact OG1-OE2 3.07Å
54	S	88	Confident	89.2	Confident	24 Å²	24	54.3 Å²	54.3	17%	0.168	27%	0.269	C	S	.	.			trans	-91.5	8.7	169.7	58.1	0	0	0	0	113.5	L56 T74 E107 S108	S54-L56 PolarHBondContact O-N 3.41Å; S54-L56 VanDerWaalsContact OG-CD1 3.31Å; S54-L56 WeakPolarHBondContact OG-CD1 3.32Å; S54-L56 VanDerWaalsContact OG-CG 3.26Å; S54-L56 WeakPolarHBondContact OG-CG 3.43Å; S54-T74 WeakPolarHBondContact CA-OG1 3.32Å; S54-E107 PolarHBondContact N-OE2 3.07Å; S54-E107 PolarHBondContact OG-OE2 3.34Å; S54-S108 WeakPolarHBondContact OG-CB 3.24Å; S54-S108 PolarHBondContact OG-OG 3.24Å
55	E	82.2	Confident	89	Confident	116 Å²	116	57.8 Å²	57.8	54%	0.542	29%	0.293	S	S	.	.	S	Bend	trans	68.3	10.4	-175	-52.1	-176.6	159.2	0	0	115.3	T53 Y57 H73	T53-E55 VanDerWaalsContact C-N 3.33Å; T53-E55 PolarHBondContact OG1-N 2.84Å; T53-E55 VanDerWaalsContact OG1-N 3.11Å; E55-Y57 PolarHBondContact O-N 2.91Å; E55-H73 VanDerWaalsContact CG-ND1 3.27Å; E55-H73 WeakPolarHBondContact CG-ND1 3.45Å; E55-H73 IonicContact OE1-CE1 3.29Å; E55-H73 PolarHBondContact OE1-CE1 3.41Å; E55-H73 VanDerWaalsContact OE1-CE1 3.29Å; E55-H73 IonicContact OE1-CG 3.7Å; E55-H73 IonicContact OE1-ND1 2.88Å; E55-H73 PolarHBondContact OE1-ND1 3.31Å
56	L	79	Confident	89	Confident	128 Å²	128	54.6 Å²	54.6	67%	0.67	28%	0.278	S	S	*	.	S	Bend	trans	-59.4	-32.8	174.2	-71.4	172.6	0	0	0	112.2	S54	S54-L56 PolarHBondContact O-N 3.41Å; S54-L56 VanDerWaalsContact OG-CD1 3.31Å; S54-L56 WeakPolarHBondContact OG-CD1 3.32Å; S54-L56 VanDerWaalsContact OG-CG 3.26Å; S54-L56 WeakPolarHBondContact OG-CG 3.43Å
57	Y	82.1	Confident	88.9	Confident	20 Å²	20	58.2 Å²	58.2	8%	0.078	30%	0.297	C	S	.	.	S	Bend	trans	-113.3	146.2	175.5	-49.7	-62.6	0	0	0	111.9	N31 E55 Y59 E107 N150	N31-Y57 HydrophobicContact CB-CE1 4.34Å; N31-Y57 WeakPolarHBondContact O-CD1 3.43Å; N31-Y57 WeakPolarHBondContact O-CE1 3.39Å; E55-Y57 PolarHBondContact O-N 2.91Å; Y57-Y59 HydrophobicContact CD2-CE2 4.3Å; Y57-Y59 WeakPolarHBondContact CD2-OH 3.39Å; Y57-Y59 VanDerWaalsContact O-CD2 3.22Å; Y57-Y59 WeakPolarHBondContact O-CD2 3.32Å; Y57-Y59 PolarHBondContact O-N 3.4Å; Y57-E107 HydrophobicContact CD2-CG 3.67Å; Y57-E107 WeakPolarHBondContact CD2-OE1 3.46Å; Y57-E107 HydrophobicContact CE2-CG 3.78Å; Y57-E107 WeakPolarHBondContact CE2-OE1 3.41Å; Y57-N150 PolarHBondContact OH-ND2 3Å; Y57-N150 VanDerWaalsContact OH-ND2 3.11Å
58	N	83.6	Confident	88.8	Confident	103 Å²	103	57.9 Å²	57.9	55%	0.551	30%	0.3	S	S	*	.			trans	-78.8	113.8	173.9	-174.1	-6	0	0	0	110.8	K60	N58-K60 VanDerWaalsContact OD1-CB 3.25Å; N58-K60 WeakPolarHBondContact OD1-CB 3.37Å; N58-K60 VanDerWaalsContact OD1-CG 3.29Å; N58-K60 WeakPolarHBondContact OD1-CG 3.32Å; N58-K60 PolarHBondContact OD1-N 3.27Å
59	Y	88.2	Confident	88.8	Confident	10 Å²	10	58 Å²	58	4%	0.039	30%	0.3	C	S	.	.			trans	-106	4.1	175.6	-67.1	-75.2	0	0	0	114	W36 K37 I40 L51 T53 Y57 T61 L62 E63 E107	W36-Y59 AromaticContact NE1-CZ 3.85Å; W36-Y59 PolarHBondContact NE1-OH 3.43Å; K37-Y59 HydrophobicContact CG-CE1 4.3Å; I40-Y59 HydrophobicContact CD1-CE1 3.99Å; L51-Y59 HydrophobicContact CD2-CD1 3.51Å; L51-Y59 HydrophobicContact CD2-CD2 3.72Å; L51-Y59 HydrophobicContact CD2-CE1 3.82Å; L51-Y59 HydrophobicContact CD2-CE2 3.99Å; L51-Y59 HydrophobicContact CD2-CG 3.47Å; L51-Y59 VanDerWaalsContact CD2-CG 3.47Å; T53-Y59 HydrophobicContact CG2-CD2 4.28Å; T53-Y59 WeakPolarHBondContact OG1-CE2 3.46Å; Y57-Y59 HydrophobicContact CD2-CE2 4.3Å; Y57-Y59 WeakPolarHBondContact CD2-OH 3.39Å; Y57-Y59 VanDerWaalsContact O-CD2 3.22Å; Y57-Y59 WeakPolarHBondContact O-CD2 3.32Å; Y57-Y59 PolarHBondContact O-N 3.4Å; Y59-T61 PolarHBondContact O-N 3.15Å; Y59-T61 VanDerWaalsContact O-N 3.14Å; Y59-L62 HydrophobicContact CD1-CD1 3.78Å; Y59-L62 HydrophobicContact CE1-CD1 4.33Å; Y59-L62 WeakPolarHBondContact O-CB 3.29Å; Y59-L62 PolarHBondContact O-N 3.42Å; Y59-E63 PolarHBondContact O-N 3.24Å; Y59-E107 HydrophobicContact CE2-CG 4.41Å; Y59-E107 WeakPolarHBondContact OH-CG 3.22Å
60	K	87.2	Confident	88.7	Confident	142 Å²	142	61.5 Å²	61.5	62%	0.617	32%	0.316	S	S	*	.	H	α-helix	trans	-55.4	-37.9	-176.4	-68.1	179.8	178.6	-177.8	0	112.9	N58 N64	N58-K60 VanDerWaalsContact OD1-CB 3.25Å; N58-K60 WeakPolarHBondContact OD1-CB 3.37Å; N58-K60 VanDerWaalsContact OD1-CG 3.29Å; N58-K60 WeakPolarHBondContact OD1-CG 3.32Å; N58-K60 PolarHBondContact OD1-N 3.27Å; K60-N64 VanDerWaalsContact O-CB 3.29Å; K60-N64 WeakPolarHBondContact O-CB 3.4Å; K60-N64 PolarHBondContact O-N 3.28Å; K60-N64 PolarHBondContact O-ND2 3.1Å; K60-N64 VanDerWaalsContact O-ND2 3.12Å
61	T	86.7	Confident	88.7	Confident	92 Å²	92	62.6 Å²	62.6	56%	0.564	32%	0.322	S	S	*	.	H	α-helix	trans	-63.3	-42.3	177.2	-51.2	0	0	0	0	111.7	Y59 S65	Y59-T61 PolarHBondContact O-N 3.15Å; Y59-T61 VanDerWaalsContact O-N 3.14Å; T61-S65 WeakPolarHBondContact O-CB 3.4Å; T61-S65 PolarHBondContact O-N 3.09Å; T61-S65 VanDerWaalsContact O-N 3.14Å; T61-S65 PolarHBondContact O-OG 3.48Å
62	L	88.5	Confident	88.6	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-70.5	-44.5	179	-78.3	161.3	0	0	0	111.2	K37 I40 N41 Y59 N64 S65 H66 L69 L239	K37-L62 HydrophobicContact CB-CD1 4.29Å; K37-L62 HydrophobicContact CG-CD1 4.41Å; I40-L62 HydrophobicContact CG2-CD1 4.47Å; N41-L62 HydrophobicContact CB-CD2 3.65Å; Y59-L62 HydrophobicContact CD1-CD1 3.78Å; Y59-L62 HydrophobicContact CE1-CD1 4.33Å; Y59-L62 WeakPolarHBondContact O-CB 3.29Å; Y59-L62 PolarHBondContact O-N 3.42Å; L62-N64 VanDerWaalsContact C-N 3.33Å; L62-N64 PolarHBondContact O-N 3.29Å; L62-S65 PolarHBondContact O-N 2.74Å; L62-S65 VanDerWaalsContact O-N 3.08Å; L62-H66 PolarHBondContact O-N 2.93Å; L62-H66 VanDerWaalsContact O-N 3.08Å; L62-L69 HydrophobicContact CB-CD2 3.95Å; L62-L239 HydrophobicContact CD1-CD1 4.48Å; L62-L239 HydrophobicContact CD2-CD1 3.95Å; L62-L239 HydrophobicContact CG-CD1 4.07Å
63	E	89	Confident	88.5	Confident	90 Å²	90	65.8 Å²	65.8	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-59.1	-43.1	176.8	-172.3	179.5	-170.2	0	0	111.8	Y59 S65 V71	Y59-E63 PolarHBondContact O-N 3.24Å; E63-S65 VanDerWaalsContact C-N 3.29Å; E63-S65 PolarHBondContact O-N 2.91Å; E63-V71 HydrophobicContact CB-CG2 4.29Å; E63-V71 HydrophobicContact CG-CG2 4.11Å
64	N	89.6	Confident	88.4	Confident	137 Å²	137	65.6 Å²	65.6	73%	0.733	34%	0.337	S	S	*	.	H	α-helix	trans	-70.9	-24.6	176.5	-69.9	-25	0	0	0	113.3	K60 L62	K60-N64 VanDerWaalsContact O-CB 3.29Å; K60-N64 WeakPolarHBondContact O-CB 3.4Å; K60-N64 PolarHBondContact O-N 3.28Å; K60-N64 PolarHBondContact O-ND2 3.1Å; K60-N64 VanDerWaalsContact O-ND2 3.12Å; L62-N64 VanDerWaalsContact C-N 3.33Å; L62-N64 PolarHBondContact O-N 3.29Å
65	S	89	Confident	88.5	Confident	76 Å²	76	69.7 Å²	69.7	53%	0.531	36%	0.356	S	S	.	.	H	α-helix	trans	-85	-27.4	-176.4	-60.4	0	0	0	0	112.7	T61 L62 E63	T61-S65 WeakPolarHBondContact O-CB 3.4Å; T61-S65 PolarHBondContact O-N 3.09Å; T61-S65 VanDerWaalsContact O-N 3.14Å; T61-S65 PolarHBondContact O-OG 3.48Å; L62-S65 PolarHBondContact O-N 2.74Å; L62-S65 VanDerWaalsContact O-N 3.08Å; E63-S65 VanDerWaalsContact C-N 3.29Å; E63-S65 PolarHBondContact O-N 2.91Å
66	H	89.2	Confident	89	Confident	27 Å²	27	69.9 Å²	69.9	13%	0.125	36%	0.361	C	S	.	.			trans	-129.9	108.5	-171.3	-66.6	-71.5	0	0	0	112.3	N41 C44 L62 S68 L69	N41-H66 PolarHBondContact OD1-NE2 3.37Å; C44-H66 HydrophobicContact CB-CB 3.9Å; C44-H66 VanDerWaalsContact CB-CG 3.49Å; L62-H66 PolarHBondContact O-N 2.93Å; L62-H66 VanDerWaalsContact O-N 3.08Å; H66-S68 PolarHBondContact O-N 3.22Å; H66-L69 HydrophobicContact CB-CB 3.97Å; H66-L69 WeakPolarHBondContact O-CB 3.49Å; H66-L69 PolarHBondContact O-N 3.23Å; H66-L69 VanDerWaalsContact O-N 3.14Å
67	Q	86.6	Confident	89.6	Confident	202 Å²	202	65.5 Å²	65.5	94%	0.944	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-20.1	171.6	-64.9	-179.5	-4.3	0	0	113	L69	Q67-L69 VanDerWaalsContact C-N 3.26Å
68	S	89.2	Confident	89.9	Confident	32 Å²	32	73.3 Å²	73.3	22%	0.224	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-11.6	175.3	54.1	0	0	0	0	113.4	C44 C49 H66	C44-S68 PolarHBondContact O-OG 2.93Å; C49-S68 PolarHBondContact N-O 3.41Å; H66-S68 PolarHBondContact O-N 3.22Å
69	L	93.1	Very high	90.3	Very high	12 Å²	12	71.2 Å²	71.2	6%	0.063	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	120.1	179.9	-178.9	60.2	0	0	0	110.7	I40 C49 L51 L62 H66 Q67 V71	I40-L69 HydrophobicContact CG2-CD1 4.33Å; I40-L69 HydrophobicContact CG2-CD2 4.38Å; C49-L69 HydrophobicContact CB-CD1 3.86Å; C49-L69 CarbonylContact O-C 3.6Å; C49-L69 WeakPolarHBondContact O-CA 3.4Å; L51-L69 HydrophobicContact CB-CD1 3.9Å; L62-L69 HydrophobicContact CB-CD2 3.95Å; H66-L69 HydrophobicContact CB-CB 3.97Å; H66-L69 WeakPolarHBondContact O-CB 3.49Å; H66-L69 PolarHBondContact O-N 3.23Å; H66-L69 VanDerWaalsContact O-N 3.14Å; Q67-L69 VanDerWaalsContact C-N 3.26Å; L69-V71 HydrophobicContact CD2-CG2 4.4Å; L69-V71 HydrophobicContact CG-CG2 4.2Å
70	K	92.4	Very high	90.4	Very high	73 Å²	73	71 Å²	71	32%	0.317	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	119.7	171.2	-67.1	179.1	-178.2	172.9	0	109.6	C49 I50 L51	C49-K70 PolarHBondContact O-N 3.33Å; I50-K70 CarbonylContact C-O 3.46Å; I50-K70 VanDerWaalsContact CA-O 3.3Å; I50-K70 WeakPolarHBondContact CA-O 3.46Å; I50-K70 HydrophobicContact CG1-CB 4.48Å; L51-K70 PolarHBondContact N-O 3.31Å
71	V	93.4	Very high	90.6	Very high	23 Å²	23	70.6 Å²	70.6	14%	0.139	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	129.7	178.5	-172.6	0	0	0	0	109.8	L51 T53 E63 L69	L51-V71 CarbonylContact O-C 3.46Å; L51-V71 WeakPolarHBondContact O-CA 3.48Å; T53-V71 HydrophobicContact CG2-CG1 3.77Å; E63-V71 HydrophobicContact CB-CG2 4.29Å; E63-V71 HydrophobicContact CG-CG2 4.11Å; L69-V71 HydrophobicContact CD2-CG2 4.4Å; L69-V71 HydrophobicContact CG-CG2 4.2Å
72	L	93.7	Very high	90.9	Very high	20 Å²	20	68.9 Å²	68.9	11%	0.105	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	130.7	172.5	-57.2	-177.8	0	0	0	108.8	I50 L51 V52 T53 Y77 L83 L87 L90	I50-L72 HydrophobicContact CG2-CD1 3.87Å; I50-L72 HydrophobicContact CG2-CG 4.07Å; L51-L72 PolarHBondContact O-N 3.09Å; V52-L72 WeakPolarHBondContact CA-O 3.23Å; T53-L72 PolarHBondContact N-O 3.39Å; L72-Y77 HydrophobicContact CB-CE2 4.4Å; L72-L83 HydrophobicContact CD1-CD1 4.26Å; L72-L87 HydrophobicContact CD1-CD2 3.63Å; L72-L87 HydrophobicContact CD1-CG 4.43Å; L72-L90 HydrophobicContact CD1-CD1 3.66Å; L72-L90 HydrophobicContact CD2-CD1 3.97Å; L72-L90 HydrophobicContact CG-CD1 4.34Å
73	H	93.3	Very high	91.2	Very high	47 Å²	47	68.7 Å²	68.7	22%	0.218	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	128.2	179.8	-58.9	-98.8	0	0	0	108.9	T53 E55 N75 N76 Y77	T53-H73 WeakPolarHBondContact O-CA 3.09Å; E55-H73 VanDerWaalsContact CG-ND1 3.27Å; E55-H73 WeakPolarHBondContact CG-ND1 3.45Å; E55-H73 IonicContact OE1-CE1 3.29Å; E55-H73 PolarHBondContact OE1-CE1 3.41Å; E55-H73 VanDerWaalsContact OE1-CE1 3.29Å; E55-H73 IonicContact OE1-CG 3.7Å; E55-H73 IonicContact OE1-ND1 2.88Å; E55-H73 PolarHBondContact OE1-ND1 3.31Å; H73-N75 PolarHBondContact O-N 3.31Å; H73-N76 WeakPolarHBondContact O-CB 3.22Å; H73-N76 PolarHBondContact O-N 3.23Å; H73-N76 VanDerWaalsContact O-N 3.07Å; H73-Y77 VanDerWaalsContact O-CD2 3.24Å; H73-Y77 WeakPolarHBondContact O-CD2 3.25Å; H73-Y77 WeakPolarHBondContact O-CE2 3.48Å
74	T	92.4	Very high	91.3	Very high	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-58.7	-33.5	-179.4	54	0	0	0	0	112.1	V52 T53 S54 N76 Y77 L83 W111	V52-T74 HydrophobicContact CG1-CG2 3.8Å; T53-T74 PolarHBondContact O-N 3.06Å; S54-T74 WeakPolarHBondContact CA-OG1 3.32Å; T74-N76 PolarHBondContact O-N 3.21Å; T74-Y77 PolarHBondContact O-N 3.06Å; T74-L83 HydrophobicContact CG2-CD2 4.34Å; T74-W111 HydrophobicContact CG2-CB 4.15Å; T74-W111 HydrophobicContact CG2-CD2 3.82Å; T74-W111 HydrophobicContact CG2-CE3 4.03Å; T74-W111 HydrophobicContact CG2-CG 3.86Å; T74-W111 WeakPolarHBondContact O-CZ2 3.42Å
75	N	89.8	Confident	91.5	Very high	109 Å²	109	62.3 Å²	62.3	58%	0.583	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-61.8	-16	177.8	-61.2	-18.1	0	0	0	114.3	H73 Y77	H73-N75 PolarHBondContact O-N 3.31Å; N75-Y77 VanDerWaalsContact C-N 3.25Å; N75-Y77 PolarHBondContact O-N 3Å
76	N	92.1	Very high	91.7	Very high	120 Å²	120	63 Å²	63	64%	0.642	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-85.2	2.4	177.6	-64.5	-17.9	0	0	0	113	H73 T74	H73-N76 WeakPolarHBondContact O-CB 3.22Å; H73-N76 PolarHBondContact O-N 3.23Å; H73-N76 VanDerWaalsContact O-N 3.07Å; T74-N76 PolarHBondContact O-N 3.21Å
77	Y	92.5	Very high	91.9	Very high	37 Å²	37	61.7 Å²	61.7	15%	0.145	31%	0.312	C	S	.	.			trans	-128.3	138	-176.2	-57.9	-89	0	0	0	109.9	L72 H73 T74 N75 L83 K86 W111	L72-Y77 HydrophobicContact CB-CE2 4.4Å; H73-Y77 VanDerWaalsContact O-CD2 3.24Å; H73-Y77 WeakPolarHBondContact O-CD2 3.25Å; H73-Y77 WeakPolarHBondContact O-CE2 3.48Å; T74-Y77 PolarHBondContact O-N 3.06Å; N75-Y77 VanDerWaalsContact C-N 3.25Å; N75-Y77 PolarHBondContact O-N 3Å; Y77-L83 HydrophobicContact CD1-CB 4.09Å; Y77-L83 HydrophobicContact CD1-CD1 4.22Å; Y77-L83 HydrophobicContact CD2-CB 4.39Å; Y77-L83 HydrophobicContact CD2-CD1 3.76Å; Y77-L83 HydrophobicContact CD2-CD2 4.44Å; Y77-L83 HydrophobicContact CD2-CG 4.42Å; Y77-L83 HydrophobicContact CE1-CD1 4.11Å; Y77-L83 HydrophobicContact CE2-CD1 3.64Å; Y77-L83 HydrophobicContact CG-CB 3.93Å; Y77-L83 HydrophobicContact CG-CD1 4.06Å; Y77-L83 HydrophobicContact CG-CG 4.44Å; Y77-K86 HydrophobicContact CE1-CB 3.77Å; Y77-K86 HydrophobicContact CE1-CG 3.8Å; Y77-K86 WeakPolarHBondContact OH-CG 3.44Å; Y77-W111 WeakPolarHBondContact O-CZ2 3.29Å
78	E	88.9	Confident	92.1	Very high	183 Å²	183	53.6 Å²	53.6	86%	0.855	28%	0.278	S	S	*	.	S	Bend	trans	-83.1	-31.5	-178.9	-65.1	178.7	172.6	0	0	112.4
79	T	90.8	Very high	92.2	Very high	60 Å²	60	58.7 Å²	58.7	37%	0.368	30%	0.296	S	S	.	.	S	Bend	trans	-138.2	154.4	-175.7	66.9	0	0	0	0	112	E81 S82 L83	T79-E81 VanDerWaalsContact C-N 3.28Å; T79-E81 PolarHBondContact O-N 3.4Å; T79-S82 WeakPolarHBondContact O-CB 3.43Å; T79-S82 PolarHBondContact O-N 3.22Å; T79-S82 WeakPolarHBondContact OG1-CB 3.35Å; T79-S82 PolarHBondContact OG1-N 2.83Å; T79-L83 PolarHBondContact O-N 2.77Å
80	T	90.2	Very high	92	Very high	4 Å²	4	59.4 Å²	59.4	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-51.2	-47.1	171.1	-71.6	0	0	0	0	111.8	S82 L83 V84 F112 D115 W125 V129	T80-S82 VanDerWaalsContact C-N 3.35Å; T80-S82 PolarHBondContact O-N 2.87Å; T80-L83 PolarHBondContact O-N 3.04Å; T80-V84 HydrophobicContact CG2-CG2 4.43Å; T80-V84 WeakPolarHBondContact O-CG2 3.42Å; T80-V84 PolarHBondContact O-N 3.48Å; T80-F112 HydrophobicContact CG2-CD1 3.63Å; T80-F112 HydrophobicContact CG2-CE1 4.38Å; T80-F112 PolarHBondContact OG1-O 3.04Å; T80-D115 WeakPolarHBondContact CB-OD2 3.31Å; T80-D115 PolarHBondContact N-OD2 2.84Å; T80-D115 PolarHBondContact OG1-OD2 2.81Å; T80-D115 VanDerWaalsContact OG1-OD2 3.04Å; T80-W125 HydrophobicContact CG2-CZ2 4.45Å; T80-V129 HydrophobicContact CG2-CG2 4.36Å
81	E	91.5	Very high	91.7	Very high	134 Å²	134	56 Å²	56	63%	0.626	29%	0.285	S	S	*	.	H	α-helix	trans	-62.5	-41.1	-178.2	-163.9	-167	157.9	0	0	112	T79 L83 V84 N85	T79-E81 VanDerWaalsContact C-N 3.28Å; T79-E81 PolarHBondContact O-N 3.4Å; E81-L83 VanDerWaalsContact C-N 3.33Å; E81-L83 PolarHBondContact O-N 2.72Å; E81-V84 PolarHBondContact O-N 3.28Å; E81-N85 VanDerWaalsContact O-CB 3.23Å; E81-N85 WeakPolarHBondContact O-CB 3.22Å; E81-N85 VanDerWaalsContact O-CG 3.26Å; E81-N85 PolarHBondContact O-N 2.74Å; E81-N85 PolarHBondContact O-ND2 2.94Å
82	S	93.3	Very high	91.3	Very high	57 Å²	57	57.6 Å²	57.6	40%	0.399	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-42.6	178.1	-176	0	0	0	0	111.8	T79 T80 K86	T79-S82 WeakPolarHBondContact O-CB 3.43Å; T79-S82 PolarHBondContact O-N 3.22Å; T79-S82 WeakPolarHBondContact OG1-CB 3.35Å; T79-S82 PolarHBondContact OG1-N 2.83Å; T80-S82 VanDerWaalsContact C-N 3.35Å; T80-S82 PolarHBondContact O-N 2.87Å; S82-K86 WeakPolarHBondContact O-CB 3.41Å; S82-K86 PolarHBondContact O-N 2.95Å
83	L	94.2	Very high	90.7	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-68.8	-45.9	178	177.7	53.2	0	0	0	112.1	V52 L72 T74 Y77 T79 T80 E81 N85 K86 L87 W111 F112	V52-L83 HydrophobicContact CG1-CD2 3.84Å; L72-L83 HydrophobicContact CD1-CD1 4.26Å; T74-L83 HydrophobicContact CG2-CD2 4.34Å; Y77-L83 HydrophobicContact CD1-CB 4.09Å; Y77-L83 HydrophobicContact CD1-CD1 4.22Å; Y77-L83 HydrophobicContact CD2-CB 4.39Å; Y77-L83 HydrophobicContact CD2-CD1 3.76Å; Y77-L83 HydrophobicContact CD2-CD2 4.44Å; Y77-L83 HydrophobicContact CD2-CG 4.42Å; Y77-L83 HydrophobicContact CE1-CD1 4.11Å; Y77-L83 HydrophobicContact CE2-CD1 3.64Å; Y77-L83 HydrophobicContact CG-CB 3.93Å; Y77-L83 HydrophobicContact CG-CD1 4.06Å; Y77-L83 HydrophobicContact CG-CG 4.44Å; T79-L83 PolarHBondContact O-N 2.77Å; T80-L83 PolarHBondContact O-N 3.04Å; E81-L83 VanDerWaalsContact C-N 3.33Å; E81-L83 PolarHBondContact O-N 2.72Å; L83-N85 VanDerWaalsContact C-N 3.3Å; L83-N85 PolarHBondContact O-N 3.37Å; L83-K86 WeakPolarHBondContact O-CB 3.46Å; L83-K86 PolarHBondContact O-N 2.85Å; L83-L87 HydrophobicContact CD1-CD1 4.49Å; L83-L87 HydrophobicContact CD1-CG 4.3Å; L83-L87 HydrophobicContact CG-CD1 4.43Å; L83-L87 WeakPolarHBondContact O-CG 3.47Å; L83-L87 PolarHBondContact O-N 3.38Å; L83-W111 HydrophobicContact CB-CZ3 4.35Å; L83-W111 HydrophobicContact CD2-CE3 4.16Å; L83-W111 HydrophobicContact CD2-CH2 4.25Å; L83-W111 HydrophobicContact CD2-CZ3 3.64Å; L83-F112 HydrophobicContact CD2-CE1 3.81Å; L83-F112 HydrophobicContact CD2-CE2 4.29Å; L83-F112 HydrophobicContact CD2-CZ 3.46Å; L83-F112 VanDerWaalsContact CD2-CZ 3.46Å; L83-F112 HydrophobicContact CG-CE1 4.2Å; L83-F112 HydrophobicContact CG-CZ 4.1Å
84	V	92.9	Very high	89.8	Confident	25 Å²	25	57.5 Å²	57.5	15%	0.152	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-42.3	176.3	175	0	0	0	0	110.8	T80 E81 K86 L87 S88 F112 L133	T80-V84 HydrophobicContact CG2-CG2 4.43Å; T80-V84 WeakPolarHBondContact O-CG2 3.42Å; T80-V84 PolarHBondContact O-N 3.48Å; E81-V84 PolarHBondContact O-N 3.28Å; V84-K86 VanDerWaalsContact C-N 3.31Å; V84-K86 PolarHBondContact O-N 3.39Å; V84-L87 PolarHBondContact O-N 3.25Å; V84-S88 PolarHBondContact O-N 2.73Å; V84-F112 HydrophobicContact CG2-CE1 4.16Å; V84-L133 HydrophobicContact CG2-CD2 4.2Å
