A0A077YX89_TRITR Loading...

ACBP and GOLD 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077YX89, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 399 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	37.9	Very low	34.6	Very low	242 Å²	242	135.7 Å²	135.7	100%	1.192	82%	0.819	S	S	*	*				0	137	0	-74.9	-171.4	-175.5	0	0	108.2
2	C	38.4	Very low	35.2	Very low	116 Å²	116	137.1 Å²	137.1	78%	0.784	82%	0.816	S	S	*	*			trans	61.4	91.2	172.8	-71.8	0	0	0	0	118	I4	C2-I4 HydrophobicContact CB-CG1 4.46Å
3	A	35.7	Very low	35.6	Very low	110 Å²	110	134.5 Å²	134.5	91%	0.909	80%	0.796	S	S	*	*			trans	-70.8	118.3	144.2	0	0	0	0	0	107.4
4	I	37.2	Very low	36.4	Very low	145 Å²	145	136.3 Å²	136.3	74%	0.744	79%	0.792	S	S	*	*			trans	-92	106.5	-178.9	-47.1	174.6	0	0	0	106.7	C2	C2-I4 HydrophobicContact CB-CG1 4.46Å
5	S	32.6	Very low	37.4	Very low	108 Å²	108	135.5 Å²	135.5	76%	0.755	78%	0.784	S	S	*	*			trans	-73.1	124.9	168.7	-177	0	0	0	0	109.1
6	T	35.2	Very low	38.6	Very low	125 Å²	125	130.9 Å²	130.9	77%	0.767	77%	0.767	S	S	*	*			trans	-147.3	59.1	162.5	40.5	0	0	0	0	109.6
7	E	30.6	Very low	40.4	Very low	183 Å²	183	127.9 Å²	127.9	86%	0.855	76%	0.755	S	S	*	*			trans	-82.5	110.3	154.6	-73.5	-173.8	179.3	0	0	107.3	P9	E7-P9 WeakPolarHBondContact O-CD 3.19Å
8	V	31.6	Very low	42	Very low	125 Å²	125	125 Å²	125	76%	0.758	73%	0.729	S	S	*	*			trans	-76.1	114.1	163.9	178	0	0	0	0	105.5	L10	V8-L10 PolarHBondContact O-N 2.82Å
9	P	36.4	Very low	43.7	Very low	115 Å²	115	120.2 Å²	120.2	75%	0.747	71%	0.709	S	S	*	*			trans	-66.2	108.9	171.7	-6.3	22.5	0	0	0	105.5	E7 G11	E7-P9 WeakPolarHBondContact O-CD 3.19Å; P9-G11 PolarHBondContact O-N 3.17Å
10	L	33.5	Very low	45.8	Very low	159 Å²	159	117.9 Å²	117.9	83%	0.832	69%	0.694	S	S	*	*			trans	-55.4	102.3	161.2	-78.1	164.6	0	0	0	104.8	V8 I12	V8-L10 PolarHBondContact O-N 2.82Å; L10-I12 PolarHBondContact O-N 2.92Å
11	G	31.9	Very low	48	Very low	65 Å²	65	113.2 Å²	113.2	67%	0.67	67%	0.665	S	S	*	*			trans	-51.5	108.7	175.3	0	0	0	0	0	106.4	P9 N13	P9-G11 PolarHBondContact O-N 3.17Å; G11-N13 PolarHBondContact O-N 3.37Å
12	I	41.9	Very low	50.5	Low	152 Å²	152	102.1 Å²	102.1	78%	0.779	61%	0.612	S	S	*	*			trans	-55.7	103.2	165.7	-62.2	172.5	0	0	0	102.5	L10 Q14	L10-I12 PolarHBondContact O-N 2.92Å; I12-Q14 PolarHBondContact O-N 3.29Å
13	N	39.6	Very low	52.9	Low	103 Å²	103	98.7 Å²	98.7	55%	0.551	59%	0.585	S	S	*	*			trans	-64.2	94.6	-172.5	-169.3	-4.8	0	0	0	105.1	G11 N15 A16 S17	G11-N13 PolarHBondContact O-N 3.37Å; N13-N15 PolarHBondContact O-N 3.09Å; N13-N15 WeakPolarHBondContact OD1-CB 3.36Å; N13-A16 HydrophobicContact CB-CB 4.16Å; N13-A16 WeakPolarHBondContact O-CB 3.25Å; N13-A16 PolarHBondContact O-N 2.81Å; N13-S17 PolarHBondContact O-N 2.72Å
14	Q	46.7	Very low	55.6	Low	160 Å²	160	97 Å²	97	75%	0.748	56%	0.557	S	S	*	*	H	α-helix	trans	-54.3	-28.6	-176.8	-68.7	-179.8	6.1	0	0	109.7	I12 A16 S17 Y18	I12-Q14 PolarHBondContact O-N 3.29Å; Q14-A16 VanDerWaalsContact C-N 3.35Å; Q14-A16 PolarHBondContact O-N 3.06Å; Q14-S17 PolarHBondContact O-N 2.73Å; Q14-Y18 WeakPolarHBondContact O-CB 3.49Å; Q14-Y18 PolarHBondContact O-N 3.08Å
15	N	52	Low	58.3	Low	125 Å²	125	91.5 Å²	91.5	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-63	-33	173.2	-62.8	-11.7	0	0	0	114	N13 G19	N13-N15 PolarHBondContact O-N 3.09Å; N13-N15 WeakPolarHBondContact OD1-CB 3.36Å; N15-G19 PolarHBondContact O-N 3.12Å
16	A	55.9	Low	61	Low	62 Å²	62	92.8 Å²	92.8	51%	0.512	52%	0.515	S	S	.	.	H	α-helix	trans	-70.5	-42.3	176.1	0	0	0	0	0	111.1	N13 Q14 G19 D20	N13-A16 HydrophobicContact CB-CB 4.16Å; N13-A16 WeakPolarHBondContact O-CB 3.25Å; N13-A16 PolarHBondContact O-N 2.81Å; Q14-A16 VanDerWaalsContact C-N 3.35Å; Q14-A16 PolarHBondContact O-N 3.06Å; A16-G19 PolarHBondContact O-N 2.92Å; A16-D20 PolarHBondContact O-N 2.85Å; A16-D20 VanDerWaalsContact O-N 3.08Å
17	S	70.1	Confident	63.7	Low	80 Å²	80	88 Å²	88	56%	0.559	48%	0.483	S	S	*	.	H	α-helix	trans	-65	-42.2	175.5	-172.6	0	0	0	0	111.6	N13 Q14 L21	N13-S17 PolarHBondContact O-N 2.72Å; Q14-S17 PolarHBondContact O-N 2.73Å; S17-L21 WeakPolarHBondContact O-CB 3.36Å; S17-L21 PolarHBondContact O-N 2.9Å; S17-L21 VanDerWaalsContact O-N 3.08Å
18	Y	68.9	Low	66.7	Low	75 Å²	75	79.3 Å²	79.3	29%	0.294	44%	0.443	S	S	.	.	H	α-helix	trans	-63.5	-44.1	174.9	-176.8	-97.6	0	0	0	111.9	Q14 D20 L21 A22 E91	Q14-Y18 WeakPolarHBondContact O-CB 3.49Å; Q14-Y18 PolarHBondContact O-N 3.08Å; Y18-D20 PolarHBondContact O-N 2.93Å; Y18-L21 PolarHBondContact O-N 3.49Å; Y18-A22 HydrophobicContact CE1-CB 4.22Å; Y18-A22 WeakPolarHBondContact O-CB 3.26Å; Y18-A22 PolarHBondContact O-N 2.78Å; Y18-E91 HydrophobicContact CD2-CG 3.42Å; Y18-E91 VanDerWaalsContact CD2-CG 3.42Å; Y18-E91 WeakPolarHBondContact CD2-OE1 3.39Å; Y18-E91 HydrophobicContact CE2-CG 3.43Å; Y18-E91 VanDerWaalsContact CE2-CG 3.43Å
19	G	74.2	Confident	69.4	Low	34 Å²	34	74.2 Å²	74.2	35%	0.351	41%	0.413	S	S	.	.	H	α-helix	trans	-58.8	-46.8	179.1	0	0	0	0	0	112.6	N15 A16 A22 E23	N15-G19 PolarHBondContact O-N 3.12Å; A16-G19 PolarHBondContact O-N 2.92Å; G19-A22 PolarHBondContact O-N 3.33Å; G19-E23 WeakPolarHBondContact O-CB 3.17Å; G19-E23 PolarHBondContact O-N 3.42Å
20	D	86.5	Confident	71.8	Confident	74 Å²	74	72 Å²	72	40%	0.396	39%	0.392	S	S	.	.	H	α-helix	trans	-62.6	-43.6	175.7	-176.8	59.3	0	0	0	111.4	A16 Y18 E23 K24	A16-D20 PolarHBondContact O-N 2.85Å; A16-D20 VanDerWaalsContact O-N 3.08Å; Y18-D20 PolarHBondContact O-N 2.93Å; D20-E23 PolarHBondContact O-N 3.39Å; D20-K24 WeakPolarHBondContact O-CB 3.25Å; D20-K24 WeakPolarHBondContact O-CG 3.14Å; D20-K24 PolarHBondContact O-N 3.39Å; D20-K24 IonicContact OD1-NZ 2.69Å; D20-K24 WeakPolarHBondContact OD2-CE 3.39Å; D20-K24 IonicContact OD2-NZ 2.85Å; D20-K24 PolarHBondContact OD2-NZ 3.46Å
21	L	91.6	Very high	74.6	Confident	19 Å²	19	64.8 Å²	64.8	10%	0.099	35%	0.354	C	S	.	.	H	α-helix	trans	-62.9	-48	177.2	177.1	65.3	0	0	0	112.3	S17 Y18 E23 K24 Y25 E91 M94 Q95 I98	S17-L21 WeakPolarHBondContact O-CB 3.36Å; S17-L21 PolarHBondContact O-N 2.9Å; S17-L21 VanDerWaalsContact O-N 3.08Å; Y18-L21 PolarHBondContact O-N 3.49Å; L21-E23 PolarHBondContact O-N 3.38Å; L21-K24 PolarHBondContact O-N 3.31Å; L21-Y25 WeakPolarHBondContact O-CB 3.15Å; L21-Y25 PolarHBondContact O-N 2.88Å; L21-E91 HydrophobicContact CD2-CB 4.13Å; L21-E91 HydrophobicContact CD2-CG 4.43Å; L21-M94 HydrophobicContact CD1-CB 4.25Å; L21-M94 HydrophobicContact CD2-CB 4.22Å; L21-M94 HydrophobicContact CG-CB 4.08Å; L21-M94 HydrophobicContact CG-SD 4.36Å; L21-Q95 HydrophobicContact CD1-CB 4.5Å; L21-Q95 HydrophobicContact CD1-CG 3.56Å; L21-Q95 HydrophobicContact CD2-CG 3.73Å; L21-Q95 HydrophobicContact CG-CG 4.3Å; L21-I98 HydrophobicContact CD1-CD1 3.61Å
22	A	89.8	Confident	77.2	Confident	10 Å²	10	61.7 Å²	61.7	8%	0.083	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-34.3	179.5	0	0	0	0	0	111.5	Y18 G19 R26 M94	Y18-A22 HydrophobicContact CE1-CB 4.22Å; Y18-A22 WeakPolarHBondContact O-CB 3.26Å; Y18-A22 PolarHBondContact O-N 2.78Å; G19-A22 PolarHBondContact O-N 3.33Å; A22-R26 WeakPolarHBondContact O-CG 3.38Å; A22-R26 PolarHBondContact O-N 2.68Å; A22-R26 VanDerWaalsContact O-N 3.08Å; A22-R26 PolarHBondContact O-NH1 3.45Å; A22-M94 HydrophobicContact CB-CE 4.35Å; A22-M94 HydrophobicContact CB-SD 4.14Å
23	E	88.6	Confident	79.2	Confident	43 Å²	43	58 Å²	58	20%	0.201	30%	0.3	C	S	.	.	H	α-helix	trans	-68.1	-50.1	173.9	-177.5	155.8	-104.2	0	0	112.7	G19 D20 L21 Y25 R26 W27 Q119	G19-E23 WeakPolarHBondContact O-CB 3.17Å; G19-E23 PolarHBondContact O-N 3.42Å; D20-E23 PolarHBondContact O-N 3.39Å; L21-E23 PolarHBondContact O-N 3.38Å; E23-Y25 VanDerWaalsContact C-N 3.27Å; E23-Y25 PolarHBondContact O-N 2.95Å; E23-R26 WeakPolarHBondContact O-CB 3.3Å; E23-R26 PolarHBondContact O-N 3.16Å; E23-R26 VanDerWaalsContact O-N 3.07Å; E23-R26 IonicContact OE1-NH2 3.63Å; E23-W27 HydrophobicContact CG-CD2 4.1Å; E23-W27 HydrophobicContact CG-CE3 4.34Å; E23-W27 HydrophobicContact CG-CH2 4.01Å; E23-W27 HydrophobicContact CG-CZ2 3.73Å; E23-W27 HydrophobicContact CG-CZ3 4.31Å; E23-W27 PolarHBondContact O-N 2.97Å; E23-Q119 PolarHBondContact OE1-NE2 3.37Å
24	K	92.3	Very high	81.2	Confident	75 Å²	75	56.9 Å²	56.9	33%	0.326	29%	0.292	S	S	.	.	H	α-helix	trans	-56	-43.5	173.9	-76.5	174.3	176	160.3	0	111.7	D20 L21 R26 W27 A28 I98	D20-K24 WeakPolarHBondContact O-CB 3.25Å; D20-K24 WeakPolarHBondContact O-CG 3.14Å; D20-K24 PolarHBondContact O-N 3.39Å; D20-K24 IonicContact OD1-NZ 2.69Å; D20-K24 WeakPolarHBondContact OD2-CE 3.39Å; D20-K24 IonicContact OD2-NZ 2.85Å; D20-K24 PolarHBondContact OD2-NZ 3.46Å; L21-K24 PolarHBondContact O-N 3.31Å; K24-R26 PolarHBondContact O-N 3.34Å; K24-W27 PolarHBondContact O-N 2.92Å; K24-A28 WeakPolarHBondContact O-CB 3.29Å; K24-A28 PolarHBondContact O-N 2.79Å; K24-I98 HydrophobicContact CB-CD1 3.9Å
25	Y	94.2	Very high	83	Confident	29 Å²	29	53.3 Å²	53.3	11%	0.114	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-44.9	175.5	172.2	-99.9	0	0	0	112	L21 E23 W27 A28 A29 S54 V57 M94 F97	L21-Y25 WeakPolarHBondContact O-CB 3.15Å; L21-Y25 PolarHBondContact O-N 2.88Å; E23-Y25 VanDerWaalsContact C-N 3.27Å; E23-Y25 PolarHBondContact O-N 2.95Å; Y25-W27 VanDerWaalsContact C-N 3.29Å; Y25-W27 PolarHBondContact O-N 2.9Å; Y25-A28 PolarHBondContact O-N 2.98Å; Y25-A29 WeakPolarHBondContact O-CB 3.18Å; Y25-A29 PolarHBondContact O-N 2.99Å; Y25-S54 WeakPolarHBondContact OH-CA 3.41Å; Y25-S54 WeakPolarHBondContact OH-CB 3.36Å; Y25-S54 PolarHBondContact OH-OG 3.4Å; Y25-V57 HydrophobicContact CD1-CG1 4.22Å; Y25-V57 HydrophobicContact CE1-CB 4.4Å; Y25-V57 HydrophobicContact CE1-CG1 3.6Å; Y25-V57 HydrophobicContact CE2-CG1 4.5Å; Y25-V57 HydrophobicContact CE2-CG2 4.2Å; Y25-M94 HydrophobicContact CD1-CE 4.3Å; Y25-M94 HydrophobicContact CD1-CG 4.12Å; Y25-M94 HydrophobicContact CD1-SD 4.41Å; Y25-M94 HydrophobicContact CD2-CB 4.1Å; Y25-M94 HydrophobicContact CD2-CG 3.94Å; Y25-M94 HydrophobicContact CG-CB 4.15Å; Y25-M94 HydrophobicContact CG-CG 3.71Å; Y25-M94 HydrophobicContact CG-SD 4.26Å; Y25-F97 HydrophobicContact CD2-CB 4.19Å; Y25-F97 AromaticContact CD2-CD1 3.81Å; Y25-F97 HydrophobicContact CD2-CD1 3.81Å; Y25-F97 HydrophobicContact CD2-CE1 4.45Å; Y25-F97 HydrophobicContact CD2-CG 4.05Å; Y25-F97 HydrophobicContact CE2-CB 4.03Å; Y25-F97 AromaticContact CE2-CD1 3.74Å; Y25-F97 HydrophobicContact CE2-CD1 3.74Å; Y25-F97 HydrophobicContact CE2-CD2 4.06Å; Y25-F97 HydrophobicContact CE2-CE1 4.21Å; Y25-F97 HydrophobicContact CE2-CE2 4.49Å; Y25-F97 AromaticContact CE2-CG 3.67Å; Y25-F97 HydrophobicContact CE2-CG 3.67Å
26	R	90	Very high	84.4	Confident	135 Å²	135	48 Å²	48	51%	0.509	25%	0.245	S	C	.	.	H	α-helix	trans	-59.7	-41.9	176.1	-75.4	-172.2	-53.7	-92.5	5.3	111.5	A22 E23 K24 K30	A22-R26 WeakPolarHBondContact O-CG 3.38Å; A22-R26 PolarHBondContact O-N 2.68Å; A22-R26 VanDerWaalsContact O-N 3.08Å; A22-R26 PolarHBondContact O-NH1 3.45Å; E23-R26 WeakPolarHBondContact O-CB 3.3Å; E23-R26 PolarHBondContact O-N 3.16Å; E23-R26 VanDerWaalsContact O-N 3.07Å; E23-R26 IonicContact OE1-NH2 3.63Å; K24-R26 PolarHBondContact O-N 3.34Å; R26-K30 VanDerWaalsContact O-CB 3.31Å; R26-K30 WeakPolarHBondContact O-CB 3.33Å; R26-K30 PolarHBondContact O-N 3.35Å
27	W	91.3	Very high	85.2	Confident	26 Å²	26	46.4 Å²	46.4	10%	0.098	24%	0.235	C	C	.	.	H	α-helix	trans	-68.6	-41.7	177.3	-67.2	-15.2	0	0	0	112.3	E23 K24 Y25 K30 F31 F111 Y112 E115 K116	E23-W27 HydrophobicContact CG-CD2 4.1Å; E23-W27 HydrophobicContact CG-CE3 4.34Å; E23-W27 HydrophobicContact CG-CH2 4.01Å; E23-W27 HydrophobicContact CG-CZ2 3.73Å; E23-W27 HydrophobicContact CG-CZ3 4.31Å; E23-W27 PolarHBondContact O-N 2.97Å; K24-W27 PolarHBondContact O-N 2.92Å; Y25-W27 VanDerWaalsContact C-N 3.29Å; Y25-W27 PolarHBondContact O-N 2.9Å; W27-K30 WeakPolarHBondContact O-CB 3.42Å; W27-K30 PolarHBondContact O-N 2.87Å; W27-F31 WeakPolarHBondContact O-CB 3.4Å; W27-F31 PolarHBondContact O-N 2.9Å; W27-F111 HydrophobicContact CB-CE1 4.2Å; W27-F111 WeakPolarHBondContact O-CE1 3.43Å; W27-Y112 HydrophobicContact CB-CD1 3.76Å; W27-Y112 HydrophobicContact CB-CE1 3.67Å; W27-Y112 HydrophobicContact CD2-CD1 4.41Å; W27-Y112 AromaticContact CE3-CD1 3.72Å; W27-Y112 HydrophobicContact CE3-CD1 3.72Å; W27-Y112 HydrophobicContact CE3-CE1 4.4Å; W27-Y112 HydrophobicContact CE3-CG 4.45Å; W27-E115 VanDerWaalsContact CD1-CG 3.48Å; W27-E115 HydrophobicContact CD2-CB 4.13Å; W27-E115 HydrophobicContact CD2-CG 3.82Å; W27-E115 VanDerWaalsContact CE2-CG 3.45Å; W27-E115 HydrophobicContact CG-CB 4.37Å; W27-E115 HydrophobicContact CG-CG 3.82Å; W27-E115 HydrophobicContact CZ2-CB 4.47Å; W27-E115 HydrophobicContact CZ2-CG 4.05Å; W27-K116 HydrophobicContact CH2-CB 4.03Å; W27-K116 HydrophobicContact CH2-CG 4.47Å; W27-K116 HydrophobicContact CZ3-CB 4.36Å
28	A	93.3	Very high	85.5	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.9	-47.4	174.4	0	0	0	0	0	111.7	K24 Y25 K30 F31 L32 F97 I98 L101 L108	K24-A28 WeakPolarHBondContact O-CB 3.29Å; K24-A28 PolarHBondContact O-N 2.79Å; Y25-A28 PolarHBondContact O-N 2.98Å; A28-K30 VanDerWaalsContact C-N 3.34Å; A28-K30 PolarHBondContact O-N 2.85Å; A28-F31 WeakPolarHBondContact O-CB 3.46Å; A28-F31 PolarHBondContact O-N 2.87Å; A28-L32 WeakPolarHBondContact O-CB 3.5Å; A28-L32 PolarHBondContact O-N 3.3Å; A28-F97 HydrophobicContact CB-CD1 4.26Å; A28-F97 HydrophobicContact CB-CE1 3.96Å; A28-I98 HydrophobicContact CB-CG1 4.21Å; A28-L101 HydrophobicContact CB-CD2 4.11Å; A28-L108 HydrophobicContact CB-CD1 4.44Å; A28-L108 HydrophobicContact CB-CD2 4.26Å