85	N	92.6	Very high	88.5	Confident	68 Å²	68	60.9 Å²	60.9	36%	0.364	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-32.9	174.6	-78.7	-32	0	0	0	113	E81 L83 S88 K89	E81-N85 VanDerWaalsContact O-CB 3.23Å; E81-N85 WeakPolarHBondContact O-CB 3.22Å; E81-N85 VanDerWaalsContact O-CG 3.26Å; E81-N85 PolarHBondContact O-N 2.74Å; E81-N85 PolarHBondContact O-ND2 2.94Å; L83-N85 VanDerWaalsContact C-N 3.3Å; L83-N85 PolarHBondContact O-N 3.37Å; N85-S88 PolarHBondContact O-OG 3.14Å; N85-K89 WeakPolarHBondContact O-CB 3.35Å; N85-K89 WeakPolarHBondContact O-CD 3.42Å; N85-K89 VanDerWaalsContact O-CG 3.23Å; N85-K89 WeakPolarHBondContact O-CG 3.31Å; N85-K89 PolarHBondContact O-N 3.34Å
86	K	93.3	Very high	87	Confident	90 Å²	90	64.6 Å²	64.6	39%	0.391	33%	0.328	S	S	.	.	H	α-helix	trans	-70.7	-41.7	173.9	-177	66.6	170.9	-168.1	0	111.5	Y77 S82 L83 V84 K89 L90	Y77-K86 HydrophobicContact CE1-CB 3.77Å; Y77-K86 HydrophobicContact CE1-CG 3.8Å; Y77-K86 WeakPolarHBondContact OH-CG 3.44Å; S82-K86 WeakPolarHBondContact O-CB 3.41Å; S82-K86 PolarHBondContact O-N 2.95Å; L83-K86 WeakPolarHBondContact O-CB 3.46Å; L83-K86 PolarHBondContact O-N 2.85Å; V84-K86 VanDerWaalsContact C-N 3.31Å; V84-K86 PolarHBondContact O-N 3.39Å; K86-K89 PolarHBondContact O-N 3Å; K86-L90 HydrophobicContact CD-CD1 4.35Å; K86-L90 HydrophobicContact CD-CG 4.36Å; K86-L90 HydrophobicContact CG-CD1 3.96Å; K86-L90 HydrophobicContact CG-CG 4.38Å; K86-L90 WeakPolarHBondContact O-CB 3.36Å; K86-L90 WeakPolarHBondContact O-CG 3.21Å; K86-L90 PolarHBondContact O-N 3.3Å
87	L	93.8	Very high	85.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-44.7	177.3	-71.9	171	0	0	0	111.7	I50 V52 L72 L83 V84 L90 S91 I104 L136	I50-L87 HydrophobicContact CG2-CD2 3.7Å; V52-L87 HydrophobicContact CG2-CD1 4.03Å; V52-L87 HydrophobicContact CG2-CD2 3.76Å; V52-L87 HydrophobicContact CG2-CG 4.41Å; L72-L87 HydrophobicContact CD1-CD2 3.63Å; L72-L87 HydrophobicContact CD1-CG 4.43Å; L83-L87 HydrophobicContact CD1-CD1 4.49Å; L83-L87 HydrophobicContact CD1-CG 4.3Å; L83-L87 HydrophobicContact CG-CD1 4.43Å; L83-L87 WeakPolarHBondContact O-CG 3.47Å; L83-L87 PolarHBondContact O-N 3.38Å; V84-L87 PolarHBondContact O-N 3.25Å; L87-L90 PolarHBondContact O-N 3.28Å; L87-S91 WeakPolarHBondContact O-CB 3.44Å; L87-S91 PolarHBondContact O-N 3.03Å; L87-S91 PolarHBondContact O-OG 2.96Å; L87-I104 HydrophobicContact CD1-CG2 4.43Å; L87-I104 HydrophobicContact CD2-CG2 4.14Å; L87-L136 HydrophobicContact CB-CD1 4.34Å; L87-L136 HydrophobicContact CB-CD2 3.9Å; L87-L136 HydrophobicContact CD1-CD2 3.83Å; L87-L136 HydrophobicContact CG-CD2 4.49Å
88	S	90.9	Very high	84.1	Confident	31 Å²	31	69 Å²	69	22%	0.217	35%	0.35	C	S	.	.	H	α-helix	trans	-62.5	-45.7	176.5	66.9	0	0	0	0	111.7	V84 N85 L90 S91 C92	V84-S88 PolarHBondContact O-N 2.73Å; N85-S88 PolarHBondContact O-OG 3.14Å; S88-L90 PolarHBondContact O-N 3.45Å; S88-S91 PolarHBondContact O-N 3.21Å; S88-C92 PolarHBondContact O-N 2.78Å; S88-C92 PolarHBondContact O-SG 2.88Å; S88-C92 VanDerWaalsContact O-SG 3.37Å
89	K	91.3	Very high	83	Confident	139 Å²	139	66.3 Å²	66.3	60%	0.604	34%	0.341	S	S	*	.	H	α-helix	trans	-61.5	-41.2	176	-73.3	171.6	-175.3	173.7	0	113.1	N85 K86 S93	N85-K89 WeakPolarHBondContact O-CB 3.35Å; N85-K89 WeakPolarHBondContact O-CD 3.42Å; N85-K89 VanDerWaalsContact O-CG 3.23Å; N85-K89 WeakPolarHBondContact O-CG 3.31Å; N85-K89 PolarHBondContact O-N 3.34Å; K86-K89 PolarHBondContact O-N 3Å; K89-S93 PolarHBondContact O-N 3.11Å; K89-S93 VanDerWaalsContact O-N 3.08Å; K89-S93 PolarHBondContact O-OG 2.9Å
90	L	89.1	Confident	82.4	Confident	28 Å²	28	67.1 Å²	67.1	15%	0.147	34%	0.341	C	S	.	.	H	α-helix	trans	-66.5	-43.7	177.8	-77.4	171.3	0	0	0	111.3	I50 L72 K86 L87 S88 C92 S93 V94	I50-L90 HydrophobicContact CD1-CB 3.96Å; L72-L90 HydrophobicContact CD1-CD1 3.66Å; L72-L90 HydrophobicContact CD2-CD1 3.97Å; L72-L90 HydrophobicContact CG-CD1 4.34Å; K86-L90 HydrophobicContact CD-CD1 4.35Å; K86-L90 HydrophobicContact CD-CG 4.36Å; K86-L90 HydrophobicContact CG-CD1 3.96Å; K86-L90 HydrophobicContact CG-CG 4.38Å; K86-L90 WeakPolarHBondContact O-CB 3.36Å; K86-L90 WeakPolarHBondContact O-CG 3.21Å; K86-L90 PolarHBondContact O-N 3.3Å; L87-L90 PolarHBondContact O-N 3.28Å; S88-L90 PolarHBondContact O-N 3.45Å; L90-C92 VanDerWaalsContact C-N 3.32Å; L90-C92 PolarHBondContact O-N 3.44Å; L90-S93 WeakPolarHBondContact O-CB 3.4Å; L90-S93 PolarHBondContact O-N 3.01Å; L90-V94 WeakPolarHBondContact O-CG2 3.46Å; L90-V94 PolarHBondContact O-N 2.78Å
91	S	86.3	Confident	82.1	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-60.3	-42.2	177.3	-54.5	0	0	0	0	111.4	L87 S88 S93 V94	L87-S91 WeakPolarHBondContact O-CB 3.44Å; L87-S91 PolarHBondContact O-N 3.03Å; L87-S91 PolarHBondContact O-OG 2.96Å; S88-S91 PolarHBondContact O-N 3.21Å; S91-S93 VanDerWaalsContact C-N 3.31Å; S91-S93 PolarHBondContact O-N 2.68Å; S91-V94 PolarHBondContact O-N 3.44Å
92	C	83.8	Confident	82.2	Confident	57 Å²	57	64.8 Å²	64.8	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-64.5	-31.6	173	-71.3	0	0	0	0	113.7	S88 L90	S88-C92 PolarHBondContact O-N 2.78Å; S88-C92 PolarHBondContact O-SG 2.88Å; S88-C92 VanDerWaalsContact O-SG 3.37Å; L90-C92 VanDerWaalsContact C-N 3.32Å; L90-C92 PolarHBondContact O-N 3.44Å
93	S	81.5	Confident	82.3	Confident	61 Å²	61	62.1 Å²	62.1	43%	0.427	31%	0.311	S	S	.	.	H	α-helix	trans	-77	-33.4	-178.9	-58.7	0	0	0	0	112.5	K89 L90 S91 K96	K89-S93 PolarHBondContact O-N 3.11Å; K89-S93 VanDerWaalsContact O-N 3.08Å; K89-S93 PolarHBondContact O-OG 2.9Å; L90-S93 WeakPolarHBondContact O-CB 3.4Å; L90-S93 PolarHBondContact O-N 3.01Å; S91-S93 VanDerWaalsContact C-N 3.31Å; S91-S93 PolarHBondContact O-N 2.68Å; S93-K96 PolarHBondContact O-N 2.97Å
94	V	74.1	Confident	82.4	Confident	4 Å²	4	62.1 Å²	62.1	2%	0.024	31%	0.311	C	S	.	.	H	α-helix	trans	-62.1	-41.8	179.3	168.6	0	0	0	0	111.7	T48 L90 S91 K96 Q97 N98	T48-V94 HydrophobicContact CG2-CB 4.5Å; T48-V94 HydrophobicContact CG2-CG1 3.73Å; T48-V94 HydrophobicContact CG2-CG2 3.9Å; L90-V94 WeakPolarHBondContact O-CG2 3.46Å; L90-V94 PolarHBondContact O-N 2.78Å; S91-V94 PolarHBondContact O-N 3.44Å; V94-K96 VanDerWaalsContact C-N 3.29Å; V94-K96 PolarHBondContact O-N 2.9Å; V94-Q97 PolarHBondContact O-N 3.06Å; V94-Q97 VanDerWaalsContact O-N 3.13Å; V94-N98 PolarHBondContact O-N 3.31Å
95	K	65.3	Low	82.6	Confident	71 Å²	71	60.9 Å²	60.9	31%	0.309	30%	0.303	S	S	.	.	H	α-helix	trans	-56.8	-42.9	177.7	176.1	168.1	176.7	178.8	0	112.7	Q97 N98 D99 Y141	K95-Q97 PolarHBondContact O-N 3.39Å; K95-N98 PolarHBondContact O-N 3.34Å; K95-D99 PolarHBondContact O-N 2.94Å; K95-D99 VanDerWaalsContact O-N 3.15Å; K95-Y141 HydrophobicContact CB-CD1 4.44Å; K95-Y141 HydrophobicContact CB-CD2 4.22Å; K95-Y141 HydrophobicContact CB-CG 4.09Å; K95-Y141 HydrophobicContact CD-CD1 3.3Å; K95-Y141 HydrophobicContact CD-CD2 4.01Å; K95-Y141 HydrophobicContact CD-CE1 3.1Å; K95-Y141 HydrophobicContact CD-CE2 3.8Å; K95-Y141 HydrophobicContact CD-CG 3.75Å; K95-Y141 HydrophobicContact CG-CD1 4.39Å; K95-Y141 HydrophobicContact CG-CE1 4.49Å; K95-Y141 PolarHBondContact NZ-OH 3.48Å; K95-Y141 VanDerWaalsContact NZ-OH 3.14Å
96	K	59.2	Low	82.8	Confident	188 Å²	188	57.7 Å²	57.7	82%	0.817	29%	0.286	S	S	*	.	H	α-helix	trans	-59.5	-20.9	-176.9	-67.9	-174.1	178.9	-178.3	0	113.1	S93 V94	S93-K96 PolarHBondContact O-N 2.97Å; V94-K96 VanDerWaalsContact C-N 3.29Å; V94-K96 PolarHBondContact O-N 2.9Å
97	Q	60.2	Low	82.8	Confident	146 Å²	146	53.9 Å²	53.9	68%	0.682	27%	0.27	S	S	*	.	H	α-helix	trans	-96.6	-47.9	-176.7	-66	-176.3	-28.2	0	0	112.3	V94 K95	V94-Q97 PolarHBondContact O-N 3.06Å; V94-Q97 VanDerWaalsContact O-N 3.13Å; K95-Q97 PolarHBondContact O-N 3.39Å
98	N	63	Low	82.4	Confident	103 Å²	103	54.4 Å²	54.4	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-132.1	-1.1	-165.3	-68.4	-9	0	0	0	115.7	V94 K95 Q100	V94-N98 PolarHBondContact O-N 3.31Å; K95-N98 PolarHBondContact O-N 3.34Å; N98-Q100 HydrophobicContact CB-CB 4.3Å; N98-Q100 HydrophobicContact CB-CG 3.93Å; N98-Q100 PolarHBondContact O-N 3.05Å
99	D	67.1	Low	82.6	Confident	126 Å²	126	52.9 Å²	52.9	67%	0.674	26%	0.263	S	S	*	.			trans	52.1	22.1	-172.1	-152.8	35.8	0	0	0	114.5	K95	K95-D99 PolarHBondContact O-N 2.94Å; K95-D99 VanDerWaalsContact O-N 3.15Å
100	Q	76.6	Confident	82.6	Confident	77 Å²	77	48.7 Å²	48.7	36%	0.36	25%	0.251	S	S	.	.	P	Polyproline II helix	trans	-86.2	142.9	-178.7	-75.8	179.6	-16.7	0	0	111.6	T48 N98	T48-Q100 PolarHBondContact OG1-OE1 2.73Å; N98-Q100 HydrophobicContact CB-CB 4.3Å; N98-Q100 HydrophobicContact CB-CG 3.93Å; N98-Q100 PolarHBondContact O-N 3.05Å
101	Q	85.1	Confident	82.7	Confident	89 Å²	89	49.8 Å²	49.8	42%	0.416	25%	0.253	S	S	.	.	P	Polyproline II helix	trans	-64	137.1	169.5	-70.3	-178.1	-12.2	0	0	110.7	Y47 T48 N143	Y47-Q101 HydrophobicContact CD1-CB 4.13Å; T48-Q101 PolarHBondContact N-O 2.99Å; Q101-N143 HydrophobicContact CB-CB 3.81Å; Q101-N143 HydrophobicContact CG-CB 4.11Å; Q101-N143 PolarHBondContact OE1-OD1 2.81Å
102	T	92.1	Very high	83.1	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.7	179	-56.8	0	0	0	0	110.8	T48 I50 I104 Y141 N143	T48-T102 WeakPolarHBondContact O-CA 3.3Å; I50-T102 HydrophobicContact CD1-CG2 3.77Å; I50-T102 HydrophobicContact CG1-CG2 4.03Å; T102-I104 HydrophobicContact CG2-CG1 4.28Å; T102-Y141 WeakPolarHBondContact CB-O 3.34Å; T102-Y141 PolarHBondContact N-O 2.92Å; T102-N143 PolarHBondContact O-N 3.39Å
103	F	95.2	Very high	83.6	Confident	1 Å²	1	47.6 Å²	47.6	0%	0.004	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.9	172.4	-81.1	-132.8	0	0	0	108.8	N12 N43 Y47 T48 C49 I50 F105 N143 R144	N12-F103 HydrophobicContact CB-CE1 4.27Å; N12-F103 HydrophobicContact CB-CZ 3.89Å; N43-F103 HydrophobicContact CB-CD1 4.28Å; N43-F103 VanDerWaalsContact OD1-CE1 3.27Å; N43-F103 WeakPolarHBondContact OD1-CE1 3.36Å; Y47-F103 HydrophobicContact CD1-CD2 4.24Å; Y47-F103 AromaticContact CD1-CE2 3.72Å; Y47-F103 HydrophobicContact CD1-CE2 3.72Å; Y47-F103 HydrophobicContact CD1-CZ 4.35Å; Y47-F103 HydrophobicContact CD2-CD1 4.49Å; Y47-F103 HydrophobicContact CD2-CD2 4.14Å; Y47-F103 HydrophobicContact CD2-CE1 4.11Å; Y47-F103 AromaticContact CD2-CE2 3.74Å; Y47-F103 HydrophobicContact CD2-CE2 3.74Å; Y47-F103 AromaticContact CD2-CZ 3.73Å; Y47-F103 HydrophobicContact CD2-CZ 3.73Å; Y47-F103 AromaticContact CE1-CE2 3.99Å; Y47-F103 HydrophobicContact CE1-CE2 3.99Å; Y47-F103 HydrophobicContact CE1-CZ 4.3Å; Y47-F103 HydrophobicContact CE2-CE1 4.23Å; Y47-F103 HydrophobicContact CE2-CE2 4.03Å; Y47-F103 AromaticContact CE2-CZ 3.68Å; Y47-F103 HydrophobicContact CE2-CZ 3.68Å; Y47-F103 AromaticContact CG-CD2 3.81Å; Y47-F103 HydrophobicContact CG-CD2 3.81Å; Y47-F103 AromaticContact CG-CE2 3.58Å; Y47-F103 HydrophobicContact CG-CE2 3.58Å; Y47-F103 HydrophobicContact CG-CG 4.49Å; Y47-F103 HydrophobicContact CG-CZ 4.07Å; Y47-F103 AromaticContact CZ-CZ 3.98Å; T48-F103 PolarHBondContact O-N 2.79Å; C49-F103 CarbonylContact C-O 3.57Å; C49-F103 VanDerWaalsContact CA-O 3.3Å; C49-F103 WeakPolarHBondContact CA-O 3.37Å; I50-F103 PolarHBondContact N-O 2.82Å; F103-F105 HydrophobicContact CB-CE2 3.94Å; F103-F105 HydrophobicContact CD1-CZ 4.41Å; F103-N143 HydrophobicContact CD2-CB 4.22Å; F103-N143 HydrophobicContact CE2-CB 3.81Å; F103-N143 WeakPolarHBondContact CE2-ND2 3.35Å; F103-N143 VanDerWaalsContact CZ-ND2 3.32Å; F103-N143 WeakPolarHBondContact CZ-ND2 3.33Å; F103-R144 CarbonylContact C-O 3.59Å; F103-R144 WeakPolarHBondContact CA-O 3.47Å; F103-R144 HydrophobicContact CD1-CB 3.76Å; F103-R144 HydrophobicContact CD1-CG 4.23Å; F103-R144 HydrophobicContact CD2-CB 4.34Å; F103-R144 HydrophobicContact CE1-CB 3.8Å; F103-R144 HydrophobicContact CE1-CG 4.26Å; F103-R144 HydrophobicContact CE2-CB 4.36Å; F103-R144 HydrophobicContact CG-CB 4.04Å; F103-R144 HydrophobicContact CZ-CB 4.1Å
104	I	96.5	Very high	84	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	123.3	179.7	-53.3	179.6	0	0	0	108.3	I50 L87 T102 I106 L136 V142 R144 V145 V146	I50-I104 HydrophobicContact CB-CG1 4.47Å; I50-I104 CarbonylContact O-C 3.54Å; I50-I104 WeakPolarHBondContact O-CA 3.43Å; L87-I104 HydrophobicContact CD1-CG2 4.43Å; L87-I104 HydrophobicContact CD2-CG2 4.14Å; T102-I104 HydrophobicContact CG2-CG1 4.28Å; I104-I106 HydrophobicContact CG2-CD1 4.48Å; I104-I106 HydrophobicContact CG2-CG1 4.08Å; I104-L136 HydrophobicContact CD1-CD1 4.32Å; I104-L136 HydrophobicContact CD1-CD2 3.7Å; I104-L136 HydrophobicContact CD1-CG 3.96Å; I104-V142 HydrophobicContact CD1-CG1 3.99Å; I104-V142 HydrophobicContact CD1-CG2 4.06Å; I104-V142 HydrophobicContact CG1-CG1 4.31Å; I104-R144 PolarHBondContact N-O 2.9Å; I104-V145 HydrophobicContact CB-CG2 4.18Å; I104-V145 HydrophobicContact CD1-CG2 4.33Å; I104-V145 CarbonylContact O-C 3.57Å; I104-V145 WeakPolarHBondContact O-CA 3.34Å; I104-V146 PolarHBondContact O-N 2.88Å
105	F	97.1	Very high	84.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	119.3	176	-68.8	-87.1	0	0	0	108.5	W36 L39 I40 N43 C49 I50 L51 V52 F103 V146	W36-F105 HydrophobicContact CH2-CB 3.92Å; W36-F105 AromaticContact CH2-CD1 3.92Å; W36-F105 HydrophobicContact CH2-CD1 3.92Å; W36-F105 HydrophobicContact CH2-CG 4.44Å; W36-F105 HydrophobicContact CZ2-CB 3.8Å; W36-F105 HydrophobicContact CZ2-CD1 4.25Å; W36-F105 HydrophobicContact CZ3-CD1 4.21Å; L39-F105 HydrophobicContact CD2-CE1 3.97Å; L39-F105 HydrophobicContact CG-CE1 3.96Å; L39-F105 HydrophobicContact CG-CZ 4.47Å; I40-F105 HydrophobicContact CD1-CB 4.41Å; I40-F105 HydrophobicContact CD1-CD1 4.48Å; I40-F105 HydrophobicContact CD1-CG 4.41Å; I40-F105 HydrophobicContact CG1-CB 4.26Å; I40-F105 HydrophobicContact CG1-CD1 3.67Å; I40-F105 HydrophobicContact CG1-CD2 4.1Å; I40-F105 HydrophobicContact CG1-CE1 3.96Å; I40-F105 HydrophobicContact CG1-CE2 4.36Å; I40-F105 HydrophobicContact CG1-CG 3.74Å; I40-F105 HydrophobicContact CG1-CZ 4.29Å; N43-F105 HydrophobicContact CB-CE2 4.35Å; N43-F105 HydrophobicContact CB-CZ 4.03Å; C49-F105 HydrophobicContact CB-CD2 4.34Å; C49-F105 HydrophobicContact CB-CE2 4.22Å; I50-F105 PolarHBondContact O-N 3.14Å; L51-F105 CarbonylContact C-O 3.51Å; L51-F105 WeakPolarHBondContact CA-O 3.3Å; L51-F105 HydrophobicContact CD1-CB 3.83Å; V52-F105 PolarHBondContact N-O 3.23Å; F103-F105 HydrophobicContact CB-CE2 3.94Å; F103-F105 HydrophobicContact CD1-CZ 4.41Å; F105-V146 HydrophobicContact CD1-CB 3.93Å; F105-V146 HydrophobicContact CD1-CG2 4.09Å; F105-V146 HydrophobicContact CE1-CB 4.18Å; F105-V146 HydrophobicContact CE1-CG2 3.86Å
106	I	96.6	Very high	86	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	102	178.6	-60.6	175.6	0	0	0	107.4	V52 I104 F112 L133 V145 V146 S148	V52-I106 HydrophobicContact CB-CG1 4.36Å; V52-I106 HydrophobicContact CG2-CG1 4.38Å; I104-I106 HydrophobicContact CG2-CD1 4.48Å; I104-I106 HydrophobicContact CG2-CG1 4.08Å; I106-F112 HydrophobicContact CG2-CD2 4.3Å; I106-F112 HydrophobicContact CG2-CE2 3.61Å; I106-F112 HydrophobicContact CG2-CZ 4.38Å; I106-L133 HydrophobicContact CD1-CD1 3.78Å; I106-L133 HydrophobicContact CD1-CD2 3.45Å; I106-L133 VanDerWaalsContact CD1-CD2 3.45Å; I106-L133 HydrophobicContact CD1-CG 4.13Å; I106-V145 HydrophobicContact CD1-CG1 4.01Å; I106-V146 PolarHBondContact N-O 2.78Å; I106-S148 WeakPolarHBondContact O-CB 3.47Å; I106-S148 PolarHBondContact O-N 2.88Å
107	E	93.6	Very high	87.6	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.047	24%	0.236	C	C	.	.	S	Bend	trans	-77.6	-39.1	-179.6	172.4	-92.8	150.6	0	0	111.8	W36 L51 V52 T53 S54 Y57 Y59	W36-E107 HydrophobicContact CZ2-CB 3.91Å; L51-E107 HydrophobicContact CD1-CB 4.31Å; V52-E107 WeakPolarHBondContact O-CB 3.37Å; V52-E107 PolarHBondContact O-N 3.5Å; T53-E107 WeakPolarHBondContact CA-OE2 3.23Å; T53-E107 WeakPolarHBondContact CB-OE2 3.27Å; T53-E107 PolarHBondContact OG1-OE2 3.07Å; S54-E107 PolarHBondContact N-OE2 3.07Å; S54-E107 PolarHBondContact OG-OE2 3.34Å; Y57-E107 HydrophobicContact CD2-CG 3.67Å; Y57-E107 WeakPolarHBondContact CD2-OE1 3.46Å; Y57-E107 HydrophobicContact CE2-CG 3.78Å; Y57-E107 WeakPolarHBondContact CE2-OE1 3.41Å; Y59-E107 HydrophobicContact CE2-CG 4.41Å; Y59-E107 WeakPolarHBondContact OH-CG 3.22Å
108	S	86.4	Confident	89	Confident	11 Å²	11	47 Å²	47	8%	0.077	25%	0.248	C	C	.	.			trans	-108.7	73.8	-175.6	-163.4	0	0	0	0	112	S54 S110 W111 F112	S54-S108 WeakPolarHBondContact OG-CB 3.24Å; S54-S108 PolarHBondContact OG-OG 3.24Å; S108-S110 PolarHBondContact O-N 3.09Å; S108-W111 PolarHBondContact O-N 3.19Å; S108-F112 WeakPolarHBondContact O-CD2 3.43Å
109	L	93.8	Very high	90.4	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-59.3	-35.4	170.7	-178.2	61.9	0	0	0	111.3	W111 F112 L113 V129 L133 S148 F149 V167 L171	L109-W111 PolarHBondContact O-N 3.04Å; L109-F112 WeakPolarHBondContact O-CB 3.47Å; L109-F112 PolarHBondContact O-N 3.13Å; L109-F112 VanDerWaalsContact O-N 3.1Å; L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 HydrophobicContact CG-CG 4.43Å; L109-L113 PolarHBondContact O-N 3.5Å; L109-V129 HydrophobicContact CD1-CG1 4.21Å; L109-L133 HydrophobicContact CD1-CD1 3.73Å; L109-S148 WeakPolarHBondContact CB-O 3.26Å; L109-F149 HydrophobicContact CD2-CB 4.19Å; L109-F149 HydrophobicContact CD2-CD2 4.27Å; L109-F149 HydrophobicContact CD2-CG 4.45Å; L109-V167 HydrophobicContact CD2-CG1 4Å; L109-L171 HydrophobicContact CD2-CD1 3.94Å; L109-L171 HydrophobicContact CD2-CD2 4.02Å; L109-L171 HydrophobicContact CD2-CG 4.28Å
110	S	91.6	Very high	91.5	Very high	51 Å²	51	48.3 Å²	48.3	36%	0.357	25%	0.247	S	C	.	.	H	α-helix	trans	-56.4	-33.3	179.1	-52.6	0	0	0	0	113.5	S108 F112 L113 I114	S108-S110 PolarHBondContact O-N 3.09Å; S110-F112 VanDerWaalsContact C-N 3.35Å; S110-F112 PolarHBondContact O-N 3.43Å; S110-L113 PolarHBondContact O-N 3.39Å; S110-I114 WeakPolarHBondContact O-CD1 3.44Å; S110-I114 VanDerWaalsContact O-CG1 3.27Å; S110-I114 WeakPolarHBondContact O-CG1 3.39Å; S110-I114 PolarHBondContact O-N 2.81Å
111	W	92.3	Very high	92.3	Very high	50 Å²	50	50.7 Å²	50.7	19%	0.189	26%	0.258	C	S	.	.	H	α-helix	trans	-61.7	-43.3	177.6	-179.8	87.1	0	0	0	111.8	T74 Y77 L83 S108 L109 L113 I114	T74-W111 HydrophobicContact CG2-CB 4.15Å; T74-W111 HydrophobicContact CG2-CD2 3.82Å; T74-W111 HydrophobicContact CG2-CE3 4.03Å; T74-W111 HydrophobicContact CG2-CG 3.86Å; T74-W111 WeakPolarHBondContact O-CZ2 3.42Å; Y77-W111 WeakPolarHBondContact O-CZ2 3.29Å; L83-W111 HydrophobicContact CB-CZ3 4.35Å; L83-W111 HydrophobicContact CD2-CE3 4.16Å; L83-W111 HydrophobicContact CD2-CH2 4.25Å; L83-W111 HydrophobicContact CD2-CZ3 3.64Å; S108-W111 PolarHBondContact O-N 3.19Å; L109-W111 PolarHBondContact O-N 3.04Å; W111-L113 VanDerWaalsContact C-N 3.28Å; W111-L113 PolarHBondContact O-N 3.49Å; W111-I114 PolarHBondContact O-N 2.97Å
112	F	94	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.2	-35	176.1	-63.1	-95.7	0	0	0	112.1	V52 T80 L83 V84 I106 S108 L109 S110 W125 V129 L133	V52-F112 HydrophobicContact CG1-CE2 4.3Å; V52-F112 HydrophobicContact CG1-CZ 4.3Å; T80-F112 HydrophobicContact CG2-CD1 3.63Å; T80-F112 HydrophobicContact CG2-CE1 4.38Å; T80-F112 PolarHBondContact OG1-O 3.04Å; L83-F112 HydrophobicContact CD2-CE1 3.81Å; L83-F112 HydrophobicContact CD2-CE2 4.29Å; L83-F112 HydrophobicContact CD2-CZ 3.46Å; L83-F112 VanDerWaalsContact CD2-CZ 3.46Å; L83-F112 HydrophobicContact CG-CE1 4.2Å; L83-F112 HydrophobicContact CG-CZ 4.1Å; V84-F112 HydrophobicContact CG2-CE1 4.16Å; I106-F112 HydrophobicContact CG2-CD2 4.3Å; I106-F112 HydrophobicContact CG2-CE2 3.61Å; I106-F112 HydrophobicContact CG2-CZ 4.38Å; S108-F112 WeakPolarHBondContact O-CD2 3.43Å; L109-F112 WeakPolarHBondContact O-CB 3.47Å; L109-F112 PolarHBondContact O-N 3.13Å; L109-F112 VanDerWaalsContact O-N 3.1Å; S110-F112 VanDerWaalsContact C-N 3.35Å; S110-F112 PolarHBondContact O-N 3.43Å; F112-W125 PolarHBondContact O-NE1 3.48Å; F112-V129 HydrophobicContact CB-CG1 3.51Å; F112-V129 HydrophobicContact CB-CG2 4.4Å; F112-V129 HydrophobicContact CG-CG1 4.23Å; F112-L133 HydrophobicContact CE1-CD2 4.43Å
113	L	93.8	Very high	92.8	Very high	12 Å²	12	53.2 Å²	53.2	6%	0.063	27%	0.271	C	S	.	.	H	α-helix	trans	-76.3	-29	-178.2	-62.9	174.2	0	0	0	112.9	L109 S110 W111 D115 C116 F122 C126 V129 V167	L109-L113 HydrophobicContact CG-CD1 4.13Å; L109-L113 HydrophobicContact CG-CG 4.43Å; L109-L113 PolarHBondContact O-N 3.5Å; S110-L113 PolarHBondContact O-N 3.39Å; W111-L113 VanDerWaalsContact C-N 3.28Å; W111-L113 PolarHBondContact O-N 3.49Å; L113-D115 VanDerWaalsContact C-N 3.29Å; L113-C116 PolarHBondContact O-N 3.4Å; L113-F122 HydrophobicContact CB-CE2 4.15Å; L113-F122 HydrophobicContact CB-CZ 4.34Å; L113-F122 HydrophobicContact CD1-CZ 4.43Å; L113-F122 HydrophobicContact CD2-CZ 4.46Å; L113-C126 HydrophobicContact CD2-CB 4.16Å; L113-V129 HydrophobicContact CD2-CB 4.32Å; L113-V129 HydrophobicContact CD2-CG1 4.33Å; L113-V167 HydrophobicContact CD1-CB 4.48Å; L113-V167 HydrophobicContact CD1-CG1 3.99Å; L113-V167 HydrophobicContact CD1-CG2 3.56Å
114	I	91.3	Very high	92.8	Very high	142 Å²	142	60 Å²	60	73%	0.728	30%	0.298	S	S	*	.	H	α-helix	trans	-71.5	-26.3	177.2	-71.2	163.7	0	0	0	111.6	S110 W111 C116	S110-I114 WeakPolarHBondContact O-CD1 3.44Å; S110-I114 VanDerWaalsContact O-CG1 3.27Å; S110-I114 WeakPolarHBondContact O-CG1 3.39Å; S110-I114 PolarHBondContact O-N 2.81Å; W111-I114 PolarHBondContact O-N 2.97Å; I114-C116 PolarHBondContact O-N 3.25Å
115	D	88.6	Confident	92.8	Very high	54 Å²	54	60.8 Å²	60.8	29%	0.289	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	19.1	175.3	-164.6	36.3	0	0	0	113.1	T80 L113 P117 W125	T80-D115 WeakPolarHBondContact CB-OD2 3.31Å; T80-D115 PolarHBondContact N-OD2 2.84Å; T80-D115 PolarHBondContact OG1-OD2 2.81Å; T80-D115 VanDerWaalsContact OG1-OD2 3.04Å; L113-D115 VanDerWaalsContact C-N 3.29Å; D115-P117 VanDerWaalsContact O-CD 3.31Å; D115-P117 WeakPolarHBondContact O-CD 3.41Å; D115-W125 HydrophobicContact CB-CZ2 4.3Å; D115-W125 VanDerWaalsContact O-CZ2 3.31Å; D115-W125 WeakPolarHBondContact O-CZ2 3.41Å
116	C	92.2	Very high	92.8	Very high	36 Å²	36	60.8 Å²	60.8	24%	0.243	30%	0.301	C	S	.	.			trans	-62.4	121	177.6	-173.2	0	0	0	0	110.2	L113 I114 W125	L113-C116 PolarHBondContact O-N 3.4Å; I114-C116 PolarHBondContact O-N 3.25Å; C116-W125 HydrophobicContact CB-CB 4.33Å; C116-W125 VanDerWaalsContact CB-CD1 3.41Å; C116-W125 HydrophobicContact CB-CD2 4.4Å; C116-W125 HydrophobicContact CB-CG 3.79Å; C116-W125 VanDerWaalsContact SG-CB 3.51Å
117	P	91.8	Very high	92.8	Very high	44 Å²	44	64.7 Å²	64.7	29%	0.286	32%	0.319	S	S	.	.			trans	-61.8	151.3	174.3	-20.7	32.5	0	0	0	111.6	D115 D119 Y120 W125	D115-P117 VanDerWaalsContact O-CD 3.31Å; D115-P117 WeakPolarHBondContact O-CD 3.41Å; P117-D119 WeakPolarHBondContact CB-OD1 3.42Å; P117-D119 PolarHBondContact O-N 3.45Å; P117-Y120 HydrophobicContact CB-CD2 3.68Å; P117-Y120 HydrophobicContact CB-CE2 4.34Å; P117-Y120 HydrophobicContact CB-CG 4.35Å; P117-Y120 HydrophobicContact CG-CD2 3.83Å; P117-Y120 HydrophobicContact CG-CE2 4.25Å; P117-Y120 HydrophobicContact CG-CG 4.28Å; P117-Y120 PolarHBondContact O-N 2.88Å; P117-Y120 VanDerWaalsContact O-N 3.12Å; P117-W125 HydrophobicContact CG-CE3 4.28Å; P117-W125 HydrophobicContact CG-CH2 4.47Å; P117-W125 HydrophobicContact CG-CZ3 4.06Å
118	I	90.3	Very high	92.8	Very high	180 Å²	180	69.2 Å²	69.2	92%	0.923	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.5	-175.5	-60.3	168.3	0	0	0	111.9
119	D	91.5	Very high	93.3	Very high	137 Å²	137	68.8 Å²	68.8	73%	0.733	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	0.3	179.5	59.6	-40.5	0	0	0	113.9	P117	P117-D119 WeakPolarHBondContact CB-OD1 3.42Å; P117-D119 PolarHBondContact O-N 3.45Å
120	Y	90.8	Very high	93.5	Very high	121 Å²	121	68.8 Å²	68.8	48%	0.475	34%	0.336	S	S	.	.	S	Bend	trans	-104.4	137.2	178.3	-82.9	-110.9	0	0	0	111.3	P117 W125	P117-Y120 HydrophobicContact CB-CD2 3.68Å; P117-Y120 HydrophobicContact CB-CE2 4.34Å; P117-Y120 HydrophobicContact CB-CG 4.35Å; P117-Y120 HydrophobicContact CG-CD2 3.83Å; P117-Y120 HydrophobicContact CG-CE2 4.25Å; P117-Y120 HydrophobicContact CG-CG 4.28Å; P117-Y120 PolarHBondContact O-N 2.88Å; P117-Y120 VanDerWaalsContact O-N 3.12Å; Y120-W125 HydrophobicContact CD1-CE3 4.29Å
121	E	93.8	Very high	93.7	Very high	127 Å²	127	66.8 Å²	66.8	59%	0.593	32%	0.324	S	S	*	.			trans	-71.2	138.1	163.8	-53.9	-175.7	169.1	0	0	109.2	D123 Y124 W125	E121-D123 PolarHBondContact O-N 3.2Å; E121-Y124 HydrophobicContact CB-CD2 3.8Å; E121-Y124 HydrophobicContact CB-CE2 4.38Å; E121-Y124 HydrophobicContact CG-CD2 4.17Å; E121-Y124 HydrophobicContact CG-CE2 4.39Å; E121-Y124 PolarHBondContact O-N 2.8Å; E121-Y124 VanDerWaalsContact O-N 3.12Å; E121-Y124 WeakPolarHBondContact OE2-CE2 3.27Å; E121-W125 PolarHBondContact O-N 3.09Å
122	F	94.1	Very high	93.9	Very high	64 Å²	64	65.7 Å²	65.7	28%	0.281	32%	0.323	S	S	.	.	H	α-helix	trans	-56.1	-37.7	-175.2	179.8	-93.7	0	0	0	112.6	L113 Y124 W125 C126 A163 V167	L113-F122 HydrophobicContact CB-CE2 4.15Å; L113-F122 HydrophobicContact CB-CZ 4.34Å; L113-F122 HydrophobicContact CD1-CZ 4.43Å; L113-F122 HydrophobicContact CD2-CZ 4.46Å; F122-Y124 PolarHBondContact O-N 2.61Å; F122-W125 PolarHBondContact O-N 3.48Å; F122-C126 HydrophobicContact CE1-CB 4.27Å; F122-C126 VanDerWaalsContact O-CB 3.26Å; F122-C126 WeakPolarHBondContact O-CB 3.39Å; F122-C126 PolarHBondContact O-N 3.04Å; F122-A163 HydrophobicContact CD1-CB 3.97Å; F122-A163 HydrophobicContact CE1-CB 3.36Å; F122-A163 HydrophobicContact CE2-CB 4.45Å; F122-A163 HydrophobicContact CZ-CB 3.63Å; F122-V167 HydrophobicContact CE1-CG2 4.01Å; F122-V167 HydrophobicContact CZ-CG2 3.94Å
123	D	94.3	Very high	94	Very high	77 Å²	77	65.7 Å²	65.7	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-63.4	-43.6	-179.6	-65.6	5	0	0	0	111.5	E121 C126 Q127 T166	E121-D123 PolarHBondContact O-N 3.2Å; D123-C126 PolarHBondContact O-N 3.04Å; D123-Q127 WeakPolarHBondContact O-CG 3.43Å; D123-Q127 PolarHBondContact O-N 3.07Å; D123-T166 HydrophobicContact CB-CG2 4.12Å; D123-T166 WeakPolarHBondContact OD1-CG2 3.47Å
124	Y	95.1	Very high	94.1	Very high	143 Å²	143	66.4 Å²	66.4	56%	0.561	33%	0.326	S	S	*	.	H	α-helix	trans	-68.1	-39.5	175.1	-66.4	-53.7	0	0	0	111.9	E121 F122 C126 Q127 F128	E121-Y124 HydrophobicContact CB-CD2 3.8Å; E121-Y124 HydrophobicContact CB-CE2 4.38Å; E121-Y124 HydrophobicContact CG-CD2 4.17Å; E121-Y124 HydrophobicContact CG-CE2 4.39Å; E121-Y124 PolarHBondContact O-N 2.8Å; E121-Y124 VanDerWaalsContact O-N 3.12Å; E121-Y124 WeakPolarHBondContact OE2-CE2 3.27Å; F122-Y124 PolarHBondContact O-N 2.61Å; Y124-C126 VanDerWaalsContact C-N 3.35Å; Y124-Q127 PolarHBondContact O-N 3.26Å; Y124-F128 WeakPolarHBondContact O-CB 3.39Å; Y124-F128 PolarHBondContact O-N 2.75Å
125	W	95.8	Very high	94.3	Very high	17 Å²	17	63.9 Å²	63.9	6%	0.064	31%	0.314	C	S	.	.	H	α-helix	trans	-62.7	-42.9	174.6	-179	-112.3	0	0	0	111.8	T80 F112 D115 C116 P117 Y120 E121 F122 Q127 F128 V129	T80-W125 HydrophobicContact CG2-CZ2 4.45Å; F112-W125 PolarHBondContact O-NE1 3.48Å; D115-W125 HydrophobicContact CB-CZ2 4.3Å; D115-W125 VanDerWaalsContact O-CZ2 3.31Å; D115-W125 WeakPolarHBondContact O-CZ2 3.41Å; C116-W125 HydrophobicContact CB-CB 4.33Å; C116-W125 VanDerWaalsContact CB-CD1 3.41Å; C116-W125 HydrophobicContact CB-CD2 4.4Å; C116-W125 HydrophobicContact CB-CG 3.79Å; C116-W125 VanDerWaalsContact SG-CB 3.51Å; P117-W125 HydrophobicContact CG-CE3 4.28Å; P117-W125 HydrophobicContact CG-CH2 4.47Å; P117-W125 HydrophobicContact CG-CZ3 4.06Å; Y120-W125 HydrophobicContact CD1-CE3 4.29Å; E121-W125 PolarHBondContact O-N 3.09Å; F122-W125 PolarHBondContact O-N 3.48Å; W125-Q127 PolarHBondContact O-N 3.22Å; W125-F128 AromaticContact CE3-CD1 3.75Å; W125-F128 HydrophobicContact CE3-CD1 3.75Å; W125-F128 HydrophobicContact CE3-CE1 4.42Å; W125-F128 HydrophobicContact CE3-CG 4.47Å; W125-F128 HydrophobicContact CH2-CD1 4Å; W125-F128 AromaticContact CH2-CE1 3.97Å; W125-F128 HydrophobicContact CH2-CE1 3.97Å; W125-F128 AromaticContact CZ3-CD1 3.45Å; W125-F128 HydrophobicContact CZ3-CD1 3.45Å; W125-F128 VanDerWaalsContact CZ3-CD1 3.45Å; W125-F128 AromaticContact CZ3-CE1 3.67Å; W125-F128 HydrophobicContact CZ3-CE1 3.67Å; W125-F128 HydrophobicContact CZ3-CG 4.46Å; W125-F128 WeakPolarHBondContact O-CB 3.45Å; W125-F128 PolarHBondContact O-N 3.29Å; W125-V129 HydrophobicContact CD2-CG2 4.05Å; W125-V129 HydrophobicContact CG-CG2 4.4Å; W125-V129 HydrophobicContact CZ2-CG2 3.79Å; W125-V129 WeakPolarHBondContact O-CG2 3.37Å; W125-V129 PolarHBondContact O-N 3.49Å
126	C	96.4	Very high	94.5	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-46.9	177.3	-172.1	0	0	0	0	111.4	L113 F122 D123 Y124 F128 V129 I130	L113-C126 HydrophobicContact CD2-CB 4.16Å; F122-C126 HydrophobicContact CE1-CB 4.27Å; F122-C126 VanDerWaalsContact O-CB 3.26Å; F122-C126 WeakPolarHBondContact O-CB 3.39Å; F122-C126 PolarHBondContact O-N 3.04Å; D123-C126 PolarHBondContact O-N 3.04Å; Y124-C126 VanDerWaalsContact C-N 3.35Å; C126-F128 VanDerWaalsContact C-N 3.35Å; C126-F128 PolarHBondContact O-N 2.86Å; C126-V129 PolarHBondContact O-N 3.41Å; C126-I130 WeakPolarHBondContact O-CB 3.45Å; C126-I130 WeakPolarHBondContact O-CG1 3.14Å; C126-I130 PolarHBondContact O-N 3.29Å
127	Q	96.4	Very high	94.6	Very high	82 Å²	82	59.8 Å²	59.8	38%	0.383	29%	0.29	S	S	.	.	H	α-helix	trans	-61.4	-41.7	174.2	-70.2	174.8	18.6	0	0	112.2	D123 Y124 W125 G131 T170	D123-Q127 WeakPolarHBondContact O-CG 3.43Å; D123-Q127 PolarHBondContact O-N 3.07Å; Y124-Q127 PolarHBondContact O-N 3.26Å; W125-Q127 PolarHBondContact O-N 3.22Å; Q127-G131 WeakPolarHBondContact O-CA 3.41Å; Q127-G131 PolarHBondContact O-N 3.11Å; Q127-T170 HydrophobicContact CB-CG2 4.42Å; Q127-T170 HydrophobicContact CG-CG2 3.88Å
128	F	95.4	Very high	94.5	Very high	106 Å²	106	59 Å²	59	47%	0.465	28%	0.283	S	S	.	.	H	α-helix	trans	-62.3	-47.2	177	173	-99	0	0	0	112.1	Y124 W125 C126 S132	Y124-F128 WeakPolarHBondContact O-CB 3.39Å; Y124-F128 PolarHBondContact O-N 2.75Å; W125-F128 AromaticContact CE3-CD1 3.75Å; W125-F128 HydrophobicContact CE3-CD1 3.75Å; W125-F128 HydrophobicContact CE3-CE1 4.42Å; W125-F128 HydrophobicContact CE3-CG 4.47Å; W125-F128 HydrophobicContact CH2-CD1 4Å; W125-F128 AromaticContact CH2-CE1 3.97Å; W125-F128 HydrophobicContact CH2-CE1 3.97Å; W125-F128 AromaticContact CZ3-CD1 3.45Å; W125-F128 HydrophobicContact CZ3-CD1 3.45Å; W125-F128 VanDerWaalsContact CZ3-CD1 3.45Å; W125-F128 AromaticContact CZ3-CE1 3.67Å; W125-F128 HydrophobicContact CZ3-CE1 3.67Å; W125-F128 HydrophobicContact CZ3-CG 4.46Å; W125-F128 WeakPolarHBondContact O-CB 3.45Å; W125-F128 PolarHBondContact O-N 3.29Å; C126-F128 VanDerWaalsContact C-N 3.35Å; C126-F128 PolarHBondContact O-N 2.86Å; F128-S132 VanDerWaalsContact O-CB 3.27Å; F128-S132 WeakPolarHBondContact O-CB 3.38Å; F128-S132 PolarHBondContact O-N 3.21Å; F128-S132 PolarHBondContact O-OG 2.88Å
129	V	96.5	Very high	94.5	Very high	1 Å²	1	52 Å²	52	1%	0.006	25%	0.249	C	C	.	.	H	α-helix	trans	-63.1	-54.8	178.6	168.9	0	0	0	0	110.6	T80 L109 F112 L113 W125 C126 G131 S132 L133	T80-V129 HydrophobicContact CG2-CG2 4.36Å; L109-V129 HydrophobicContact CD1-CG1 4.21Å; F112-V129 HydrophobicContact CB-CG1 3.51Å; F112-V129 HydrophobicContact CB-CG2 4.4Å; F112-V129 HydrophobicContact CG-CG1 4.23Å; L113-V129 HydrophobicContact CD2-CB 4.32Å; L113-V129 HydrophobicContact CD2-CG1 4.33Å; W125-V129 HydrophobicContact CD2-CG2 4.05Å; W125-V129 HydrophobicContact CG-CG2 4.4Å; W125-V129 HydrophobicContact CZ2-CG2 3.79Å; W125-V129 WeakPolarHBondContact O-CG2 3.37Å; W125-V129 PolarHBondContact O-N 3.49Å; C126-V129 PolarHBondContact O-N 3.41Å; V129-G131 VanDerWaalsContact C-N 3.33Å; V129-G131 PolarHBondContact O-N 2.71Å; V129-S132 WeakPolarHBondContact O-CB 3.48Å; V129-S132 PolarHBondContact O-N 3.06Å; V129-S132 VanDerWaalsContact O-N 3.13Å; V129-L133 HydrophobicContact CG1-CD1 4.3Å; V129-L133 WeakPolarHBondContact O-CG 3.42Å; V129-L133 PolarHBondContact O-N 2.98Å
130	I	97.7	Very high	94.1	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.8	-40.1	-177.4	-69.7	168.6	0	0	0	110.6	F18 C126 S132 L133 F134 T170 L171 Y174	F18-I130 HydrophobicContact CE1-CG2 4Å; F18-I130 HydrophobicContact CZ-CG2 4.15Å; C126-I130 WeakPolarHBondContact O-CB 3.45Å; C126-I130 WeakPolarHBondContact O-CG1 3.14Å; C126-I130 PolarHBondContact O-N 3.29Å; I130-S132 VanDerWaalsContact C-N 3.32Å; I130-S132 PolarHBondContact O-N 3.02Å; I130-L133 PolarHBondContact O-N 2.89Å; I130-F134 WeakPolarHBondContact O-CB 3.34Å; I130-F134 PolarHBondContact O-N 3.46Å; I130-T170 HydrophobicContact CB-CG2 4.02Å; I130-T170 HydrophobicContact CD1-CG2 3.53Å; I130-T170 HydrophobicContact CG1-CG2 4.34Å; I130-T170 HydrophobicContact CG2-CG2 4.22Å; I130-L171 HydrophobicContact CD1-CD2 3.87Å; I130-L171 HydrophobicContact CD1-CG 3.78Å; I130-L171 HydrophobicContact CG1-CD2 4.12Å; I130-L171 HydrophobicContact CG2-CD2 4.29Å; I130-Y174 HydrophobicContact CG2-CD2 4.03Å; I130-Y174 HydrophobicContact CG2-CG 3.97Å
131	G	96.3	Very high	93.7	Very high	10 Å²	10	47.8 Å²	47.8	10%	0.103	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-38.9	173.4	0	0	0	0	0	112.6	Q127 V129 F134 N135	Q127-G131 WeakPolarHBondContact O-CA 3.41Å; Q127-G131 PolarHBondContact O-N 3.11Å; V129-G131 VanDerWaalsContact C-N 3.33Å; V129-G131 PolarHBondContact O-N 2.71Å; G131-F134 PolarHBondContact O-N 3.24Å; G131-N135 WeakPolarHBondContact O-CB 3.45Å; G131-N135 VanDerWaalsContact O-CG 3.24Å; G131-N135 PolarHBondContact O-N 2.73Å; G131-N135 PolarHBondContact O-ND2 3.26Å
132	S	95.5	Very high	93.6	Very high	26 Å²	26	41.8 Å²	41.8	18%	0.182	20%	0.204	C	C	.	.	H	α-helix	trans	-65.9	-40.2	174.7	-63.8	0	0	0	0	112.2	F128 V129 I130 N135 L136	F128-S132 VanDerWaalsContact O-CB 3.27Å; F128-S132 WeakPolarHBondContact O-CB 3.38Å; F128-S132 PolarHBondContact O-N 3.21Å; F128-S132 PolarHBondContact O-OG 2.88Å; V129-S132 WeakPolarHBondContact O-CB 3.48Å; V129-S132 PolarHBondContact O-N 3.06Å; V129-S132 VanDerWaalsContact O-N 3.13Å; I130-S132 VanDerWaalsContact C-N 3.32Å; I130-S132 PolarHBondContact O-N 3.02Å; S132-N135 PolarHBondContact O-N 2.85Å; S132-L136 PolarHBondContact O-N 2.89Å
133	L	96.8	Very high	93.5	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-35.2	175.3	-63.1	179.5	0	0	0	112.4	F18 V84 I106 L109 F112 V129 I130 L136 S137	F18-L133 HydrophobicContact CE2-CB 3.9Å; F18-L133 HydrophobicContact CZ-CB 4.22Å; V84-L133 HydrophobicContact CG2-CD2 4.2Å; I106-L133 HydrophobicContact CD1-CD1 3.78Å; I106-L133 HydrophobicContact CD1-CD2 3.45Å; I106-L133 VanDerWaalsContact CD1-CD2 3.45Å; I106-L133 HydrophobicContact CD1-CG 4.13Å; L109-L133 HydrophobicContact CD1-CD1 3.73Å; F112-L133 HydrophobicContact CE1-CD2 4.43Å; V129-L133 HydrophobicContact CG1-CD1 4.3Å; V129-L133 WeakPolarHBondContact O-CG 3.42Å; V129-L133 PolarHBondContact O-N 2.98Å; I130-L133 PolarHBondContact O-N 2.89Å; L133-L136 WeakPolarHBondContact O-CB 3.45Å; L133-L136 PolarHBondContact O-N 2.89Å; L133-S137 PolarHBondContact O-N 3.31Å; L133-S137 VanDerWaalsContact O-N 3.15Å
134	F	96.2	Very high	93.5	Very high	26 Å²	26	36.7 Å²	36.7	11%	0.114	18%	0.18	C	C	.	.	H	α-helix	trans	-63.8	-46.2	170.5	176.2	-101.9	0	0	0	110.9	F18 I130 G131 L136 S137 L138 Y174 T176	F18-F134 HydrophobicContact CB-CD2 3.69Å; F18-F134 HydrophobicContact CB-CE2 4.21Å; F18-F134 HydrophobicContact CD1-CB 4.25Å; F18-F134 AromaticContact CD1-CD2 3.85Å; F18-F134 HydrophobicContact CD1-CD2 3.85Å; F18-F134 HydrophobicContact CE1-CB 4.42Å; F18-F134 HydrophobicContact CG-CB 4.37Å; F18-F134 AromaticContact CG-CD2 3.83Å; F18-F134 HydrophobicContact CG-CD2 3.83Å; I130-F134 WeakPolarHBondContact O-CB 3.34Å; I130-F134 PolarHBondContact O-N 3.46Å; G131-F134 PolarHBondContact O-N 3.24Å; F134-L136 PolarHBondContact O-N 3.29Å; F134-S137 WeakPolarHBondContact O-CA 3.23Å; F134-S137 VanDerWaalsContact O-CB 3.29Å; F134-S137 WeakPolarHBondContact O-CB 3.26Å; F134-S137 PolarHBondContact O-N 3.44Å; F134-S137 PolarHBondContact O-OG 2.8Å; F134-L138 HydrophobicContact CD1-CD1 4.25Å; F134-L138 HydrophobicContact CE1-CD1 3.7Å; F134-L138 HydrophobicContact CE1-CG 4.28Å; F134-L138 HydrophobicContact CZ-CD1 4.17Å; F134-L138 HydrophobicContact CZ-CD2 4.32Å; F134-L138 HydrophobicContact CZ-CG 4.44Å; F134-L138 PolarHBondContact O-N 3.34Å; F134-Y174 HydrophobicContact CB-CD1 4.21Å; F134-Y174 HydrophobicContact CD1-CD1 4.3Å; F134-Y174 WeakPolarHBondContact CD2-O 3.16Å; F134-Y174 HydrophobicContact CG-CD1 4.24Å; F134-T176 HydrophobicContact CE2-CG2 4.5Å
135	N	94	Very high	93.6	Very high	89 Å²	89	29.9 Å²	29.9	48%	0.476	15%	0.153	S	C	.	.	H	α-helix	trans	-60.9	-34.3	174.7	-74.3	-30.2	0	0	0	112.3	G131 S132 S137 L138 T139	G131-N135 WeakPolarHBondContact O-CB 3.45Å; G131-N135 VanDerWaalsContact O-CG 3.24Å; G131-N135 PolarHBondContact O-N 2.73Å; G131-N135 PolarHBondContact O-ND2 3.26Å; S132-N135 PolarHBondContact O-N 2.85Å; N135-S137 VanDerWaalsContact C-N 3.27Å; N135-S137 PolarHBondContact O-N 3.38Å; N135-L138 WeakPolarHBondContact O-CB 3.45Å; N135-L138 PolarHBondContact O-N 3.14Å; N135-L138 VanDerWaalsContact O-N 3.09Å; N135-T139 PolarHBondContact O-N 3.42Å; N135-T139 PolarHBondContact O-OG1 3.37Å