29	A	89.9	Confident	85.9	Confident	17 Å²	17	49.7 Å²	49.7	14%	0.14	26%	0.255	C	S	.	.	H	α-helix	trans	-63.5	-39	176.1	0	0	0	0	0	112	Y25 K33	Y25-A29 WeakPolarHBondContact O-CB 3.18Å; Y25-A29 PolarHBondContact O-N 2.99Å; A29-K33 VanDerWaalsContact O-CB 3.26Å; A29-K33 WeakPolarHBondContact O-CB 3.4Å; A29-K33 PolarHBondContact O-N 2.72Å
30	K	86.8	Confident	86.3	Confident	70 Å²	70	49.8 Å²	49.8	30%	0.304	25%	0.245	S	C	.	.	H	α-helix	trans	-63.2	-47.7	173.7	-177.8	-173.3	174.1	-162.2	0	111.4	R26 W27 A28 K33 E34 F111 E115	R26-K30 VanDerWaalsContact O-CB 3.31Å; R26-K30 WeakPolarHBondContact O-CB 3.33Å; R26-K30 PolarHBondContact O-N 3.35Å; W27-K30 WeakPolarHBondContact O-CB 3.42Å; W27-K30 PolarHBondContact O-N 2.87Å; A28-K30 VanDerWaalsContact C-N 3.34Å; A28-K30 PolarHBondContact O-N 2.85Å; K30-K33 WeakPolarHBondContact O-CB 3.35Å; K30-K33 PolarHBondContact O-N 2.85Å; K30-E34 WeakPolarHBondContact CE-OE1 3.33Å; K30-E34 WeakPolarHBondContact CG-OE1 3.12Å; K30-E34 WeakPolarHBondContact O-CB 3.32Å; K30-E34 WeakPolarHBondContact O-CG 3.35Å; K30-E34 PolarHBondContact O-N 3.42Å; K30-F111 HydrophobicContact CB-CZ 4.47Å; K30-F111 HydrophobicContact CD-CZ 3.97Å; K30-F111 HydrophobicContact CG-CZ 4.12Å; K30-E115 IonicContact NZ-OE1 3.28Å; K30-E115 PolarHBondContact NZ-OE1 3.29Å; K30-E115 IonicContact NZ-OE2 3.79Å; K30-E115 PolarHBondContact NZ-OE2 2.84Å
31	F	90.5	Very high	86.2	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.031	26%	0.26	C	S	.	.	H	α-helix	trans	-56.7	-52.2	176.6	171.5	-98.5	0	0	0	111	W27 A28 K33 E34 K35 F40 L101 C105 E107 L108 F111	W27-F31 WeakPolarHBondContact O-CB 3.4Å; W27-F31 PolarHBondContact O-N 2.9Å; A28-F31 WeakPolarHBondContact O-CB 3.46Å; A28-F31 PolarHBondContact O-N 2.87Å; F31-K33 VanDerWaalsContact C-N 3.31Å; F31-K33 PolarHBondContact O-N 2.82Å; F31-E34 PolarHBondContact O-N 2.86Å; F31-E34 VanDerWaalsContact O-N 3.14Å; F31-K35 HydrophobicContact CD2-CB 4.5Å; F31-K35 HydrophobicContact CD2-CG 3.74Å; F31-K35 HydrophobicContact CE2-CB 4.33Å; F31-K35 HydrophobicContact CE2-CG 3.72Å; F31-K35 HydrophobicContact CG-CG 4.37Å; F31-K35 HydrophobicContact CZ-CB 4.44Å; F31-K35 HydrophobicContact CZ-CG 4.31Å; F31-K35 VanDerWaalsContact O-CB 3.28Å; F31-K35 WeakPolarHBondContact O-CB 3.39Å; F31-K35 WeakPolarHBondContact O-CG 3.38Å; F31-K35 PolarHBondContact O-N 3.4Å; F31-F40 HydrophobicContact CD1-CE1 4.39Å; F31-F40 HydrophobicContact CD1-CZ 4.32Å; F31-F40 AromaticContact CE1-CE1 3.53Å; F31-F40 HydrophobicContact CE1-CE1 3.53Å; F31-F40 AromaticContact CE1-CZ 3.71Å; F31-F40 HydrophobicContact CE1-CZ 3.71Å; F31-F40 AromaticContact CZ-CE1 3.67Å; F31-F40 HydrophobicContact CZ-CE1 3.67Å; F31-F40 HydrophobicContact CZ-CZ 4.33Å; F31-L101 HydrophobicContact CD1-CD2 4.26Å; F31-C105 HydrophobicContact CE1-CB 3.86Å; F31-C105 HydrophobicContact CZ-CB 4.27Å; F31-E107 HydrophobicContact CE2-CB 4.42Å; F31-E107 HydrophobicContact CZ-CB 4.2Å; F31-L108 HydrophobicContact CB-CD1 3.75Å; F31-L108 HydrophobicContact CD1-CB 4.27Å; F31-L108 HydrophobicContact CD1-CD1 3.78Å; F31-L108 HydrophobicContact CD1-CG 4.49Å; F31-L108 HydrophobicContact CD2-CD1 4.32Å; F31-L108 HydrophobicContact CE1-CB 4.09Å; F31-L108 HydrophobicContact CE1-CD1 4.44Å; F31-L108 HydrophobicContact CG-CD1 3.7Å; F31-L108 HydrophobicContact CZ-CB 4.34Å; F31-F111 HydrophobicContact CB-CD1 3.77Å; F31-F111 HydrophobicContact CB-CD2 4.34Å; F31-F111 HydrophobicContact CB-CE1 3.84Å; F31-F111 HydrophobicContact CB-CE2 4.38Å; F31-F111 HydrophobicContact CB-CG 4.03Å; F31-F111 HydrophobicContact CB-CZ 4.13Å; F31-F111 HydrophobicContact CD2-CB 3.64Å; F31-F111 HydrophobicContact CD2-CD1 4.19Å; F31-F111 AromaticContact CD2-CD2 3.66Å; F31-F111 HydrophobicContact CD2-CD2 3.66Å; F31-F111 HydrophobicContact CD2-CE2 4.33Å; F31-F111 AromaticContact CD2-CG 3.56Å; F31-F111 HydrophobicContact CD2-CG 3.56Å; F31-F111 HydrophobicContact CE2-CB 4.1Å; F31-F111 HydrophobicContact CE2-CG 4.45Å; F31-F111 HydrophobicContact CG-CB 4.45Å; F31-F111 HydrophobicContact CG-CD1 4.38Å; F31-F111 HydrophobicContact CG-CD2 4.49Å; F31-F111 HydrophobicContact CG-CG 4.2Å
32	L	87.8	Confident	86	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-57.1	-47.4	179.1	-177.6	63.1	0	0	0	110.9	A28 E34 E36 F40 L42 L50 F97 L101 W386	A28-L32 WeakPolarHBondContact O-CB 3.5Å; A28-L32 PolarHBondContact O-N 3.3Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.28Å; L32-E36 HydrophobicContact CD1-CB 3.86Å; L32-E36 HydrophobicContact CD1-CG 4.21Å; L32-E36 HydrophobicContact CG-CB 4.46Å; L32-E36 WeakPolarHBondContact O-CB 3.24Å; L32-E36 PolarHBondContact O-N 3.46Å; L32-F40 HydrophobicContact CD1-CE2 3.92Å; L32-F40 HydrophobicContact CD1-CZ 4.01Å; L32-L42 HydrophobicContact CD1-CD1 3.45Å; L32-L42 VanDerWaalsContact CD1-CD1 3.45Å; L32-L42 HydrophobicContact CD1-CG 4.25Å; L32-L50 HydrophobicContact CD2-CD1 4.06Å; L32-F97 HydrophobicContact CD2-CE2 4.31Å; L32-F97 HydrophobicContact CD2-CZ 3.76Å; L32-L101 HydrophobicContact CB-CD2 4.05Å; L32-L101 HydrophobicContact CD1-CD1 3.96Å; L32-W386 HydrophobicContact CD2-CD2 4.04Å; L32-W386 VanDerWaalsContact CD2-CE2 3.44Å; L32-W386 HydrophobicContact CD2-CG 4.46Å; L32-W386 HydrophobicContact CD2-CH2 4.39Å; L32-W386 HydrophobicContact CD2-CZ2 3.66Å; L32-W386 HydrophobicContact CG-CG 4.47Å
33	K	82.4	Confident	85.9	Confident	73 Å²	73	55.4 Å²	55.4	32%	0.317	28%	0.278	S	S	.	.	H	α-helix	trans	-58.5	-40.5	177.2	173.2	172.1	-175.2	175.9	0	113.7	A29 K30 F31 W386	A29-K33 VanDerWaalsContact O-CB 3.26Å; A29-K33 WeakPolarHBondContact O-CB 3.4Å; A29-K33 PolarHBondContact O-N 2.72Å; K30-K33 WeakPolarHBondContact O-CB 3.35Å; K30-K33 PolarHBondContact O-N 2.85Å; F31-K33 VanDerWaalsContact C-N 3.31Å; F31-K33 PolarHBondContact O-N 2.82Å; K33-W386 HydrophobicContact CB-CB 3.99Å; K33-W386 WeakPolarHBondContact CD-O 2.96Å; K33-W386 WeakPolarHBondContact CE-O 3.5Å; K33-W386 HydrophobicContact CG-CB 4.28Å; K33-W386 WeakPolarHBondContact CG-O 3.36Å
34	E	82.4	Confident	85.9	Confident	81 Å²	81	56.9 Å²	56.9	38%	0.379	28%	0.282	S	S	.	.	H	α-helix	trans	-82.4	-33.4	-174	-74.5	180	-170.7	0	0	113.3	K30 F31 L32 K38	K30-E34 WeakPolarHBondContact CE-OE1 3.33Å; K30-E34 WeakPolarHBondContact CG-OE1 3.12Å; K30-E34 WeakPolarHBondContact O-CB 3.32Å; K30-E34 WeakPolarHBondContact O-CG 3.35Å; K30-E34 PolarHBondContact O-N 3.42Å; F31-E34 PolarHBondContact O-N 2.86Å; F31-E34 VanDerWaalsContact O-N 3.14Å; L32-E34 VanDerWaalsContact C-N 3.33Å; L32-E34 PolarHBondContact O-N 3.28Å; E34-K38 WeakPolarHBondContact O-CD 3.05Å; E34-K38 PolarHBondContact O-NZ 2.97Å; E34-K38 VanDerWaalsContact O-NZ 3.16Å
35	K	83.8	Confident	85.8	Confident	85 Å²	85	58.2 Å²	58.2	37%	0.37	29%	0.292	S	S	.	.	H	α-helix	trans	-105.6	-29	-169.1	-60	-65.1	-174.6	173.5	0	113.8	F31 G37 K38 A39 F40	F31-K35 HydrophobicContact CD2-CB 4.5Å; F31-K35 HydrophobicContact CD2-CG 3.74Å; F31-K35 HydrophobicContact CE2-CB 4.33Å; F31-K35 HydrophobicContact CE2-CG 3.72Å; F31-K35 HydrophobicContact CG-CG 4.37Å; F31-K35 HydrophobicContact CZ-CB 4.44Å; F31-K35 HydrophobicContact CZ-CG 4.31Å; F31-K35 VanDerWaalsContact O-CB 3.28Å; F31-K35 WeakPolarHBondContact O-CB 3.39Å; F31-K35 WeakPolarHBondContact O-CG 3.38Å; F31-K35 PolarHBondContact O-N 3.4Å; K35-G37 PolarHBondContact O-N 2.89Å; K35-K38 PolarHBondContact O-N 2.61Å; K35-A39 HydrophobicContact CB-CB 4.18Å; K35-A39 HydrophobicContact CD-CB 4.18Å; K35-A39 PolarHBondContact O-N 2.65Å; K35-F40 HydrophobicContact CB-CD1 4.02Å; K35-F40 HydrophobicContact CB-CE1 3.37Å; K35-F40 HydrophobicContact CB-CZ 4.14Å; K35-F40 HydrophobicContact CG-CE1 4.49Å; K35-F40 PolarHBondContact O-N 3.07Å
36	E	82.6	Confident	85.7	Confident	13 Å²	13	57.3 Å²	57.3	6%	0.061	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-63.3	132	175.3	-169.9	-99.3	-179.1	0	0	110.2	L32 K38 F40 L42 R47 R387	L32-E36 HydrophobicContact CD1-CB 3.86Å; L32-E36 HydrophobicContact CD1-CG 4.21Å; L32-E36 HydrophobicContact CG-CB 4.46Å; L32-E36 WeakPolarHBondContact O-CB 3.24Å; L32-E36 PolarHBondContact O-N 3.46Å; E36-K38 PolarHBondContact O-N 3.41Å; E36-F40 HydrophobicContact CB-CE2 4.1Å; E36-F40 HydrophobicContact CB-CZ 4.37Å; E36-F40 HydrophobicContact CG-CE2 4.38Å; E36-L42 HydrophobicContact CG-CG 4.46Å; E36-R47 WeakPolarHBondContact OE1-CD 3.5Å; E36-R387 PolarHBondContact O-NH2 3.35Å; E36-R387 IonicContact OE2-CZ 3.68Å; E36-R387 IonicContact OE2-NH2 2.79Å; E36-R387 PolarHBondContact OE2-NH2 3.44Å
37	G	73.3	Confident	85.7	Confident	29 Å²	29	54.3 Å²	54.3	30%	0.299	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.2	-1.6	-174.3	0	0	0	0	0	115.5	K35 F40	K35-G37 PolarHBondContact O-N 2.89Å; G37-F40 PolarHBondContact N-O 2.91Å
38	K	76.4	Confident	85.6	Confident	148 Å²	148	53.6 Å²	53.6	64%	0.643	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-53.2	176	-60	-174.8	-163.1	151.8	0	112.4	E34 K35 E36	E34-K38 WeakPolarHBondContact O-CD 3.05Å; E34-K38 PolarHBondContact O-NZ 2.97Å; E34-K38 VanDerWaalsContact O-NZ 3.16Å; K35-K38 PolarHBondContact O-N 2.61Å; E36-K38 PolarHBondContact O-N 3.41Å
39	A	77.4	Confident	85.6	Confident	76 Å²	76	58.6 Å²	58.6	63%	0.628	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-32.2	-179.6	0	0	0	0	0	111.8	K35	K35-A39 HydrophobicContact CB-CB 4.18Å; K35-A39 HydrophobicContact CD-CB 4.18Å; K35-A39 PolarHBondContact O-N 2.65Å
40	F	81.9	Confident	85.8	Confident	35 Å²	35	57.8 Å²	57.8	15%	0.154	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-150.1	162.4	178.3	62.1	-93.3	0	0	0	111.4	F31 L32 K35 E36 G37 L42 C105	F31-F40 HydrophobicContact CD1-CE1 4.39Å; F31-F40 HydrophobicContact CD1-CZ 4.32Å; F31-F40 AromaticContact CE1-CE1 3.53Å; F31-F40 HydrophobicContact CE1-CE1 3.53Å; F31-F40 AromaticContact CE1-CZ 3.71Å; F31-F40 HydrophobicContact CE1-CZ 3.71Å; F31-F40 AromaticContact CZ-CE1 3.67Å; F31-F40 HydrophobicContact CZ-CE1 3.67Å; F31-F40 HydrophobicContact CZ-CZ 4.33Å; L32-F40 HydrophobicContact CD1-CE2 3.92Å; L32-F40 HydrophobicContact CD1-CZ 4.01Å; K35-F40 HydrophobicContact CB-CD1 4.02Å; K35-F40 HydrophobicContact CB-CE1 3.37Å; K35-F40 HydrophobicContact CB-CZ 4.14Å; K35-F40 HydrophobicContact CG-CE1 4.49Å; K35-F40 PolarHBondContact O-N 3.07Å; E36-F40 HydrophobicContact CB-CE2 4.1Å; E36-F40 HydrophobicContact CB-CZ 4.37Å; E36-F40 HydrophobicContact CG-CE2 4.38Å; G37-F40 PolarHBondContact N-O 2.91Å; F40-L42 HydrophobicContact CD2-CD2 3.94Å; F40-L42 HydrophobicContact CD2-CG 4.1Å; F40-L42 HydrophobicContact CE2-CD1 4.46Å; F40-L42 HydrophobicContact CE2-CD2 3.75Å; F40-L42 HydrophobicContact CE2-CG 3.81Å; F40-C105 VanDerWaalsContact CE2-SG 3.55Å
41	H	83.7	Confident	85.9	Confident	150 Å²	150	54.7 Å²	54.7	69%	0.694	28%	0.277	S	S	*	.			trans	-122.3	125.8	171.3	-70	-88.5	0	0	0	109.3
42	L	86.7	Confident	85.9	Confident	11 Å²	11	54.4 Å²	54.4	6%	0.058	28%	0.276	C	S	.	.			trans	-79	147.2	175.1	-67.1	-177.1	0	0	0	111	L32 E36 F40 T46 R47 L50 I104	L32-L42 HydrophobicContact CD1-CD1 3.45Å; L32-L42 VanDerWaalsContact CD1-CD1 3.45Å; L32-L42 HydrophobicContact CD1-CG 4.25Å; E36-L42 HydrophobicContact CG-CG 4.46Å; F40-L42 HydrophobicContact CD2-CD2 3.94Å; F40-L42 HydrophobicContact CD2-CG 4.1Å; F40-L42 HydrophobicContact CE2-CD1 4.46Å; F40-L42 HydrophobicContact CE2-CD2 3.75Å; F40-L42 HydrophobicContact CE2-CG 3.81Å; L42-T46 HydrophobicContact CD1-CG2 4.22Å; L42-T46 HydrophobicContact CD2-CG2 4.37Å; L42-R47 HydrophobicContact CB-CG 3.44Å; L42-R47 VanDerWaalsContact CB-CG 3.44Å; L42-R47 HydrophobicContact CD1-CG 4.04Å; L42-R47 HydrophobicContact CG-CG 4.37Å; L42-R47 PolarHBondContact O-NE 2.97Å; L42-L50 HydrophobicContact CD1-CD1 3.65Å; L42-I104 HydrophobicContact CD2-CG2 3.64Å
43	A	89.4	Confident	86.2	Confident	61 Å²	61	54.6 Å²	54.6	50%	0.504	28%	0.277	S	S	.	.			trans	-55.6	148.6	167.9	0	0	0	0	0	110.7	D45 T46 R47	A43-D45 PolarHBondContact O-N 2.85Å; A43-T46 PolarHBondContact O-N 2.98Å; A43-R47 WeakPolarHBondContact O-CG 3.36Å; A43-R47 PolarHBondContact O-N 3.28Å
44	Y	88.3	Confident	86.6	Confident	73 Å²	73	51.7 Å²	51.7	29%	0.286	27%	0.266	S	S	.	.	H	α-helix	trans	-55.9	-49.8	-177.3	178.8	-93.9	0	0	0	112	T46 R47 V48 F74 D77	Y44-T46 VanDerWaalsContact C-N 3.32Å; Y44-T46 PolarHBondContact O-N 2.7Å; Y44-R47 WeakPolarHBondContact O-CB 3.36Å; Y44-R47 PolarHBondContact O-N 2.93Å; Y44-V48 HydrophobicContact CD1-CG2 4.09Å; Y44-V48 HydrophobicContact CE1-CG2 3.68Å; Y44-V48 HydrophobicContact CE2-CG2 4.46Å; Y44-V48 WeakPolarHBondContact O-CG2 3.28Å; Y44-V48 PolarHBondContact O-N 3.01Å; Y44-F74 HydrophobicContact CD2-CD2 4.45Å; Y44-F74 AromaticContact CE2-CD2 3.75Å; Y44-F74 HydrophobicContact CE2-CD2 3.75Å; Y44-F74 WeakPolarHBondContact OH-CA 3.29Å; Y44-D77 WeakPolarHBondContact CE1-OD2 3.27Å; Y44-D77 PolarHBondContact OH-OD2 3.2Å
45	D	90.3	Very high	86.7	Confident	103 Å²	103	48.8 Å²	48.8	55%	0.551	25%	0.252	S	S	*	.	H	α-helix	trans	-62.6	-38.7	-178.2	-56.7	-44.6	0	0	0	112.4	A43 V48 R49	A43-D45 PolarHBondContact O-N 2.85Å; D45-V48 WeakPolarHBondContact O-CB 3.33Å; D45-V48 PolarHBondContact O-N 2.88Å; D45-R49 WeakPolarHBondContact O-CG 3.35Å; D45-R49 PolarHBondContact O-N 3.38Å