136	L	93.5	Very high	93.7	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.026	15%	0.15	C	C	.	.	H	α-helix	trans	-61	-37.2	171.2	-178	64.7	0	0	0	111.6	L87 I104 S132 L133 F134 L138 T139 V142 V145	L87-L136 HydrophobicContact CB-CD1 4.34Å; L87-L136 HydrophobicContact CB-CD2 3.9Å; L87-L136 HydrophobicContact CD1-CD2 3.83Å; L87-L136 HydrophobicContact CG-CD2 4.49Å; I104-L136 HydrophobicContact CD1-CD1 4.32Å; I104-L136 HydrophobicContact CD1-CD2 3.7Å; I104-L136 HydrophobicContact CD1-CG 3.96Å; S132-L136 PolarHBondContact O-N 2.89Å; L133-L136 WeakPolarHBondContact O-CB 3.45Å; L133-L136 PolarHBondContact O-N 2.89Å; F134-L136 PolarHBondContact O-N 3.29Å; L136-L138 PolarHBondContact O-N 3.24Å; L136-T139 VanDerWaalsContact O-CB 3.22Å; L136-T139 WeakPolarHBondContact O-CB 3.43Å; L136-T139 PolarHBondContact O-N 3.11Å; L136-T139 VanDerWaalsContact O-N 3.1Å; L136-T139 PolarHBondContact O-OG1 3.44Å; L136-V142 HydrophobicContact CD1-CG2 4.45Å; L136-V142 WeakPolarHBondContact O-CB 3.15Å; L136-V145 HydrophobicContact CG-CG2 4.32Å
137	S	93.5	Very high	93.7	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-68.7	-15.3	174.6	84.6	0	0	0	0	114.9	N17 L133 F134 N135	N17-S137 PolarHBondContact ND2-O 3.37Å; N17-S137 VanDerWaalsContact ND2-O 3.09Å; N17-S137 VanDerWaalsContact O-CB 3.32Å; N17-S137 WeakPolarHBondContact O-CB 3.11Å; L133-S137 PolarHBondContact O-N 3.31Å; L133-S137 VanDerWaalsContact O-N 3.15Å; F134-S137 WeakPolarHBondContact O-CA 3.23Å; F134-S137 VanDerWaalsContact O-CB 3.29Å; F134-S137 WeakPolarHBondContact O-CB 3.26Å; F134-S137 PolarHBondContact O-N 3.44Å; F134-S137 PolarHBondContact O-OG 2.8Å; N135-S137 VanDerWaalsContact C-N 3.27Å; N135-S137 PolarHBondContact O-N 3.38Å
138	L	91.4	Very high	93.7	Very high	27 Å²	27	25.3 Å²	25.3	14%	0.141	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-7.5	173.7	-56	-177.9	0	0	0	112.3	F134 N135 L136 C211	F134-L138 HydrophobicContact CD1-CD1 4.25Å; F134-L138 HydrophobicContact CE1-CD1 3.7Å; F134-L138 HydrophobicContact CE1-CG 4.28Å; F134-L138 HydrophobicContact CZ-CD1 4.17Å; F134-L138 HydrophobicContact CZ-CD2 4.32Å; F134-L138 HydrophobicContact CZ-CG 4.44Å; F134-L138 PolarHBondContact O-N 3.34Å; N135-L138 WeakPolarHBondContact O-CB 3.45Å; N135-L138 PolarHBondContact O-N 3.14Å; N135-L138 VanDerWaalsContact O-N 3.09Å; L136-L138 PolarHBondContact O-N 3.24Å; L138-C211 HydrophobicContact CD2-CB 3.79Å
139	T	88.9	Confident	93.6	Very high	33 Å²	33	20.9 Å²	20.9	20%	0.202	11%	0.113	C	C	.	.	S	Bend	trans	-63.8	137	177	-60.5	0	0	0	0	108.7	N135 L136 Y141 V142	N135-T139 PolarHBondContact O-N 3.42Å; N135-T139 PolarHBondContact O-OG1 3.37Å; L136-T139 VanDerWaalsContact O-CB 3.22Å; L136-T139 WeakPolarHBondContact O-CB 3.43Å; L136-T139 PolarHBondContact O-N 3.11Å; L136-T139 VanDerWaalsContact O-N 3.1Å; L136-T139 PolarHBondContact O-OG1 3.44Å; T139-Y141 PolarHBondContact O-N 3.4Å; T139-V142 PolarHBondContact O-N 3.14Å; T139-V142 VanDerWaalsContact O-N 3.16Å
140	P	83.3	Confident	93.4	Very high	74 Å²	74	23.5 Å²	23.5	48%	0.481	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.8	138.2	173.6	-27.8	35	0	0	0	110.8	V142	P140-V142 PolarHBondContact O-N 2.86Å
141	Y	83.9	Confident	93	Very high	96 Å²	96	23.6 Å²	23.6	38%	0.376	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	-12.4	176.4	-32.3	-50.4	0	0	0	116	K95 T102 T139 N143	K95-Y141 HydrophobicContact CB-CD1 4.44Å; K95-Y141 HydrophobicContact CB-CD2 4.22Å; K95-Y141 HydrophobicContact CB-CG 4.09Å; K95-Y141 HydrophobicContact CD-CD1 3.3Å; K95-Y141 HydrophobicContact CD-CD2 4.01Å; K95-Y141 HydrophobicContact CD-CE1 3.1Å; K95-Y141 HydrophobicContact CD-CE2 3.8Å; K95-Y141 HydrophobicContact CD-CG 3.75Å; K95-Y141 HydrophobicContact CG-CD1 4.39Å; K95-Y141 HydrophobicContact CG-CE1 4.49Å; K95-Y141 PolarHBondContact NZ-OH 3.48Å; K95-Y141 VanDerWaalsContact NZ-OH 3.14Å; T102-Y141 WeakPolarHBondContact CB-O 3.34Å; T102-Y141 PolarHBondContact N-O 2.92Å; T139-Y141 PolarHBondContact O-N 3.4Å; Y141-N143 PolarHBondContact O-N 3.35Å
142	V	91.1	Very high	92.6	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	110.8	163.7	-176.7	0	0	0	0	107.1	I104 L136 T139 P140 V145	I104-V142 HydrophobicContact CD1-CG1 3.99Å; I104-V142 HydrophobicContact CD1-CG2 4.06Å; I104-V142 HydrophobicContact CG1-CG1 4.31Å; L136-V142 HydrophobicContact CD1-CG2 4.45Å; L136-V142 WeakPolarHBondContact O-CB 3.15Å; T139-V142 PolarHBondContact O-N 3.14Å; T139-V142 VanDerWaalsContact O-N 3.16Å; P140-V142 PolarHBondContact O-N 2.86Å; V142-V145 HydrophobicContact CG1-CG2 3.61Å
143	N	91.1	Very high	92.2	Very high	32 Å²	32	27.1 Å²	27.1	17%	0.171	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	-32.1	178.2	-176.6	77.1	0	0	0	111.5	N12 Q101 T102 F103 Y141	N12-N143 PolarHBondContact ND2-ND2 3.37Å; N12-N143 PolarHBondContact OD1-ND2 3.41Å; Q101-N143 HydrophobicContact CB-CB 3.81Å; Q101-N143 HydrophobicContact CG-CB 4.11Å; Q101-N143 PolarHBondContact OE1-OD1 2.81Å; T102-N143 PolarHBondContact O-N 3.39Å; F103-N143 HydrophobicContact CD2-CB 4.22Å; F103-N143 HydrophobicContact CE2-CB 3.81Å; F103-N143 WeakPolarHBondContact CE2-ND2 3.35Å; F103-N143 VanDerWaalsContact CZ-ND2 3.32Å; F103-N143 WeakPolarHBondContact CZ-ND2 3.33Å; Y141-N143 PolarHBondContact O-N 3.35Å
144	R	94.7	Very high	91.4	Very high	2 Å²	2	30 Å²	30	1%	0.008	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	135.7	-176.7	-174.8	174.9	-69.3	-169.7	-5.3	111.8	L9 L10 N12 I14 S16 N17 I19 F103 I104 V146	L9-R144 PolarHBondContact O-NH1 3.3Å; L9-R144 PolarHBondContact O-NH2 3.39Å; L10-R144 PolarHBondContact O-NH1 3.2Å; N12-R144 PolarHBondContact OD1-NH2 3.31Å; I14-R144 PolarHBondContact O-NH2 3.36Å; S16-R144 WeakPolarHBondContact O-CG 3.33Å; S16-R144 PolarHBondContact O-NE 3.19Å; S16-R144 VanDerWaalsContact O-NE 3.09Å; N17-R144 CarbonylContact O-C 3.56Å; N17-R144 VanDerWaalsContact O-CA 3.32Å; N17-R144 WeakPolarHBondContact O-CA 3.31Å; I19-R144 HydrophobicContact CD1-CG 4.33Å; F103-R144 CarbonylContact C-O 3.59Å; F103-R144 WeakPolarHBondContact CA-O 3.47Å; F103-R144 HydrophobicContact CD1-CB 3.76Å; F103-R144 HydrophobicContact CD1-CG 4.23Å; F103-R144 HydrophobicContact CD2-CB 4.34Å; F103-R144 HydrophobicContact CE1-CB 3.8Å; F103-R144 HydrophobicContact CE1-CG 4.26Å; F103-R144 HydrophobicContact CE2-CB 4.36Å; F103-R144 HydrophobicContact CG-CB 4.04Å; F103-R144 HydrophobicContact CZ-CB 4.1Å; I104-R144 PolarHBondContact N-O 2.9Å; R144-V146 HydrophobicContact CG-CG2 3.8Å
145	V	97.1	Very high	90.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	165.7	178.2	0	0	0	0	107.6	N17 F18 I19 I104 I106 L136 V142	N17-V145 PolarHBondContact O-N 2.78Å; F18-V145 WeakPolarHBondContact CA-O 3.28Å; F18-V145 HydrophobicContact CD2-CB 3.95Å; F18-V145 HydrophobicContact CD2-CG1 4.03Å; F18-V145 HydrophobicContact CE2-CB 4.35Å; F18-V145 HydrophobicContact CE2-CG1 3.9Å; I19-V145 PolarHBondContact N-O 2.79Å; I104-V145 HydrophobicContact CB-CG2 4.18Å; I104-V145 HydrophobicContact CD1-CG2 4.33Å; I104-V145 CarbonylContact O-C 3.57Å; I104-V145 WeakPolarHBondContact O-CA 3.34Å; I106-V145 HydrophobicContact CD1-CG1 4.01Å; L136-V145 HydrophobicContact CG-CG2 4.32Å; V142-V145 HydrophobicContact CG1-CG2 3.61Å
146	V	97.7	Very high	89.8	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	118.1	176.4	-167.9	0	0	0	0	108.3	I19 W36 L39 I104 F105 I106 R144	I19-V146 HydrophobicContact CB-CB 4.45Å; I19-V146 HydrophobicContact CB-CG1 4.05Å; I19-V146 HydrophobicContact CB-CG2 4.23Å; I19-V146 HydrophobicContact CD1-CG2 4.43Å; I19-V146 HydrophobicContact CG2-CG1 4.04Å; I19-V146 CarbonylContact O-C 3.58Å; I19-V146 WeakPolarHBondContact O-CA 3.37Å; W36-V146 HydrophobicContact CH2-CB 4.47Å; W36-V146 HydrophobicContact CH2-CG1 4.33Å; W36-V146 HydrophobicContact CZ3-CB 4.26Å; W36-V146 HydrophobicContact CZ3-CG1 3.66Å; L39-V146 HydrophobicContact CD2-CG1 4.42Å; I104-V146 PolarHBondContact O-N 2.88Å; F105-V146 HydrophobicContact CD1-CB 3.93Å; F105-V146 HydrophobicContact CD1-CG2 4.09Å; F105-V146 HydrophobicContact CE1-CB 4.18Å; F105-V146 HydrophobicContact CE1-CG2 3.86Å; I106-V146 PolarHBondContact N-O 2.78Å; R144-V146 HydrophobicContact CG-CG2 3.8Å
147	C	97.2	Very high	88.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.3	178.5	-65.7	0	0	0	0	110.1	F18 I19 Y21 L171	F18-C147 VanDerWaalsContact CE2-SG 3.56Å; I19-C147 PolarHBondContact O-N 3.4Å; Y21-C147 PolarHBondContact N-O 3.4Å; C147-L171 HydrophobicContact CB-CD2 4.44Å
148	S	95.1	Very high	88.1	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.014	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	135.2	171.6	-166	0	0	0	0	110.5	Y21 I106 L109	Y21-S148 WeakPolarHBondContact CD1-OG 3.25Å; Y21-S148 CarbonylContact O-C 3.55Å; Y21-S148 VanDerWaalsContact O-CA 3.26Å; Y21-S148 WeakPolarHBondContact O-CA 3.32Å; I106-S148 WeakPolarHBondContact O-CB 3.47Å; I106-S148 PolarHBondContact O-N 2.88Å; L109-S148 WeakPolarHBondContact CB-O 3.26Å
149	F	94.3	Very high	87.8	Confident	13 Å²	13	48.8 Å²	48.8	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	131.3	172.2	-177.8	-116.6	0	0	0	110.3	Y21 I22 D23 L109 P151 V167 I168 L171	Y21-F149 PolarHBondContact O-N 3.47Å; I22-F149 WeakPolarHBondContact CA-O 3.49Å; D23-F149 PolarHBondContact N-O 3.1Å; L109-F149 HydrophobicContact CD2-CB 4.19Å; L109-F149 HydrophobicContact CD2-CD2 4.27Å; L109-F149 HydrophobicContact CD2-CG 4.45Å; F149-P151 HydrophobicContact CD1-CB 4.29Å; F149-P151 HydrophobicContact CE1-CB 3.77Å; F149-P151 VanDerWaalsContact O-CD 3.3Å; F149-P151 WeakPolarHBondContact O-CD 3.25Å; F149-V167 HydrophobicContact CD1-CG1 3.92Å; F149-V167 HydrophobicContact CD2-CG1 3.85Å; F149-V167 HydrophobicContact CE1-CB 3.97Å; F149-V167 HydrophobicContact CE1-CG1 3.8Å; F149-V167 HydrophobicContact CE2-CB 4.26Å; F149-V167 HydrophobicContact CE2-CG1 3.74Å; F149-V167 HydrophobicContact CE2-CG2 4.49Å; F149-V167 HydrophobicContact CG-CG1 3.95Å; F149-V167 HydrophobicContact CZ-CB 3.82Å; F149-V167 HydrophobicContact CZ-CG1 3.72Å; F149-V167 HydrophobicContact CZ-CG2 4.27Å; F149-I168 HydrophobicContact CD1-CG1 4Å; F149-I168 HydrophobicContact CE1-CD1 4.35Å; F149-I168 HydrophobicContact CE1-CG1 3.92Å; F149-L171 HydrophobicContact CB-CD1 3.81Å; F149-L171 HydrophobicContact CD1-CD1 4.29Å; F149-L171 HydrophobicContact CG-CD1 4.2Å
150	N	91.3	Very high	87.8	Confident	55 Å²	55	50.5 Å²	50.5	29%	0.294	28%	0.276	S	S	.	.			trans	-108.8	95.6	177.2	-66.2	14.4	0	0	0	107.6	Y57	Y57-N150 PolarHBondContact OH-ND2 3Å; Y57-N150 VanDerWaalsContact OH-ND2 3.11Å
151	P	90.8	Very high	87.7	Confident	3 Å²	3	55 Å²	55	2%	0.019	29%	0.285	C	S	.	.			trans	-66.1	151.4	179.4	26.2	-34.5	0	0	0	111.8	I22 D23 E24 F149 I153 Y160 I168	I22-P151 HydrophobicContact CG2-CG 3.85Å; D23-P151 WeakPolarHBondContact O-CD 3.4Å; E24-P151 HydrophobicContact CG-CG 4.23Å; F149-P151 HydrophobicContact CD1-CB 4.29Å; F149-P151 HydrophobicContact CE1-CB 3.77Å; F149-P151 VanDerWaalsContact O-CD 3.3Å; F149-P151 WeakPolarHBondContact O-CD 3.25Å; P151-I153 HydrophobicContact CB-CG1 4.44Å; P151-I153 HydrophobicContact CG-CD1 4.34Å; P151-I153 HydrophobicContact CG-CG1 4.37Å; P151-Y160 HydrophobicContact CB-CD1 3.76Å; P151-Y160 HydrophobicContact CB-CE1 3.92Å; P151-Y160 HydrophobicContact CG-CD1 4.32Å; P151-Y160 HydrophobicContact CG-CE1 3.98Å; P151-I168 HydrophobicContact CB-CD1 3.79Å; P151-I168 HydrophobicContact CG-CD1 4.08Å
152	V	88.2	Confident	87.8	Confident	79 Å²	79	52.9 Å²	52.9	48%	0.479	29%	0.292	S	S	.	.			trans	-87.9	118.8	167	-176.5	0	0	0	0	108	Y161 S164	V152-Y161 PolarHBondContact O-N 3.48Å; V152-S164 PolarHBondContact N-OG 3.19Å; V152-S164 VanDerWaalsContact N-OG 3.14Å
153	I	85.4	Confident	87.7	Confident	31 Å²	31	54.9 Å²	54.9	16%	0.159	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.3	-178.1	-56.5	168.2	0	0	0	109.3	E24 P151 N155 Y160	E24-I153 HydrophobicContact CB-CD1 3.62Å; E24-I153 HydrophobicContact CG-CD1 3.95Å; P151-I153 HydrophobicContact CB-CG1 4.44Å; P151-I153 HydrophobicContact CG-CD1 4.34Å; P151-I153 HydrophobicContact CG-CG1 4.37Å; I153-N155 PolarHBondContact O-N 3.2Å; I153-Y160 HydrophobicContact CD1-CE1 4.15Å; I153-Y160 HydrophobicContact CG1-CD1 3.79Å; I153-Y160 HydrophobicContact CG1-CE1 3.87Å
154	D	81.8	Confident	87.8	Confident	62 Å²	62	53.9 Å²	53.9	33%	0.332	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	110.6	165.4	171.6	19.1	0	0	0	109.5	S156 S157 K158 A159	D154-S156 PolarHBondContact O-N 3.31Å; D154-S156 VanDerWaalsContact O-N 3.1Å; D154-S156 WeakPolarHBondContact OD1-CB 3.27Å; D154-S156 PolarHBondContact OD1-N 2.68Å; D154-S156 PolarHBondContact OD1-OG 2.92Å; D154-S156 PolarHBondContact OD2-OG 2.74Å; D154-S157 WeakPolarHBondContact CB-OG 3.46Å; D154-S157 VanDerWaalsContact CG-OG 3.29Å; D154-S157 PolarHBondContact O-N 2.9Å; D154-S157 WeakPolarHBondContact OD2-CB 3.47Å; D154-S157 PolarHBondContact OD2-N 2.66Å; D154-S157 PolarHBondContact OD2-OG 2.78Å; D154-K158 VanDerWaalsContact O-CA 3.27Å; D154-K158 WeakPolarHBondContact O-CA 3.5Å; D154-K158 PolarHBondContact O-N 3.22Å; D154-A159 PolarHBondContact N-O 2.99Å
155	N	75.7	Confident	87.7	Confident	136 Å²	136	55.9 Å²	55.9	73%	0.727	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-23.4	179.6	-71.3	-28.5	0	0	0	113.5	I153	I153-N155 PolarHBondContact O-N 3.2Å
156	S	79.6	Confident	87.5	Confident	107 Å²	107	57.3 Å²	57.3	75%	0.748	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-39.6	-178.1	73.7	0	0	0	0	112.9	D154	D154-S156 PolarHBondContact O-N 3.31Å; D154-S156 VanDerWaalsContact O-N 3.1Å; D154-S156 WeakPolarHBondContact OD1-CB 3.27Å; D154-S156 PolarHBondContact OD1-N 2.68Å; D154-S156 PolarHBondContact OD1-OG 2.92Å; D154-S156 PolarHBondContact OD2-OG 2.74Å
157	S	75.7	Confident	87.5	Confident	67 Å²	67	57.3 Å²	57.3	47%	0.469	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-11.6	-178	60.7	0	0	0	0	114.1	D154 A159	D154-S157 WeakPolarHBondContact CB-OG 3.46Å; D154-S157 VanDerWaalsContact CG-OG 3.29Å; D154-S157 PolarHBondContact O-N 2.9Å; D154-S157 WeakPolarHBondContact OD2-CB 3.47Å; D154-S157 PolarHBondContact OD2-N 2.66Å; D154-S157 PolarHBondContact OD2-OG 2.78Å; S157-A159 PolarHBondContact O-N 2.79Å; S157-A159 VanDerWaalsContact O-N 3.17Å; S157-A159 VanDerWaalsContact OG-CB 3.29Å; S157-A159 WeakPolarHBondContact OG-CB 3.3Å; S157-A159 PolarHBondContact OG-N 3.36Å
158	K	76.4	Confident	87.4	Confident	182 Å²	182	57.5 Å²	57.5	79%	0.791	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	21.4	-164.2	-62.7	-174.3	176.3	-175.9	0	113.2	D154	D154-K158 VanDerWaalsContact O-CA 3.27Å; D154-K158 WeakPolarHBondContact O-CA 3.5Å; D154-K158 PolarHBondContact O-N 3.22Å
159	A	84.7	Confident	87.4	Confident	48 Å²	48	62.1 Å²	62.1	40%	0.397	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	148.2	176	0	0	0	0	0	110.3	D154 S157	D154-A159 PolarHBondContact N-O 2.99Å; S157-A159 PolarHBondContact O-N 2.79Å; S157-A159 VanDerWaalsContact O-N 3.17Å; S157-A159 VanDerWaalsContact OG-CB 3.29Å; S157-A159 WeakPolarHBondContact OG-CB 3.3Å; S157-A159 PolarHBondContact OG-N 3.36Å
160	Y	88.1	Confident	87.5	Confident	69 Å²	69	62 Å²	62	27%	0.271	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	140	170.4	-59.5	-58.1	0	0	0	110.5	E24 P151 I153 I168	E24-Y160 PolarHBondContact OE1-OH 3.34Å; P151-Y160 HydrophobicContact CB-CD1 3.76Å; P151-Y160 HydrophobicContact CB-CE1 3.92Å; P151-Y160 HydrophobicContact CG-CD1 4.32Å; P151-Y160 HydrophobicContact CG-CE1 3.98Å; I153-Y160 HydrophobicContact CD1-CE1 4.15Å; I153-Y160 HydrophobicContact CG1-CD1 3.79Å; I153-Y160 HydrophobicContact CG1-CE1 3.87Å; Y160-I168 HydrophobicContact CD1-CD1 3.73Å; Y160-I168 HydrophobicContact CD2-CD1 3.81Å; Y160-I168 HydrophobicContact CE1-CD1 3.41Å; Y160-I168 VanDerWaalsContact CE1-CD1 3.41Å; Y160-I168 HydrophobicContact CE2-CD1 3.47Å; Y160-I168 VanDerWaalsContact CE2-CD1 3.47Å; Y160-I168 HydrophobicContact CE2-CG2 4.41Å; Y160-I168 HydrophobicContact CG-CD1 3.94Å
161	Y	83.1	Confident	87.8	Confident	169 Å²	169	59.4 Å²	59.4	66%	0.663	34%	0.339	S	S	*	.	P	Polyproline II helix	trans	-96	139.2	-179.8	-168.4	-95.6	0	0	0	112.2	V152 A163 S164	V152-Y161 PolarHBondContact O-N 3.48Å; Y161-A163 PolarHBondContact O-N 3.18Å; Y161-S164 VanDerWaalsContact O-CB 3.24Å; Y161-S164 WeakPolarHBondContact O-CB 3Å; Y161-S164 PolarHBondContact O-N 2.99Å; Y161-S164 VanDerWaalsContact O-N 3.15Å; Y161-S164 PolarHBondContact O-OG 3.4Å
162	G	84	Confident	88.1	Confident	51 Å²	51	62 Å²	62	53%	0.526	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	-133.8	173.8	0	0	0	0	0	112.6	S164 S165	G162-S164 PolarHBondContact O-N 2.99Å; G162-S164 VanDerWaalsContact O-N 3.12Å; G162-S165 PolarHBondContact O-OG 3.48Å
163	A	90.6	Very high	88.4	Confident	44 Å²	44	61 Å²	61	36%	0.364	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-11.1	179	0	0	0	0	0	115.1	F122 Y161 S165 T166 V167	F122-A163 HydrophobicContact CD1-CB 3.97Å; F122-A163 HydrophobicContact CE1-CB 3.36Å; F122-A163 HydrophobicContact CE2-CB 4.45Å; F122-A163 HydrophobicContact CZ-CB 3.63Å; Y161-A163 PolarHBondContact O-N 3.18Å; A163-S165 VanDerWaalsContact C-N 3.3Å; A163-S165 PolarHBondContact O-N 3.49Å; A163-T166 PolarHBondContact O-N 2.8Å; A163-V167 VanDerWaalsContact O-CG2 3.31Å; A163-V167 WeakPolarHBondContact O-CG2 3.5Å; A163-V167 PolarHBondContact O-N 3.15Å
164	S	92.8	Very high	88.9	Confident	11 Å²	11	63.1 Å²	63.1	8%	0.077	36%	0.358	C	S	.	.	H	α-helix	trans	-62	-36.6	-174.7	-54.4	0	0	0	0	112.4	V152 Y161 G162 I168	V152-S164 PolarHBondContact N-OG 3.19Å; V152-S164 VanDerWaalsContact N-OG 3.14Å; Y161-S164 VanDerWaalsContact O-CB 3.24Å; Y161-S164 WeakPolarHBondContact O-CB 3Å; Y161-S164 PolarHBondContact O-N 2.99Å; Y161-S164 VanDerWaalsContact O-N 3.15Å; Y161-S164 PolarHBondContact O-OG 3.4Å; G162-S164 PolarHBondContact O-N 2.99Å; G162-S164 VanDerWaalsContact O-N 3.12Å; S164-I168 WeakPolarHBondContact O-CG1 3.37Å; S164-I168 PolarHBondContact O-N 2.93Å; S164-I168 VanDerWaalsContact O-N 3.09Å
165	S	92.6	Very high	89.6	Confident	43 Å²	43	60.2 Å²	60.2	30%	0.301	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-49.4	175.8	53.6	0	0	0	0	111.3	G162 A163 V167 I168 D169	G162-S165 PolarHBondContact O-OG 3.48Å; A163-S165 VanDerWaalsContact C-N 3.3Å; A163-S165 PolarHBondContact O-N 3.49Å; S165-V167 VanDerWaalsContact C-N 3.28Å; S165-V167 PolarHBondContact O-N 3.49Å; S165-I168 PolarHBondContact O-N 3.42Å; S165-I168 VanDerWaalsContact O-N 3.11Å; S165-D169 VanDerWaalsContact O-CG 3.27Å; S165-D169 PolarHBondContact O-N 3.12Å