46	T	91.5	Very high	87.1	Confident	11 Å²	11	44.8 Å²	44.8	7%	0.067	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-44.3	173.2	-58.3	0	0	0	0	111.2	L42 A43 Y44 V48 R49 L50 E100 I104	L42-T46 HydrophobicContact CD1-CG2 4.22Å; L42-T46 HydrophobicContact CD2-CG2 4.37Å; A43-T46 PolarHBondContact O-N 2.98Å; Y44-T46 VanDerWaalsContact C-N 3.32Å; Y44-T46 PolarHBondContact O-N 2.7Å; T46-V48 VanDerWaalsContact C-N 3.29Å; T46-V48 PolarHBondContact O-N 2.99Å; T46-R49 PolarHBondContact O-N 3.02Å; T46-R49 PolarHBondContact OG1-NH2 2.93Å; T46-L50 HydrophobicContact CG2-CD1 3.91Å; T46-L50 HydrophobicContact CG2-CG 4.17Å; T46-L50 WeakPolarHBondContact O-CB 3.48Å; T46-L50 WeakPolarHBondContact O-CG 3.41Å; T46-L50 PolarHBondContact O-N 2.97Å; T46-E100 HydrophobicContact CG2-CG 4.48Å; T46-I104 HydrophobicContact CG2-CD1 3.26Å
47	R	89.3	Confident	87.4	Confident	72 Å²	72	44.6 Å²	44.6	27%	0.272	23%	0.234	S	C	.	.	H	α-helix	trans	-60.8	-41.9	177.9	-70.2	-173.5	-67	149.5	2.5	111.4	E36 L42 A43 Y44 A51 F74 L385	E36-R47 WeakPolarHBondContact OE1-CD 3.5Å; L42-R47 HydrophobicContact CB-CG 3.44Å; L42-R47 VanDerWaalsContact CB-CG 3.44Å; L42-R47 HydrophobicContact CD1-CG 4.04Å; L42-R47 HydrophobicContact CG-CG 4.37Å; L42-R47 PolarHBondContact O-NE 2.97Å; A43-R47 WeakPolarHBondContact O-CG 3.36Å; A43-R47 PolarHBondContact O-N 3.28Å; Y44-R47 WeakPolarHBondContact O-CB 3.36Å; Y44-R47 PolarHBondContact O-N 2.93Å; R47-A51 WeakPolarHBondContact O-CB 3.16Å; R47-A51 PolarHBondContact O-N 3.41Å; R47-F74 HydrophobicContact CB-CE2 3.98Å; R47-F74 HydrophobicContact CB-CZ 4.41Å; R47-L385 HydrophobicContact CB-CD1 4Å
48	V	90.3	Very high	87.9	Confident	10 Å²	10	47.2 Å²	47.2	6%	0.061	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-50.9	175.3	169	0	0	0	0	110.7	Y44 D45 T46 A51 A52 F74 D77	Y44-V48 HydrophobicContact CD1-CG2 4.09Å; Y44-V48 HydrophobicContact CE1-CG2 3.68Å; Y44-V48 HydrophobicContact CE2-CG2 4.46Å; Y44-V48 WeakPolarHBondContact O-CG2 3.28Å; Y44-V48 PolarHBondContact O-N 3.01Å; D45-V48 WeakPolarHBondContact O-CB 3.33Å; D45-V48 PolarHBondContact O-N 2.88Å; T46-V48 VanDerWaalsContact C-N 3.29Å; T46-V48 PolarHBondContact O-N 2.99Å; V48-A51 PolarHBondContact O-N 3.31Å; V48-A52 PolarHBondContact O-N 3.01Å; V48-F74 HydrophobicContact CB-CE2 4.29Å; V48-F74 HydrophobicContact CB-CZ 4.42Å; V48-F74 HydrophobicContact CG2-CD2 3.78Å; V48-F74 HydrophobicContact CG2-CE2 3.43Å; V48-F74 VanDerWaalsContact CG2-CE2 3.43Å; V48-F74 HydrophobicContact CG2-CZ 3.95Å; V48-D77 VanDerWaalsContact CG1-C 3.44Å; V48-D77 HydrophobicContact CG1-CB 3.93Å; V48-D77 WeakPolarHBondContact CG1-O 3.29Å; V48-D77 HydrophobicContact CG2-CB 3.99Å
49	R	93.2	Very high	88.2	Confident	105 Å²	105	43.8 Å²	43.8	40%	0.396	24%	0.242	S	C	.	.	H	α-helix	trans	-63.4	-47.5	179.9	-73.7	-168.3	-59.4	-102.4	0.2	113.2	D45 T46 A51 A52 L53 E100	D45-R49 WeakPolarHBondContact O-CG 3.35Å; D45-R49 PolarHBondContact O-N 3.38Å; T46-R49 PolarHBondContact O-N 3.02Å; T46-R49 PolarHBondContact OG1-NH2 2.93Å; R49-A51 VanDerWaalsContact C-N 3.29Å; R49-A51 PolarHBondContact O-N 2.79Å; R49-A52 WeakPolarHBondContact O-CB 3.3Å; R49-A52 PolarHBondContact O-N 2.83Å; R49-A52 VanDerWaalsContact O-N 3.14Å; R49-L53 WeakPolarHBondContact O-CG 3.44Å; R49-L53 PolarHBondContact O-N 2.79Å; R49-E100 IonicContact CZ-OE1 3.48Å; R49-E100 VanDerWaalsContact CZ-OE1 3.26Å; R49-E100 IonicContact NE-OE1 3.13Å; R49-E100 PolarHBondContact NE-OE1 2.88Å; R49-E100 IonicContact NE-OE2 3.82Å; R49-E100 IonicContact NH2-OE1 2.89Å; R49-E100 PolarHBondContact NH2-OE1 3.28Å
50	L	93.3	Very high	88.7	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62	-38.1	176.7	-69.4	-179.9	0	0	0	111.5	L32 L42 T46 L53 S54 F97 E100 L101 W386	L32-L50 HydrophobicContact CD2-CD1 4.06Å; L42-L50 HydrophobicContact CD1-CD1 3.65Å; T46-L50 HydrophobicContact CG2-CD1 3.91Å; T46-L50 HydrophobicContact CG2-CG 4.17Å; T46-L50 WeakPolarHBondContact O-CB 3.48Å; T46-L50 WeakPolarHBondContact O-CG 3.41Å; T46-L50 PolarHBondContact O-N 2.97Å; L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.9Å; L50-S54 PolarHBondContact O-N 2.75Å; L50-S54 PolarHBondContact O-OG 2.95Å; L50-F97 HydrophobicContact CB-CD2 4.13Å; L50-F97 HydrophobicContact CB-CE2 3.84Å; L50-F97 HydrophobicContact CD2-CD2 3.74Å; L50-F97 HydrophobicContact CD2-CE2 4.03Å; L50-F97 HydrophobicContact CD2-CG 4.08Å; L50-F97 HydrophobicContact CG-CE2 4.41Å; L50-F97 WeakPolarHBondContact O-CD2 3.34Å; L50-E100 HydrophobicContact CD2-CB 4.12Å; L50-E100 HydrophobicContact CD2-CG 4.24Å; L50-L101 HydrophobicContact CD1-CD1 4.21Å; L50-W386 HydrophobicContact CB-CZ2 4.29Å
51	A	88.8	Confident	89.1	Confident	6 Å²	6	42.3 Å²	42.3	5%	0.05	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-38	174.7	0	0	0	0	0	112.3	R47 V48 R49 K55 F74 R78 W386	R47-A51 WeakPolarHBondContact O-CB 3.16Å; R47-A51 PolarHBondContact O-N 3.41Å; V48-A51 PolarHBondContact O-N 3.31Å; R49-A51 VanDerWaalsContact C-N 3.29Å; R49-A51 PolarHBondContact O-N 2.79Å; A51-K55 PolarHBondContact O-N 3.38Å; A51-F74 HydrophobicContact CB-CE1 3.93Å; A51-F74 HydrophobicContact CB-CZ 3.82Å; A51-R78 HydrophobicContact CB-CG 3.84Å; A51-W386 HydrophobicContact CB-CZ2 4.31Å
52	A	91.3	Very high	89.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-43.6	174.3	0	0	0	0	0	112	V48 R49 S54 K55 Q56 R78 W82 L85	V48-A52 PolarHBondContact O-N 3.01Å; R49-A52 WeakPolarHBondContact O-CB 3.3Å; R49-A52 PolarHBondContact O-N 2.83Å; R49-A52 VanDerWaalsContact O-N 3.14Å; A52-S54 PolarHBondContact O-N 3.02Å; A52-K55 WeakPolarHBondContact O-CB 3.44Å; A52-K55 PolarHBondContact O-N 2.83Å; A52-K55 VanDerWaalsContact O-N 3.16Å; A52-Q56 PolarHBondContact O-N 3.25Å; A52-R78 HydrophobicContact CB-CG 4.25Å; A52-W82 HydrophobicContact CB-CB 3.94Å; A52-L85 HydrophobicContact CB-CD1 4.24Å
53	L	94.1	Very high	88.7	Confident	4 Å²	4	41 Å²	41	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-43	175	-73.2	166.1	0	0	0	111.6	R49 L50 K55 Q56 V57 L85 M88 A93 Q96 F97	R49-L53 WeakPolarHBondContact O-CG 3.44Å; R49-L53 PolarHBondContact O-N 2.79Å; L50-L53 HydrophobicContact CD2-CD1 4.41Å; L50-L53 PolarHBondContact O-N 2.9Å; L53-K55 VanDerWaalsContact C-N 3.29Å; L53-K55 PolarHBondContact O-N 2.96Å; L53-Q56 WeakPolarHBondContact O-CB 3.31Å; L53-Q56 PolarHBondContact O-N 3.23Å; L53-V57 WeakPolarHBondContact O-CG2 3.47Å; L53-V57 PolarHBondContact O-N 3.36Å; L53-L85 HydrophobicContact CD2-CD1 4.02Å; L53-L85 HydrophobicContact CD2-CD2 4.1Å; L53-L85 HydrophobicContact CG-CD1 4.4Å; L53-M88 HydrophobicContact CD2-SD 4.1Å; L53-A93 HydrophobicContact CD2-CB 4.28Å; L53-Q96 HydrophobicContact CD1-CB 4Å; L53-Q96 HydrophobicContact CD2-CB 3.88Å; L53-F97 HydrophobicContact CB-CB 4.2Å; L53-F97 HydrophobicContact CB-CD2 4.17Å; L53-F97 HydrophobicContact CD1-CB 4.31Å
54	S	90	Very high	87.7	Confident	13 Å²	13	40.4 Å²	40.4	9%	0.091	23%	0.227	C	C	.	.	H	α-helix	trans	-63.2	-34.8	174.4	-76	0	0	0	0	113.2	Y25 L50 A52 V57 S58 F97 W386	Y25-S54 WeakPolarHBondContact OH-CA 3.41Å; Y25-S54 WeakPolarHBondContact OH-CB 3.36Å; Y25-S54 PolarHBondContact OH-OG 3.4Å; L50-S54 PolarHBondContact O-N 2.75Å; L50-S54 PolarHBondContact O-OG 2.95Å; A52-S54 PolarHBondContact O-N 3.02Å; S54-V57 PolarHBondContact O-N 3.44Å; S54-S58 PolarHBondContact O-N 2.98Å; S54-S58 PolarHBondContact O-OG 2.89Å; S54-F97 WeakPolarHBondContact OG-CE2 3.38Å; S54-W386 WeakPolarHBondContact OG-CH2 3.27Å; S54-W386 VanDerWaalsContact OG-CZ3 3.27Å; S54-W386 WeakPolarHBondContact OG-CZ3 3.45Å
55	K	85.4	Confident	86.7	Confident	19 Å²	19	38.7 Å²	38.7	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-64.8	-43.9	171.7	-82.4	-69.3	-164.4	167.7	0	111.9	A51 A52 L53 V57 S58 C59 W82	A51-K55 PolarHBondContact O-N 3.38Å; A52-K55 WeakPolarHBondContact O-CB 3.44Å; A52-K55 PolarHBondContact O-N 2.83Å; A52-K55 VanDerWaalsContact O-N 3.16Å; L53-K55 VanDerWaalsContact C-N 3.29Å; L53-K55 PolarHBondContact O-N 2.96Å; K55-V57 PolarHBondContact O-N 3.23Å; K55-S58 PolarHBondContact O-N 2.7Å; K55-S58 PolarHBondContact O-OG 3.07Å; K55-C59 WeakPolarHBondContact O-CB 3.08Å; K55-C59 PolarHBondContact O-N 2.89Å; K55-W82 HydrophobicContact CB-CD2 3.56Å; K55-W82 HydrophobicContact CB-CE3 3.7Å; K55-W82 HydrophobicContact CB-CG 4.16Å; K55-W82 HydrophobicContact CB-CH2 4.1Å; K55-W82 HydrophobicContact CB-CZ2 3.95Å; K55-W82 HydrophobicContact CB-CZ3 3.97Å; K55-W82 HydrophobicContact CD-CE3 4.25Å; K55-W82 HydrophobicContact CD-CH2 4.05Å; K55-W82 HydrophobicContact CD-CZ3 3.82Å; K55-W82 HydrophobicContact CG-CD2 4.32Å; K55-W82 HydrophobicContact CG-CE3 3.95Å; K55-W82 HydrophobicContact CG-CH2 4.48Å; K55-W82 HydrophobicContact CG-CZ3 4.05Å
56	Q	90.7	Very high	85.3	Confident	2 Å²	2	35.2 Å²	35.2	1%	0.009	22%	0.215	C	C	.	.	H	α-helix	trans	-57.1	-39.3	173.4	-165.5	77.6	7.9	0	0	111.7	A52 L53 G60 L85 G86 M88 A93	A52-Q56 PolarHBondContact O-N 3.25Å; L53-Q56 WeakPolarHBondContact O-CB 3.31Å; L53-Q56 PolarHBondContact O-N 3.23Å; Q56-G60 WeakPolarHBondContact CA-O 3.4Å; Q56-G60 WeakPolarHBondContact O-CA 3.21Å; Q56-G60 PolarHBondContact O-N 2.92Å; Q56-G60 PolarHBondContact OE1-O 2.84Å; Q56-L85 HydrophobicContact CB-CD1 3.89Å; Q56-L85 HydrophobicContact CG-CD1 4.32Å; Q56-G86 PolarHBondContact NE2-O 2.95Å; Q56-M88 HydrophobicContact CG-CB 4.28Å; Q56-M88 PolarHBondContact NE2-O 3.35Å; Q56-A93 HydrophobicContact CB-CB 3.86Å; Q56-A93 HydrophobicContact CG-CB 3.77Å
57	V	89.1	Confident	83.9	Confident	9 Å²	9	41.5 Å²	41.5	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-71.2	-37.3	179	173	0	0	0	0	112.9	Y25 L53 S54 K55 K90 A93 M94	Y25-V57 HydrophobicContact CD1-CG1 4.22Å; Y25-V57 HydrophobicContact CE1-CB 4.4Å; Y25-V57 HydrophobicContact CE1-CG1 3.6Å; Y25-V57 HydrophobicContact CE2-CG1 4.5Å; Y25-V57 HydrophobicContact CE2-CG2 4.2Å; L53-V57 WeakPolarHBondContact O-CG2 3.47Å; L53-V57 PolarHBondContact O-N 3.36Å; S54-V57 PolarHBondContact O-N 3.44Å; K55-V57 PolarHBondContact O-N 3.23Å; V57-K90 HydrophobicContact CG1-CG 4.26Å; V57-K90 WeakPolarHBondContact O-CE 3.19Å; V57-K90 PolarHBondContact O-NZ 2.86Å; V57-A93 HydrophobicContact CG2-CB 3.64Å; V57-M94 HydrophobicContact CB-CG 4.48Å; V57-M94 HydrophobicContact CG1-CE 3.5Å; V57-M94 HydrophobicContact CG1-CG 3.92Å; V57-M94 HydrophobicContact CG2-CB 4.43Å; V57-M94 HydrophobicContact CG2-CG 3.62Å
58	S	84	Confident	82.8	Confident	83 Å²	83	39.4 Å²	39.4	58%	0.58	24%	0.239	S	C	*	.	H	α-helix	trans	-82.2	-42.6	-177.1	60.9	0	0	0	0	113	S54 K55	S54-S58 PolarHBondContact O-N 2.98Å; S54-S58 PolarHBondContact O-OG 2.89Å; K55-S58 PolarHBondContact O-N 2.7Å; K55-S58 PolarHBondContact O-OG 3.07Å
59	C	83	Confident	81.3	Confident	76 Å²	76	41.4 Å²	41.4	51%	0.514	26%	0.262	S	S	.	.	H	α-helix	trans	-116.1	-14.6	-167.2	-58.1	0	0	0	0	113.1	K55 W82	K55-C59 WeakPolarHBondContact O-CB 3.08Å; K55-C59 PolarHBondContact O-N 2.89Å; C59-W82 HydrophobicContact CB-CH2 3.85Å; C59-W82 HydrophobicContact CB-CZ2 3.78Å
60	G	88.1	Confident	79.8	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	29%	0.286	C	S	.	.			trans	85.6	-160.1	-171.5	0	0	0	0	0	112.5	Q56 W82	Q56-G60 WeakPolarHBondContact CA-O 3.4Å; Q56-G60 WeakPolarHBondContact O-CA 3.21Å; Q56-G60 PolarHBondContact O-N 2.92Å; Q56-G60 PolarHBondContact OE1-O 2.84Å; G60-W82 WeakPolarHBondContact O-CZ2 3.26Å; G60-W82 PolarHBondContact O-NE1 3.18Å
61	P	89.9	Confident	78	Confident	60 Å²	60	53.7 Å²	53.7	39%	0.39	33%	0.325	S	S	.	.	S	Bend	trans	-56.7	148.4	177.9	-25.1	36.1	0	0	0	112.8	T63 G86	P61-T63 PolarHBondContact O-N 2.94Å; P61-G86 WeakPolarHBondContact CB-O 3.21Å
62	Y	84.2	Confident	77.2	Confident	41 Å²	41	54.7 Å²	54.7	16%	0.161	33%	0.329	C	S	.	.			trans	-58.1	133.2	176.4	178.1	-83.7	0	0	0	111.5	A64 C66 N79 W82 R83	Y62-A64 PolarHBondContact OH-O 3.25Å; Y62-C66 HydrophobicContact CD2-CB 4.06Å; Y62-C66 HydrophobicContact CE2-CB 3.52Å; Y62-N79 HydrophobicContact CD2-CB 4.38Å; Y62-N79 HydrophobicContact CE2-CB 3.84Å; Y62-W82 HydrophobicContact CD2-CB 4.49Å; Y62-W82 AromaticContact CD2-CD2 3.96Å; Y62-W82 HydrophobicContact CD2-CD2 3.96Å; Y62-W82 AromaticContact CD2-CE3 3.63Å; Y62-W82 HydrophobicContact CD2-CE3 3.63Å; Y62-W82 HydrophobicContact CD2-CG 4.36Å; Y62-W82 HydrophobicContact CD2-CZ3 4.08Å; Y62-W82 HydrophobicContact CE2-CE3 4.41Å; Y62-W82 HydrophobicContact CG-CD2 4.5Å; Y62-R83 HydrophobicContact CD1-CG 3.3Å; Y62-R83 HydrophobicContact CD2-CG 3.87Å; Y62-R83 HydrophobicContact CE1-CG 3.71Å; Y62-R83 HydrophobicContact CE2-CG 4.22Å; Y62-R83 HydrophobicContact CG-CB 4.48Å; Y62-R83 HydrophobicContact CG-CG 3.42Å; Y62-R83 VanDerWaalsContact CG-CG 3.42Å; Y62-R83 PolarHBondContact OH-NH2 3.4Å
63	T	78	Confident	76.6	Confident	92 Å²	92	63.6 Å²	63.6	56%	0.564	36%	0.363	S	S	*	.			trans	-116.3	152.5	171.4	55.2	0	0	0	0	110.3	P61 G65 C66	P61-T63 PolarHBondContact O-N 2.94Å; T63-G65 VanDerWaalsContact C-N 3.29Å; T63-G65 PolarHBondContact O-N 3.26Å; T63-C66 WeakPolarHBondContact O-CB 3.46Å; T63-C66 PolarHBondContact O-N 3.45Å; T63-C66 VanDerWaalsContact O-N 3.15Å
64	A	69.4	Low	76	Confident	48 Å²	48	64.5 Å²	64.5	40%	0.397	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-42.1	-171.7	0	0	0	0	0	113.7	Y62 C66 E67	Y62-A64 PolarHBondContact OH-O 3.25Å; A64-C66 PolarHBondContact O-N 2.95Å; A64-E67 WeakPolarHBondContact O-CG 3.12Å
65	G	65.8	Low	75.5	Confident	38 Å²	38	63.9 Å²	63.9	39%	0.392	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-2	-178.5	0	0	0	0	0	116.7	T63 E67	T63-G65 VanDerWaalsContact C-N 3.29Å; T63-G65 PolarHBondContact O-N 3.26Å; G65-E67 PolarHBondContact O-N 3.37Å; G65-E67 VanDerWaalsContact O-N 3.09Å