166	T	93.5	Very high	90.6	Very high	30 Å²	30	53.7 Å²	53.7	18%	0.184	31%	0.307	C	S	.	.	H	α-helix	trans	-56.9	-43.3	178.8	-54.3	0	0	0	0	111.6	D123 A163 T170	D123-T166 HydrophobicContact CB-CG2 4.12Å; D123-T166 WeakPolarHBondContact OD1-CG2 3.47Å; A163-T166 PolarHBondContact O-N 2.8Å; T166-T170 WeakPolarHBondContact O-CB 3.48Å; T166-T170 PolarHBondContact O-N 2.79Å; T166-T170 PolarHBondContact O-OG1 3.34Å
167	V	96.3	Very high	91.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-42.6	179.2	176.7	0	0	0	0	110.9	L109 L113 F122 F149 A163 S165 T170 L171	L109-V167 HydrophobicContact CD2-CG1 4Å; L113-V167 HydrophobicContact CD1-CB 4.48Å; L113-V167 HydrophobicContact CD1-CG1 3.99Å; L113-V167 HydrophobicContact CD1-CG2 3.56Å; F122-V167 HydrophobicContact CE1-CG2 4.01Å; F122-V167 HydrophobicContact CZ-CG2 3.94Å; F149-V167 HydrophobicContact CD1-CG1 3.92Å; F149-V167 HydrophobicContact CD2-CG1 3.85Å; F149-V167 HydrophobicContact CE1-CB 3.97Å; F149-V167 HydrophobicContact CE1-CG1 3.8Å; F149-V167 HydrophobicContact CE2-CB 4.26Å; F149-V167 HydrophobicContact CE2-CG1 3.74Å; F149-V167 HydrophobicContact CE2-CG2 4.49Å; F149-V167 HydrophobicContact CG-CG1 3.95Å; F149-V167 HydrophobicContact CZ-CB 3.82Å; F149-V167 HydrophobicContact CZ-CG1 3.72Å; F149-V167 HydrophobicContact CZ-CG2 4.27Å; A163-V167 VanDerWaalsContact O-CG2 3.31Å; A163-V167 WeakPolarHBondContact O-CG2 3.5Å; A163-V167 PolarHBondContact O-N 3.15Å; S165-V167 VanDerWaalsContact C-N 3.28Å; S165-V167 PolarHBondContact O-N 3.49Å; V167-T170 PolarHBondContact O-N 3.42Å; V167-L171 HydrophobicContact CG1-CD1 4.01Å; V167-L171 HydrophobicContact CG1-CG 4.38Å; V167-L171 WeakPolarHBondContact O-CB 3.48Å; V167-L171 VanDerWaalsContact O-CG 3.28Å; V167-L171 WeakPolarHBondContact O-CG 3.17Å; V167-L171 PolarHBondContact O-N 3.28Å
168	I	95.5	Very high	92.4	Very high	3 Å²	3	45.5 Å²	45.5	2%	0.015	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-49.7	177	-72.3	173.9	0	0	0	110.7	I22 F149 P151 Y160 S164 S165 T170 L171 E172 Y180	I22-I168 HydrophobicContact CD1-CG1 4.17Å; I22-I168 HydrophobicContact CD1-CG2 4.16Å; I22-I168 HydrophobicContact CG2-CD1 4.23Å; F149-I168 HydrophobicContact CD1-CG1 4Å; F149-I168 HydrophobicContact CE1-CD1 4.35Å; F149-I168 HydrophobicContact CE1-CG1 3.92Å; P151-I168 HydrophobicContact CB-CD1 3.79Å; P151-I168 HydrophobicContact CG-CD1 4.08Å; Y160-I168 HydrophobicContact CD1-CD1 3.73Å; Y160-I168 HydrophobicContact CD2-CD1 3.81Å; Y160-I168 HydrophobicContact CE1-CD1 3.41Å; Y160-I168 VanDerWaalsContact CE1-CD1 3.41Å; Y160-I168 HydrophobicContact CE2-CD1 3.47Å; Y160-I168 VanDerWaalsContact CE2-CD1 3.47Å; Y160-I168 HydrophobicContact CE2-CG2 4.41Å; Y160-I168 HydrophobicContact CG-CD1 3.94Å; S164-I168 WeakPolarHBondContact O-CG1 3.37Å; S164-I168 PolarHBondContact O-N 2.93Å; S164-I168 VanDerWaalsContact O-N 3.09Å; S165-I168 PolarHBondContact O-N 3.42Å; S165-I168 VanDerWaalsContact O-N 3.11Å; I168-T170 PolarHBondContact O-N 2.86Å; I168-L171 CarbonylContact O-C 3.58Å; I168-L171 PolarHBondContact O-N 3.01Å; I168-L171 VanDerWaalsContact O-N 3.09Å; I168-E172 HydrophobicContact CG2-CG 4.17Å; I168-E172 WeakPolarHBondContact O-CB 3.17Å; I168-E172 WeakPolarHBondContact O-CG 3.4Å; I168-E172 PolarHBondContact O-N 3.04Å; I168-Y180 WeakPolarHBondContact CG2-OH 3.31Å
169	D	95.4	Very high	93.3	Very high	100 Å²	100	37 Å²	37	54%	0.535	21%	0.213	S	C	.	.	H	α-helix	trans	-57.6	-40.6	179.6	-66.5	-21.9	0	0	0	110.8	S165 A173	S165-D169 VanDerWaalsContact O-CG 3.27Å; S165-D169 PolarHBondContact O-N 3.12Å; D169-A173 WeakPolarHBondContact O-CB 3.38Å; D169-A173 PolarHBondContact O-N 3.25Å
170	T	96.9	Very high	93.8	Very high	10 Å²	10	35.4 Å²	35.4	6%	0.061	20%	0.197	C	C	.	.	H	α-helix	trans	-69	-44.7	176.3	-53.5	0	0	0	0	111.5	Q127 I130 T166 V167 I168 E172 A173 Y174	Q127-T170 HydrophobicContact CB-CG2 4.42Å; Q127-T170 HydrophobicContact CG-CG2 3.88Å; I130-T170 HydrophobicContact CB-CG2 4.02Å; I130-T170 HydrophobicContact CD1-CG2 3.53Å; I130-T170 HydrophobicContact CG1-CG2 4.34Å; I130-T170 HydrophobicContact CG2-CG2 4.22Å; T166-T170 WeakPolarHBondContact O-CB 3.48Å; T166-T170 PolarHBondContact O-N 2.79Å; T166-T170 PolarHBondContact O-OG1 3.34Å; V167-T170 PolarHBondContact O-N 3.42Å; I168-T170 PolarHBondContact O-N 2.86Å; T170-E172 VanDerWaalsContact C-N 3.34Å; T170-E172 PolarHBondContact O-N 3.17Å; T170-A173 PolarHBondContact O-N 3.46Å; T170-Y174 HydrophobicContact CG2-CD2 3.97Å; T170-Y174 HydrophobicContact CG2-CE2 3.99Å; T170-Y174 VanDerWaalsContact O-CD2 3.31Å; T170-Y174 WeakPolarHBondContact O-CD2 3.42Å; T170-Y174 PolarHBondContact O-N 2.98Å; T170-Y174 VanDerWaalsContact O-N 3.15Å
171	L	97.6	Very high	94	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.8	-47	174.6	-79.1	171.8	0	0	0	111	A20 I22 L109 I130 C147 F149 V167 I168 A173 Y174 A175	A20-L171 HydrophobicContact CB-CB 3.93Å; A20-L171 HydrophobicContact CB-CD1 4.4Å; A20-L171 HydrophobicContact CB-CD2 4.1Å; A20-L171 HydrophobicContact CB-CG 4.37Å; I22-L171 HydrophobicContact CG1-CD1 4.48Å; L109-L171 HydrophobicContact CD2-CD1 3.94Å; L109-L171 HydrophobicContact CD2-CD2 4.02Å; L109-L171 HydrophobicContact CD2-CG 4.28Å; I130-L171 HydrophobicContact CD1-CD2 3.87Å; I130-L171 HydrophobicContact CD1-CG 3.78Å; I130-L171 HydrophobicContact CG1-CD2 4.12Å; I130-L171 HydrophobicContact CG2-CD2 4.29Å; C147-L171 HydrophobicContact CB-CD2 4.44Å; F149-L171 HydrophobicContact CB-CD1 3.81Å; F149-L171 HydrophobicContact CD1-CD1 4.29Å; F149-L171 HydrophobicContact CG-CD1 4.2Å; V167-L171 HydrophobicContact CG1-CD1 4.01Å; V167-L171 HydrophobicContact CG1-CG 4.38Å; V167-L171 WeakPolarHBondContact O-CB 3.48Å; V167-L171 VanDerWaalsContact O-CG 3.28Å; V167-L171 WeakPolarHBondContact O-CG 3.17Å; V167-L171 PolarHBondContact O-N 3.28Å; I168-L171 CarbonylContact O-C 3.58Å; I168-L171 PolarHBondContact O-N 3.01Å; I168-L171 VanDerWaalsContact O-N 3.09Å; L171-A173 VanDerWaalsContact C-N 3.29Å; L171-A173 PolarHBondContact O-N 3.07Å; L171-Y174 PolarHBondContact O-N 3Å; L171-A175 WeakPolarHBondContact O-CA 3.42Å; L171-A175 WeakPolarHBondContact O-CB 3.31Å; L171-A175 PolarHBondContact O-N 3.17Å
172	E	95.5	Very high	94.1	Very high	58 Å²	58	28.9 Å²	28.9	27%	0.271	18%	0.175	S	C	.	.	H	α-helix	trans	-62.5	-35	176.8	-69.6	-156.4	143.8	0	0	112.1	I168 T170 V178 Y180 R204	I168-E172 HydrophobicContact CG2-CG 4.17Å; I168-E172 WeakPolarHBondContact O-CB 3.17Å; I168-E172 WeakPolarHBondContact O-CG 3.4Å; I168-E172 PolarHBondContact O-N 3.04Å; T170-E172 VanDerWaalsContact C-N 3.34Å; T170-E172 PolarHBondContact O-N 3.17Å; E172-V178 HydrophobicContact CG-CG1 4.46Å; E172-V178 HydrophobicContact CG-CG2 4.24Å; E172-Y180 WeakPolarHBondContact OE1-CE2 3.37Å; E172-Y180 PolarHBondContact OE1-OH 2.88Å; E172-R204 PolarHBondContact O-NH1 2.9Å; E172-R204 PolarHBondContact O-NH2 3.42Å
173	A	95.2	Very high	93.9	Very high	57 Å²	57	29 Å²	29	47%	0.471	17%	0.168	S	C	.	.	H	α-helix	trans	-64.8	-43.3	177.2	0	0	0	0	0	112.3	D169 T170 L171 R204	D169-A173 WeakPolarHBondContact O-CB 3.38Å; D169-A173 PolarHBondContact O-N 3.25Å; T170-A173 PolarHBondContact O-N 3.46Å; L171-A173 VanDerWaalsContact C-N 3.29Å; L171-A173 PolarHBondContact O-N 3.07Å; A173-R204 PolarHBondContact O-NH1 3.03Å; A173-R204 VanDerWaalsContact O-NH1 3.12Å
174	Y	95.7	Very high	93.4	Very high	77 Å²	77	28.3 Å²	28.3	30%	0.302	16%	0.158	S	C	.	.	H	α-helix	trans	-92.6	-24	-175.1	-74.4	-96.5	0	0	0	114.4	I130 F134 T170 L171 T176	I130-Y174 HydrophobicContact CG2-CD2 4.03Å; I130-Y174 HydrophobicContact CG2-CG 3.97Å; F134-Y174 HydrophobicContact CB-CD1 4.21Å; F134-Y174 HydrophobicContact CD1-CD1 4.3Å; F134-Y174 WeakPolarHBondContact CD2-O 3.16Å; F134-Y174 HydrophobicContact CG-CD1 4.24Å; T170-Y174 HydrophobicContact CG2-CD2 3.97Å; T170-Y174 HydrophobicContact CG2-CE2 3.99Å; T170-Y174 VanDerWaalsContact O-CD2 3.31Å; T170-Y174 WeakPolarHBondContact O-CD2 3.42Å; T170-Y174 PolarHBondContact O-N 2.98Å; T170-Y174 VanDerWaalsContact O-N 3.15Å; L171-Y174 PolarHBondContact O-N 3Å; Y174-T176 PolarHBondContact O-N 2.97Å
175	A	96.9	Very high	92.7	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	18%	0.179	C	C	.	.			trans	-68.3	130.8	-175.9	0	0	0	0	0	113.3	F18 A20 L171 S177 V178	F18-A175 HydrophobicContact CD1-CB 4.3Å; A20-A175 HydrophobicContact CB-CB 3.86Å; L171-A175 WeakPolarHBondContact O-CA 3.42Å; L171-A175 WeakPolarHBondContact O-CB 3.31Å; L171-A175 PolarHBondContact O-N 3.17Å; A175-S177 VanDerWaalsContact C-N 3.27Å; A175-S177 WeakPolarHBondContact CB-O 3.45Å; A175-V178 HydrophobicContact CB-CG2 3.72Å
176	T	95.6	Very high	91.7	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-70.1	-30.8	165.9	62.7	0	0	0	0	110.8	S16 N17 F18 F134 Y174 H203 R204 L207 Q208	S16-T176 PolarHBondContact OG-OG1 2.8Å; N17-T176 PolarHBondContact N-OG1 2.85Å; F18-T176 PolarHBondContact N-OG1 3.01Å; F18-T176 PolarHBondContact O-N 3.5Å; F18-T176 PolarHBondContact O-OG1 2.87Å; F134-T176 HydrophobicContact CE2-CG2 4.5Å; Y174-T176 PolarHBondContact O-N 2.97Å; T176-H203 PolarHBondContact O-ND1 3.07Å; T176-R204 PolarHBondContact O-N 3.37Å; T176-L207 HydrophobicContact CG2-CD2 4.33Å; T176-L207 HydrophobicContact CG2-CG 4.18Å; T176-Q208 HydrophobicContact CG2-CB 4.5Å
177	S	96.9	Very high	90.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	143	173	-43.5	0	0	0	0	111.6	L9 S16 F18 I19 A20 A175 F202 H203	L9-S177 WeakPolarHBondContact CD1-OG 3.48Å; S16-S177 WeakPolarHBondContact CB-OG 3.34Å; S16-S177 WeakPolarHBondContact OG-CB 3.42Å; S16-S177 PolarHBondContact OG-OG 2.79Å; F18-S177 PolarHBondContact O-N 3.39Å; I19-S177 CarbonylContact C-O 3.51Å; I19-S177 VanDerWaalsContact CA-O 3.3Å; I19-S177 WeakPolarHBondContact CA-O 3.22Å; A20-S177 PolarHBondContact N-O 3.06Å; A175-S177 VanDerWaalsContact C-N 3.27Å; A175-S177 WeakPolarHBondContact CB-O 3.45Å; S177-F202 CarbonylContact C-O 3.51Å; S177-F202 WeakPolarHBondContact CA-O 3.49Å; S177-H203 PolarHBondContact OG-ND1 2.91Å
178	V	97.3	Very high	88.5	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.006	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.6	177.1	-171.5	0	0	0	0	108.7	A20 I22 E172 A175 Y180 L201 F202	A20-V178 HydrophobicContact CB-CG1 4.27Å; A20-V178 HydrophobicContact CB-CG2 4.36Å; A20-V178 CarbonylContact O-C 3.47Å; A20-V178 WeakPolarHBondContact O-CA 3.43Å; I22-V178 HydrophobicContact CD1-CG1 3.71Å; I22-V178 HydrophobicContact CG1-CG1 4.47Å; E172-V178 HydrophobicContact CG-CG1 4.46Å; E172-V178 HydrophobicContact CG-CG2 4.24Å; A175-V178 HydrophobicContact CB-CG2 3.72Å; V178-Y180 HydrophobicContact CB-CE2 4.32Å; V178-Y180 HydrophobicContact CG1-CD2 3.82Å; V178-Y180 HydrophobicContact CG1-CE2 3.35Å; V178-L201 CarbonylContact O-C 3.57Å; V178-L201 WeakPolarHBondContact O-CA 3.42Å; V178-F202 HydrophobicContact CG2-CD1 4.47Å; V178-F202 PolarHBondContact N-O 2.9Å; V178-F202 PolarHBondContact O-N 2.81Å
179	I	96.1	Very high	86.6	Confident	3 Å²	3	46 Å²	46	2%	0.015	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	115.2	177.2	-59	166	0	0	0	107.4	L10 I19 A20 Y21 I22 K200 L201	L10-I179 HydrophobicContact CD2-CD1 3.61Å; I19-I179 HydrophobicContact CG2-CD1 3.65Å; I19-I179 HydrophobicContact CG2-CG1 4.15Å; A20-I179 PolarHBondContact O-N 3.04Å; Y21-I179 HydrophobicContact CD2-CB 4.34Å; Y21-I179 HydrophobicContact CD2-CG2 4.19Å; Y21-I179 HydrophobicContact CE2-CG2 4.46Å; I22-I179 PolarHBondContact N-O 2.9Å; I179-K200 WeakPolarHBondContact CA-O 2.88Å; I179-L201 HydrophobicContact CD1-CD1 4.45Å; I179-L201 HydrophobicContact CG1-CD1 3.59Å
180	Y	94.3	Very high	84.8	Confident	15 Å²	15	47.1 Å²	47.1	6%	0.059	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	127.6	170.5	-72.5	-87.2	0	0	0	109.7	I22 E24 I168 E172 V178 L199 K200	I22-Y180 HydrophobicContact CB-CD1 3.87Å; I22-Y180 HydrophobicContact CB-CE1 4Å; I22-Y180 HydrophobicContact CD1-CD1 4.19Å; I22-Y180 HydrophobicContact CD1-CE1 3.5Å; I22-Y180 HydrophobicContact CD1-CE2 4.3Å; I22-Y180 HydrophobicContact CG1-CE1 4.35Å; I22-Y180 HydrophobicContact CG2-CD1 3.8Å; I22-Y180 HydrophobicContact CG2-CE1 3.8Å; I22-Y180 CarbonylContact O-C 3.51Å; I22-Y180 WeakPolarHBondContact O-CA 3.43Å; E24-Y180 HydrophobicContact CG-CD1 4.38Å; I168-Y180 WeakPolarHBondContact CG2-OH 3.31Å; E172-Y180 WeakPolarHBondContact OE1-CE2 3.37Å; E172-Y180 PolarHBondContact OE1-OH 2.88Å; V178-Y180 HydrophobicContact CB-CE2 4.32Å; V178-Y180 HydrophobicContact CG1-CD2 3.82Å; V178-Y180 HydrophobicContact CG1-CE2 3.35Å; Y180-L199 CarbonylContact O-C 3.47Å; Y180-L199 WeakPolarHBondContact O-CA 3.49Å; Y180-K200 HydrophobicContact CD2-CD 4.23Å; Y180-K200 HydrophobicContact CD2-CG 4.46Å; Y180-K200 PolarHBondContact N-O 2.71Å; Y180-K200 PolarHBondContact O-N 2.92Å
181	C	92	Very high	83	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	127.4	175	-56.3	0	0	0	0	109	Y21 I22 E24	Y21-C181 WeakPolarHBondContact CE2-SG 3.45Å; Y21-C181 VanDerWaalsContact CZ-SG 3.56Å; I22-C181 PolarHBondContact O-N 2.85Å; E24-C181 WeakPolarHBondContact CA-O 3.37Å; E24-C181 VanDerWaalsContact CB-O 3.28Å; E24-C181 WeakPolarHBondContact CB-O 3.39Å; E24-C181 PolarHBondContact N-O 3.35Å
182	Q	84.9	Confident	81.5	Confident	101 Å²	101	56.4 Å²	56.4	47%	0.472	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	-65.5	-166.8	-55.4	-168.1	-49.8	0	0	114.5	E24 C25 S198	E24-Q182 WeakPolarHBondContact OE2-CG 3.43Å; E24-Q182 PolarHBondContact OE2-NE2 2.95Å; C25-Q182 PolarHBondContact SG-O 3.4Å; Q182-S198 PolarHBondContact N-O 2.76Å; Q182-S198 VanDerWaalsContact N-O 3.1Å
183	S	80.5	Confident	81	Confident	55 Å²	55	57.3 Å²	57.3	39%	0.385	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	136.2	-173.1	58.9	0	0	0	0	110.5	Q197 S198	S183-Q197 CarbonylContact O-C 3.56Å; S183-Q197 VanDerWaalsContact O-CA 3.3Å; S183-Q197 WeakPolarHBondContact O-CA 3.1Å; S183-S198 PolarHBondContact O-N 2.81Å; S183-S198 VanDerWaalsContact OG-CB 3.25Å; S183-S198 WeakPolarHBondContact OG-CB 3.36Å; S183-S198 PolarHBondContact OG-OG 2.81Å
184	L	80.4	Confident	80.7	Confident	28 Å²	28	57.3 Å²	57.3	15%	0.147	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.3	175.6	-177.4	71.3	0	0	0	108.9	M27 I195 Q197	M27-L184 HydrophobicContact CE-CB 4.01Å; M27-L184 WeakPolarHBondContact CE-O 3.4Å; L184-I195 HydrophobicContact CD1-CB 3.99Å; L184-I195 HydrophobicContact CD1-CD1 3.74Å; L184-I195 HydrophobicContact CD1-CG1 4.19Å; L184-Q197 HydrophobicContact CD1-CB 4.2Å; L184-Q197 HydrophobicContact CD1-CG 4.44Å
185	T	78.2	Confident	80.3	Confident	86 Å²	86	54 Å²	54	53%	0.528	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	121.3	175.5	-51.8	0	0	0	0	108.6	C196	T185-C196 PolarHBondContact N-O 3.13Å; T185-C196 PolarHBondContact O-N 2.99Å
186	E	71.4	Confident	80	Confident	136 Å²	136	55.4 Å²	55.4	64%	0.636	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72	130.9	170.2	-67	-176.3	176.3	0	0	109.5	S188 I195	E186-S188 PolarHBondContact O-N 2.79Å; E186-S188 VanDerWaalsContact O-N 3.16Å; E186-I195 HydrophobicContact CG-CG2 4.23Å
187	I	68.5	Low	79.7	Confident	56 Å²	56	55.6 Å²	55.6	29%	0.287	32%	0.32	S	S	.	.			trans	-73.2	111.8	173.9	-55.8	178.3	0	0	0	106.1	S189 Q194 C196	I187-S189 PolarHBondContact O-N 2.86Å; I187-Q194 HydrophobicContact CD1-CB 3.92Å; I187-Q194 PolarHBondContact N-O 3.42Å; I187-C196 VanDerWaalsContact CD1-SG 3.55Å; I187-C196 VanDerWaalsContact CG1-SG 3.57Å
188	S	53.6	Low	79.5	Confident	128 Å²	128	56.9 Å²	56.9	90%	0.895	33%	0.329	S	S	*	.	S	Bend	trans	-64	17.3	-165.3	58.7	0	0	0	0	117	E186	E186-S188 PolarHBondContact O-N 2.79Å; E186-S188 VanDerWaalsContact O-N 3.16Å
189	S	56.8	Low	79.3	Confident	54 Å²	54	57.1 Å²	57.1	38%	0.378	33%	0.331	S	S	.	.			trans	-88.1	113.1	167.5	111.5	0	0	0	0	108.2	I187 L191 T192	I187-S189 PolarHBondContact O-N 2.86Å; S189-L191 PolarHBondContact O-N 3.11Å; S189-T192 PolarHBondContact O-N 3.3Å; S189-T192 PolarHBondContact O-OG1 3.48Å; S189-T192 WeakPolarHBondContact OG-CB 3.42Å; S189-T192 WeakPolarHBondContact OG-CG2 3.46Å; S189-T192 PolarHBondContact OG-N 2.64Å; S189-T192 PolarHBondContact OG-OG1 2.84Å
190	S	55.9	Low	79.1	Confident	125 Å²	125	60.6 Å²	60.6	87%	0.874	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-9.5	178.1	52.3	0	0	0	0	114.5
191	L	59.9	Low	79.1	Confident	156 Å²	156	59.9 Å²	59.9	82%	0.817	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-21.6	175.9	-100.6	77.2	0	0	0	114.1	S189	S189-L191 PolarHBondContact O-N 3.11Å
192	T	66.5	Low	79.3	Confident	49 Å²	49	62.7 Å²	62.7	30%	0.301	36%	0.355	S	S	.	.			trans	-93.4	115.2	-176.6	50.2	0	0	0	0	109.4	S189 Q194	S189-T192 PolarHBondContact O-N 3.3Å; S189-T192 PolarHBondContact O-OG1 3.48Å; S189-T192 WeakPolarHBondContact OG-CB 3.42Å; S189-T192 WeakPolarHBondContact OG-CG2 3.46Å; S189-T192 PolarHBondContact OG-N 2.64Å; S189-T192 PolarHBondContact OG-OG1 2.84Å; T192-Q194 PolarHBondContact O-N 2.99Å
193	N	84.1	Confident	79.7	Confident	76 Å²	76	58 Å²	58	41%	0.406	33%	0.333	S	S	.	.			trans	-70.5	43.9	166.2	-65.3	-58.6	0	0	0	110.4	D235 T236 R237	N193-D235 CarbonylContact O-C 3.55Å; N193-D235 WeakPolarHBondContact O-CA 3.29Å; N193-T236 WeakPolarHBondContact CB-OG1 3.5Å; N193-T236 PolarHBondContact O-N 3.37Å; N193-T236 PolarHBondContact O-OG1 3.14Å; N193-T236 VanDerWaalsContact O-OG1 3.06Å; N193-R237 HydrophobicContact CB-CB 3.86Å
194	Q	88.5	Confident	80.3	Confident	58 Å²	58	58.6 Å²	58.6	27%	0.271	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	137.7	-170.5	-64.6	-179.6	0.9	0	0	110.5	I187 T192 L234 L242	I187-Q194 HydrophobicContact CD1-CB 3.92Å; I187-Q194 PolarHBondContact N-O 3.42Å; T192-Q194 PolarHBondContact O-N 2.99Å; Q194-L234 VanDerWaalsContact CA-O 3.22Å; Q194-L234 WeakPolarHBondContact CA-O 3.46Å; Q194-L242 HydrophobicContact CG-CD1 3.91Å
195	I	88.7	Confident	80.6	Confident	8 Å²	8	60 Å²	60	4%	0.041	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.8	-178.3	60.6	176	0	0	0	108.9	W34 L184 E186 E233 L234 T236	W34-I195 HydrophobicContact CB-CD1 3.27Å; W34-I195 HydrophobicContact CD2-CD1 4.07Å; W34-I195 HydrophobicContact CG-CD1 3.22Å; L184-I195 HydrophobicContact CD1-CB 3.99Å; L184-I195 HydrophobicContact CD1-CD1 3.74Å; L184-I195 HydrophobicContact CD1-CG1 4.19Å; E186-I195 HydrophobicContact CG-CG2 4.23Å; I195-E233 WeakPolarHBondContact O-CA 3.44Å; I195-L234 HydrophobicContact CD1-CB 4.16Å; I195-L234 HydrophobicContact CD1-CD1 3.94Å; I195-L234 HydrophobicContact CG1-CB 3.77Å; I195-L234 HydrophobicContact CG1-CD1 4.21Å; I195-L234 HydrophobicContact CG1-CG 4.41Å; I195-L234 PolarHBondContact N-O 2.85Å; I195-L234 PolarHBondContact O-N 3.1Å; I195-T236 HydrophobicContact CB-CG2 4.38Å; I195-T236 HydrophobicContact CD1-CG2 3.51Å; I195-T236 HydrophobicContact CG1-CG2 3.75Å; I195-T236 HydrophobicContact CG2-CG2 3.77Å