66	C	61.8	Low	75.3	Confident	29 Å²	29	67.6 Å²	67.6	20%	0.196	38%	0.38	C	S	.	.			trans	-79.4	29.6	175.1	-67.5	0	0	0	0	113.1	Y62 T63 A64 N79 W82	Y62-C66 HydrophobicContact CD2-CB 4.06Å; Y62-C66 HydrophobicContact CE2-CB 3.52Å; T63-C66 WeakPolarHBondContact O-CB 3.46Å; T63-C66 PolarHBondContact O-N 3.45Å; T63-C66 VanDerWaalsContact O-N 3.15Å; A64-C66 PolarHBondContact O-N 2.95Å; C66-N79 PolarHBondContact O-ND2 2.88Å; C66-W82 HydrophobicContact CB-CH2 4.5Å; C66-W82 HydrophobicContact CB-CZ3 3.91Å
67	E	63.2	Low	75.1	Confident	143 Å²	143	69.6 Å²	69.6	67%	0.668	39%	0.391	S	S	*	.			trans	-67.6	150	-174.5	-66.3	-151.4	144.2	0	0	114.2	A64 G65	A64-E67 WeakPolarHBondContact O-CG 3.12Å; G65-E67 PolarHBondContact O-N 3.37Å; G65-E67 VanDerWaalsContact O-N 3.09Å
68	V	65.9	Low	75.1	Confident	29 Å²	29	69.4 Å²	69.4	18%	0.176	39%	0.389	C	S	.	.			trans	-105.1	146.2	-179.8	-47.5	0	0	0	0	111.7	D72 G75 H76 N79 E264	V68-D72 HydrophobicContact CB-CB 4.39Å; V68-G75 WeakPolarHBondContact CG1-O 3.34Å; V68-H76 HydrophobicContact CG2-CB 3.79Å; V68-N79 WeakPolarHBondContact CG1-ND2 3.32Å; V68-E264 WeakPolarHBondContact CA-OE1 3.36Å; V68-E264 WeakPolarHBondContact CB-OE1 3.29Å; V68-E264 WeakPolarHBondContact CG1-OE1 3.39Å; V68-E264 VanDerWaalsContact CG1-OE2 3.3Å; V68-E264 WeakPolarHBondContact CG1-OE2 3.34Å
69	G	57.2	Low	75.2	Confident	52 Å²	52	65.5 Å²	65.5	54%	0.536	36%	0.361	S	S	.	.			trans	-59	146.8	173.9	0	0	0	0	0	112.1	L71 D72	G69-L71 PolarHBondContact O-N 2.87Å; G69-D72 PolarHBondContact O-N 2.88Å
70	F	62	Low	75.6	Confident	209 Å²	209	65 Å²	65	92%	0.917	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	-27.9	-175.3	178.6	-102	0	0	0	115.5
71	L	55.2	Low	75.8	Confident	153 Å²	153	65 Å²	65	80%	0.801	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-5	-179.9	-64	177.3	0	0	0	114.3	G69 R73	G69-L71 PolarHBondContact O-N 2.87Å; L71-R73 PolarHBondContact O-N 2.95Å
72	D	72.5	Confident	75.9	Confident	27 Å²	27	62.2 Å²	62.2	14%	0.144	33%	0.334	C	S	.	.			trans	-92.9	77.2	-179.9	-170.2	4.6	0	0	0	111.9	V68 G69 F74 G75 H76	V68-D72 HydrophobicContact CB-CB 4.39Å; G69-D72 PolarHBondContact O-N 2.88Å; D72-F74 VanDerWaalsContact C-N 3.26Å; D72-F74 PolarHBondContact O-N 3.25Å; D72-F74 PolarHBondContact OD1-N 3.05Å; D72-G75 VanDerWaalsContact CG-N 3.27Å; D72-G75 PolarHBondContact O-N 2.99Å; D72-G75 PolarHBondContact OD1-N 3.16Å; D72-G75 WeakPolarHBondContact OD2-CA 3.4Å; D72-G75 PolarHBondContact OD2-N 2.84Å; D72-H76 PolarHBondContact O-N 3.25Å
73	R	79.9	Confident	76.3	Confident	187 Å²	187	65.1 Å²	65.1	71%	0.706	35%	0.345	S	S	*	.	H	α-helix	trans	-56.3	-40.8	175.3	-179	178.2	176.8	174.7	1.9	112.4	L71 H76 D77	L71-R73 PolarHBondContact O-N 2.95Å; R73-H76 PolarHBondContact O-N 2.98Å; R73-D77 IonicContact NE-OD2 3.25Å; R73-D77 VanDerWaalsContact O-CG 3.22Å; R73-D77 PolarHBondContact O-N 2.83Å
74	F	80.5	Confident	77.1	Confident	24 Å²	24	65.3 Å²	65.3	11%	0.105	35%	0.35	C	S	.	.	H	α-helix	trans	-66.2	-46.2	-179.9	179.8	-77.1	0	0	0	110.5	Y44 R47 V48 A51 D72 H76 D77 R78 L385	Y44-F74 HydrophobicContact CD2-CD2 4.45Å; Y44-F74 AromaticContact CE2-CD2 3.75Å; Y44-F74 HydrophobicContact CE2-CD2 3.75Å; Y44-F74 WeakPolarHBondContact OH-CA 3.29Å; R47-F74 HydrophobicContact CB-CE2 3.98Å; R47-F74 HydrophobicContact CB-CZ 4.41Å; V48-F74 HydrophobicContact CB-CE2 4.29Å; V48-F74 HydrophobicContact CB-CZ 4.42Å; V48-F74 HydrophobicContact CG2-CD2 3.78Å; V48-F74 HydrophobicContact CG2-CE2 3.43Å; V48-F74 VanDerWaalsContact CG2-CE2 3.43Å; V48-F74 HydrophobicContact CG2-CZ 3.95Å; A51-F74 HydrophobicContact CB-CE1 3.93Å; A51-F74 HydrophobicContact CB-CZ 3.82Å; D72-F74 VanDerWaalsContact C-N 3.26Å; D72-F74 PolarHBondContact O-N 3.25Å; D72-F74 PolarHBondContact OD1-N 3.05Å; F74-H76 PolarHBondContact O-N 3.28Å; F74-D77 PolarHBondContact O-N 3.15Å; F74-R78 HydrophobicContact CD1-CB 4.33Å; F74-R78 HydrophobicContact CE1-CB 3.89Å; F74-R78 HydrophobicContact CE1-CG 4.39Å; F74-R78 WeakPolarHBondContact O-CB 3.42Å; F74-R78 PolarHBondContact O-N 3.39Å; F74-L385 HydrophobicContact CD1-CD2 3.43Å; F74-L385 VanDerWaalsContact CD1-CD2 3.43Å; F74-L385 HydrophobicContact CD2-CD1 4.39Å; F74-L385 HydrophobicContact CD2-CD2 4.4Å; F74-L385 HydrophobicContact CE1-CD1 4.11Å; F74-L385 HydrophobicContact CE1-CD2 2.98Å; F74-L385 HydrophobicContact CE1-CG 4.15Å; F74-L385 HydrophobicContact CE2-CD1 3.6Å; F74-L385 HydrophobicContact CE2-CD2 4Å; F74-L385 HydrophobicContact CE2-CG 4.43Å; F74-L385 HydrophobicContact CG-CD2 4.16Å; F74-L385 HydrophobicContact CZ-CD1 3.43Å; F74-L385 VanDerWaalsContact CZ-CD1 3.43Å; F74-L385 HydrophobicContact CZ-CD2 3.28Å; F74-L385 HydrophobicContact CZ-CG 3.98Å
75	G	79.6	Confident	78.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-55.6	-42.9	175.5	0	0	0	0	0	111.4	V68 D72 R78 N79	V68-G75 WeakPolarHBondContact CG1-O 3.34Å; D72-G75 VanDerWaalsContact CG-N 3.27Å; D72-G75 PolarHBondContact O-N 2.99Å; D72-G75 PolarHBondContact OD1-N 3.16Å; D72-G75 WeakPolarHBondContact OD2-CA 3.4Å; D72-G75 PolarHBondContact OD2-N 2.84Å; G75-R78 PolarHBondContact O-N 3.05Å; G75-N79 WeakPolarHBondContact O-CB 3.38Å; G75-N79 VanDerWaalsContact O-CG 3.23Å; G75-N79 PolarHBondContact O-N 3.3Å; G75-N79 PolarHBondContact O-OD1 2.99Å
76	H	81.7	Confident	79.6	Confident	97 Å²	97	64.2 Å²	64.2	45%	0.449	34%	0.336	S	S	.	.	H	α-helix	trans	-63.2	-47	178.1	-179.8	-84.2	0	0	0	111.3	V68 D72 R73 F74 N79 T80	V68-H76 HydrophobicContact CG2-CB 3.79Å; D72-H76 PolarHBondContact O-N 3.25Å; R73-H76 PolarHBondContact O-N 2.98Å; F74-H76 PolarHBondContact O-N 3.28Å; H76-N79 PolarHBondContact O-N 2.86Å; H76-T80 PolarHBondContact CE1-OG1 3.19Å; H76-T80 WeakPolarHBondContact O-CB 3.25Å; H76-T80 PolarHBondContact O-N 3.37Å; H76-T80 PolarHBondContact O-OG1 2.78Å
77	D	86.1	Confident	81	Confident	44 Å²	44	68.3 Å²	68.3	24%	0.235	36%	0.364	C	S	.	.	H	α-helix	trans	-65.7	-39.8	178.7	-66	-16.2	0	0	0	111.1	Y44 V48 R73 F74 T80 S81	Y44-D77 WeakPolarHBondContact CE1-OD2 3.27Å; Y44-D77 PolarHBondContact OH-OD2 3.2Å; V48-D77 VanDerWaalsContact CG1-C 3.44Å; V48-D77 HydrophobicContact CG1-CB 3.93Å; V48-D77 WeakPolarHBondContact CG1-O 3.29Å; V48-D77 HydrophobicContact CG2-CB 3.99Å; R73-D77 IonicContact NE-OD2 3.25Å; R73-D77 VanDerWaalsContact O-CG 3.22Å; R73-D77 PolarHBondContact O-N 2.83Å; F74-D77 PolarHBondContact O-N 3.15Å; D77-T80 PolarHBondContact O-N 3.06Å; D77-S81 WeakPolarHBondContact O-CB 3.35Å; D77-S81 PolarHBondContact O-N 3.47Å
78	R	88.4	Confident	82.5	Confident	5 Å²	5	62.9 Å²	62.9	2%	0.019	34%	0.339	C	S	.	.	H	α-helix	trans	-60.6	-47.1	174.1	-178.6	-165.8	66.2	-145.4	-7.8	110.6	A51 A52 F74 G75 S81 W82 E264	A51-R78 HydrophobicContact CB-CG 3.84Å; A52-R78 HydrophobicContact CB-CG 4.25Å; F74-R78 HydrophobicContact CD1-CB 4.33Å; F74-R78 HydrophobicContact CE1-CB 3.89Å; F74-R78 HydrophobicContact CE1-CG 4.39Å; F74-R78 WeakPolarHBondContact O-CB 3.42Å; F74-R78 PolarHBondContact O-N 3.39Å; G75-R78 PolarHBondContact O-N 3.05Å; R78-S81 CarbonylContact O-C 3.58Å; R78-S81 WeakPolarHBondContact O-CB 3.46Å; R78-S81 PolarHBondContact O-N 2.87Å; R78-W82 VanDerWaalsContact O-CB 3.29Å; R78-W82 WeakPolarHBondContact O-CB 3.46Å; R78-W82 PolarHBondContact O-N 2.87Å; R78-E264 IonicContact CZ-OE2 3.92Å; R78-E264 IonicContact NH2-OE2 2.76Å; R78-E264 PolarHBondContact NH2-OE2 3.18Å
79	N	87.5	Confident	83.8	Confident	1 Å²	1	68.3 Å²	68.3	1%	0.005	36%	0.362	C	S	.	.	H	α-helix	trans	-70.6	-35.3	-178.2	-71.3	5.1	0	0	0	111.6	Y62 C66 V68 G75 H76 W82 R83	Y62-N79 HydrophobicContact CD2-CB 4.38Å; Y62-N79 HydrophobicContact CE2-CB 3.84Å; C66-N79 PolarHBondContact O-ND2 2.88Å; V68-N79 WeakPolarHBondContact CG1-ND2 3.32Å; G75-N79 WeakPolarHBondContact O-CB 3.38Å; G75-N79 VanDerWaalsContact O-CG 3.23Å; G75-N79 PolarHBondContact O-N 3.3Å; G75-N79 PolarHBondContact O-OD1 2.99Å; H76-N79 PolarHBondContact O-N 2.86Å; N79-W82 PolarHBondContact O-N 2.84Å; N79-R83 WeakPolarHBondContact O-CB 3.34Å; N79-R83 VanDerWaalsContact O-CG 3.25Å; N79-R83 WeakPolarHBondContact O-CG 3.5Å; N79-R83 PolarHBondContact O-N 2.83Å
80	T	90.3	Very high	85.5	Confident	65 Å²	65	70.4 Å²	70.4	40%	0.399	36%	0.356	S	S	.	.	H	α-helix	trans	-59.6	-47.6	169.3	-58.8	0	0	0	0	110.8	H76 D77 W82 S84	H76-T80 PolarHBondContact CE1-OG1 3.19Å; H76-T80 WeakPolarHBondContact O-CB 3.25Å; H76-T80 PolarHBondContact O-N 3.37Å; H76-T80 PolarHBondContact O-OG1 2.78Å; D77-T80 PolarHBondContact O-N 3.06Å; T80-W82 VanDerWaalsContact C-N 3.33Å; T80-W82 PolarHBondContact O-N 2.87Å; T80-S84 PolarHBondContact O-N 3.41Å; T80-S84 VanDerWaalsContact O-N 3.15Å
81	S	92.2	Very high	87	Confident	20 Å²	20	65 Å²	65	14%	0.14	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-38.6	174.5	-174.1	0	0	0	0	111.9	D77 R78 S84 L85	D77-S81 WeakPolarHBondContact O-CB 3.35Å; D77-S81 PolarHBondContact O-N 3.47Å; R78-S81 CarbonylContact O-C 3.58Å; R78-S81 WeakPolarHBondContact O-CB 3.46Å; R78-S81 PolarHBondContact O-N 2.87Å; S81-S84 WeakPolarHBondContact O-CB 3.22Å; S81-S84 PolarHBondContact O-N 2.78Å; S81-S84 PolarHBondContact O-OG 3.49Å; S81-L85 WeakPolarHBondContact O-CG 3.42Å; S81-L85 PolarHBondContact O-N 2.9Å
82	W	92.1	Very high	88.9	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.008	32%	0.32	C	S	.	.	H	α-helix	trans	-69.1	-43	-179.3	-173.1	12.2	0	0	0	111.5	A52 K55 C59 G60 Y62 C66 R78 N79 T80 S84 L85	A52-W82 HydrophobicContact CB-CB 3.94Å; K55-W82 HydrophobicContact CB-CD2 3.56Å; K55-W82 HydrophobicContact CB-CE3 3.7Å; K55-W82 HydrophobicContact CB-CG 4.16Å; K55-W82 HydrophobicContact CB-CH2 4.1Å; K55-W82 HydrophobicContact CB-CZ2 3.95Å; K55-W82 HydrophobicContact CB-CZ3 3.97Å; K55-W82 HydrophobicContact CD-CE3 4.25Å; K55-W82 HydrophobicContact CD-CH2 4.05Å; K55-W82 HydrophobicContact CD-CZ3 3.82Å; K55-W82 HydrophobicContact CG-CD2 4.32Å; K55-W82 HydrophobicContact CG-CE3 3.95Å; K55-W82 HydrophobicContact CG-CH2 4.48Å; K55-W82 HydrophobicContact CG-CZ3 4.05Å; C59-W82 HydrophobicContact CB-CH2 3.85Å; C59-W82 HydrophobicContact CB-CZ2 3.78Å; G60-W82 WeakPolarHBondContact O-CZ2 3.26Å; G60-W82 PolarHBondContact O-NE1 3.18Å; Y62-W82 HydrophobicContact CD2-CB 4.49Å; Y62-W82 AromaticContact CD2-CD2 3.96Å; Y62-W82 HydrophobicContact CD2-CD2 3.96Å; Y62-W82 AromaticContact CD2-CE3 3.63Å; Y62-W82 HydrophobicContact CD2-CE3 3.63Å; Y62-W82 HydrophobicContact CD2-CG 4.36Å; Y62-W82 HydrophobicContact CD2-CZ3 4.08Å; Y62-W82 HydrophobicContact CE2-CE3 4.41Å; Y62-W82 HydrophobicContact CG-CD2 4.5Å; C66-W82 HydrophobicContact CB-CH2 4.5Å; C66-W82 HydrophobicContact CB-CZ3 3.91Å; R78-W82 VanDerWaalsContact O-CB 3.29Å; R78-W82 WeakPolarHBondContact O-CB 3.46Å; R78-W82 PolarHBondContact O-N 2.87Å; N79-W82 PolarHBondContact O-N 2.84Å; T80-W82 VanDerWaalsContact C-N 3.33Å; T80-W82 PolarHBondContact O-N 2.87Å; W82-S84 PolarHBondContact O-N 3.04Å; W82-L85 VanDerWaalsContact O-CB 3.32Å; W82-L85 WeakPolarHBondContact O-CB 3.21Å; W82-L85 PolarHBondContact O-N 3.03Å
83	R	92.7	Very high	90	Very high	103 Å²	103	62 Å²	62	39%	0.389	31%	0.314	S	S	.	.	H	α-helix	trans	-54.2	-42.2	169.7	-73.1	173.2	-161.4	139.6	-2.5	111.5	Y62 N79 L85 G86	Y62-R83 HydrophobicContact CD1-CG 3.3Å; Y62-R83 HydrophobicContact CD2-CG 3.87Å; Y62-R83 HydrophobicContact CE1-CG 3.71Å; Y62-R83 HydrophobicContact CE2-CG 4.22Å; Y62-R83 HydrophobicContact CG-CB 4.48Å; Y62-R83 HydrophobicContact CG-CG 3.42Å; Y62-R83 VanDerWaalsContact CG-CG 3.42Å; Y62-R83 PolarHBondContact OH-NH2 3.4Å; N79-R83 WeakPolarHBondContact O-CB 3.34Å; N79-R83 VanDerWaalsContact O-CG 3.25Å; N79-R83 WeakPolarHBondContact O-CG 3.5Å; N79-R83 PolarHBondContact O-N 2.83Å; R83-L85 PolarHBondContact O-N 2.91Å; R83-G86 PolarHBondContact O-N 3.12Å; R83-G86 VanDerWaalsContact O-N 3.09Å
84	S	94.2	Very high	90.7	Very high	95 Å²	95	53.5 Å²	53.5	66%	0.664	28%	0.282	S	S	*	.	H	α-helix	trans	-66.7	-18.1	179.4	83.2	0	0	0	0	114.3	T80 S81 W82 G86	T80-S84 PolarHBondContact O-N 3.41Å; T80-S84 VanDerWaalsContact O-N 3.15Å; S81-S84 WeakPolarHBondContact O-CB 3.22Å; S81-S84 PolarHBondContact O-N 2.78Å; S81-S84 PolarHBondContact O-OG 3.49Å; W82-S84 PolarHBondContact O-N 3.04Å; S84-G86 VanDerWaalsContact C-N 3.28Å
85	L	95.2	Very high	91.4	Very high	31 Å²	31	56.8 Å²	56.8	16%	0.162	30%	0.297	C	S	.	.	H	α-helix	trans	-72.8	-24.1	174.2	-58.1	177.9	0	0	0	111.9	A52 L53 Q56 S81 W82 R83 M88	A52-L85 HydrophobicContact CB-CD1 4.24Å; L53-L85 HydrophobicContact CD2-CD1 4.02Å; L53-L85 HydrophobicContact CD2-CD2 4.1Å; L53-L85 HydrophobicContact CG-CD1 4.4Å; Q56-L85 HydrophobicContact CB-CD1 3.89Å; Q56-L85 HydrophobicContact CG-CD1 4.32Å; S81-L85 WeakPolarHBondContact O-CG 3.42Å; S81-L85 PolarHBondContact O-N 2.9Å; W82-L85 VanDerWaalsContact O-CB 3.32Å; W82-L85 WeakPolarHBondContact O-CB 3.21Å; W82-L85 PolarHBondContact O-N 3.03Å; R83-L85 PolarHBondContact O-N 2.91Å; L85-M88 HydrophobicContact CB-CB 4.36Å; L85-M88 HydrophobicContact CB-CE 4.23Å; L85-M88 HydrophobicContact CD2-CE 3.72Å; L85-M88 HydrophobicContact CD2-SD 4.41Å; L85-M88 WeakPolarHBondContact O-CB 3.41Å; L85-M88 PolarHBondContact O-N 3.4Å
86	G	93	Very high	92.3	Very high	33 Å²	33	60.3 Å²	60.3	34%	0.34	31%	0.314	S	S	.	.			trans	57.4	-141	-179.4	0	0	0	0	0	113.1	Q56 P61 R83 S84 M88	Q56-G86 PolarHBondContact NE2-O 2.95Å; P61-G86 WeakPolarHBondContact CB-O 3.21Å; R83-G86 PolarHBondContact O-N 3.12Å; R83-G86 VanDerWaalsContact O-N 3.09Å; S84-G86 VanDerWaalsContact C-N 3.28Å; G86-M88 PolarHBondContact O-N 3.09Å
87	C	92.3	Very high	93	Very high	115 Å²	115	55.7 Å²	55.7	78%	0.777	29%	0.293	S	S	*	.	S	Bend	trans	-78.1	36.2	179.5	-55.6	0	0	0	0	113.5	E89	C87-E89 PolarHBondContact O-N 3.02Å