196	C	89.3	Confident	81	Confident	28 Å²	28	59.7 Å²	59.7	19%	0.189	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	130.9	170.6	-65.3	0	0	0	0	108.8	T185 I187 I232	T185-C196 PolarHBondContact N-O 3.13Å; T185-C196 PolarHBondContact O-N 2.99Å; I187-C196 VanDerWaalsContact CD1-SG 3.55Å; I187-C196 VanDerWaalsContact CG1-SG 3.57Å; C196-I232 CarbonylContact C-O 3.58Å; C196-I232 WeakPolarHBondContact CA-O 3.39Å
197	Q	90.5	Very high	81.7	Confident	5 Å²	5	55.3 Å²	55.3	2%	0.023	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	133.3	172.8	-165.8	171.1	17.7	0	0	110.1	C25 S183 L184 T231 I232	C25-Q197 PolarHBondContact SG-NE2 2.92Å; S183-Q197 CarbonylContact O-C 3.56Å; S183-Q197 VanDerWaalsContact O-CA 3.3Å; S183-Q197 WeakPolarHBondContact O-CA 3.1Å; L184-Q197 HydrophobicContact CD1-CB 4.2Å; L184-Q197 HydrophobicContact CD1-CG 4.44Å; Q197-T231 CarbonylContact O-C 3.54Å; Q197-T231 WeakPolarHBondContact O-CA 3.3Å; Q197-I232 HydrophobicContact CB-CG2 3.88Å; Q197-I232 PolarHBondContact N-O 3.12Å; Q197-I232 WeakPolarHBondContact O-CG2 3.49Å; Q197-I232 PolarHBondContact O-N 3.38Å
198	S	91.7	Very high	82.7	Confident	27 Å²	27	52.9 Å²	52.9	19%	0.189	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	134.1	173.5	-55.5	0	0	0	0	109.9	Q182 S183 G230	Q182-S198 PolarHBondContact N-O 2.76Å; Q182-S198 VanDerWaalsContact N-O 3.1Å; S183-S198 PolarHBondContact O-N 2.81Å; S183-S198 VanDerWaalsContact OG-CB 3.25Å; S183-S198 WeakPolarHBondContact OG-CB 3.36Å; S183-S198 PolarHBondContact OG-OG 2.81Å; S198-G230 WeakPolarHBondContact CA-O 3.3Å
199	L	93	Very high	84.1	Confident	6 Å²	6	46.9 Å²	46.9	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	148	179.1	76.1	93.9	0	0	0	112.5	Y180 L201 F229 G230 I232 Y244	Y180-L199 CarbonylContact O-C 3.47Å; Y180-L199 WeakPolarHBondContact O-CA 3.49Å; L199-L201 HydrophobicContact CD1-CB 3.99Å; L199-F229 WeakPolarHBondContact O-CA 3.41Å; L199-G230 PolarHBondContact N-O 2.86Å; L199-G230 PolarHBondContact O-N 2.85Å; L199-I232 HydrophobicContact CD2-CB 3.71Å; L199-I232 HydrophobicContact CD2-CD1 4.27Å; L199-I232 HydrophobicContact CD2-CG2 3.83Å; L199-Y244 HydrophobicContact CD1-CE2 3.84Å; L199-Y244 HydrophobicContact CD2-CD2 3.85Å; L199-Y244 HydrophobicContact CD2-CE2 3.61Å; L199-Y244 HydrophobicContact CG-CD2 4.48Å; L199-Y244 HydrophobicContact CG-CE2 3.75Å
200	K	93.5	Very high	85.4	Confident	75 Å²	75	48.9 Å²	48.9	33%	0.326	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123	165.3	166.8	-173.1	-168.3	-179.7	0	108.1	I179 Y180 F229	I179-K200 WeakPolarHBondContact CA-O 2.88Å; Y180-K200 HydrophobicContact CD2-CD 4.23Å; Y180-K200 HydrophobicContact CD2-CG 4.46Å; Y180-K200 PolarHBondContact N-O 2.71Å; Y180-K200 PolarHBondContact O-N 2.92Å; K200-F229 HydrophobicContact CB-CD1 3.63Å; K200-F229 HydrophobicContact CB-CE1 3.89Å; K200-F229 HydrophobicContact CD-CD1 3.97Å; K200-F229 HydrophobicContact CD-CE1 3.29Å; K200-F229 HydrophobicContact CD-CZ 4.02Å; K200-F229 HydrophobicContact CG-CD1 3.56Å; K200-F229 HydrophobicContact CG-CE1 3.31Å; K200-F229 HydrophobicContact CG-CG 4.47Å; K200-F229 HydrophobicContact CG-CZ 4Å
201	L	94.4	Very high	86.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	134.2	178.4	172.8	71.9	0	0	0	109.2	C6 L9 V178 I179 L199 F226 T227 E228	C6-L201 VanDerWaalsContact CA-CD2 3.49Å; C6-L201 HydrophobicContact CB-CD2 3.84Å; L9-L201 HydrophobicContact CB-CD2 4.44Å; L9-L201 HydrophobicContact CD1-CD1 4.11Å; L9-L201 HydrophobicContact CD1-CD2 4.23Å; L9-L201 HydrophobicContact CD2-CD1 4.02Å; V178-L201 CarbonylContact O-C 3.57Å; V178-L201 WeakPolarHBondContact O-CA 3.42Å; I179-L201 HydrophobicContact CD1-CD1 4.45Å; I179-L201 HydrophobicContact CG1-CD1 3.59Å; L199-L201 HydrophobicContact CD1-CB 3.99Å; L201-F226 HydrophobicContact CD2-CE2 3.87Å; L201-F226 HydrophobicContact CG-CE2 4.46Å; L201-T227 CarbonylContact O-C 3.57Å; L201-T227 VanDerWaalsContact O-CA 3.24Å; L201-T227 WeakPolarHBondContact O-CA 3.28Å; L201-T227 WeakPolarHBondContact O-CG2 3.36Å; L201-E228 PolarHBondContact N-O 2.84Å; L201-E228 PolarHBondContact O-N 2.86Å
202	F	94.1	Very high	87.5	Confident	59 Å²	59	37.4 Å²	37.4	26%	0.259	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	134.5	170	172.6	-112.7	0	0	0	109.4	S177 V178 R204 T227	S177-F202 CarbonylContact C-O 3.51Å; S177-F202 WeakPolarHBondContact CA-O 3.49Å; V178-F202 HydrophobicContact CG2-CD1 4.47Å; V178-F202 PolarHBondContact N-O 2.9Å; V178-F202 PolarHBondContact O-N 2.81Å; F202-R204 HydrophobicContact CD1-CG 4.31Å; F202-R204 HydrophobicContact CE1-CG 3.39Å; F202-R204 VanDerWaalsContact CE1-NE 3.29Å; F202-R204 HydrophobicContact CZ-CG 3.57Å; F202-T227 WeakPolarHBondContact CD2-OG1 3.02Å
203	H	94.6	Very high	87.8	Confident	3 Å²	3	38.7 Å²	38.7	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	125.2	-179.2	176.4	70.8	0	0	0	111.8	L9 P15 T176 S177 G225 F226	L9-H203 HydrophobicContact CD1-CB 3.85Å; P15-H203 PolarHBondContact O-CE1 3.26Å; T176-H203 PolarHBondContact O-ND1 3.07Å; S177-H203 PolarHBondContact OG-ND1 2.91Å; H203-G225 CarbonylContact O-C 3.54Å; H203-G225 WeakPolarHBondContact O-CA 3.35Å; H203-F226 HydrophobicContact CB-CD1 4.07Å; H203-F226 HydrophobicContact CB-CD2 4.39Å; H203-F226 HydrophobicContact CB-CE1 3.63Å; H203-F226 HydrophobicContact CB-CE2 3.95Å; H203-F226 HydrophobicContact CB-CG 4.44Å; H203-F226 HydrophobicContact CB-CZ 3.55Å; H203-F226 AromaticContact CD2-CD1 3.83Å; H203-F226 AromaticContact CD2-CE1 3.25Å; H203-F226 WeakPolarHBondContact CD2-CE1 2.75Å; H203-F226 AromaticContact CD2-CZ 3.93Å; H203-F226 AromaticContact CG-CE1 3.66Å; H203-F226 AromaticContact CG-CZ 3.89Å; H203-F226 PolarHBondContact N-O 2.87Å; H203-F226 PolarHBondContact O-N 2.8Å
204	R	92.5	Very high	86.8	Confident	67 Å²	67	43.9 Å²	43.9	25%	0.253	21%	0.207	S	C	.	.			trans	-96.4	96	178.9	-65.9	-174.8	174.6	153	15.7	110.9	E172 A173 T176 F202 S206 L207 Q208	E172-R204 PolarHBondContact O-NH1 2.9Å; E172-R204 PolarHBondContact O-NH2 3.42Å; A173-R204 PolarHBondContact O-NH1 3.03Å; A173-R204 VanDerWaalsContact O-NH1 3.12Å; T176-R204 PolarHBondContact O-N 3.37Å; F202-R204 HydrophobicContact CD1-CG 4.31Å; F202-R204 HydrophobicContact CE1-CG 3.39Å; F202-R204 VanDerWaalsContact CE1-NE 3.29Å; F202-R204 HydrophobicContact CZ-CG 3.57Å; R204-S206 VanDerWaalsContact C-N 3.32Å; R204-S206 PolarHBondContact O-N 2.83Å; R204-L207 HydrophobicContact CB-CB 4.04Å; R204-L207 PolarHBondContact O-N 3.19Å; R204-Q208 WeakPolarHBondContact O-CB 3.32Å; R204-Q208 PolarHBondContact O-N 3.47Å; R204-Q208 VanDerWaalsContact O-N 3.07Å
205	R	88.1	Confident	85.5	Confident	59 Å²	59	45.3 Å²	45.3	22%	0.223	21%	0.214	C	C	.	.	H	α-helix	trans	-64.5	-33.2	177.5	-71.7	-170.3	-179.4	143	-2	113.7	G209 K223 S224	R205-G209 PolarHBondContact O-N 2.91Å; R205-K223 WeakPolarHBondContact CB-O 3.31Å; R205-S224 WeakPolarHBondContact CD-O 3.31Å; R205-S224 PolarHBondContact NH1-O 3.09Å
206	S	86.2	Confident	83.9	Confident	78 Å²	78	51.8 Å²	51.8	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-52.7	177	51.1	0	0	0	0	111.4	R204 Q208 G209 E210	R204-S206 VanDerWaalsContact C-N 3.32Å; R204-S206 PolarHBondContact O-N 2.83Å; S206-Q208 VanDerWaalsContact C-N 3.32Å; S206-Q208 PolarHBondContact O-N 2.96Å; S206-G209 WeakPolarHBondContact O-CA 3.39Å; S206-G209 PolarHBondContact O-N 2.77Å; S206-E210 PolarHBondContact O-N 3.39Å
207	L	85.9	Confident	82.2	Confident	44 Å²	44	58.8 Å²	58.8	23%	0.23	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-38.5	178.2	-173.8	61.6	0	0	0	112	T176 R204 G209 E210 C211	T176-L207 HydrophobicContact CG2-CD2 4.33Å; T176-L207 HydrophobicContact CG2-CG 4.18Å; R204-L207 HydrophobicContact CB-CB 4.04Å; R204-L207 PolarHBondContact O-N 3.19Å; L207-G209 VanDerWaalsContact C-N 3.32Å; L207-G209 PolarHBondContact O-N 3.45Å; L207-E210 PolarHBondContact O-N 3.25Å; L207-C211 PolarHBondContact O-N 3.12Å; L207-C211 VanDerWaalsContact O-N 3.09Å; L207-C211 PolarHBondContact O-SG 3.12Å
208	Q	88.3	Confident	80.3	Confident	5 Å²	5	61.1 Å²	61.1	2%	0.023	30%	0.297	C	S	.	.	H	α-helix	trans	-62.6	-39.1	172.2	-179.4	58.3	38.4	0	0	112.2	P15 N17 T176 R204 S206 E210 C211 N212	P15-Q208 HydrophobicContact CB-CG 4.47Å; P15-Q208 HydrophobicContact CG-CG 4.33Å; P15-Q208 WeakPolarHBondContact O-CG 3.36Å; N17-Q208 PolarHBondContact OD1-NE2 2.85Å; T176-Q208 HydrophobicContact CG2-CB 4.5Å; R204-Q208 WeakPolarHBondContact O-CB 3.32Å; R204-Q208 PolarHBondContact O-N 3.47Å; R204-Q208 VanDerWaalsContact O-N 3.07Å; S206-Q208 VanDerWaalsContact C-N 3.32Å; S206-Q208 PolarHBondContact O-N 2.96Å; Q208-E210 VanDerWaalsContact C-N 3.32Å; Q208-E210 PolarHBondContact O-N 2.88Å; Q208-C211 WeakPolarHBondContact O-CB 3.26Å; Q208-C211 PolarHBondContact O-N 3.18Å; Q208-N212 PolarHBondContact NE2-OD1 2.79Å; Q208-N212 PolarHBondContact O-N 2.97Å; Q208-N212 PolarHBondContact O-OD1 2.89Å
209	G	84.7	Confident	78.5	Confident	3 Å²	3	66.9 Å²	66.9	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-59.2	-42.7	174.1	0	0	0	0	0	112.2	R205 S206 L207 C211 N212 K213	R205-G209 PolarHBondContact O-N 2.91Å; S206-G209 WeakPolarHBondContact O-CA 3.39Å; S206-G209 PolarHBondContact O-N 2.77Å; L207-G209 VanDerWaalsContact C-N 3.32Å; L207-G209 PolarHBondContact O-N 3.45Å; G209-C211 VanDerWaalsContact C-N 3.34Å; G209-C211 PolarHBondContact O-N 3.5Å; G209-N212 PolarHBondContact O-N 3.47Å; G209-K213 WeakPolarHBondContact O-CG 3.48Å; G209-K213 PolarHBondContact O-N 3.04Å
210	E	82.8	Confident	76.7	Confident	96 Å²	96	69.2 Å²	69.2	45%	0.449	34%	0.341	S	S	.	.	H	α-helix	trans	-64.2	-36.2	174.8	-64.4	-53	129.3	0	0	112.8	S206 L207 Q208 N212 K213	S206-E210 PolarHBondContact O-N 3.39Å; L207-E210 PolarHBondContact O-N 3.25Å; Q208-E210 VanDerWaalsContact C-N 3.32Å; Q208-E210 PolarHBondContact O-N 2.88Å; E210-N212 VanDerWaalsContact C-N 3.34Å; E210-K213 WeakPolarHBondContact OE1-CE 3.21Å; E210-K213 IonicContact OE1-NZ 3.13Å; E210-K213 PolarHBondContact OE1-NZ 2.67Å; E210-K213 IonicContact OE2-NZ 2.71Å
211	C	82.3	Confident	75	Confident	3 Å²	3	70.6 Å²	70.6	2%	0.02	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-42.7	173.3	-61.1	0	0	0	0	111.2	N17 L138 L207 Q208 G209 R214	N17-C211 HydrophobicContact CB-CB 4.46Å; L138-C211 HydrophobicContact CD2-CB 3.79Å; L207-C211 PolarHBondContact O-N 3.12Å; L207-C211 VanDerWaalsContact O-N 3.09Å; L207-C211 PolarHBondContact O-SG 3.12Å; Q208-C211 WeakPolarHBondContact O-CB 3.26Å; Q208-C211 PolarHBondContact O-N 3.18Å; G209-C211 VanDerWaalsContact C-N 3.34Å; G209-C211 PolarHBondContact O-N 3.5Å; C211-R214 PolarHBondContact O-N 3.12Å
212	N	78.8	Confident	73.5	Confident	36 Å²	36	77.8 Å²	77.8	19%	0.193	39%	0.385	C	S	.	.	H	α-helix	trans	-68.3	-39.2	-179.7	-67.2	-9.4	0	0	0	112.5	Q208 G209 E210 R214 M215 E216	Q208-N212 PolarHBondContact NE2-OD1 2.79Å; Q208-N212 PolarHBondContact O-N 2.97Å; Q208-N212 PolarHBondContact O-OD1 2.89Å; G209-N212 PolarHBondContact O-N 3.47Å; E210-N212 VanDerWaalsContact C-N 3.34Å; N212-R214 PolarHBondContact O-N 2.84Å; N212-M215 PolarHBondContact O-N 2.97Å; N212-E216 PolarHBondContact O-N 2.68Å
213	K	71.9	Confident	72.5	Confident	77 Å²	77	81.2 Å²	81.2	34%	0.335	40%	0.4	S	S	.	.	H	α-helix	trans	-56.1	-34.4	176.5	-76.6	176	-179.4	175.6	0	112.9	G209 E210 M215 E216 S218	G209-K213 WeakPolarHBondContact O-CG 3.48Å; G209-K213 PolarHBondContact O-N 3.04Å; E210-K213 WeakPolarHBondContact OE1-CE 3.21Å; E210-K213 IonicContact OE1-NZ 3.13Å; E210-K213 PolarHBondContact OE1-NZ 2.67Å; E210-K213 IonicContact OE2-NZ 2.71Å; K213-M215 VanDerWaalsContact C-N 3.29Å; K213-E216 CarbonylContact C-O 3.59Å; K213-E216 WeakPolarHBondContact CA-O 3.14Å; K213-E216 VanDerWaalsContact O-O 3.09Å; K213-S218 WeakPolarHBondContact CG-O 3.35Å
214	R	63.6	Low	71.9	Confident	185 Å²	185	85.6 Å²	85.6	70%	0.698	43%	0.431	S	S	*	.	H	α-helix	trans	-72.2	-22.1	176.7	-71.1	-174.3	177.4	-169.6	0.3	113.1	C211 N212	C211-R214 PolarHBondContact O-N 3.12Å; N212-R214 PolarHBondContact O-N 2.84Å
215	M	61.4	Low	71.6	Confident	87 Å²	87	84 Å²	84	43%	0.429	44%	0.436	S	S	.	.	H	α-helix	trans	-91.6	-38.1	-179.6	-60.4	-171.8	98.9	0	0	111.9	N212 K213	N212-M215 PolarHBondContact O-N 2.97Å; K213-M215 VanDerWaalsContact C-N 3.29Å
216	E	55	Low	71.7	Confident	144 Å²	144	82.3 Å²	82.3	67%	0.673	43%	0.431	S	S	*	.	S	Bend	trans	-150.1	151.3	177.4	-64.3	179.4	170.2	0	0	109.4	N212 K213 S218	N212-E216 PolarHBondContact O-N 2.68Å; K213-E216 CarbonylContact C-O 3.59Å; K213-E216 WeakPolarHBondContact CA-O 3.14Å; K213-E216 VanDerWaalsContact O-O 3.09Å; E216-S218 PolarHBondContact O-N 3.27Å
217	N	52.5	Low	72	Confident	176 Å²	176	81.9 Å²	81.9	94%	0.941	42%	0.424	S	S	*	.			trans	-64.4	53.1	177.3	-73.7	-10.2	0	0	0	113.3
218	S	51.5	Low	72.2	Confident	53 Å²	53	80.8 Å²	80.8	37%	0.371	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-88.8	142.7	-176.8	-75	0	0	0	0	111.8	K213 E216	K213-S218 WeakPolarHBondContact CG-O 3.35Å; E216-S218 PolarHBondContact O-N 3.27Å
219	I	53.8	Low	72.4	Confident	148 Å²	148	83.7 Å²	83.7	76%	0.759	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-61.9	144.7	-177.2	-58.9	161.8	0	0	0	110.9	F221	I219-F221 PolarHBondContact O-N 3.31Å
220	S	55.1	Low	72.8	Confident	56 Å²	56	83.6 Å²	83.6	39%	0.392	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-50.6	128.5	176.1	38.7	0	0	0	0	112.6	N222	S220-N222 PolarHBondContact O-N 3.2Å
221	F	57.3	Low	73.2	Confident	104 Å²	104	80.7 Å²	80.7	46%	0.456	42%	0.419	S	S	.	.			trans	-85.3	89.2	167.1	-80.5	-83.1	0	0	0	109.5	I219 K223	I219-F221 PolarHBondContact O-N 3.31Å; F221-K223 PolarHBondContact O-N 2.74Å
222	N	62.2	Low	73.7	Confident	150 Å²	150	80.6 Å²	80.6	80%	0.802	42%	0.418	S	S	*	.			trans	-73.6	15.9	174	-71.5	-7.8	0	0	0	113.9	S220	S220-N222 PolarHBondContact O-N 3.2Å
223	K	74.2	Confident	74.3	Confident	131 Å²	131	80.4 Å²	80.4	57%	0.57	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-77.1	134.9	177.7	-71.4	-178	-179.5	172.3	0	109.3	R205 F221	R205-K223 WeakPolarHBondContact CB-O 3.31Å; F221-K223 PolarHBondContact O-N 2.74Å
224	S	81	Confident	75.3	Confident	95 Å²	95	76.8 Å²	76.8	66%	0.664	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-55.5	144.4	168.2	50.9	0	0	0	0	110.6	R205	R205-S224 WeakPolarHBondContact CD-O 3.31Å; R205-S224 PolarHBondContact NH1-O 3.09Å
225	G	86.4	Confident	76.7	Confident	35 Å²	35	69.7 Å²	69.7	36%	0.361	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-58	171	166.7	0	0	0	0	0	111.3	H203	H203-G225 CarbonylContact O-C 3.54Å; H203-G225 WeakPolarHBondContact O-CA 3.35Å
226	F	90.9	Very high	77.9	Confident	23 Å²	23	66.8 Å²	66.8	10%	0.101	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.5	177.1	66.1	-95.3	0	0	0	110.9	H5 L9 I14 L201 H203 E228	H5-F226 HydrophobicContact CB-CD2 3.94Å; H5-F226 HydrophobicContact CB-CE1 4.22Å; H5-F226 HydrophobicContact CB-CE2 3.39Å; H5-F226 HydrophobicContact CB-CZ 3.55Å; L9-F226 HydrophobicContact CD1-CZ 4.03Å; I14-F226 HydrophobicContact CD1-CE1 4.1Å; I14-F226 HydrophobicContact CD1-CZ 3.92Å; L201-F226 HydrophobicContact CD2-CE2 3.87Å; L201-F226 HydrophobicContact CG-CE2 4.46Å; H203-F226 HydrophobicContact CB-CD1 4.07Å; H203-F226 HydrophobicContact CB-CD2 4.39Å; H203-F226 HydrophobicContact CB-CE1 3.63Å; H203-F226 HydrophobicContact CB-CE2 3.95Å; H203-F226 HydrophobicContact CB-CG 4.44Å; H203-F226 HydrophobicContact CB-CZ 3.55Å; H203-F226 AromaticContact CD2-CD1 3.83Å; H203-F226 AromaticContact CD2-CE1 3.25Å; H203-F226 WeakPolarHBondContact CD2-CE1 2.75Å; H203-F226 AromaticContact CD2-CZ 3.93Å; H203-F226 AromaticContact CG-CE1 3.66Å; H203-F226 AromaticContact CG-CZ 3.89Å; H203-F226 PolarHBondContact N-O 2.87Å; H203-F226 PolarHBondContact O-N 2.8Å; F226-E228 HydrophobicContact CD2-CG 4.15Å
227	T	91.5	Very high	79.5	Confident	68 Å²	68	69.6 Å²	69.6	42%	0.417	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.8	173.8	-45.7	0	0	0	0	108.1	L201 F202 F229	L201-T227 CarbonylContact O-C 3.57Å; L201-T227 VanDerWaalsContact O-CA 3.24Å; L201-T227 WeakPolarHBondContact O-CA 3.28Å; L201-T227 WeakPolarHBondContact O-CG2 3.36Å; F202-T227 WeakPolarHBondContact CD2-OG1 3.02Å; T227-F229 HydrophobicContact CG2-CD2 4.14Å; T227-F229 HydrophobicContact CG2-CE2 3.33Å; T227-F229 HydrophobicContact CG2-CZ 3.56Å
228	E	91.4	Very high	81.2	Confident	21 Å²	21	63.4 Å²	63.4	10%	0.098	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	142.9	174	-69.7	-169.5	171.5	0	0	110.1	H5 C6 L201 F226 Y244	H5-E228 WeakPolarHBondContact CB-OE1 2.82Å; H5-E228 IonicContact CD2-OE1 3.4Å; H5-E228 PolarHBondContact CD2-OE1 3.22Å; H5-E228 IonicContact CG-OE1 3.2Å; H5-E228 PolarHBondContact N-OE1 2.86Å; H5-E228 PolarHBondContact N-OE2 2.87Å; C6-E228 VanDerWaalsContact CB-OE2 3.29Å; C6-E228 WeakPolarHBondContact CB-OE2 3.33Å; C6-E228 PolarHBondContact N-OE2 2.83Å; L201-E228 PolarHBondContact N-O 2.84Å; L201-E228 PolarHBondContact O-N 2.86Å; F226-E228 HydrophobicContact CD2-CG 4.15Å; E228-Y244 WeakPolarHBondContact OE2-CE1 3.4Å
229	F	92	Very high	83.1	Confident	67 Å²	67	61.9 Å²	61.9	29%	0.294	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136.2	176.1	-55.2	-105	0	0	0	108.1	L199 K200 T227 Y244 T246 N247	L199-F229 WeakPolarHBondContact O-CA 3.41Å; K200-F229 HydrophobicContact CB-CD1 3.63Å; K200-F229 HydrophobicContact CB-CE1 3.89Å; K200-F229 HydrophobicContact CD-CD1 3.97Å; K200-F229 HydrophobicContact CD-CE1 3.29Å; K200-F229 HydrophobicContact CD-CZ 4.02Å; K200-F229 HydrophobicContact CG-CD1 3.56Å; K200-F229 HydrophobicContact CG-CE1 3.31Å; K200-F229 HydrophobicContact CG-CG 4.47Å; K200-F229 HydrophobicContact CG-CZ 4Å; T227-F229 HydrophobicContact CG2-CD2 4.14Å; T227-F229 HydrophobicContact CG2-CE2 3.33Å; T227-F229 HydrophobicContact CG2-CZ 3.56Å; F229-Y244 VanDerWaalsContact C-OH 3.29Å; F229-T246 WeakPolarHBondContact O-CA 3.45Å; F229-N247 PolarHBondContact O-N 3.33Å
230	G	92.2	Very high	84.9	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.01	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-177.7	-171	-176.2	0	0	0	0	0	113.6	S198 L199 Y244 S245	S198-G230 WeakPolarHBondContact CA-O 3.3Å; L199-G230 PolarHBondContact N-O 2.86Å; L199-G230 PolarHBondContact O-N 2.85Å; G230-Y244 PolarHBondContact N-OH 2.86Å; G230-S245 CarbonylContact C-O 3.58Å; G230-S245 WeakPolarHBondContact CA-O 3.36Å
231	T	92.1	Very high	86.8	Confident	35 Å²	35	56.3 Å²	56.3	22%	0.215	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	132.4	178	54	0	0	0	0	109.7	Q197 Y244 S245	Q197-T231 CarbonylContact O-C 3.54Å; Q197-T231 WeakPolarHBondContact O-CA 3.3Å; T231-Y244 WeakPolarHBondContact O-CA 3.34Å; T231-Y244 WeakPolarHBondContact O-CD2 3.41Å; T231-S245 PolarHBondContact N-O 3.48Å; T231-S245 PolarHBondContact O-N 2.78Å
232	I	92.8	Very high	88.4	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	132.1	174.6	-168.2	156.3	0	0	0	109.4	L7 L10 L35 C196 Q197 L199 L234 I241 Y244	L7-I232 HydrophobicContact CD2-CD1 4.45Å; L10-I232 HydrophobicContact CD1-CD1 3.83Å; L35-I232 HydrophobicContact CD1-CD1 3.68Å; L35-I232 HydrophobicContact CD1-CG2 4.48Å; L35-I232 HydrophobicContact CD2-CG2 4.41Å; C196-I232 CarbonylContact C-O 3.58Å; C196-I232 WeakPolarHBondContact CA-O 3.39Å; Q197-I232 HydrophobicContact CB-CG2 3.88Å; Q197-I232 PolarHBondContact N-O 3.12Å; Q197-I232 WeakPolarHBondContact O-CG2 3.49Å; Q197-I232 PolarHBondContact O-N 3.38Å; L199-I232 HydrophobicContact CD2-CB 3.71Å; L199-I232 HydrophobicContact CD2-CD1 4.27Å; L199-I232 HydrophobicContact CD2-CG2 3.83Å; I232-L234 HydrophobicContact CD1-CD2 4.18Å; I232-L234 HydrophobicContact CG1-CD2 3.84Å; I232-L234 HydrophobicContact CG1-CG 4.46Å; I232-L234 HydrophobicContact CG2-CD1 4.5Å; I232-L234 HydrophobicContact CG2-CD2 4.39Å; I232-L234 HydrophobicContact CG2-CG 4.35Å; I232-I241 HydrophobicContact CD1-CB 4.5Å; I232-I241 HydrophobicContact CD1-CD1 4.27Å; I232-I241 HydrophobicContact CD1-CG1 4.25Å; I232-I241 HydrophobicContact CD1-CG2 3.53Å; I232-I241 HydrophobicContact CG1-CG2 3.8Å; I232-Y244 HydrophobicContact CB-CD2 4.39Å
233	E	92.5	Very high	89.8	Confident	33 Å²	33	52.6 Å²	52.6	15%	0.154	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129.4	173	-66.2	-168.3	-157.6	0	0	109.4	I195 L242 K243	I195-E233 WeakPolarHBondContact O-CA 3.44Å; E233-L242 HydrophobicContact CB-CB 4.32Å; E233-L242 WeakPolarHBondContact O-CB 3.36Å; E233-L242 PolarHBondContact O-N 3.3Å; E233-K243 HydrophobicContact CB-CG 4.03Å; E233-K243 VanDerWaalsContact CD-NZ 3.28Å; E233-K243 HydrophobicContact CG-CG 4.23Å; E233-K243 PolarHBondContact N-O 2.75Å; E233-K243 WeakPolarHBondContact OE1-CE 3.06Å; E233-K243 IonicContact OE1-NZ 2.78Å; E233-K243 PolarHBondContact OE1-NZ 3.2Å; E233-K243 WeakPolarHBondContact OE2-CE 3.5Å; E233-K243 IonicContact OE2-NZ 2.74Å; E233-K243 PolarHBondContact OE2-NZ 3.19Å
234	L	92.8	Very high	90.6	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	142.9	-174.3	-53.4	170.6	0	0	0	109.9	W34 L35 C38 Q194 I195 I232 K240 I241	W34-L234 HydrophobicContact CB-CD1 4Å; L35-L234 HydrophobicContact CB-CD1 3.91Å; L35-L234 HydrophobicContact CD1-CD2 4.03Å; C38-L234 HydrophobicContact CB-CD2 4.27Å; Q194-L234 VanDerWaalsContact CA-O 3.22Å; Q194-L234 WeakPolarHBondContact CA-O 3.46Å; I195-L234 HydrophobicContact CD1-CB 4.16Å; I195-L234 HydrophobicContact CD1-CD1 3.94Å; I195-L234 HydrophobicContact CG1-CB 3.77Å; I195-L234 HydrophobicContact CG1-CD1 4.21Å; I195-L234 HydrophobicContact CG1-CG 4.41Å; I195-L234 PolarHBondContact N-O 2.85Å; I195-L234 PolarHBondContact O-N 3.1Å; I232-L234 HydrophobicContact CD1-CD2 4.18Å; I232-L234 HydrophobicContact CG1-CD2 3.84Å; I232-L234 HydrophobicContact CG1-CG 4.46Å; I232-L234 HydrophobicContact CG2-CD1 4.5Å; I232-L234 HydrophobicContact CG2-CD2 4.39Å; I232-L234 HydrophobicContact CG2-CG 4.35Å; L234-K240 WeakPolarHBondContact CA-O 3.4Å; L234-I241 HydrophobicContact CD2-CB 4.28Å; L234-I241 HydrophobicContact CD2-CG1 3.74Å; L234-I241 HydrophobicContact CD2-CG2 4.5Å
235	D	91.4	Very high	91.1	Very high	36 Å²	36	44.1 Å²	44.1	19%	0.193	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	113.1	165.4	-171.2	-41.3	0	0	0	109.2	N193 R237 A238 L239 K240 L242	N193-D235 CarbonylContact O-C 3.55Å; N193-D235 WeakPolarHBondContact O-CA 3.29Å; D235-R237 VanDerWaalsContact C-N 3.31Å; D235-R237 PolarHBondContact O-N 2.79Å; D235-R237 WeakPolarHBondContact OD1-CA 3.17Å; D235-R237 PolarHBondContact OD1-N 2.79Å; D235-A238 HydrophobicContact CB-CB 4.13Å; D235-A238 PolarHBondContact OD1-N 2.86Å; D235-L239 WeakPolarHBondContact O-CA 3.37Å; D235-L239 PolarHBondContact O-N 3.12Å; D235-K240 PolarHBondContact N-O 2.9Å; D235-K240 PolarHBondContact O-N 3.01Å; D235-L242 HydrophobicContact CB-CD1 4.2Å; D235-L242 HydrophobicContact CB-CD2 4.15Å; D235-L242 HydrophobicContact CB-CG 4.25Å
236	T	87.3	Confident	91.1	Very high	26 Å²	26	44.7 Å²	44.7	16%	0.16	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-20.5	-176.6	62.2	0	0	0	0	113.2	W34 N193 I195 L239	W34-T236 HydrophobicContact CD2-CG2 3.67Å; W34-T236 HydrophobicContact CE3-CG2 3.8Å; W34-T236 HydrophobicContact CG-CG2 4.15Å; W34-T236 HydrophobicContact CH2-CG2 4.3Å; W34-T236 HydrophobicContact CZ2-CG2 4.17Å; W34-T236 HydrophobicContact CZ3-CG2 4.12Å; N193-T236 WeakPolarHBondContact CB-OG1 3.5Å; N193-T236 PolarHBondContact O-N 3.37Å; N193-T236 PolarHBondContact O-OG1 3.14Å; N193-T236 VanDerWaalsContact O-OG1 3.06Å; I195-T236 HydrophobicContact CB-CG2 4.38Å; I195-T236 HydrophobicContact CD1-CG2 3.51Å; I195-T236 HydrophobicContact CG1-CG2 3.75Å; I195-T236 HydrophobicContact CG2-CG2 3.77Å; T236-L239 WeakPolarHBondContact O-CD2 3.28Å
237	R	88.2	Confident	90.6	Very high	204 Å²	204	48 Å²	48	77%	0.77	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-45.1	178.7	-176.6	176.9	-179.1	170.6	1.6	111.3	N193 D235 L239	N193-R237 HydrophobicContact CB-CB 3.86Å; D235-R237 VanDerWaalsContact C-N 3.31Å; D235-R237 PolarHBondContact O-N 2.79Å; D235-R237 WeakPolarHBondContact OD1-CA 3.17Å; D235-R237 PolarHBondContact OD1-N 2.79Å; R237-L239 VanDerWaalsContact C-N 3.3Å
238	A	89.4	Confident	89.3	Confident	45 Å²	45	52.6 Å²	52.6	37%	0.372	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-14	176.8	0	0	0	0	0	112.7	N41 D235 K240	N41-A238 PolarHBondContact ND2-O 2.91Å; D235-A238 HydrophobicContact CB-CB 4.13Å; D235-A238 PolarHBondContact OD1-N 2.86Å; A238-K240 VanDerWaalsContact C-N 3.31Å; A238-K240 HydrophobicContact CB-CB 4.43Å; A238-K240 HydrophobicContact CB-CG 3.98Å; A238-K240 WeakPolarHBondContact O-CG 3.24Å; A238-K240 PolarHBondContact O-N 2.5Å
239	L	90.9	Very high	87.1	Confident	21 Å²	21	58 Å²	58	11%	0.11	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	48.4	-173.2	-58.7	172	0	0	0	111.4	W34 K37 C38 N41 L62 D235 T236 R237	W34-L239 HydrophobicContact CE3-CD2 4.19Å; W34-L239 HydrophobicContact CZ3-CD2 4.17Å; K37-L239 HydrophobicContact CB-CD2 4.11Å; C38-L239 WeakPolarHBondContact CA-O 3.21Å; N41-L239 HydrophobicContact CB-CB 3.99Å; N41-L239 WeakPolarHBondContact CB-O 3.34Å; N41-L239 PolarHBondContact ND2-O 2.78Å; L62-L239 HydrophobicContact CD1-CD1 4.48Å; L62-L239 HydrophobicContact CD2-CD1 3.95Å; L62-L239 HydrophobicContact CG-CD1 4.07Å; D235-L239 WeakPolarHBondContact O-CA 3.37Å; D235-L239 PolarHBondContact O-N 3.12Å; T236-L239 WeakPolarHBondContact O-CD2 3.28Å; R237-L239 VanDerWaalsContact C-N 3.3Å
240	K	92.3	Very high	84.9	Confident	73 Å²	73	62 Å²	62	32%	0.317	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.5	-176.9	-63.9	-155.9	173.1	-119.2	0	112	E42 E45 L234 D235 A238	E42-K240 WeakPolarHBondContact OE1-CB 3.47Å; E42-K240 WeakPolarHBondContact OE1-CD 3.24Å; E42-K240 WeakPolarHBondContact OE1-CG 3.34Å; E42-K240 IonicContact OE1-NZ 3.84Å; E45-K240 IonicContact OE1-NZ 2.74Å; E45-K240 PolarHBondContact OE1-NZ 3.04Å; E45-K240 IonicContact OE2-NZ 3.66Å; L234-K240 WeakPolarHBondContact CA-O 3.4Å; D235-K240 PolarHBondContact N-O 2.9Å; D235-K240 PolarHBondContact O-N 3.01Å; A238-K240 VanDerWaalsContact C-N 3.31Å; A238-K240 HydrophobicContact CB-CB 4.43Å; A238-K240 HydrophobicContact CB-CG 3.98Å; A238-K240 WeakPolarHBondContact O-CG 3.24Å; A238-K240 PolarHBondContact O-N 2.5Å
241	I	93.2	Very high	82.6	Confident	14 Å²	14	66.9 Å²	66.9	7%	0.072	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	116.5	170.8	-61.3	169.9	0	0	0	107.8	L7 L10 F11 L35 C38 I232 L234	L7-I241 HydrophobicContact CD2-CG2 3.61Å; L10-I241 HydrophobicContact CD1-CD1 4.18Å; F11-I241 HydrophobicContact CE1-CB 4.46Å; F11-I241 HydrophobicContact CE1-CD1 4.15Å; F11-I241 HydrophobicContact CZ-CB 3.96Å; F11-I241 HydrophobicContact CZ-CD1 4.29Å; F11-I241 HydrophobicContact CZ-CG2 4.2Å; L35-I241 HydrophobicContact CD1-CD1 4.15Å; L35-I241 HydrophobicContact CD1-CG1 4.39Å; C38-I241 HydrophobicContact CB-CG1 4.03Å; I232-I241 HydrophobicContact CD1-CB 4.5Å; I232-I241 HydrophobicContact CD1-CD1 4.27Å; I232-I241 HydrophobicContact CD1-CG1 4.25Å; I232-I241 HydrophobicContact CD1-CG2 3.53Å; I232-I241 HydrophobicContact CG1-CG2 3.8Å; L234-I241 HydrophobicContact CD2-CB 4.28Å; L234-I241 HydrophobicContact CD2-CG1 3.74Å; L234-I241 HydrophobicContact CD2-CG2 4.5Å
242	L	91.5	Very high	80.2	Confident	79 Å²	79	72.9 Å²	72.9	41%	0.414	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-55.1	-174.9	-60.9	178.2	0	0	0	111.6	Q194 E233 D235	Q194-L242 HydrophobicContact CG-CD1 3.91Å; E233-L242 HydrophobicContact CB-CB 4.32Å; E233-L242 WeakPolarHBondContact O-CB 3.36Å; E233-L242 PolarHBondContact O-N 3.3Å; D235-L242 HydrophobicContact CB-CD1 4.2Å; D235-L242 HydrophobicContact CB-CD2 4.15Å; D235-L242 HydrophobicContact CB-CG 4.25Å
243	K	91.2	Very high	77.3	Confident	98 Å²	98	77 Å²	77	43%	0.426	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	165.9	179	61.7	174.7	175.2	170.2	0	111.5	E233	E233-K243 HydrophobicContact CB-CG 4.03Å; E233-K243 VanDerWaalsContact CD-NZ 3.28Å; E233-K243 HydrophobicContact CG-CG 4.23Å; E233-K243 PolarHBondContact N-O 2.75Å; E233-K243 WeakPolarHBondContact OE1-CE 3.06Å; E233-K243 IonicContact OE1-NZ 2.78Å; E233-K243 PolarHBondContact OE1-NZ 3.2Å; E233-K243 WeakPolarHBondContact OE2-CE 3.5Å; E233-K243 IonicContact OE2-NZ 2.74Å; E233-K243 PolarHBondContact OE2-NZ 3.19Å
244	Y	92.1	Very high	74.8	Confident	2 Å²	2	83 Å²	83	1%	0.008	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	132.5	174.9	175.3	-112.8	0	0	0	109.9	Q4 C6 L199 E228 F229 G230 T231 I232 T246	Q4-Y244 HydrophobicContact CB-CD1 4.42Å; Q4-Y244 HydrophobicContact CG-CD1 4.43Å; Q4-Y244 PolarHBondContact NE2-O 3.49Å; C6-Y244 HydrophobicContact CB-CD1 3.73Å; C6-Y244 HydrophobicContact CB-CD2 4.38Å; C6-Y244 HydrophobicContact CB-CE1 3.41Å; C6-Y244 VanDerWaalsContact CB-CE1 3.41Å; C6-Y244 HydrophobicContact CB-CE2 4.15Å; C6-Y244 HydrophobicContact CB-CG 4.18Å; L199-Y244 HydrophobicContact CD1-CE2 3.84Å; L199-Y244 HydrophobicContact CD2-CD2 3.85Å; L199-Y244 HydrophobicContact CD2-CE2 3.61Å; L199-Y244 HydrophobicContact CG-CD2 4.48Å; L199-Y244 HydrophobicContact CG-CE2 3.75Å; E228-Y244 WeakPolarHBondContact OE2-CE1 3.4Å; F229-Y244 VanDerWaalsContact C-OH 3.29Å; G230-Y244 PolarHBondContact N-OH 2.86Å; T231-Y244 WeakPolarHBondContact O-CA 3.34Å; T231-Y244 WeakPolarHBondContact O-CD2 3.41Å; I232-Y244 HydrophobicContact CB-CD2 4.39Å; Y244-T246 HydrophobicContact CD1-CG2 4.16Å; Y244-T246 HydrophobicContact CE1-CG2 3.38Å
245	S	90.5	Very high	72.3	Confident	46 Å²	46	88.2 Å²	88.2	32%	0.322	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	119.5	177.1	-55.5	0	0	0	0	108.9	G230 T231	G230-S245 CarbonylContact C-O 3.58Å; G230-S245 WeakPolarHBondContact CA-O 3.36Å; T231-S245 PolarHBondContact N-O 3.48Å; T231-S245 PolarHBondContact O-N 2.78Å
246	T	87.6	Confident	69.7	Low	46 Å²	46	94.9 Å²	94.9	28%	0.282	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	134.2	174.8	48.7	0	0	0	0	110.4	F229 Y244 K248	F229-T246 WeakPolarHBondContact O-CA 3.45Å; Y244-T246 HydrophobicContact CD1-CG2 4.16Å; Y244-T246 HydrophobicContact CE1-CG2 3.38Å; T246-K248 PolarHBondContact O-N 3.26Å
247	N	80.8	Confident	67.5	Low	93 Å²	93	98.7 Å²	98.7	50%	0.497	52%	0.524	S	S	.	.			trans	-74.9	107	169.6	-69.4	-18	0	0	0	107.3	F229 N249	F229-N247 PolarHBondContact O-N 3.33Å; N247-N249 PolarHBondContact O-N 3.09Å
248	K	62.7	Low	65.7	Low	164 Å²	164	93.1 Å²	93.1	71%	0.713	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	15.8	-176.7	-74.4	-170.7	175	-176.9	0	115.3	T246	T246-K248 PolarHBondContact O-N 3.26Å
249	N	46.2	Very low	63.8	Low	134 Å²	134	96.7 Å²	96.7	72%	0.717	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	9.6	-162	-73	-1.1	0	0	0	116.8	N247	N247-N249 PolarHBondContact O-N 3.09Å
250	E	45	Very low	62	Low	151 Å²	151	102.3 Å²	102.3	71%	0.706	57%	0.566	S	S	*	*	S	Bend	trans	-132.5	2.6	175.4	-78.4	-168.6	163.2	0	0	116.2
251	S	44	Very low	60.3	Low	104 Å²	104	104.6 Å²	104.6	73%	0.727	59%	0.588	S	S	*	*	S	Bend	trans	-95.7	6.6	177.9	68.8	0	0	0	0	115.7
252	D	42.3	Very low	58.8	Low	162 Å²	162	113.6 Å²	113.6	87%	0.866	63%	0.627	S	S	*	*	S	Bend	trans	-157.2	-1.3	173.9	-97.1	-31.6	0	0	0	117.3	L254	D252-L254 PolarHBondContact O-N 2.85Å
253	S	32.7	Very low	57.7	Low	86 Å²	86	112.9 Å²	112.9	60%	0.601	63%	0.628	S	S	*	*			trans	-92.4	93.8	165.8	58.9	0	0	0	0	108.6
254	L	38.1	Very low	56.8	Low	160 Å²	160	114.8 Å²	114.8	84%	0.838	65%	0.648	S	S	*	*			trans	-41.5	126.9	151.1	-70.6	168.3	0	0	0	106.7	D252 M256	D252-L254 PolarHBondContact O-N 2.85Å; L254-M256 PolarHBondContact O-N 3.11Å
255	P	40.9	Very low	56	Low	109 Å²	109	122.1 Å²	122.1	71%	0.708	68%	0.68	S	S	*	*			trans	-50.1	125.9	177	17.1	-27.7	0	0	0	107.3	P257	P255-P257 VanDerWaalsContact O-N 3.13Å
256	M	38	Very low	55.2	Low	176 Å²	176	124.7 Å²	124.7	87%	0.867	69%	0.691	S	S	*	*			trans	-41.1	127.4	171.8	-81.6	-171.1	-74.6	0	0	107.1	L254 S258	L254-M256 PolarHBondContact O-N 3.11Å; M256-S258 VanDerWaalsContact C-N 3.31Å; M256-S258 PolarHBondContact O-N 3.07Å
257	P	40.9	Very low	54.7	Low	105 Å²	105	129.8 Å²	129.8	68%	0.682	72%	0.715	S	S	*	*			trans	-66	94.6	-161.7	25.6	-33.6	0	0	0	109.1	P255 L260	P255-P257 VanDerWaalsContact O-N 3.13Å; P257-L260 HydrophobicContact CB-CD1 4.47Å
258	S	50	Low	54.8	Low	87 Å²	87	130.2 Å²	130.2	61%	0.608	72%	0.721	S	S	*	*	S	Bend	trans	-51.7	125.5	138	56.6	0	0	0	0	104.4	M256 L260	M256-S258 VanDerWaalsContact C-N 3.31Å; M256-S258 PolarHBondContact O-N 3.07Å; S258-L260 PolarHBondContact O-N 2.95Å
259	P	49.1	Very low	55.5	Low	121 Å²	121	125.9 Å²	125.9	79%	0.786	71%	0.705	S	S	*	*			trans	-49.4	114.1	-171.4	17.7	-29.4	0	0	0	107.5	P261	P259-P261 VanDerWaalsContact O-N 3.16Å
260	L	53.3	Low	57.5	Low	139 Å²	139	122.3 Å²	122.3	73%	0.728	69%	0.688	S	S	*	*			trans	-46.8	129.9	-177.7	-95.4	73.4	0	0	0	106.3	P257 S258 K262	P257-L260 HydrophobicContact CB-CD1 4.47Å; S258-L260 PolarHBondContact O-N 2.95Å; L260-K262 PolarHBondContact O-N 3.49Å
261	P	57	Low	59.6	Low	121 Å²	121	121 Å²	121	79%	0.786	68%	0.682	S	S	*	*			trans	-51	120.6	172.8	21.2	-30.3	0	0	0	106.1	P259 S263	P259-P261 VanDerWaalsContact O-N 3.16Å; P261-S263 PolarHBondContact O-N 3.33Å
262	K	61.7	Low	61.7	Low	202 Å²	202	120 Å²	120	88%	0.878	68%	0.675	S	S	*	*			trans	-50.7	113.8	-177.8	-72.7	179.8	-179.2	180	0	106.3	L260 T264	L260-K262 PolarHBondContact O-N 3.49Å; K262-T264 PolarHBondContact O-N 3.37Å
263	S	67	Low	64	Low	64 Å²	64	116.3 Å²	116.3	45%	0.448	65%	0.652	S	S	.	*			trans	-45.9	131.1	174.2	168.2	0	0	0	0	108.5	P261 F265	P261-S263 PolarHBondContact O-N 3.33Å; S263-F265 WeakPolarHBondContact CB-O 3.19Å; S263-F265 PolarHBondContact O-N 3.19Å; S263-F265 WeakPolarHBondContact OG-CB 3.47Å; S263-F265 PolarHBondContact OG-N 3.26Å; S263-F265 VanDerWaalsContact OG-N 3.09Å; S263-F265 PolarHBondContact OG-O 2.9Å
264	T	73	Confident	66.7	Low	138 Å²	138	117 Å²	117	85%	0.847	65%	0.645	S	S	*	*	S	Bend	trans	-63.6	-22	171.5	48.9	0	0	0	0	111.3	K262	K262-T264 PolarHBondContact O-N 3.37Å
265	F	75.4	Confident	69.2	Low	156 Å²	156	113.8 Å²	113.8	68%	0.684	63%	0.627	S	S	*	*	S	Bend	trans	-83.9	119.6	169.3	-60.8	-82.4	0	0	0	109.3	S263 L267	S263-F265 WeakPolarHBondContact CB-O 3.19Å; S263-F265 PolarHBondContact O-N 3.19Å; S263-F265 WeakPolarHBondContact OG-CB 3.47Å; S263-F265 PolarHBondContact OG-N 3.26Å; S263-F265 VanDerWaalsContact OG-N 3.09Å; S263-F265 PolarHBondContact OG-O 2.9Å; F265-L267 HydrophobicContact CB-CD2 4.37Å; F265-L267 PolarHBondContact O-N 3.41Å
266	N	73.2	Confident	71.4	Confident	101 Å²	101	111.2 Å²	111.2	54%	0.54	62%	0.615	S	S	.	*			trans	-68.4	97.4	169.4	-175.3	17.1	0	0	0	108.9	T268	N266-T268 PolarHBondContact ND2-O 3Å; N266-T268 PolarHBondContact O-N 3.31Å; N266-T268 PolarHBondContact OD1-N 3.29Å; N266-T268 PolarHBondContact OD1-O 3.47Å; N266-T268 PolarHBondContact OD1-OG1 3.39Å
267	L	78	Confident	73.7	Confident	152 Å²	152	111.4 Å²	111.4	80%	0.796	61%	0.606	S	S	*	*			trans	-79.6	-6.8	176.6	-61.6	177.5	0	0	0	112.4	F265	F265-L267 HydrophobicContact CB-CD2 4.37Å; F265-L267 PolarHBondContact O-N 3.41Å
268	T	82	Confident	75.9	Confident	102 Å²	102	110.6 Å²	110.6	63%	0.626	60%	0.603	S	S	*	*	S	Bend	trans	-102	118.8	177.4	51.1	0	0	0	0	110.2	N266 T270	N266-T268 PolarHBondContact ND2-O 3Å; N266-T268 PolarHBondContact O-N 3.31Å; N266-T268 PolarHBondContact OD1-N 3.29Å; N266-T268 PolarHBondContact OD1-O 3.47Å; N266-T268 PolarHBondContact OD1-OG1 3.39Å; T268-T270 PolarHBondContact O-N 2.88Å
269	M	78.4	Confident	77.7	Confident	74 Å²	74	113.9 Å²	113.9	37%	0.365	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-70.5	126.5	170.2	-69.3	178	76.6	0	0	109.9	E273 K274 R277	M269-E273 WeakPolarHBondContact CA-OE2 3.41Å; M269-E273 HydrophobicContact CB-CB 4.23Å; M269-E273 VanDerWaalsContact CE-C 3.45Å; M269-E273 HydrophobicContact CE-CB 4.03Å; M269-E273 VanDerWaalsContact CE-O 3.24Å; M269-E273 WeakPolarHBondContact CE-O 3.25Å; M269-K274 HydrophobicContact CB-CG 3.83Å; M269-K274 HydrophobicContact CE-CG 4.19Å; M269-K274 HydrophobicContact SD-CG 4.44Å; M269-R277 HydrophobicContact CE-CB 3.71Å; M269-R277 HydrophobicContact CE-CG 4.27Å
270	T	86.5	Confident	79.5	Confident	59 Å²	59	112.8 Å²	112.8	36%	0.362	60%	0.598	S	S	.	*	P	Polyproline II helix	trans	-62	156.3	163.5	59.6	0	0	0	0	110.2	T268 S272 E273 K274	T268-T270 PolarHBondContact O-N 2.88Å; T270-S272 PolarHBondContact O-N 3.46Å; T270-S272 PolarHBondContact OG1-OG 3.45Å; T270-E273 PolarHBondContact N-OE2 2.7Å; T270-E273 PolarHBondContact O-N 3.28Å; T270-E273 WeakPolarHBondContact OG1-CB 3.38Å; T270-E273 WeakPolarHBondContact OG1-CG 3.27Å; T270-E273 PolarHBondContact OG1-N 3.32Å; T270-E273 PolarHBondContact OG1-OE2 2.74Å; T270-K274 PolarHBondContact O-N 3.16Å
271	E	89.3	Confident	81	Confident	123 Å²	123	109.9 Å²	109.9	58%	0.575	59%	0.586	S	S	*	*	H	α-helix	trans	-57.3	-36.3	175.4	-76.3	-58.9	135.7	0	0	112	E273 K274 I275	E271-E273 PolarHBondContact O-N 3.39Å; E271-K274 PolarHBondContact O-N 3.15Å; E271-K274 IonicContact OE1-NZ 3.63Å; E271-K274 PolarHBondContact OE1-NZ 3.21Å; E271-I275 WeakPolarHBondContact O-CD1 3.41Å; E271-I275 VanDerWaalsContact O-CG1 3.24Å; E271-I275 WeakPolarHBondContact O-CG1 3.43Å; E271-I275 PolarHBondContact O-N 2.79Å