88	M	94.2	Very high	93.4	Very high	29 Å²	29	54.1 Å²	54.1	14%	0.143	28%	0.284	C	S	.	.			trans	-63.4	127.1	179.6	179.2	-179.2	-59.5	0	0	111.5	L53 Q56 L85 G86 K92 A93	L53-M88 HydrophobicContact CD2-SD 4.1Å; Q56-M88 HydrophobicContact CG-CB 4.28Å; Q56-M88 PolarHBondContact NE2-O 3.35Å; L85-M88 HydrophobicContact CB-CB 4.36Å; L85-M88 HydrophobicContact CB-CE 4.23Å; L85-M88 HydrophobicContact CD2-CE 3.72Å; L85-M88 HydrophobicContact CD2-SD 4.41Å; L85-M88 WeakPolarHBondContact O-CB 3.41Å; L85-M88 PolarHBondContact O-N 3.4Å; G86-M88 PolarHBondContact O-N 3.09Å; M88-K92 HydrophobicContact CG-CB 3.97Å; M88-K92 HydrophobicContact CG-CD 4.33Å; M88-K92 HydrophobicContact CG-CG 4.18Å; M88-K92 HydrophobicContact SD-CB 4.48Å; M88-K92 HydrophobicContact SD-CG 4.32Å; M88-A93 HydrophobicContact CG-CB 4.37Å; M88-A93 HydrophobicContact SD-CB 3.92Å
89	E	93.6	Very high	93.8	Very high	143 Å²	143	58 Å²	58	67%	0.668	31%	0.308	S	S	*	.			trans	-61.5	146.5	175.8	-66.2	-63.1	161.2	0	0	112.4	C87 E91 K92 A93	C87-E89 PolarHBondContact O-N 3.02Å; E89-E91 PolarHBondContact O-N 3.29Å; E89-K92 PolarHBondContact O-N 3.37Å; E89-A93 PolarHBondContact O-N 2.58Å
90	K	91.8	Very high	94.1	Very high	95 Å²	95	59.4 Å²	59.4	41%	0.413	32%	0.315	S	S	.	.	H	α-helix	trans	-54	-39.1	179.8	177.9	168.4	-179.3	169.5	0	112.8	V57 A93 M94	V57-K90 HydrophobicContact CG1-CG 4.26Å; V57-K90 WeakPolarHBondContact O-CE 3.19Å; V57-K90 PolarHBondContact O-NZ 2.86Å; K90-A93 PolarHBondContact O-N 2.69Å; K90-M94 HydrophobicContact CD-CE 4.2Å; K90-M94 VanDerWaalsContact CE-CE 3.4Å; K90-M94 HydrophobicContact CG-CE 3.85Å; K90-M94 WeakPolarHBondContact O-CG 3.43Å; K90-M94 PolarHBondContact O-N 3.02Å
91	E	93.5	Very high	94.3	Very high	95 Å²	95	56.3 Å²	56.3	44%	0.444	30%	0.296	S	S	.	.	H	α-helix	trans	-61.1	-47.7	176.2	-70.6	-176	-167.8	0	0	112.3	Y18 L21 E89 A93 M94 Q95	Y18-E91 HydrophobicContact CD2-CG 3.42Å; Y18-E91 VanDerWaalsContact CD2-CG 3.42Å; Y18-E91 WeakPolarHBondContact CD2-OE1 3.39Å; Y18-E91 HydrophobicContact CE2-CG 3.43Å; Y18-E91 VanDerWaalsContact CE2-CG 3.43Å; L21-E91 HydrophobicContact CD2-CB 4.13Å; L21-E91 HydrophobicContact CD2-CG 4.43Å; E89-E91 PolarHBondContact O-N 3.29Å; E91-A93 VanDerWaalsContact C-N 3.31Å; E91-A93 PolarHBondContact O-N 2.85Å; E91-M94 PolarHBondContact O-N 3.23Å; E91-Q95 WeakPolarHBondContact O-CG 3.21Å; E91-Q95 PolarHBondContact O-N 3.39Å
92	K	95.6	Very high	94.4	Very high	119 Å²	119	59.3 Å²	59.3	52%	0.517	31%	0.307	S	S	.	.	H	α-helix	trans	-66.9	-36.2	-179.1	-170	170	-177.4	178.3	0	111.2	M88 E89 Q95 Q96	M88-K92 HydrophobicContact CG-CB 3.97Å; M88-K92 HydrophobicContact CG-CD 4.33Å; M88-K92 HydrophobicContact CG-CG 4.18Å; M88-K92 HydrophobicContact SD-CB 4.48Å; M88-K92 HydrophobicContact SD-CG 4.32Å; E89-K92 PolarHBondContact O-N 3.37Å; K92-Q95 PolarHBondContact O-N 2.78Å; K92-Q96 WeakPolarHBondContact O-CG 3.35Å; K92-Q96 PolarHBondContact O-N 3Å
93	A	95.3	Very high	94.5	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-64.6	-43.3	174	0	0	0	0	0	112.1	L53 Q56 V57 M88 E89 K90 E91 Q96 F97	L53-A93 HydrophobicContact CD2-CB 4.28Å; Q56-A93 HydrophobicContact CB-CB 3.86Å; Q56-A93 HydrophobicContact CG-CB 3.77Å; V57-A93 HydrophobicContact CG2-CB 3.64Å; M88-A93 HydrophobicContact CG-CB 4.37Å; M88-A93 HydrophobicContact SD-CB 3.92Å; E89-A93 PolarHBondContact O-N 2.58Å; K90-A93 PolarHBondContact O-N 2.69Å; E91-A93 VanDerWaalsContact C-N 3.31Å; E91-A93 PolarHBondContact O-N 2.85Å; A93-Q96 PolarHBondContact O-N 3.28Å; A93-F97 WeakPolarHBondContact O-CB 3.47Å; A93-F97 PolarHBondContact O-N 3.46Å
94	M	94.1	Very high	94.3	Very high	8 Å²	8	65.1 Å²	65.1	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-60.5	-45.3	172.9	-71.5	-178.7	-174.8	0	0	111.7	L21 A22 Y25 V57 K90 E91 F97 I98	L21-M94 HydrophobicContact CD1-CB 4.25Å; L21-M94 HydrophobicContact CD2-CB 4.22Å; L21-M94 HydrophobicContact CG-CB 4.08Å; L21-M94 HydrophobicContact CG-SD 4.36Å; A22-M94 HydrophobicContact CB-CE 4.35Å; A22-M94 HydrophobicContact CB-SD 4.14Å; Y25-M94 HydrophobicContact CD1-CE 4.3Å; Y25-M94 HydrophobicContact CD1-CG 4.12Å; Y25-M94 HydrophobicContact CD1-SD 4.41Å; Y25-M94 HydrophobicContact CD2-CB 4.1Å; Y25-M94 HydrophobicContact CD2-CG 3.94Å; Y25-M94 HydrophobicContact CG-CB 4.15Å; Y25-M94 HydrophobicContact CG-CG 3.71Å; Y25-M94 HydrophobicContact CG-SD 4.26Å; V57-M94 HydrophobicContact CB-CG 4.48Å; V57-M94 HydrophobicContact CG1-CE 3.5Å; V57-M94 HydrophobicContact CG1-CG 3.92Å; V57-M94 HydrophobicContact CG2-CB 4.43Å; V57-M94 HydrophobicContact CG2-CG 3.62Å; K90-M94 HydrophobicContact CD-CE 4.2Å; K90-M94 VanDerWaalsContact CE-CE 3.4Å; K90-M94 HydrophobicContact CG-CE 3.85Å; K90-M94 WeakPolarHBondContact O-CG 3.43Å; K90-M94 PolarHBondContact O-N 3.02Å; E91-M94 PolarHBondContact O-N 3.23Å; M94-F97 PolarHBondContact O-N 3.13Å; M94-I98 WeakPolarHBondContact O-CD1 3.48Å; M94-I98 VanDerWaalsContact O-CG1 3.27Å; M94-I98 WeakPolarHBondContact O-CG1 3.34Å; M94-I98 PolarHBondContact O-N 2.66Å
95	Q	96.6	Very high	94.2	Very high	93 Å²	93	60.8 Å²	60.8	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-61.4	-48	178.9	-73.9	171.2	0	0	0	111.8	L21 E91 K92 F97 I98 V99	L21-Q95 HydrophobicContact CD1-CB 4.5Å; L21-Q95 HydrophobicContact CD1-CG 3.56Å; L21-Q95 HydrophobicContact CD2-CG 3.73Å; L21-Q95 HydrophobicContact CG-CG 4.3Å; E91-Q95 WeakPolarHBondContact O-CG 3.21Å; E91-Q95 PolarHBondContact O-N 3.39Å; K92-Q95 PolarHBondContact O-N 2.78Å; Q95-F97 VanDerWaalsContact C-N 3.32Å; Q95-F97 PolarHBondContact O-N 2.78Å; Q95-I98 PolarHBondContact O-N 2.8Å; Q95-V99 WeakPolarHBondContact O-CB 3.17Å; Q95-V99 VanDerWaalsContact O-CG2 3.32Å; Q95-V99 WeakPolarHBondContact O-CG2 3.35Å; Q95-V99 PolarHBondContact O-N 3.41Å
96	Q	97.6	Very high	93.8	Very high	74 Å²	74	63.8 Å²	63.8	35%	0.346	33%	0.331	S	S	.	.	H	α-helix	trans	-63.3	-39.6	178.3	-73.6	-173.3	17.6	0	0	112	L53 K92 A93 I98 V99 E100	L53-Q96 HydrophobicContact CD1-CB 4Å; L53-Q96 HydrophobicContact CD2-CB 3.88Å; K92-Q96 WeakPolarHBondContact O-CG 3.35Å; K92-Q96 PolarHBondContact O-N 3Å; A93-Q96 PolarHBondContact O-N 3.28Å; Q96-I98 VanDerWaalsContact C-N 3.33Å; Q96-I98 PolarHBondContact O-N 3.46Å; Q96-V99 PolarHBondContact O-N 3.15Å; Q96-E100 VanDerWaalsContact O-CB 3.31Å; Q96-E100 WeakPolarHBondContact O-CB 3.38Å; Q96-E100 PolarHBondContact O-N 2.56Å
97	F	96	Very high	93.6	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.3	-46.5	175.6	-177.8	-79.6	0	0	0	111.2	Y25 A28 L32 L50 L53 S54 A93 M94 Q95 L101 W386	Y25-F97 HydrophobicContact CD2-CB 4.19Å; Y25-F97 AromaticContact CD2-CD1 3.81Å; Y25-F97 HydrophobicContact CD2-CD1 3.81Å; Y25-F97 HydrophobicContact CD2-CE1 4.45Å; Y25-F97 HydrophobicContact CD2-CG 4.05Å; Y25-F97 HydrophobicContact CE2-CB 4.03Å; Y25-F97 AromaticContact CE2-CD1 3.74Å; Y25-F97 HydrophobicContact CE2-CD1 3.74Å; Y25-F97 HydrophobicContact CE2-CD2 4.06Å; Y25-F97 HydrophobicContact CE2-CE1 4.21Å; Y25-F97 HydrophobicContact CE2-CE2 4.49Å; Y25-F97 AromaticContact CE2-CG 3.67Å; Y25-F97 HydrophobicContact CE2-CG 3.67Å; A28-F97 HydrophobicContact CB-CD1 4.26Å; A28-F97 HydrophobicContact CB-CE1 3.96Å; L32-F97 HydrophobicContact CD2-CE2 4.31Å; L32-F97 HydrophobicContact CD2-CZ 3.76Å; L50-F97 HydrophobicContact CB-CD2 4.13Å; L50-F97 HydrophobicContact CB-CE2 3.84Å; L50-F97 HydrophobicContact CD2-CD2 3.74Å; L50-F97 HydrophobicContact CD2-CE2 4.03Å; L50-F97 HydrophobicContact CD2-CG 4.08Å; L50-F97 HydrophobicContact CG-CE2 4.41Å; L50-F97 WeakPolarHBondContact O-CD2 3.34Å; L53-F97 HydrophobicContact CB-CB 4.2Å; L53-F97 HydrophobicContact CB-CD2 4.17Å; L53-F97 HydrophobicContact CD1-CB 4.31Å; S54-F97 WeakPolarHBondContact OG-CE2 3.38Å; A93-F97 WeakPolarHBondContact O-CB 3.47Å; A93-F97 PolarHBondContact O-N 3.46Å; M94-F97 PolarHBondContact O-N 3.13Å; Q95-F97 VanDerWaalsContact C-N 3.32Å; Q95-F97 PolarHBondContact O-N 2.78Å; F97-L101 HydrophobicContact CE1-CD2 4.03Å; F97-L101 VanDerWaalsContact O-CB 3.29Å; F97-L101 WeakPolarHBondContact O-CB 3.16Å; F97-L101 PolarHBondContact O-N 3.31Å; F97-L101 VanDerWaalsContact O-N 3.11Å; F97-W386 AromaticContact CE2-CH2 3.8Å; F97-W386 HydrophobicContact CE2-CH2 3.8Å; F97-W386 HydrophobicContact CE2-CZ2 4.27Å; F97-W386 HydrophobicContact CE2-CZ3 4.48Å; F97-W386 HydrophobicContact CZ-CH2 4.34Å
98	I	96.1	Very high	93.6	Very high	10 Å²	10	62.6 Å²	62.6	5%	0.051	31%	0.305	C	S	.	.	H	α-helix	trans	-64.6	-51.6	179.5	-68.3	162	0	0	0	110.3	L21 K24 A28 M94 Q95 Q96 E100 L101 E102	L21-I98 HydrophobicContact CD1-CD1 3.61Å; K24-I98 HydrophobicContact CB-CD1 3.9Å; A28-I98 HydrophobicContact CB-CG1 4.21Å; M94-I98 WeakPolarHBondContact O-CD1 3.48Å; M94-I98 VanDerWaalsContact O-CG1 3.27Å; M94-I98 WeakPolarHBondContact O-CG1 3.34Å; M94-I98 PolarHBondContact O-N 2.66Å; Q95-I98 PolarHBondContact O-N 2.8Å; Q96-I98 VanDerWaalsContact C-N 3.33Å; Q96-I98 PolarHBondContact O-N 3.46Å; I98-E100 PolarHBondContact O-N 2.7Å; I98-L101 PolarHBondContact O-N 2.69Å; I98-E102 VanDerWaalsContact CG2-CD 3.45Å; I98-E102 HydrophobicContact CG2-CG 4.04Å; I98-E102 VanDerWaalsContact CG2-OE1 3.31Å; I98-E102 WeakPolarHBondContact CG2-OE1 3.42Å; I98-E102 WeakPolarHBondContact O-CB 3.05Å; I98-E102 VanDerWaalsContact O-CG 3.31Å; I98-E102 WeakPolarHBondContact O-CG 3.18Å; I98-E102 PolarHBondContact O-N 3.15Å
99	V	95.8	Very high	93.5	Very high	87 Å²	87	64.8 Å²	64.8	53%	0.527	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-46.1	-176.7	170.2	0	0	0	0	111.4	Q95 Q96 L101 E102 E103	Q95-V99 WeakPolarHBondContact O-CB 3.17Å; Q95-V99 VanDerWaalsContact O-CG2 3.32Å; Q95-V99 WeakPolarHBondContact O-CG2 3.35Å; Q95-V99 PolarHBondContact O-N 3.41Å; Q96-V99 PolarHBondContact O-N 3.15Å; V99-L101 VanDerWaalsContact C-N 3.3Å; V99-L101 PolarHBondContact O-N 2.93Å; V99-E102 PolarHBondContact O-N 2.98Å; V99-E103 WeakPolarHBondContact O-CB 3.24Å; V99-E103 PolarHBondContact O-N 2.85Å
100	E	94.7	Very high	93.3	Very high	31 Å²	31	60.8 Å²	60.8	15%	0.145	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-36.3	178.8	-175.5	169.1	-174.4	0	0	111.3	T46 R49 L50 Q96 I98 I104	T46-E100 HydrophobicContact CG2-CG 4.48Å; R49-E100 IonicContact CZ-OE1 3.48Å; R49-E100 VanDerWaalsContact CZ-OE1 3.26Å; R49-E100 IonicContact NE-OE1 3.13Å; R49-E100 PolarHBondContact NE-OE1 2.88Å; R49-E100 IonicContact NE-OE2 3.82Å; R49-E100 IonicContact NH2-OE1 2.89Å; R49-E100 PolarHBondContact NH2-OE1 3.28Å; L50-E100 HydrophobicContact CD2-CB 4.12Å; L50-E100 HydrophobicContact CD2-CG 4.24Å; Q96-E100 VanDerWaalsContact O-CB 3.31Å; Q96-E100 WeakPolarHBondContact O-CB 3.38Å; Q96-E100 PolarHBondContact O-N 2.56Å; I98-E100 PolarHBondContact O-N 2.7Å; E100-I104 HydrophobicContact CG-CD1 4.08Å; E100-I104 WeakPolarHBondContact O-CD1 3.41Å; E100-I104 VanDerWaalsContact O-CG1 3.26Å; E100-I104 WeakPolarHBondContact O-CG1 3.22Å; E100-I104 PolarHBondContact O-N 3.09Å
101	L	94.2	Very high	93.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-74	-38.1	176.8	-172.1	60.7	0	0	0	112.8	A28 F31 L32 L50 F97 I98 V99 E103 I104 C105 L108	A28-L101 HydrophobicContact CB-CD2 4.11Å; F31-L101 HydrophobicContact CD1-CD2 4.26Å; L32-L101 HydrophobicContact CB-CD2 4.05Å; L32-L101 HydrophobicContact CD1-CD1 3.96Å; L50-L101 HydrophobicContact CD1-CD1 4.21Å; F97-L101 HydrophobicContact CE1-CD2 4.03Å; F97-L101 VanDerWaalsContact O-CB 3.29Å; F97-L101 WeakPolarHBondContact O-CB 3.16Å; F97-L101 PolarHBondContact O-N 3.31Å; F97-L101 VanDerWaalsContact O-N 3.11Å; I98-L101 PolarHBondContact O-N 2.69Å; V99-L101 VanDerWaalsContact C-N 3.3Å; V99-L101 PolarHBondContact O-N 2.93Å; L101-E103 VanDerWaalsContact C-N 3.34Å; L101-I104 PolarHBondContact O-N 3.19Å; L101-C105 HydrophobicContact CD1-CB 4.4Å; L101-C105 WeakPolarHBondContact O-CB 3.46Å; L101-C105 PolarHBondContact O-N 3.46Å; L101-L108 HydrophobicContact CB-CD2 4.22Å; L101-L108 HydrophobicContact CD2-CD2 3.88Å; L101-L108 HydrophobicContact CG-CD2 3.85Å
102	E	93.9	Very high	93.3	Very high	83 Å²	83	54 Å²	54	39%	0.388	28%	0.284	S	S	.	.	H	α-helix	trans	-64.7	-37.4	175.6	-76.2	177.3	168.2	0	0	111.9	I98 V99 I104 L108 Y112	I98-E102 VanDerWaalsContact CG2-CD 3.45Å; I98-E102 HydrophobicContact CG2-CG 4.04Å; I98-E102 VanDerWaalsContact CG2-OE1 3.31Å; I98-E102 WeakPolarHBondContact CG2-OE1 3.42Å; I98-E102 WeakPolarHBondContact O-CB 3.05Å; I98-E102 VanDerWaalsContact O-CG 3.31Å; I98-E102 WeakPolarHBondContact O-CG 3.18Å; I98-E102 PolarHBondContact O-N 3.15Å; V99-E102 PolarHBondContact O-N 2.98Å; E102-I104 VanDerWaalsContact C-N 3.3Å; E102-I104 PolarHBondContact O-N 3.2Å; E102-L108 HydrophobicContact CG-CD2 3.68Å; E102-L108 HydrophobicContact CG-CG 4.37Å; E102-Y112 WeakPolarHBondContact OE1-CE2 3.28Å
103	E	93.2	Very high	93	Very high	157 Å²	157	52.2 Å²	52.2	73%	0.734	28%	0.28	S	S	*	.	H	α-helix	trans	-63.8	-37.1	176.2	-174.6	177.5	177.8	0	0	111.8	V99 L101	V99-E103 WeakPolarHBondContact O-CB 3.24Å; V99-E103 PolarHBondContact O-N 2.85Å; L101-E103 VanDerWaalsContact C-N 3.34Å
104	I	90	Very high	92.8	Very high	70 Å²	70	55.8 Å²	55.8	36%	0.359	30%	0.301	S	S	.	.	H	α-helix	trans	-91	-29.9	-174.8	-60.6	170	0	0	0	112	L42 T46 E100 L101 E102	L42-I104 HydrophobicContact CD2-CG2 3.64Å; T46-I104 HydrophobicContact CG2-CD1 3.26Å; E100-I104 HydrophobicContact CG-CD1 4.08Å; E100-I104 WeakPolarHBondContact O-CD1 3.41Å; E100-I104 VanDerWaalsContact O-CG1 3.26Å; E100-I104 WeakPolarHBondContact O-CG1 3.22Å; E100-I104 PolarHBondContact O-N 3.09Å; L101-I104 PolarHBondContact O-N 3.19Å; E102-I104 VanDerWaalsContact C-N 3.3Å; E102-I104 PolarHBondContact O-N 3.2Å
105	C	90.7	Very high	92.5	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.027	31%	0.306	C	S	.	.			trans	-130.2	84.5	-174.8	-61.8	0	0	0	0	111.5	F31 F40 L101 E107 L108	F31-C105 HydrophobicContact CE1-CB 3.86Å; F31-C105 HydrophobicContact CZ-CB 4.27Å; F40-C105 VanDerWaalsContact CE2-SG 3.55Å; L101-C105 HydrophobicContact CD1-CB 4.4Å; L101-C105 WeakPolarHBondContact O-CB 3.46Å; L101-C105 PolarHBondContact O-N 3.46Å; C105-E107 PolarHBondContact O-N 3.45Å; C105-E107 VanDerWaalsContact O-N 3.1Å; C105-L108 WeakPolarHBondContact O-CB 3.27Å; C105-L108 PolarHBondContact O-N 3.41Å
106	P	88.5	Confident	92	Very high	93 Å²	93	58.5 Å²	58.5	60%	0.604	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.8	177.5	-25.4	35.5	0	0	0	114	L108 S109	P106-L108 PolarHBondContact O-N 3.01Å; P106-L108 VanDerWaalsContact O-N 3.15Å; P106-S109 PolarHBondContact O-N 3.47Å
107	E	88.6	Confident	91.5	Very high	123 Å²	123	62.6 Å²	62.6	58%	0.575	32%	0.324	S	S	*	.	H	α-helix	trans	-63.2	-16.3	176	-61.5	83.2	178.8	0	0	113.5	F31 C105 S109 A110 F111	F31-E107 HydrophobicContact CE2-CB 4.42Å; F31-E107 HydrophobicContact CZ-CB 4.2Å; C105-E107 PolarHBondContact O-N 3.45Å; C105-E107 VanDerWaalsContact O-N 3.1Å; E107-S109 PolarHBondContact O-N 2.77Å; E107-A110 PolarHBondContact O-N 2.93Å; E107-F111 PolarHBondContact O-N 2.77Å; E107-F111 VanDerWaalsContact O-N 3.1Å
108	L	92.2	Very high	90.9	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-58.7	-33.9	174.4	178.4	55.2	0	0	0	111.9	A28 F31 L101 E102 C105 P106 F111 Y112	A28-L108 HydrophobicContact CB-CD1 4.44Å; A28-L108 HydrophobicContact CB-CD2 4.26Å; F31-L108 HydrophobicContact CB-CD1 3.75Å; F31-L108 HydrophobicContact CD1-CB 4.27Å; F31-L108 HydrophobicContact CD1-CD1 3.78Å; F31-L108 HydrophobicContact CD1-CG 4.49Å; F31-L108 HydrophobicContact CD2-CD1 4.32Å; F31-L108 HydrophobicContact CE1-CB 4.09Å; F31-L108 HydrophobicContact CE1-CD1 4.44Å; F31-L108 HydrophobicContact CG-CD1 3.7Å; F31-L108 HydrophobicContact CZ-CB 4.34Å; L101-L108 HydrophobicContact CB-CD2 4.22Å; L101-L108 HydrophobicContact CD2-CD2 3.88Å; L101-L108 HydrophobicContact CG-CD2 3.85Å; E102-L108 HydrophobicContact CG-CD2 3.68Å; E102-L108 HydrophobicContact CG-CG 4.37Å; C105-L108 WeakPolarHBondContact O-CB 3.27Å; C105-L108 PolarHBondContact O-N 3.41Å; P106-L108 PolarHBondContact O-N 3.01Å; P106-L108 VanDerWaalsContact O-N 3.15Å; L108-F111 HydrophobicContact CD1-CD1 4.37Å; L108-F111 WeakPolarHBondContact O-CB 3.13Å; L108-F111 PolarHBondContact O-N 2.82Å; L108-F111 VanDerWaalsContact O-N 3.17Å; L108-Y112 HydrophobicContact CD1-CD1 4.26Å; L108-Y112 HydrophobicContact CD1-CE1 3.71Å; L108-Y112 HydrophobicContact CD1-CE2 4.18Å; L108-Y112 HydrophobicContact CD2-CE2 4.29Å; L108-Y112 HydrophobicContact CG-CD2 4.4Å; L108-Y112 HydrophobicContact CG-CE1 4.2Å; L108-Y112 HydrophobicContact CG-CE2 3.75Å; L108-Y112 WeakPolarHBondContact O-CD2 3.38Å; L108-Y112 PolarHBondContact O-N 3.01Å
109	S	91.1	Very high	90.3	Very high	75 Å²	75	69.9 Å²	69.9	52%	0.524	36%	0.358	S	S	.	.	H	α-helix	trans	-61	-48.1	176.3	-179.7	0	0	0	0	111.9	P106 E107 F111 Y112 D113	P106-S109 PolarHBondContact O-N 3.47Å; E107-S109 PolarHBondContact O-N 2.77Å; S109-F111 PolarHBondContact O-N 3.04Å; S109-Y112 PolarHBondContact O-N 2.9Å; S109-D113 PolarHBondContact O-N 2.98Å
110	A	90.4	Very high	89.7	Confident	60 Å²	60	68.8 Å²	68.8	50%	0.496	35%	0.351	S	S	.	.	H	α-helix	trans	-63.6	-32.6	176.1	0	0	0	0	0	112	E107 D113 V114	E107-A110 PolarHBondContact O-N 2.93Å; A110-D113 PolarHBondContact O-N 3.28Å; A110-V114 WeakPolarHBondContact O-CG2 3.24Å; A110-V114 PolarHBondContact O-N 3.34Å
111	F	92.1	Very high	89.1	Confident	23 Å²	23	69.9 Å²	69.9	10%	0.101	37%	0.366	C	S	.	.	H	α-helix	trans	-65.2	-42.2	174.6	-177.3	-91.2	0	0	0	112.3	W27 K30 F31 E107 L108 S109 D113 V114 E115	W27-F111 HydrophobicContact CB-CE1 4.2Å; W27-F111 WeakPolarHBondContact O-CE1 3.43Å; K30-F111 HydrophobicContact CB-CZ 4.47Å; K30-F111 HydrophobicContact CD-CZ 3.97Å; K30-F111 HydrophobicContact CG-CZ 4.12Å; F31-F111 HydrophobicContact CB-CD1 3.77Å; F31-F111 HydrophobicContact CB-CD2 4.34Å; F31-F111 HydrophobicContact CB-CE1 3.84Å; F31-F111 HydrophobicContact CB-CE2 4.38Å; F31-F111 HydrophobicContact CB-CG 4.03Å; F31-F111 HydrophobicContact CB-CZ 4.13Å; F31-F111 HydrophobicContact CD2-CB 3.64Å; F31-F111 HydrophobicContact CD2-CD1 4.19Å; F31-F111 AromaticContact CD2-CD2 3.66Å; F31-F111 HydrophobicContact CD2-CD2 3.66Å; F31-F111 HydrophobicContact CD2-CE2 4.33Å; F31-F111 AromaticContact CD2-CG 3.56Å; F31-F111 HydrophobicContact CD2-CG 3.56Å; F31-F111 HydrophobicContact CE2-CB 4.1Å; F31-F111 HydrophobicContact CE2-CG 4.45Å; F31-F111 HydrophobicContact CG-CB 4.45Å; F31-F111 HydrophobicContact CG-CD1 4.38Å; F31-F111 HydrophobicContact CG-CD2 4.49Å; F31-F111 HydrophobicContact CG-CG 4.2Å; E107-F111 PolarHBondContact O-N 2.77Å; E107-F111 VanDerWaalsContact O-N 3.1Å; L108-F111 HydrophobicContact CD1-CD1 4.37Å; L108-F111 WeakPolarHBondContact O-CB 3.13Å; L108-F111 PolarHBondContact O-N 2.82Å; L108-F111 VanDerWaalsContact O-N 3.17Å; S109-F111 PolarHBondContact O-N 3.04Å; F111-D113 VanDerWaalsContact C-N 3.34Å; F111-D113 PolarHBondContact O-N 2.94Å; F111-V114 PolarHBondContact O-N 3.21Å; F111-E115 HydrophobicContact CE1-CB 4.4Å; F111-E115 WeakPolarHBondContact O-CB 2.96Å; F111-E115 PolarHBondContact O-N 3.5Å
112	Y	93	Very high	88.5	Confident	25 Å²	25	76.9 Å²	76.9	10%	0.098	39%	0.392	C	S	.	.	H	α-helix	trans	-61	-42.5	175.8	-65.5	-39.5	0	0	0	112.5	W27 E102 L108 S109 V114 E115 K116	W27-Y112 HydrophobicContact CB-CD1 3.76Å; W27-Y112 HydrophobicContact CB-CE1 3.67Å; W27-Y112 HydrophobicContact CD2-CD1 4.41Å; W27-Y112 AromaticContact CE3-CD1 3.72Å; W27-Y112 HydrophobicContact CE3-CD1 3.72Å; W27-Y112 HydrophobicContact CE3-CE1 4.4Å; W27-Y112 HydrophobicContact CE3-CG 4.45Å; E102-Y112 WeakPolarHBondContact OE1-CE2 3.28Å; L108-Y112 HydrophobicContact CD1-CD1 4.26Å; L108-Y112 HydrophobicContact CD1-CE1 3.71Å; L108-Y112 HydrophobicContact CD1-CE2 4.18Å; L108-Y112 HydrophobicContact CD2-CE2 4.29Å; L108-Y112 HydrophobicContact CG-CD2 4.4Å; L108-Y112 HydrophobicContact CG-CE1 4.2Å; L108-Y112 HydrophobicContact CG-CE2 3.75Å; L108-Y112 WeakPolarHBondContact O-CD2 3.38Å; L108-Y112 PolarHBondContact O-N 3.01Å; S109-Y112 PolarHBondContact O-N 2.9Å; Y112-V114 VanDerWaalsContact C-N 3.32Å; Y112-V114 PolarHBondContact O-N 3.13Å; Y112-E115 PolarHBondContact O-N 2.82Å; Y112-K116 VanDerWaalsContact O-CB 3.24Å; Y112-K116 WeakPolarHBondContact O-CB 3.26Å; Y112-K116 PolarHBondContact O-N 3.31Å
113	D	89.4	Confident	87.8	Confident	81 Å²	81	75.8 Å²	75.8	43%	0.433	39%	0.389	S	S	.	.	H	α-helix	trans	-60.5	-43.1	177.5	-80.9	-11.8	0	0	0	111.9	S109 A110 F111 R117	S109-D113 PolarHBondContact O-N 2.98Å; A110-D113 PolarHBondContact O-N 3.28Å; F111-D113 VanDerWaalsContact C-N 3.34Å; F111-D113 PolarHBondContact O-N 2.94Å; D113-R117 VanDerWaalsContact O-CG 3.27Å; D113-R117 WeakPolarHBondContact O-CG 3.15Å; D113-R117 PolarHBondContact O-N 3.33Å; D113-R117 VanDerWaalsContact O-N 3.14Å
114	V	89.8	Confident	87.2	Confident	74 Å²	74	70.2 Å²	70.2	45%	0.448	37%	0.366	S	S	.	.	H	α-helix	trans	-65.2	-48.6	176.3	172.8	0	0	0	0	110.6	A110 F111 Y112 K116 R117 E118	A110-V114 WeakPolarHBondContact O-CG2 3.24Å; A110-V114 PolarHBondContact O-N 3.34Å; F111-V114 PolarHBondContact O-N 3.21Å; Y112-V114 VanDerWaalsContact C-N 3.32Å; Y112-V114 PolarHBondContact O-N 3.13Å; V114-K116 VanDerWaalsContact C-N 3.31Å; V114-K116 PolarHBondContact O-N 2.9Å; V114-R117 WeakPolarHBondContact O-CB 3.13Å; V114-R117 PolarHBondContact O-N 2.63Å; V114-E118 HydrophobicContact CG1-CG 4.38Å; V114-E118 WeakPolarHBondContact O-CG 3.45Å; V114-E118 PolarHBondContact O-N 2.85Å
115	E	87.7	Confident	86.7	Confident	27 Å²	27	77.7 Å²	77.7	13%	0.126	39%	0.389	C	S	.	.	H	α-helix	trans	-65.8	-35.3	-177	-163.2	69.7	-161.7	0	0	112.1	W27 K30 F111 Y112 E118 Q119	W27-E115 VanDerWaalsContact CD1-CG 3.48Å; W27-E115 HydrophobicContact CD2-CB 4.13Å; W27-E115 HydrophobicContact CD2-CG 3.82Å; W27-E115 VanDerWaalsContact CE2-CG 3.45Å; W27-E115 HydrophobicContact CG-CB 4.37Å; W27-E115 HydrophobicContact CG-CG 3.82Å; W27-E115 HydrophobicContact CZ2-CB 4.47Å; W27-E115 HydrophobicContact CZ2-CG 4.05Å; K30-E115 IonicContact NZ-OE1 3.28Å; K30-E115 PolarHBondContact NZ-OE1 3.29Å; K30-E115 IonicContact NZ-OE2 3.79Å; K30-E115 PolarHBondContact NZ-OE2 2.84Å; F111-E115 HydrophobicContact CE1-CB 4.4Å; F111-E115 WeakPolarHBondContact O-CB 2.96Å; F111-E115 PolarHBondContact O-N 3.5Å; Y112-E115 PolarHBondContact O-N 2.82Å; E115-E118 PolarHBondContact O-N 3.35Å; E115-Q119 WeakPolarHBondContact O-CB 2.97Å; E115-Q119 PolarHBondContact O-N 3.26Å
116	K	87.7	Confident	86.1	Confident	131 Å²	131	83 Å²	83	57%	0.57	42%	0.417	S	S	*	.	H	α-helix	trans	-64.8	-41.9	173.5	-171.4	171.7	-175.9	173.4	0	111.7	W27 Y112 V114 Q119 V120	W27-K116 HydrophobicContact CH2-CB 4.03Å; W27-K116 HydrophobicContact CH2-CG 4.47Å; W27-K116 HydrophobicContact CZ3-CB 4.36Å; Y112-K116 VanDerWaalsContact O-CB 3.24Å; Y112-K116 WeakPolarHBondContact O-CB 3.26Å; Y112-K116 PolarHBondContact O-N 3.31Å; V114-K116 VanDerWaalsContact C-N 3.31Å; V114-K116 PolarHBondContact O-N 2.9Å; K116-Q119 PolarHBondContact O-N 3.35Å; K116-V120 WeakPolarHBondContact O-CG2 2.98Å; K116-V120 PolarHBondContact O-N 2.98Å
117	R	85.9	Confident	85.8	Confident	160 Å²	160	81.3 Å²	81.3	60%	0.604	42%	0.417	S	S	*	.	H	α-helix	trans	-63.3	-45.3	174.1	-71.1	175.1	-163.3	120	5	111.4	D113 V114 Q119 V120 A121	D113-R117 VanDerWaalsContact O-CG 3.27Å; D113-R117 WeakPolarHBondContact O-CG 3.15Å; D113-R117 PolarHBondContact O-N 3.33Å; D113-R117 VanDerWaalsContact O-N 3.14Å; V114-R117 WeakPolarHBondContact O-CB 3.13Å; V114-R117 PolarHBondContact O-N 2.63Å; R117-Q119 VanDerWaalsContact C-N 3.33Å; R117-Q119 PolarHBondContact O-N 2.95Å; R117-V120 PolarHBondContact O-N 3.35Å; R117-A121 WeakPolarHBondContact O-CB 2.79Å; R117-A121 PolarHBondContact O-N 3.49Å
118	E	84.9	Confident	85.3	Confident	105 Å²	105	81.7 Å²	81.7	49%	0.491	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-37.8	177.3	-74.7	-64.7	143.3	0	0	112.4	V114 E115 R122	V114-E118 HydrophobicContact CG1-CG 4.38Å; V114-E118 WeakPolarHBondContact O-CG 3.45Å; V114-E118 PolarHBondContact O-N 2.85Å; E115-E118 PolarHBondContact O-N 3.35Å; E118-R122 WeakPolarHBondContact O-CB 3.5Å; E118-R122 PolarHBondContact O-N 3.43Å
119	Q	82.7	Confident	84.4	Confident	59 Å²	59	86.4 Å²	86.4	28%	0.276	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-47.3	175.5	-175.9	-177.3	54.8	0	0	111.5	E23 E115 K116 R117 R122 L123	E23-Q119 PolarHBondContact OE1-NE2 3.37Å; E115-Q119 WeakPolarHBondContact O-CB 2.97Å; E115-Q119 PolarHBondContact O-N 3.26Å; K116-Q119 PolarHBondContact O-N 3.35Å; R117-Q119 VanDerWaalsContact C-N 3.33Å; R117-Q119 PolarHBondContact O-N 2.95Å; Q119-R122 WeakPolarHBondContact O-CB 3.14Å; Q119-R122 PolarHBondContact O-N 2.84Å; Q119-L123 WeakPolarHBondContact O-CG 3.42Å; Q119-L123 PolarHBondContact O-N 2.72Å
120	V	82.1	Confident	83.6	Confident	63 Å²	63	91 Å²	91	38%	0.382	46%	0.457	S	S	.	.	H	α-helix	trans	-60.9	-47	176.5	172.8	0	0	0	0	110.5	K116 R117 R122 L123 V124	K116-V120 WeakPolarHBondContact O-CG2 2.98Å; K116-V120 PolarHBondContact O-N 2.98Å; R117-V120 PolarHBondContact O-N 3.35Å; V120-R122 VanDerWaalsContact C-N 3.27Å; V120-R122 PolarHBondContact O-N 3.39Å; V120-L123 PolarHBondContact O-N 2.62Å; V120-L123 VanDerWaalsContact O-N 3.13Å; V120-V124 HydrophobicContact CG1-CG2 4.48Å; V120-V124 WeakPolarHBondContact O-CG2 3.42Å; V120-V124 PolarHBondContact O-N 2.74Å
121	A	82.2	Confident	82.7	Confident	55 Å²	55	92.9 Å²	92.9	46%	0.455	46%	0.455	S	S	.	.	H	α-helix	trans	-57.9	-39	176.6	0	0	0	0	0	112.3	R117 V124 R125	R117-A121 WeakPolarHBondContact O-CB 2.79Å; R117-A121 PolarHBondContact O-N 3.49Å; A121-V124 PolarHBondContact O-N 2.61Å; A121-R125 WeakPolarHBondContact O-CB 3.45Å; A121-R125 PolarHBondContact O-N 3.21Å
122	R	82.2	Confident	82	Confident	146 Å²	146	95.8 Å²	95.8	55%	0.551	48%	0.476	S	S	*	.	H	α-helix	trans	-65.6	-43.4	175.3	-169.5	-171.2	-53	-93.5	-5.7	112.3	E118 Q119 V120 V124 R125 L126	E118-R122 WeakPolarHBondContact O-CB 3.5Å; E118-R122 PolarHBondContact O-N 3.43Å; Q119-R122 WeakPolarHBondContact O-CB 3.14Å; Q119-R122 PolarHBondContact O-N 2.84Å; V120-R122 VanDerWaalsContact C-N 3.27Å; V120-R122 PolarHBondContact O-N 3.39Å; R122-V124 VanDerWaalsContact C-N 3.35Å; R122-R125 PolarHBondContact O-N 3.15Å; R122-L126 HydrophobicContact CG-CD1 4.19Å; R122-L126 WeakPolarHBondContact O-CB 3.44Å; R122-L126 WeakPolarHBondContact O-CG 3.42Å; R122-L126 PolarHBondContact O-N 3.4Å
123	L	80.3	Confident	81.4	Confident	61 Å²	61	98.2 Å²	98.2	32%	0.319	49%	0.494	S	S	.	.	H	α-helix	trans	-65.9	-37.7	178	-67.7	173.6	0	0	0	111.9	Q119 V120 L126 G127 L128 H129	Q119-L123 WeakPolarHBondContact O-CG 3.42Å; Q119-L123 PolarHBondContact O-N 2.72Å; V120-L123 PolarHBondContact O-N 2.62Å; V120-L123 VanDerWaalsContact O-N 3.13Å; L123-L126 CarbonylContact O-C 3.6Å; L123-L126 PolarHBondContact O-N 3.16Å; L123-G127 PolarHBondContact O-N 3Å; L123-G127 VanDerWaalsContact O-N 3.15Å; L123-L128 HydrophobicContact CB-CB 4.44Å; L123-L128 HydrophobicContact CD2-CB 4.1Å; L123-L128 HydrophobicContact CD2-CD1 3.96Å; L123-L128 PolarHBondContact O-N 3.24Å; L123-H129 HydrophobicContact CB-CB 3.74Å; L123-H129 PolarHBondContact O-N 2.86Å