272	S	89.3	Confident	82.3	Confident	83 Å²	83	108.3 Å²	108.3	58%	0.58	57%	0.57	S	S	*	*	H	α-helix	trans	-61.3	-39.7	172.6	40.8	0	0	0	0	113.3	T270 A276	T270-S272 PolarHBondContact O-N 3.46Å; T270-S272 PolarHBondContact OG1-OG 3.45Å; S272-A276 WeakPolarHBondContact O-CB 3.29Å; S272-A276 PolarHBondContact O-N 2.89Å
273	E	89.5	Confident	83.2	Confident	84 Å²	84	103.7 Å²	103.7	39%	0.393	56%	0.561	S	S	.	*	H	α-helix	trans	-71.5	-35.8	177.7	-75.1	161.4	158.4	0	0	111.8	M269 T270 E271 A276 R277	M269-E273 WeakPolarHBondContact CA-OE2 3.41Å; M269-E273 HydrophobicContact CB-CB 4.23Å; M269-E273 VanDerWaalsContact CE-C 3.45Å; M269-E273 HydrophobicContact CE-CB 4.03Å; M269-E273 VanDerWaalsContact CE-O 3.24Å; M269-E273 WeakPolarHBondContact CE-O 3.25Å; T270-E273 PolarHBondContact N-OE2 2.7Å; T270-E273 PolarHBondContact O-N 3.28Å; T270-E273 WeakPolarHBondContact OG1-CB 3.38Å; T270-E273 WeakPolarHBondContact OG1-CG 3.27Å; T270-E273 PolarHBondContact OG1-N 3.32Å; T270-E273 PolarHBondContact OG1-OE2 2.74Å; E271-E273 PolarHBondContact O-N 3.39Å; E273-A276 PolarHBondContact O-N 3.37Å; E273-R277 VanDerWaalsContact O-CB 3.32Å; E273-R277 WeakPolarHBondContact O-CB 3.42Å; E273-R277 PolarHBondContact O-N 2.9Å
274	K	89.3	Confident	83.7	Confident	102 Å²	102	105.8 Å²	105.8	44%	0.443	56%	0.563	S	S	.	*	H	α-helix	trans	-62.9	-45.3	174.3	-68.5	-178.8	-168.9	165.9	0	111.1	M269 T270 E271 R277 S278	M269-K274 HydrophobicContact CB-CG 3.83Å; M269-K274 HydrophobicContact CE-CG 4.19Å; M269-K274 HydrophobicContact SD-CG 4.44Å; T270-K274 PolarHBondContact O-N 3.16Å; E271-K274 PolarHBondContact O-N 3.15Å; E271-K274 IonicContact OE1-NZ 3.63Å; E271-K274 PolarHBondContact OE1-NZ 3.21Å; K274-R277 PolarHBondContact O-N 2.53Å; K274-S278 PolarHBondContact O-N 3.45Å
275	I	90.6	Very high	84	Confident	91 Å²	91	101.9 Å²	101.9	47%	0.467	54%	0.537	S	S	.	.	H	α-helix	trans	-62.2	-48.4	176.2	-67.9	166.1	0	0	0	109.9	E271 R277 S278 F279	E271-I275 WeakPolarHBondContact O-CD1 3.41Å; E271-I275 VanDerWaalsContact O-CG1 3.24Å; E271-I275 WeakPolarHBondContact O-CG1 3.43Å; E271-I275 PolarHBondContact O-N 2.79Å; I275-R277 PolarHBondContact O-N 3.15Å; I275-S278 PolarHBondContact O-N 3.12Å; I275-S278 VanDerWaalsContact O-N 3.13Å; I275-S278 PolarHBondContact O-OG 3.41Å; I275-F279 HydrophobicContact CG2-CD2 4.03Å; I275-F279 HydrophobicContact CG2-CE2 3.37Å; I275-F279 HydrophobicContact CG2-CZ 4.27Å; I275-F279 WeakPolarHBondContact O-CD2 3.46Å; I275-F279 PolarHBondContact O-N 2.77Å
276	A	87.6	Confident	84	Confident	56 Å²	56	96.7 Å²	96.7	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-58.6	-44.9	177.5	0	0	0	0	0	112.2	S272 E273 S278 F279 V280	S272-A276 WeakPolarHBondContact O-CB 3.29Å; S272-A276 PolarHBondContact O-N 2.89Å; E273-A276 PolarHBondContact O-N 3.37Å; A276-S278 VanDerWaalsContact C-N 3.28Å; A276-S278 PolarHBondContact O-N 3.21Å; A276-F279 PolarHBondContact O-N 3.01Å; A276-F279 VanDerWaalsContact O-N 3.08Å; A276-V280 PolarHBondContact O-N 2.92Å
277	R	87	Confident	83.9	Confident	179 Å²	179	96 Å²	96	68%	0.675	52%	0.522	S	S	*	.	H	α-helix	trans	-60.8	-35.9	176.9	-174.5	177.8	178.2	179.3	-0.7	112.3	M269 E273 K274 I275 F279 V280	M269-R277 HydrophobicContact CE-CB 3.71Å; M269-R277 HydrophobicContact CE-CG 4.27Å; E273-R277 VanDerWaalsContact O-CB 3.32Å; E273-R277 WeakPolarHBondContact O-CB 3.42Å; E273-R277 PolarHBondContact O-N 2.9Å; K274-R277 PolarHBondContact O-N 2.53Å; I275-R277 PolarHBondContact O-N 3.15Å; R277-F279 PolarHBondContact O-N 3.5Å; R277-V280 PolarHBondContact O-N 2.85Å
278	S	86.3	Confident	83.4	Confident	89 Å²	89	97.1 Å²	97.1	62%	0.622	52%	0.516	S	S	*	.	H	α-helix	trans	-67.5	-18	177.3	73.5	0	0	0	0	114.1	K274 I275 A276	K274-S278 PolarHBondContact O-N 3.45Å; I275-S278 PolarHBondContact O-N 3.12Å; I275-S278 VanDerWaalsContact O-N 3.13Å; I275-S278 PolarHBondContact O-OG 3.41Å; A276-S278 VanDerWaalsContact C-N 3.28Å; A276-S278 PolarHBondContact O-N 3.21Å
279	F	88.5	Confident	82.6	Confident	156 Å²	156	97.2 Å²	97.2	68%	0.684	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-6.4	175.8	-62.9	-59.2	0	0	0	113.7	I275 A276 R277 V281	I275-F279 HydrophobicContact CG2-CD2 4.03Å; I275-F279 HydrophobicContact CG2-CE2 3.37Å; I275-F279 HydrophobicContact CG2-CZ 4.27Å; I275-F279 WeakPolarHBondContact O-CD2 3.46Å; I275-F279 PolarHBondContact O-N 2.77Å; A276-F279 PolarHBondContact O-N 3.01Å; A276-F279 VanDerWaalsContact O-N 3.08Å; R277-F279 PolarHBondContact O-N 3.5Å; F279-V281 PolarHBondContact O-N 3.37Å
280	V	86.7	Confident	81.9	Confident	97 Å²	97	97 Å²	97	59%	0.588	52%	0.518	S	S	*	.			trans	-73.2	104.7	177.1	178.8	0	0	0	0	108.2	A276 R277 L282	A276-V280 PolarHBondContact O-N 2.92Å; R277-V280 PolarHBondContact O-N 2.85Å; V280-L282 PolarHBondContact O-N 3.1Å
281	V	84.9	Confident	80.5	Confident	79 Å²	79	99.9 Å²	99.9	48%	0.479	53%	0.531	S	S	.	.			trans	-69.3	123.2	169.9	-178.7	0	0	0	0	107.8	F279 D285 A286 L289	F279-V281 PolarHBondContact O-N 3.37Å; V281-D285 HydrophobicContact CG1-CB 3.79Å; V281-A286 HydrophobicContact CG1-CB 4.11Å; V281-L289 HydrophobicContact CG1-CD1 4.02Å
282	L	84.6	Confident	78.8	Confident	87 Å²	87	99.4 Å²	99.4	46%	0.455	54%	0.537	S	S	.	.			trans	-66.6	147.2	176.7	-63.8	176.8	0	0	0	109.5	V280 H284 D285 A286	V280-L282 PolarHBondContact O-N 3.1Å; L282-H284 PolarHBondContact O-N 2.81Å; L282-D285 PolarHBondContact O-N 3.24Å; L282-A286 PolarHBondContact O-N 3.33Å; L282-A286 VanDerWaalsContact O-N 3.12Å
283	P	80.8	Confident	77	Confident	106 Å²	106	100.4 Å²	100.4	69%	0.688	54%	0.539	S	S	*	.	H	α-helix	trans	-52.9	-34.3	-176.3	-29.5	35.5	0	0	0	114.7
284	H	76.8	Confident	74.9	Confident	107 Å²	107	103.7 Å²	103.7	50%	0.495	55%	0.554	S	S	.	*	H	α-helix	trans	-74.3	-31.2	178.2	61	-98.4	0	0	0	113.3	L282 A286 V287 R288	L282-H284 PolarHBondContact O-N 2.81Å; H284-A286 VanDerWaalsContact C-N 3.35Å; H284-V287 PolarHBondContact O-N 2.88Å; H284-R288 PolarHBondContact O-N 3.38Å
285	D	78.3	Confident	72.8	Confident	56 Å²	56	109.3 Å²	109.3	30%	0.299	58%	0.579	S	S	.	*	H	α-helix	trans	-71.9	-33.2	174.6	-68.7	-34.2	0	0	0	111.3	V281 L282 V287 R288 L289	V281-D285 HydrophobicContact CG1-CB 3.79Å; L282-D285 PolarHBondContact O-N 3.24Å; D285-V287 VanDerWaalsContact C-N 3.3Å; D285-V287 PolarHBondContact O-N 3.06Å; D285-R288 PolarHBondContact O-N 3.44Å; D285-L289 WeakPolarHBondContact O-CB 3.36Å; D285-L289 WeakPolarHBondContact O-CG 3.4Å; D285-L289 PolarHBondContact O-N 2.98Å
286	A	76	Confident	70.6	Confident	48 Å²	48	108.5 Å²	108.5	40%	0.397	58%	0.581	S	S	.	*	H	α-helix	trans	-60.3	-40	175.2	0	0	0	0	0	112	V281 L282 H284 L289 S290	V281-A286 HydrophobicContact CG1-CB 4.11Å; L282-A286 PolarHBondContact O-N 3.33Å; L282-A286 VanDerWaalsContact O-N 3.12Å; H284-A286 VanDerWaalsContact C-N 3.35Å; A286-L289 PolarHBondContact O-N 3.17Å; A286-S290 PolarHBondContact O-N 3.22Å; A286-S290 PolarHBondContact O-OG 3.29Å
287	V	70.6	Confident	68.9	Low	85 Å²	85	115.8 Å²	115.8	52%	0.515	61%	0.606	S	S	.	*	H	α-helix	trans	-67.8	-37.2	176	178.3	0	0	0	0	111.6	H284 D285 S290 N291	H284-V287 PolarHBondContact O-N 2.88Å; D285-V287 VanDerWaalsContact C-N 3.3Å; D285-V287 PolarHBondContact O-N 3.06Å; V287-S290 WeakPolarHBondContact CA-OG 3.44Å; V287-S290 PolarHBondContact O-OG 2.78Å; V287-N291 PolarHBondContact O-N 2.92Å; V287-N291 PolarHBondContact O-ND2 2.86Å; V287-N291 PolarHBondContact O-OD1 2.62Å
288	R	68.6	Low	67.1	Low	176 Å²	176	111.5 Å²	111.5	66%	0.664	60%	0.603	S	S	*	*	H	α-helix	trans	-67.9	-42.6	175.9	-70.7	178.2	176.3	175.2	-1.4	111.5	H284 D285 N291 T292	H284-R288 PolarHBondContact O-N 3.38Å; D285-R288 PolarHBondContact O-N 3.44Å; R288-N291 PolarHBondContact O-N 3.05Å; R288-T292 PolarHBondContact O-N 2.78Å; R288-T292 PolarHBondContact O-OG1 3.09Å
289	L	64.9	Low	65.4	Low	104 Å²	104	113.5 Å²	113.5	55%	0.545	62%	0.617	S	S	.	*	H	α-helix	trans	-65.6	-38.3	177.8	-77.6	160.4	0	0	0	112.4	V281 D285 A286 N291 T292	V281-L289 HydrophobicContact CG1-CD1 4.02Å; D285-L289 WeakPolarHBondContact O-CB 3.36Å; D285-L289 WeakPolarHBondContact O-CG 3.4Å; D285-L289 PolarHBondContact O-N 2.98Å; A286-L289 PolarHBondContact O-N 3.17Å; L289-N291 VanDerWaalsContact C-N 3.3Å; L289-N291 PolarHBondContact O-N 3.39Å; L289-T292 PolarHBondContact O-N 3.4Å; L289-T292 PolarHBondContact O-OG1 3.38Å
290	S	63.1	Low	63.6	Low	69 Å²	69	109 Å²	109	48%	0.483	62%	0.615	S	S	.	*	H	α-helix	trans	-66.1	-32.2	175.2	59.1	0	0	0	0	112.7	A286 V287 T292 V293	A286-S290 PolarHBondContact O-N 3.22Å; A286-S290 PolarHBondContact O-OG 3.29Å; V287-S290 WeakPolarHBondContact CA-OG 3.44Å; V287-S290 PolarHBondContact O-OG 2.78Å; S290-T292 VanDerWaalsContact C-N 3.28Å; S290-T292 PolarHBondContact O-N 3.48Å; S290-V293 PolarHBondContact O-N 2.86Å
291	N	58.4	Low	62.6	Low	121 Å²	121	110 Å²	110	65%	0.647	63%	0.625	S	S	*	*	H	α-helix	trans	-76.2	-13.8	-179.4	-67.7	-8.7	0	0	0	113.7	V287 R288 L289	V287-N291 PolarHBondContact O-N 2.92Å; V287-N291 PolarHBondContact O-ND2 2.86Å; V287-N291 PolarHBondContact O-OD1 2.62Å; R288-N291 PolarHBondContact O-N 3.05Å; L289-N291 VanDerWaalsContact C-N 3.3Å; L289-N291 PolarHBondContact O-N 3.39Å
292	T	53.7	Low	61.6	Low	113 Å²	113	111.7 Å²	111.7	69%	0.693	64%	0.635	S	S	*	*	H	α-helix	trans	-82.8	-17.4	172	23.2	0	0	0	0	113.9	R288 L289 S290	R288-T292 PolarHBondContact O-N 2.78Å; R288-T292 PolarHBondContact O-OG1 3.09Å; L289-T292 PolarHBondContact O-N 3.4Å; L289-T292 PolarHBondContact O-OG1 3.38Å; S290-T292 VanDerWaalsContact C-N 3.28Å; S290-T292 PolarHBondContact O-N 3.48Å
293	V	51.1	Low	60.7	Low	104 Å²	104	114.6 Å²	114.6	63%	0.63	65%	0.65	S	S	*	*	S	Bend	trans	-97.9	99.5	176	-176.8	0	0	0	0	108.4	S290	S290-V293 PolarHBondContact O-N 2.86Å
294	E	45.6	Very low	60	Low	152 Å²	152	117.8 Å²	117.8	71%	0.71	66%	0.655	S	S	*	*			trans	67.7	93.4	165.4	-57.6	-177.9	-177	0	0	115.2	S296	E294-S296 PolarHBondContact O-N 3.08Å
295	K	44.4	Very low	59.9	Low	221 Å²	221	120.2 Å²	120.2	96%	0.961	66%	0.661	S	S	*	*			trans	-49.7	80	140.4	-82.6	179.8	174.5	177.7	0	109
296	S	44.3	Very low	59.5	Low	73 Å²	73	126 Å²	126	51%	0.51	69%	0.687	S	S	.	*			trans	-114	117.5	161.7	58.3	0	0	0	0	106.1	E294 S298	E294-S296 PolarHBondContact O-N 3.08Å; S296-S298 PolarHBondContact O-N 3.35Å; S296-S298 PolarHBondContact O-OG 3.42Å
297	E	51.5	Low	59.2	Low	209 Å²	209	128 Å²	128	98%	0.977	70%	0.696	S	S	*	*			trans	-54	95.3	-177.9	-65.7	166.9	157.2	0	0	110.1
298	S	49.3	Very low	59.5	Low	90 Å²	90	128.3 Å²	128.3	63%	0.629	69%	0.694	S	S	*	*			trans	-142.4	93.6	170	56.4	0	0	0	0	109.8	S296 G300	S296-S298 PolarHBondContact O-N 3.35Å; S296-S298 PolarHBondContact O-OG 3.42Å; S298-G300 VanDerWaalsContact C-N 3.28Å; S298-G300 PolarHBondContact O-N 2.65Å
299	S	52.1	Low	59.8	Low	131 Å²	131	125.4 Å²	125.4	92%	0.916	70%	0.7	S	S	*	*			trans	37.4	44.4	143.3	-47.8	0	0	0	0	118.1	C301	S299-C301 PolarHBondContact O-N 3.13Å
300	G	50.9	Low	60.2	Low	62 Å²	62	128.6 Å²	128.6	64%	0.639	71%	0.71	S	S	*	*			trans	-64.5	125	168.6	0	0	0	0	0	109.6	S298 V302	S298-G300 VanDerWaalsContact C-N 3.28Å; S298-G300 PolarHBondContact O-N 2.65Å; G300-V302 PolarHBondContact O-N 3.05Å
301	C	64.3	Low	60.7	Low	117 Å²	117	127.4 Å²	127.4	79%	0.791	70%	0.698	S	S	*	*			trans	-60.2	108.2	173	-174.4	0	0	0	0	108.7	S299 I303	S299-C301 PolarHBondContact O-N 3.13Å; C301-I303 PolarHBondContact O-N 3.43Å
302	V	64.7	Low	61.2	Low	115 Å²	115	128.5 Å²	128.5	70%	0.697	70%	0.704	S	S	*	*			trans	-79.5	99.8	172.2	-176.9	0	0	0	0	106.8	G300 Q304	G300-V302 PolarHBondContact O-N 3.05Å; V302-Q304 HydrophobicContact CG1-CG 3.9Å; V302-Q304 PolarHBondContact O-N 2.69Å; V302-Q304 VanDerWaalsContact O-N 3.11Å
303	I	66.2	Low	61.4	Low	147 Å²	147	130 Å²	130	75%	0.754	71%	0.707	S	S	*	*			trans	-73.8	100.9	169.1	-58.5	175.3	0	0	0	106.5	C301 Y305	C301-I303 PolarHBondContact O-N 3.43Å; I303-Y305 PolarHBondContact O-N 2.83Å
304	Q	65.9	Low	62.1	Low	173 Å²	173	129.8 Å²	129.8	81%	0.808	70%	0.702	S	S	*	*			trans	-83.1	101.5	169.1	-68.9	-172.1	-26	0	0	108	V302	V302-Q304 HydrophobicContact CG1-CG 3.9Å; V302-Q304 PolarHBondContact O-N 2.69Å; V302-Q304 VanDerWaalsContact O-N 3.11Å
305	Y	74.3	Confident	63	Low	158 Å²	158	130.2 Å²	130.2	62%	0.62	71%	0.709	S	S	*	*			trans	-75	121.3	170.1	-168.3	-102.1	0	0	0	108.9	I303 P307 D311	I303-Y305 PolarHBondContact O-N 2.83Å; Y305-P307 HydrophobicContact CD1-CG 4.09Å; Y305-P307 HydrophobicContact CE1-CB 4.21Å; Y305-P307 HydrophobicContact CE1-CG 4.19Å; Y305-D311 VanDerWaalsContact CE1-OD2 3.23Å; Y305-D311 WeakPolarHBondContact CE1-OD2 3.07Å; Y305-D311 VanDerWaalsContact CZ-OD2 3.29Å; Y305-D311 PolarHBondContact OH-OD1 2.99Å; Y305-D311 PolarHBondContact OH-OD2 3.42Å
306	Q	68.9	Low	63.8	Low	179 Å²	179	127.5 Å²	127.5	84%	0.836	70%	0.7	S	S	*	*			trans	-99.7	113.3	164.9	-85.1	-170	-62.5	0	0	107.2	D308	Q306-D308 PolarHBondContact O-N 2.94Å
307	P	70.4	Confident	64.7	Low	90 Å²	90	127.8 Å²	127.8	58%	0.584	70%	0.696	S	S	*	*			trans	-59.1	133.2	175.7	-21	31.1	0	0	0	110.8	Y305 D311	Y305-P307 HydrophobicContact CD1-CG 4.09Å; Y305-P307 HydrophobicContact CE1-CB 4.21Å; Y305-P307 HydrophobicContact CE1-CG 4.19Å; P307-D311 WeakPolarHBondContact CA-OD2 3.38Å
308	D	77.8	Confident	65.3	Low	91 Å²	91	122.5 Å²	122.5	49%	0.487	68%	0.679	S	S	.	*			trans	-99.6	175.2	176.4	82	22.4	0	0	0	112.4	Q306 F310 D311	Q306-D308 PolarHBondContact O-N 2.94Å; D308-F310 PolarHBondContact O-N 3.28Å; D308-F310 WeakPolarHBondContact OD1-CA 3.24Å; D308-F310 WeakPolarHBondContact OD1-CB 3.32Å; D308-F310 PolarHBondContact OD1-N 2.76Å; D308-D311 PolarHBondContact N-OD2 2.88Å; D308-D311 PolarHBondContact O-N 3.25Å; D308-D311 PolarHBondContact OD1-N 2.91Å
309	C	74.7	Confident	66.2	Low	115 Å²	115	122.9 Å²	122.9	78%	0.777	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-7.2	-176.6	57.5	0	0	0	0	114.6
310	F	73.4	Confident	66.9	Low	171 Å²	171	123 Å²	123	75%	0.75	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	-7.1	177.3	-57.4	-74.1	0	0	0	112.3	D308 D312	D308-F310 PolarHBondContact O-N 3.28Å; D308-F310 WeakPolarHBondContact OD1-CA 3.24Å; D308-F310 WeakPolarHBondContact OD1-CB 3.32Å; D308-F310 PolarHBondContact OD1-N 2.76Å; F310-D312 PolarHBondContact O-N 3.2Å
311	D	72.7	Confident	68	Low	44 Å²	44	126.4 Å²	126.4	24%	0.235	67%	0.668	C	S	.	*			trans	-63.6	107.3	166.7	-70.4	-24.3	0	0	0	108.7	Y305 P307 D308 L313	Y305-D311 VanDerWaalsContact CE1-OD2 3.23Å; Y305-D311 WeakPolarHBondContact CE1-OD2 3.07Å; Y305-D311 VanDerWaalsContact CZ-OD2 3.29Å; Y305-D311 PolarHBondContact OH-OD1 2.99Å; Y305-D311 PolarHBondContact OH-OD2 3.42Å; P307-D311 WeakPolarHBondContact CA-OD2 3.38Å; D308-D311 PolarHBondContact N-OD2 2.88Å; D308-D311 PolarHBondContact O-N 3.25Å; D308-D311 PolarHBondContact OD1-N 2.91Å; D311-L313 PolarHBondContact O-N 2.87Å
312	D	69.7	Low	68	Low	144 Å²	144	125.6 Å²	125.6	77%	0.77	66%	0.655	S	S	*	*			trans	-67.7	82	166.7	49.2	-12.3	0	0	0	108.4	F310 D314	F310-D312 PolarHBondContact O-N 3.2Å; D312-D314 PolarHBondContact O-N 2.78Å
313	L	58.1	Low	68.3	Low	145 Å²	145	128.2 Å²	128.2	76%	0.759	67%	0.666	S	S	*	*			trans	-64.1	79.2	149.2	-61.5	177.8	0	0	0	106	D311	D311-L313 PolarHBondContact O-N 2.87Å
314	D	66	Low	67.9	Low	99 Å²	99	132.2 Å²	132.2	53%	0.529	69%	0.686	S	S	.	*			trans	-66.1	133.7	162.9	90.3	27.1	0	0	0	107.1	D312 E316 D317	D312-D314 PolarHBondContact O-N 2.78Å; D314-E316 PolarHBondContact O-N 2.75Å; D314-E316 WeakPolarHBondContact OD1-CA 3.18Å; D314-E316 PolarHBondContact OD1-N 2.95Å; D314-D317 PolarHBondContact OD1-N 3.22Å
315	D	64.2	Low	68	Low	160 Å²	160	130.2 Å²	130.2	86%	0.856	68%	0.68	S	S	*	*	S	Bend	trans	-78.3	8.7	175.9	-66.6	-42.4	0	0	0	110.8
316	E	59.6	Low	67.6	Low	165 Å²	165	128.7 Å²	128.7	77%	0.771	68%	0.683	S	S	*	*			trans	-121.7	48.3	-175.7	-69.7	-170.5	177.9	0	0	109.4	D314 P318	D314-E316 PolarHBondContact O-N 2.75Å; D314-E316 WeakPolarHBondContact OD1-CA 3.18Å; D314-E316 PolarHBondContact OD1-N 2.95Å; E316-P318 WeakPolarHBondContact O-CD 3.44Å
317	D	64.5	Low	67.6	Low	79 Å²	79	125.9 Å²	125.9	42%	0.422	67%	0.674	S	S	.	*			trans	-53	112	163.9	-172.1	-14.7	0	0	0	106.1	D314 D319 D320	D314-D317 PolarHBondContact OD1-N 3.22Å; D317-D319 PolarHBondContact O-N 3.33Å; D317-D319 VanDerWaalsContact OD1-CB 3.31Å; D317-D319 WeakPolarHBondContact OD1-CB 3.45Å; D317-D319 PolarHBondContact OD1-N 3Å; D317-D320 WeakPolarHBondContact O-CB 3.35Å; D317-D320 PolarHBondContact O-N 3.26Å
318	P	62.8	Low	67.4	Low	97 Å²	97	128 Å²	128	63%	0.63	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.2	-3.3	-176.6	29.7	-35.9	0	0	0	111.9	E316	E316-P318 WeakPolarHBondContact O-CD 3.44Å
319	D	68.2	Low	66.8	Low	98 Å²	98	130.3 Å²	130.3	52%	0.524	69%	0.692	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.5	-8.7	174.4	-56.4	-4.5	0	0	0	112.4	D317 D321 L322	D317-D319 PolarHBondContact O-N 3.33Å; D317-D319 VanDerWaalsContact OD1-CB 3.31Å; D317-D319 WeakPolarHBondContact OD1-CB 3.45Å; D317-D319 PolarHBondContact OD1-N 3Å; D319-D321 PolarHBondContact O-N 3.46Å; D319-D321 VanDerWaalsContact O-N 3.17Å; D319-L322 HydrophobicContact CB-CD1 3.99Å; D319-L322 WeakPolarHBondContact O-CB 3.24Å; D319-L322 PolarHBondContact O-N 3.03Å
320	D	68.5	Low	66.2	Low	135 Å²	135	131.3 Å²	131.3	72%	0.722	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.6	-18.5	-179.2	-95.9	-2.7	0	0	0	113.5	D317	D317-D320 WeakPolarHBondContact O-CB 3.35Å; D317-D320 PolarHBondContact O-N 3.26Å
321	D	72.4	Confident	65.7	Low	133 Å²	133	128.5 Å²	128.5	71%	0.711	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	3.4	173.7	75.8	-11.5	0	0	0	114	D319 D323	D319-D321 PolarHBondContact O-N 3.46Å; D319-D321 VanDerWaalsContact O-N 3.17Å; D321-D323 PolarHBondContact O-N 2.9Å; D321-D323 VanDerWaalsContact O-N 3.12Å
322	L	64.2	Low	65.2	Low	99 Å²	99	135 Å²	135	52%	0.518	72%	0.716	S	S	.	*			trans	-80	94.9	174.3	-65.7	178.7	0	0	0	110	D319 I324	D319-L322 HydrophobicContact CB-CD1 3.99Å; D319-L322 WeakPolarHBondContact O-CB 3.24Å; D319-L322 PolarHBondContact O-N 3.03Å; L322-I324 PolarHBondContact O-N 3Å
323	D	71	Confident	64.8	Low	171 Å²	171	134.3 Å²	134.3	91%	0.914	71%	0.711	S	S	*	*			trans	-58.7	101.8	161.2	-72.6	-34	0	0	0	109.1	D321	D321-D323 PolarHBondContact O-N 2.9Å; D321-D323 VanDerWaalsContact O-N 3.12Å
324	I	58.1	Low	65.4	Low	230 Å²	230	133.3 Å²	133.3	100%	1.179	71%	0.707	S	S	*	*			trans	-91.6	0	167.3	-60.5	170.8	0	0	0	110.4	L322	L322-I324 PolarHBondContact O-N 3Å

Retrieved 324 of 324 residues in 98.8 ms (Link to these results)

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