124	V	78.9	Confident	81	Confident	40 Å²	40	97 Å²	97	24%	0.242	50%	0.495	C	S	.	.	H	α-helix	trans	-63.1	-47	172.8	172.6	0	0	0	0	111	V120 A121 R122 L126 G127 H129 E131	V120-V124 HydrophobicContact CG1-CG2 4.48Å; V120-V124 WeakPolarHBondContact O-CG2 3.42Å; V120-V124 PolarHBondContact O-N 2.74Å; A121-V124 PolarHBondContact O-N 2.61Å; R122-V124 VanDerWaalsContact C-N 3.35Å; V124-L126 PolarHBondContact O-N 3.04Å; V124-G127 PolarHBondContact O-N 2.8Å; V124-H129 WeakPolarHBondContact CA-O 3.5Å; V124-H129 HydrophobicContact CG2-CB 4.02Å; V124-E131 HydrophobicContact CG1-CG 3.9Å; V124-E131 HydrophobicContact CG2-CG 4.13Å
125	R	79.9	Confident	80.9	Confident	227 Å²	227	99.9 Å²	99.9	86%	0.857	50%	0.503	S	S	*	.	H	α-helix	trans	-61.1	-31.5	177.5	-175.2	177.7	175.8	-176.8	-0.2	113	A121 R122 G127	A121-R125 WeakPolarHBondContact O-CB 3.45Å; A121-R125 PolarHBondContact O-N 3.21Å; R122-R125 PolarHBondContact O-N 3.15Å; R125-G127 VanDerWaalsContact C-N 3.31Å
126	L	79.4	Confident	80.9	Confident	115 Å²	115	103.7 Å²	103.7	60%	0.602	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-1.5	175.4	-68.6	171.6	0	0	0	113.3	R122 L123 V124 L128	R122-L126 HydrophobicContact CG-CD1 4.19Å; R122-L126 WeakPolarHBondContact O-CB 3.44Å; R122-L126 WeakPolarHBondContact O-CG 3.42Å; R122-L126 PolarHBondContact O-N 3.4Å; L123-L126 CarbonylContact O-C 3.6Å; L123-L126 PolarHBondContact O-N 3.16Å; V124-L126 PolarHBondContact O-N 3.04Å; L126-L128 HydrophobicContact CB-CD1 4.26Å; L126-L128 HydrophobicContact CB-CG 4.14Å; L126-L128 PolarHBondContact O-N 3.33Å
127	G	80.5	Confident	80.8	Confident	58 Å²	58	98.5 Å²	98.5	60%	0.598	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	10.9	-177.4	0	0	0	0	0	114.6	L123 V124 R125	L123-G127 PolarHBondContact O-N 3Å; L123-G127 VanDerWaalsContact O-N 3.15Å; V124-G127 PolarHBondContact O-N 2.8Å; R125-G127 VanDerWaalsContact C-N 3.31Å
128	L	78.8	Confident	81	Confident	131 Å²	131	96 Å²	96	69%	0.686	49%	0.491	S	S	*	.	S	Bend	trans	-85	-15.2	178.8	-63.1	178.6	0	0	0	112.7	L123 L126	L123-L128 HydrophobicContact CB-CB 4.44Å; L123-L128 HydrophobicContact CD2-CB 4.1Å; L123-L128 HydrophobicContact CD2-CD1 3.96Å; L123-L128 PolarHBondContact O-N 3.24Å; L126-L128 HydrophobicContact CB-CD1 4.26Å; L126-L128 HydrophobicContact CB-CG 4.14Å; L126-L128 PolarHBondContact O-N 3.33Å
129	H	73.7	Confident	81.3	Confident	98 Å²	98	97.1 Å²	97.1	45%	0.454	50%	0.496	S	S	.	.	S	Bend	trans	-130.1	127.7	173.9	-156.1	74.7	0	0	0	108.4	L123 V124	L123-H129 HydrophobicContact CB-CB 3.74Å; L123-H129 PolarHBondContact O-N 2.86Å; V124-H129 WeakPolarHBondContact CA-O 3.5Å; V124-H129 HydrophobicContact CG2-CB 4.02Å
130	Q	73.7	Confident	81.7	Confident	172 Å²	172	96.3 Å²	96.3	80%	0.804	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-91.9	128.7	176.3	-68.8	-175.7	-10.8	0	0	108.5
131	E	72.7	Confident	82.2	Confident	99 Å²	99	94.1 Å²	94.1	46%	0.463	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-60.4	136.2	167	-67.3	-164.1	-175.3	0	0	108.5	V124 T133 R187	V124-E131 HydrophobicContact CG1-CG 3.9Å; V124-E131 HydrophobicContact CG2-CG 4.13Å; E131-T133 PolarHBondContact O-N 3.42Å; E131-R187 IonicContact OE1-NH2 2.68Å; E131-R187 IonicContact OE2-CZ 2.66Å; E131-R187 IonicContact OE2-NH1 2.8Å; E131-R187 PolarHBondContact OE2-NH1 2.87Å; E131-R187 VanDerWaalsContact OE2-NH1 3.13Å; E131-R187 IonicContact OE2-NH2 3.15Å; E131-R187 PolarHBondContact OE2-NH2 3.29Å
132	P	76.4	Confident	82.6	Confident	84 Å²	84	93.2 Å²	93.2	55%	0.545	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-60.2	133.1	178	26.5	-34	0	0	0	109.1	Q136 V137	P132-Q136 HydrophobicContact CB-CB 4.43Å; P132-V137 HydrophobicContact CB-CG2 3.88Å; P132-V137 HydrophobicContact CG-CG2 3.89Å
133	T	80.1	Confident	83.1	Confident	77 Å²	77	95 Å²	95	47%	0.472	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-65.1	155.2	175.8	56.1	0	0	0	0	110.5	E131 E135 Q136 V137	E131-T133 PolarHBondContact O-N 3.42Å; T133-E135 PolarHBondContact O-N 3.46Å; T133-E135 VanDerWaalsContact O-N 3.09Å; T133-Q136 PolarHBondContact O-N 3.2Å; T133-Q136 VanDerWaalsContact OG1-CD 3.27Å; T133-Q136 VanDerWaalsContact OG1-CG 3.28Å; T133-Q136 WeakPolarHBondContact OG1-CG 3.3Å; T133-Q136 PolarHBondContact OG1-OE1 3.2Å; T133-V137 WeakPolarHBondContact O-CG2 3.36Å; T133-V137 PolarHBondContact O-N 2.9Å
134	A	82.3	Confident	83.7	Confident	54 Å²	54	99 Å²	99	45%	0.446	50%	0.497	S	S	.	.	H	α-helix	trans	-51.1	-36	177.2	0	0	0	0	0	112.6	R138 F176	A134-R138 WeakPolarHBondContact O-CB 3.03Å; A134-R138 PolarHBondContact O-N 3.24Å; A134-F176 HydrophobicContact CB-CZ 4.12Å; A134-F176 WeakPolarHBondContact O-CE2 3.33Å
135	E	87.6	Confident	84.3	Confident	135 Å²	135	97.8 Å²	97.8	63%	0.631	49%	0.489	S	S	*	.	H	α-helix	trans	-69.6	-41.6	177.6	-65.6	-176	168.2	0	0	113	T133 R138 E139	T133-E135 PolarHBondContact O-N 3.46Å; T133-E135 VanDerWaalsContact O-N 3.09Å; E135-R138 PolarHBondContact O-N 3Å; E135-E139 PolarHBondContact O-N 2.85Å
136	Q	87.5	Confident	85	Confident	108 Å²	108	92.1 Å²	92.1	51%	0.505	47%	0.471	S	S	.	.	H	α-helix	trans	-65.6	-40.3	176.3	-72.3	167.5	-40	0	0	111.5	P132 T133 E139 A140	P132-Q136 HydrophobicContact CB-CB 4.43Å; T133-Q136 PolarHBondContact O-N 3.2Å; T133-Q136 VanDerWaalsContact OG1-CD 3.27Å; T133-Q136 VanDerWaalsContact OG1-CG 3.28Å; T133-Q136 WeakPolarHBondContact OG1-CG 3.3Å; T133-Q136 PolarHBondContact OG1-OE1 3.2Å; Q136-E139 PolarHBondContact O-N 2.85Å; Q136-A140 WeakPolarHBondContact O-CB 3.46Å; Q136-A140 PolarHBondContact O-N 2.83Å
137	V	85.7	Confident	85.7	Confident	21 Å²	21	93.1 Å²	93.1	13%	0.127	47%	0.473	C	S	.	.	H	α-helix	trans	-61.3	-46.7	173.9	176	0	0	0	0	110.1	P132 T133 E139 A140 L141 F176 Y179 M180	P132-V137 HydrophobicContact CB-CG2 3.88Å; P132-V137 HydrophobicContact CG-CG2 3.89Å; T133-V137 WeakPolarHBondContact O-CG2 3.36Å; T133-V137 PolarHBondContact O-N 2.9Å; V137-E139 PolarHBondContact O-N 3.29Å; V137-A140 PolarHBondContact O-N 2.96Å; V137-L141 HydrophobicContact CG1-CD1 3.83Å; V137-L141 HydrophobicContact CG1-CG 4.42Å; V137-L141 VanDerWaalsContact O-CG 3.3Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 3.46Å; V137-F176 HydrophobicContact CB-CE2 4.17Å; V137-F176 HydrophobicContact CG1-CD2 4.37Å; V137-F176 HydrophobicContact CG1-CE2 3.95Å; V137-Y179 HydrophobicContact CG1-CD1 3.84Å; V137-Y179 HydrophobicContact CG1-CE1 3.53Å; V137-M180 HydrophobicContact CG1-SD 4.37Å
138	R	90.5	Very high	86.4	Confident	108 Å²	108	96.3 Å²	96.3	41%	0.408	47%	0.472	S	S	.	.	H	α-helix	trans	-59.2	-47.6	177	-174.7	-175	65.6	175.6	-3.9	112.1	A134 E135 A140 L141 N142 F176	A134-R138 WeakPolarHBondContact O-CB 3.03Å; A134-R138 PolarHBondContact O-N 3.24Å; E135-R138 PolarHBondContact O-N 3Å; R138-A140 PolarHBondContact O-N 2.74Å; R138-L141 PolarHBondContact O-N 3.26Å; R138-N142 VanDerWaalsContact O-CB 3.27Å; R138-N142 WeakPolarHBondContact O-CB 3.5Å; R138-N142 PolarHBondContact O-N 3.15Å; R138-N142 PolarHBondContact O-OD1 3.31Å; R138-F176 HydrophobicContact CB-CD2 3.8Å; R138-F176 HydrophobicContact CB-CE2 3.86Å; R138-F176 HydrophobicContact CB-CG 4.4Å; R138-F176 HydrophobicContact CG-CD2 4.25Å; R138-F176 HydrophobicContact CG-CG 4.41Å
139	E	90.7	Very high	87.2	Confident	128 Å²	128	91.4 Å²	91.4	60%	0.598	45%	0.445	S	S	*	.	H	α-helix	trans	-63.9	-40.7	-179.5	-171.3	-178.5	174.9	0	0	112.2	E135 Q136 V137 N142 R143	E135-E139 PolarHBondContact O-N 2.85Å; Q136-E139 PolarHBondContact O-N 2.85Å; V137-E139 PolarHBondContact O-N 3.29Å; E139-N142 PolarHBondContact O-N 2.81Å; E139-R143 PolarHBondContact O-N 3.23Å
140	A	91.1	Very high	88.2	Confident	42 Å²	42	88.8 Å²	88.8	35%	0.347	44%	0.438	S	S	.	.	H	α-helix	trans	-63.1	-49.2	176.8	0	0	0	0	0	111.9	Q136 V137 R138 N142 R143 E144	Q136-A140 WeakPolarHBondContact O-CB 3.46Å; Q136-A140 PolarHBondContact O-N 2.83Å; V137-A140 PolarHBondContact O-N 2.96Å; R138-A140 PolarHBondContact O-N 2.74Å; A140-N142 VanDerWaalsContact C-N 3.3Å; A140-N142 PolarHBondContact O-N 3.23Å; A140-R143 PolarHBondContact O-N 3.16Å; A140-E144 PolarHBondContact O-N 3.39Å
141	L	91.2	Very high	89.2	Confident	18 Å²	18	85.9 Å²	85.9	9%	0.094	42%	0.424	C	S	.	.	H	α-helix	trans	-62.9	-38.5	177.1	-66.5	169.2	0	0	0	111.5	V137 R138 R143 E144 N145 F176 Y179	V137-L141 HydrophobicContact CG1-CD1 3.83Å; V137-L141 HydrophobicContact CG1-CG 4.42Å; V137-L141 VanDerWaalsContact O-CG 3.3Å; V137-L141 WeakPolarHBondContact O-CG 3.44Å; V137-L141 PolarHBondContact O-N 3.46Å; R138-L141 PolarHBondContact O-N 3.26Å; L141-R143 VanDerWaalsContact C-N 3.32Å; L141-R143 PolarHBondContact O-N 3.04Å; L141-E144 PolarHBondContact O-N 2.68Å; L141-N145 WeakPolarHBondContact O-CB 3.12Å; L141-N145 PolarHBondContact O-N 3.32Å; L141-F176 HydrophobicContact CD1-CD2 4.1Å; L141-Y179 HydrophobicContact CD1-CD1 3.77Å; L141-Y179 HydrophobicContact CD1-CD2 4.37Å; L141-Y179 HydrophobicContact CD1-CE1 4.33Å; L141-Y179 HydrophobicContact CD1-CG 3.79Å; L141-Y179 HydrophobicContact CD2-CD2 4.25Å; L141-Y179 HydrophobicContact CD2-CE2 4.4Å; L141-Y179 HydrophobicContact CD2-CG 4.48Å
142	N	91.4	Very high	90.3	Very high	36 Å²	36	86.3 Å²	86.3	19%	0.193	42%	0.423	C	S	.	.	H	α-helix	trans	-60.5	-42.8	175.6	-76.2	-4.8	0	0	0	111.3	R138 E139 A140 F146 Q172	R138-N142 VanDerWaalsContact O-CB 3.27Å; R138-N142 WeakPolarHBondContact O-CB 3.5Å; R138-N142 PolarHBondContact O-N 3.15Å; R138-N142 PolarHBondContact O-OD1 3.31Å; E139-N142 PolarHBondContact O-N 2.81Å; A140-N142 VanDerWaalsContact C-N 3.3Å; A140-N142 PolarHBondContact O-N 3.23Å; N142-F146 WeakPolarHBondContact O-CA 3.13Å; N142-F146 WeakPolarHBondContact O-CB 3.4Å; N142-F146 PolarHBondContact O-N 3.03Å; N142-Q172 VanDerWaalsContact OD1-CB 3.31Å; N142-Q172 WeakPolarHBondContact OD1-CB 3.19Å; N142-Q172 VanDerWaalsContact OD1-CG 3.28Å; N142-Q172 WeakPolarHBondContact OD1-CG 3.14Å
143	R	92.8	Very high	91.2	Very high	183 Å²	183	82.3 Å²	82.3	69%	0.691	40%	0.397	S	S	*	.	H	α-helix	trans	-68.1	-40.9	179.6	-178.6	171	58.6	-135.6	-3.8	112.7	E139 A140 L141	E139-R143 PolarHBondContact O-N 3.23Å; A140-R143 PolarHBondContact O-N 3.16Å; L141-R143 VanDerWaalsContact C-N 3.32Å; L141-R143 PolarHBondContact O-N 3.04Å
144	E	92	Very high	91.9	Very high	145 Å²	145	80.3 Å²	80.3	68%	0.678	39%	0.388	S	S	*	.	H	α-helix	trans	-68	-44.5	179.8	-171.8	175.4	175.5	0	0	111.7	A140 L141	A140-E144 PolarHBondContact O-N 3.39Å; L141-E144 PolarHBondContact O-N 2.68Å
145	N	91.7	Very high	92.4	Very high	15 Å²	15	84.4 Å²	84.4	8%	0.08	40%	0.398	C	S	.	.	H	α-helix	trans	-95.1	-3	-173.2	-63.8	-7.8	0	0	0	113.9	L141 E147 Q148 F149 H175	L141-N145 WeakPolarHBondContact O-CB 3.12Å; L141-N145 PolarHBondContact O-N 3.32Å; N145-E147 VanDerWaalsContact C-N 3.29Å; N145-E147 PolarHBondContact O-N 3.36Å; N145-Q148 PolarHBondContact O-N 2.77Å; N145-F149 HydrophobicContact CB-CD2 3.85Å; N145-F149 HydrophobicContact CB-CE1 4.22Å; N145-F149 HydrophobicContact CB-CE2 3.39Å; N145-F149 HydrophobicContact CB-CG 4.47Å; N145-F149 HydrophobicContact CB-CZ 3.6Å; N145-F149 WeakPolarHBondContact O-CD2 3.33Å; N145-F149 VanDerWaalsContact O-CG 3.27Å; N145-F149 WeakPolarHBondContact O-CG 3.45Å; N145-F149 PolarHBondContact O-N 2.91Å; N145-H175 PolarHBondContact ND2-CE1 2.93Å; N145-H175 PolarHBondContact ND2-ND1 3.23Å; N145-H175 PolarHBondContact ND2-NE2 3.46Å; N145-H175 VanDerWaalsContact ND2-NE2 3.11Å
146	F	94.8	Very high	92.7	Very high	108 Å²	108	82.7 Å²	82.7	47%	0.474	39%	0.39	S	S	.	.	H	α-helix	trans	-55.3	-45.1	-177.4	-179.5	-106.6	0	0	0	112.2	N142 F149 S150 I168	N142-F146 WeakPolarHBondContact O-CA 3.13Å; N142-F146 WeakPolarHBondContact O-CB 3.4Å; N142-F146 PolarHBondContact O-N 3.03Å; F146-F149 PolarHBondContact O-N 3.14Å; F146-S150 WeakPolarHBondContact O-CB 3.35Å; F146-S150 PolarHBondContact O-N 3.3Å; F146-I168 HydrophobicContact CD2-CG2 4.37Å; F146-I168 HydrophobicContact CE2-CG2 4.39Å
147	E	94.5	Very high	93	Very high	135 Å²	135	81.6 Å²	81.6	63%	0.631	38%	0.382	S	S	*	.	H	α-helix	trans	-63.7	-45.4	-176.2	-173.4	168.2	-168	0	0	111.5	N145 S150 Q151	N145-E147 VanDerWaalsContact C-N 3.29Å; N145-E147 PolarHBondContact O-N 3.36Å; E147-S150 PolarHBondContact O-N 3.31Å; E147-Q151 WeakPolarHBondContact O-CG 2.87Å; E147-Q151 PolarHBondContact O-N 2.97Å
148	Q	94.6	Very high	93.2	Very high	126 Å²	126	84.6 Å²	84.6	59%	0.589	40%	0.401	S	S	*	.	H	α-helix	trans	-64.1	-46.7	177.9	-62.3	178.7	7.7	0	0	111.5	N145 S150 Q151 Y152	N145-Q148 PolarHBondContact O-N 2.77Å; Q148-S150 VanDerWaalsContact C-N 3.31Å; Q148-S150 PolarHBondContact O-N 3.25Å; Q148-Q151 PolarHBondContact O-N 2.79Å; Q148-Y152 PolarHBondContact O-N 3.39Å
149	F	96.8	Very high	93.3	Very high	28 Å²	28	86.7 Å²	86.7	12%	0.123	42%	0.421	C	S	.	.	H	α-helix	trans	-65.5	-35.7	178	-62.2	-24.2	0	0	0	112.2	N145 F146 A153 I168 L171 Q172 H175	N145-F149 HydrophobicContact CB-CD2 3.85Å; N145-F149 HydrophobicContact CB-CE1 4.22Å; N145-F149 HydrophobicContact CB-CE2 3.39Å; N145-F149 HydrophobicContact CB-CG 4.47Å; N145-F149 HydrophobicContact CB-CZ 3.6Å; N145-F149 WeakPolarHBondContact O-CD2 3.33Å; N145-F149 VanDerWaalsContact O-CG 3.27Å; N145-F149 WeakPolarHBondContact O-CG 3.45Å; N145-F149 PolarHBondContact O-N 2.91Å; F146-F149 PolarHBondContact O-N 3.14Å; F149-A153 VanDerWaalsContact O-CB 3.24Å; F149-A153 WeakPolarHBondContact O-CB 3.19Å; F149-A153 PolarHBondContact O-N 2.9Å; F149-I168 HydrophobicContact CB-CG1 4.45Å; F149-I168 HydrophobicContact CB-CG2 4.31Å; F149-L171 HydrophobicContact CB-CD1 4.43Å; F149-L171 HydrophobicContact CD1-CB 4.13Å; F149-L171 HydrophobicContact CD1-CD1 4.25Å; F149-L171 HydrophobicContact CD2-CB 4.34Å; F149-L171 HydrophobicContact CE1-CB 4.3Å; F149-L171 HydrophobicContact CE2-CB 4.48Å; F149-L171 HydrophobicContact CG-CB 4.15Å; F149-L171 HydrophobicContact CG-CD1 4.47Å; F149-L171 HydrophobicContact CZ-CB 4.47Å; F149-Q172 HydrophobicContact CD2-CG 3.63Å; F149-Q172 HydrophobicContact CE2-CG 3.8Å; F149-H175 HydrophobicContact CE2-CB 4.4Å; F149-H175 HydrophobicContact CZ-CB 3.9Å
150	S	94.4	Very high	93.4	Very high	43 Å²	43	84.4 Å²	84.4	30%	0.301	41%	0.41	S	S	.	.	H	α-helix	trans	-65.9	-44.3	176.8	-176.1	0	0	0	0	111.8	F146 E147 Q148 A153 A154	F146-S150 WeakPolarHBondContact O-CB 3.35Å; F146-S150 PolarHBondContact O-N 3.3Å; E147-S150 PolarHBondContact O-N 3.31Å; Q148-S150 VanDerWaalsContact C-N 3.31Å; Q148-S150 PolarHBondContact O-N 3.25Å; S150-A153 PolarHBondContact O-N 3.4Å; S150-A154 WeakPolarHBondContact O-CB 3.19Å; S150-A154 PolarHBondContact O-N 3.06Å
151	Q	95	Very high	93.5	Very high	110 Å²	110	85.9 Å²	85.9	51%	0.514	42%	0.416	S	S	.	.	H	α-helix	trans	-62	-50.1	175.7	-71.7	175.9	14.6	0	0	111.3	E147 Q148 A153 A154 E155	E147-Q151 WeakPolarHBondContact O-CG 2.87Å; E147-Q151 PolarHBondContact O-N 2.97Å; Q148-Q151 PolarHBondContact O-N 2.79Å; Q151-A153 VanDerWaalsContact C-N 3.32Å; Q151-A153 PolarHBondContact O-N 3.35Å; Q151-A154 WeakPolarHBondContact O-CB 3.21Å; Q151-A154 PolarHBondContact O-N 3.4Å; Q151-A154 VanDerWaalsContact O-N 3.11Å; Q151-E155 PolarHBondContact O-N 2.96Å
152	Y	94.9	Very high	93.7	Very high	109 Å²	109	91.2 Å²	91.2	43%	0.427	45%	0.445	S	S	.	.	H	α-helix	trans	-58.3	-43.8	177.1	177.6	-101.3	0	0	0	112	Q148 A154 E155 Q156 L167 L171	Q148-Y152 PolarHBondContact O-N 3.39Å; Y152-A154 VanDerWaalsContact C-N 3.34Å; Y152-A154 PolarHBondContact O-N 3.46Å; Y152-E155 PolarHBondContact O-N 3Å; Y152-Q156 HydrophobicContact CE1-CG 4.11Å; Y152-Q156 HydrophobicContact CE2-CG 4.29Å; Y152-Q156 WeakPolarHBondContact O-CG 3.29Å; Y152-Q156 PolarHBondContact O-N 3.43Å; Y152-L167 HydrophobicContact CD1-CD2 4.14Å; Y152-L167 HydrophobicContact CE1-CD2 3.97Å; Y152-L171 HydrophobicContact CD1-CD1 3.59Å; Y152-L171 HydrophobicContact CE1-CD1 3.98Å
153	A	95.7	Very high	93.7	Very high	0 Å²	0	94.2 Å²	94.2	0%	0	46%	0.456	C	S	.	.	H	α-helix	trans	-64.8	-37.9	176.8	0	0	0	0	0	112.5	F149 S150 Q151 E155 Q156 Y157 R164 L167 I168	F149-A153 VanDerWaalsContact O-CB 3.24Å; F149-A153 WeakPolarHBondContact O-CB 3.19Å; F149-A153 PolarHBondContact O-N 2.9Å; S150-A153 PolarHBondContact O-N 3.4Å; Q151-A153 VanDerWaalsContact C-N 3.32Å; Q151-A153 PolarHBondContact O-N 3.35Å; A153-E155 VanDerWaalsContact C-N 3.32Å; A153-E155 PolarHBondContact O-N 3Å; A153-Q156 PolarHBondContact O-N 2.96Å; A153-Y157 PolarHBondContact O-N 3.01Å; A153-R164 HydrophobicContact CB-CB 4.1Å; A153-R164 HydrophobicContact CB-CG 4.25Å; A153-R164 WeakPolarHBondContact O-CG 3.41Å; A153-L167 HydrophobicContact CB-CD2 4.1Å; A153-L167 HydrophobicContact CB-CG 4.48Å; A153-I168 HydrophobicContact CB-CD1 4.11Å; A153-I168 HydrophobicContact CB-CG1 3.72Å
154	A	93.7	Very high	93.8	Very high	35 Å²	35	89.5 Å²	89.5	29%	0.289	44%	0.438	S	S	.	.	H	α-helix	trans	-64.4	-34.3	176.5	0	0	0	0	0	113.1	S150 Q151 Y152 P158	S150-A154 WeakPolarHBondContact O-CB 3.19Å; S150-A154 PolarHBondContact O-N 3.06Å; Q151-A154 WeakPolarHBondContact O-CB 3.21Å; Q151-A154 PolarHBondContact O-N 3.4Å; Q151-A154 VanDerWaalsContact O-N 3.11Å; Y152-A154 VanDerWaalsContact C-N 3.34Å; Y152-A154 PolarHBondContact O-N 3.46Å; A154-P158 VanDerWaalsContact O-CA 3.3Å; A154-P158 WeakPolarHBondContact O-CA 3.39Å; A154-P158 WeakPolarHBondContact O-CG 3.21Å
155	E	94.3	Very high	93.9	Very high	139 Å²	139	87.4 Å²	87.4	65%	0.65	43%	0.428	S	S	*	.	H	α-helix	trans	-69.7	-41.7	174.7	-69.4	176.2	178.1	0	0	112.4	Q151 Y152 A153	Q151-E155 PolarHBondContact O-N 2.96Å; Y152-E155 PolarHBondContact O-N 3Å; A153-E155 VanDerWaalsContact C-N 3.32Å; A153-E155 PolarHBondContact O-N 3Å
156	Q	93.4	Very high	94	Very high	100 Å²	100	89.4 Å²	89.4	47%	0.467	45%	0.447	S	S	.	.	H	α-helix	trans	-73.5	-35.5	-179.4	-62.1	-54.5	-57.4	0	0	112.6	Y152 A153 L167	Y152-Q156 HydrophobicContact CE1-CG 4.11Å; Y152-Q156 HydrophobicContact CE2-CG 4.29Å; Y152-Q156 WeakPolarHBondContact O-CG 3.29Å; Y152-Q156 PolarHBondContact O-N 3.43Å; A153-Q156 PolarHBondContact O-N 2.96Å; Q156-L167 HydrophobicContact CB-CD2 4.25Å; Q156-L167 HydrophobicContact CG-CD2 4.32Å
157	Y	93.4	Very high	94	Very high	85 Å²	85	85.5 Å²	85.5	33%	0.333	43%	0.431	S	S	.	.			trans	-134.6	69	-175.9	-59	-69.7	0	0	0	112.9	A153 N159 E160 K163 R164 L167	A153-Y157 PolarHBondContact O-N 3.01Å; Y157-N159 VanDerWaalsContact C-N 3.3Å; Y157-N159 PolarHBondContact O-N 3.36Å; Y157-E160 WeakPolarHBondContact CD1-OE2 3.44Å; Y157-E160 PolarHBondContact O-N 3.4Å; Y157-K163 HydrophobicContact CD1-CB 3.97Å; Y157-K163 HydrophobicContact CD1-CD 3.95Å; Y157-K163 HydrophobicContact CD2-CB 4.03Å; Y157-K163 HydrophobicContact CE1-CB 4.28Å; Y157-K163 HydrophobicContact CE1-CD 3.81Å; Y157-K163 HydrophobicContact CE2-CB 4.3Å; Y157-K163 HydrophobicContact CG-CB 3.85Å; Y157-R164 WeakPolarHBondContact O-CD 3.32Å; Y157-R164 VanDerWaalsContact O-CG 3.31Å; Y157-R164 WeakPolarHBondContact O-CG 3.41Å; Y157-L167 HydrophobicContact CD2-CD2 4.09Å; Y157-L167 HydrophobicContact CE2-CB 4.44Å; Y157-L167 HydrophobicContact CE2-CD2 3.85Å
158	P	90.4	Very high	94	Very high	83 Å²	83	80 Å²	80	54%	0.539	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-37	-173.4	-25.6	33.4	0	0	0	114.9	A154	A154-P158 VanDerWaalsContact O-CA 3.3Å; A154-P158 WeakPolarHBondContact O-CA 3.39Å; A154-P158 WeakPolarHBondContact O-CG 3.21Å
159	N	91.6	Very high	94	Very high	153 Å²	153	79.1 Å²	79.1	82%	0.818	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	4.6	-172.4	-63.5	-28.4	0	0	0	114.1	Y157	Y157-N159 VanDerWaalsContact C-N 3.3Å; Y157-N159 PolarHBondContact O-N 3.36Å
160	E	93.8	Very high	94	Very high	80 Å²	80	84.1 Å²	84.1	37%	0.374	42%	0.424	S	S	.	.			trans	-122.9	89.1	-172.7	-66.3	-179.1	145.2	0	0	110.6	Y157 D162 K163 R164	Y157-E160 WeakPolarHBondContact CD1-OE2 3.44Å; Y157-E160 PolarHBondContact O-N 3.4Å; E160-D162 PolarHBondContact O-N 2.95Å; E160-K163 HydrophobicContact CB-CB 4.21Å; E160-K163 HydrophobicContact CB-CG 4.31Å; E160-K163 PolarHBondContact O-N 3.49Å; E160-K163 IonicContact OE1-NZ 3.88Å; E160-K163 PolarHBondContact OE1-NZ 3.44Å; E160-K163 WeakPolarHBondContact OE2-CD 3.48Å; E160-K163 WeakPolarHBondContact OE2-CE 3.37Å; E160-K163 IonicContact OE2-NZ 2.63Å; E160-K163 PolarHBondContact OE2-NZ 2.87Å; E160-R164 WeakPolarHBondContact O-CG 3.25Å; E160-R164 PolarHBondContact O-N 3.14Å
161	P	93.1	Very high	94	Very high	73 Å²	73	84.2 Å²	84.2	47%	0.474	42%	0.421	S	S	.	.	H	α-helix	trans	-61.4	-40.9	-175.6	24.5	-33	0	0	0	113.3	K163 R164 E165	P161-K163 VanDerWaalsContact C-N 3.33Å; P161-K163 PolarHBondContact O-N 2.93Å; P161-R164 WeakPolarHBondContact O-CB 3.49Å; P161-R164 PolarHBondContact O-N 2.94Å; P161-E165 PolarHBondContact O-N 3.32Å
162	D	94.2	Very high	94	Very high	130 Å²	130	80.1 Å²	80.1	70%	0.695	40%	0.401	S	S	*	.	H	α-helix	trans	-64.1	-38.8	-177.9	-57.1	-32.6	0	0	0	112	E160 E165 A166	E160-D162 PolarHBondContact O-N 2.95Å; D162-E165 PolarHBondContact O-N 3.41Å; D162-A166 WeakPolarHBondContact O-CB 3.07Å; D162-A166 PolarHBondContact O-N 2.97Å
163	K	93.3	Very high	93.9	Very high	99 Å²	99	78.7 Å²	78.7	43%	0.43	40%	0.401	S	S	.	.	H	α-helix	trans	-70.7	-34.9	176.3	-63.9	-161.7	-157.6	150.6	0	111.9	Y157 E160 P161 L167	Y157-K163 HydrophobicContact CD1-CB 3.97Å; Y157-K163 HydrophobicContact CD1-CD 3.95Å; Y157-K163 HydrophobicContact CD2-CB 4.03Å; Y157-K163 HydrophobicContact CE1-CB 4.28Å; Y157-K163 HydrophobicContact CE1-CD 3.81Å; Y157-K163 HydrophobicContact CE2-CB 4.3Å; Y157-K163 HydrophobicContact CG-CB 3.85Å; E160-K163 HydrophobicContact CB-CB 4.21Å; E160-K163 HydrophobicContact CB-CG 4.31Å; E160-K163 PolarHBondContact O-N 3.49Å; E160-K163 IonicContact OE1-NZ 3.88Å; E160-K163 PolarHBondContact OE1-NZ 3.44Å; E160-K163 WeakPolarHBondContact OE2-CD 3.48Å; E160-K163 WeakPolarHBondContact OE2-CE 3.37Å; E160-K163 IonicContact OE2-NZ 2.63Å; E160-K163 PolarHBondContact OE2-NZ 2.87Å; P161-K163 VanDerWaalsContact C-N 3.33Å; P161-K163 PolarHBondContact O-N 2.93Å; K163-L167 WeakPolarHBondContact O-CB 3.45Å; K163-L167 PolarHBondContact O-N 3.25Å
164	R	93.1	Very high	93.8	Very high	83 Å²	83	82 Å²	82	31%	0.313	42%	0.424	S	S	.	.	H	α-helix	trans	-61	-48.9	172.9	-69.7	-172	-69.1	172.1	-1.2	111.5	A153 Y157 E160 P161 A166 L167 I168	A153-R164 HydrophobicContact CB-CB 4.1Å; A153-R164 HydrophobicContact CB-CG 4.25Å; A153-R164 WeakPolarHBondContact O-CG 3.41Å; Y157-R164 WeakPolarHBondContact O-CD 3.32Å; Y157-R164 VanDerWaalsContact O-CG 3.31Å; Y157-R164 WeakPolarHBondContact O-CG 3.41Å; E160-R164 WeakPolarHBondContact O-CG 3.25Å; E160-R164 PolarHBondContact O-N 3.14Å; P161-R164 WeakPolarHBondContact O-CB 3.49Å; P161-R164 PolarHBondContact O-N 2.94Å; R164-A166 PolarHBondContact O-N 2.63Å; R164-L167 PolarHBondContact O-N 2.79Å; R164-I168 VanDerWaalsContact O-CG1 3.25Å; R164-I168 WeakPolarHBondContact O-CG1 3.32Å; R164-I168 PolarHBondContact O-N 3.38Å
165	E	94	Very high	93.7	Very high	101 Å²	101	83 Å²	83	47%	0.472	42%	0.423	S	S	.	.	H	α-helix	trans	-63.5	-42.4	-179.6	-167.5	-173.1	157.7	0	0	111.8	P161 D162 L167 I168 K169	P161-E165 PolarHBondContact O-N 3.32Å; D162-E165 PolarHBondContact O-N 3.41Å; E165-L167 PolarHBondContact O-N 2.95Å; E165-I168 PolarHBondContact O-N 2.95Å; E165-K169 WeakPolarHBondContact O-CG 3.4Å; E165-K169 PolarHBondContact O-N 2.99Å; E165-K169 VanDerWaalsContact OE1-CE 3.24Å; E165-K169 WeakPolarHBondContact OE1-CE 3.47Å; E165-K169 IonicContact OE1-NZ 3.01Å; E165-K169 PolarHBondContact OE1-NZ 3.23Å
166	A	94.7	Very high	93.6	Very high	58 Å²	58	78.2 Å²	78.2	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-60.5	-43.6	175.6	0	0	0	0	0	112.1	D162 R164 K169 Q170	D162-A166 WeakPolarHBondContact O-CB 3.07Å; D162-A166 PolarHBondContact O-N 2.97Å; R164-A166 PolarHBondContact O-N 2.63Å; A166-K169 PolarHBondContact O-N 3.35Å; A166-Q170 PolarHBondContact O-N 3.19Å
167	L	94.5	Very high	93.4	Very high	25 Å²	25	79.9 Å²	79.9	13%	0.131	41%	0.408	C	S	.	.	H	α-helix	trans	-65.4	-42.9	177.4	179.3	59.8	0	0	0	112	Y152 A153 Q156 Y157 K163 R164 E165 K169 Q170 L171	Y152-L167 HydrophobicContact CD1-CD2 4.14Å; Y152-L167 HydrophobicContact CE1-CD2 3.97Å; A153-L167 HydrophobicContact CB-CD2 4.1Å; A153-L167 HydrophobicContact CB-CG 4.48Å; Q156-L167 HydrophobicContact CB-CD2 4.25Å; Q156-L167 HydrophobicContact CG-CD2 4.32Å; Y157-L167 HydrophobicContact CD2-CD2 4.09Å; Y157-L167 HydrophobicContact CE2-CB 4.44Å; Y157-L167 HydrophobicContact CE2-CD2 3.85Å; K163-L167 WeakPolarHBondContact O-CB 3.45Å; K163-L167 PolarHBondContact O-N 3.25Å; R164-L167 PolarHBondContact O-N 2.79Å; E165-L167 PolarHBondContact O-N 2.95Å; L167-K169 VanDerWaalsContact C-N 3.34Å; L167-K169 PolarHBondContact O-N 3.43Å; L167-Q170 PolarHBondContact O-N 3.18Å; L167-L171 HydrophobicContact CD1-CD1 4.14Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.98Å; L167-L171 HydrophobicContact CG-CG 4.41Å; L167-L171 WeakPolarHBondContact O-CG 3.01Å; L167-L171 PolarHBondContact O-N 2.83Å
168	I	95	Very high	93.2	Very high	19 Å²	19	82.3 Å²	82.3	10%	0.097	42%	0.422	C	S	.	.	H	α-helix	trans	-58.9	-46.8	176.4	-67.5	163.1	0	0	0	110.3	F146 F149 A153 R164 E165 Q170 L171 Q172	F146-I168 HydrophobicContact CD2-CG2 4.37Å; F146-I168 HydrophobicContact CE2-CG2 4.39Å; F149-I168 HydrophobicContact CB-CG1 4.45Å; F149-I168 HydrophobicContact CB-CG2 4.31Å; A153-I168 HydrophobicContact CB-CD1 4.11Å; A153-I168 HydrophobicContact CB-CG1 3.72Å; R164-I168 VanDerWaalsContact O-CG1 3.25Å; R164-I168 WeakPolarHBondContact O-CG1 3.32Å; R164-I168 PolarHBondContact O-N 3.38Å; E165-I168 PolarHBondContact O-N 2.95Å; I168-Q170 VanDerWaalsContact C-N 3.33Å; I168-Q170 PolarHBondContact O-N 3.13Å; I168-L171 PolarHBondContact O-N 3.15Å; I168-Q172 HydrophobicContact CG2-CG 4.3Å; I168-Q172 WeakPolarHBondContact O-CB 3.48Å; I168-Q172 VanDerWaalsContact O-CG 3.24Å; I168-Q172 WeakPolarHBondContact O-CG 3.47Å; I168-Q172 PolarHBondContact O-N 2.93Å
169	K	95.1	Very high	93.2	Very high	108 Å²	108	82.7 Å²	82.7	47%	0.47	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-41.7	176.9	-73.9	177.2	-175.1	164.7	0	112	E165 A166 L167 N173	E165-K169 WeakPolarHBondContact O-CG 3.4Å; E165-K169 PolarHBondContact O-N 2.99Å; E165-K169 VanDerWaalsContact OE1-CE 3.24Å; E165-K169 WeakPolarHBondContact OE1-CE 3.47Å; E165-K169 IonicContact OE1-NZ 3.01Å; E165-K169 PolarHBondContact OE1-NZ 3.23Å; A166-K169 PolarHBondContact O-N 3.35Å; L167-K169 VanDerWaalsContact C-N 3.34Å; L167-K169 PolarHBondContact O-N 3.43Å; K169-N173 VanDerWaalsContact O-CG 3.26Å; K169-N173 PolarHBondContact O-N 3.09Å; K169-N173 PolarHBondContact O-ND2 2.97Å
170	Q	95.8	Very high	92.8	Very high	134 Å²	134	79 Å²	79	63%	0.626	39%	0.392	S	S	*	.	H	α-helix	trans	-62.8	-46	177.1	-176.5	-177.4	-26.6	0	0	111.7	A166 L167 I168 N173 S174	A166-Q170 PolarHBondContact O-N 3.19Å; L167-Q170 PolarHBondContact O-N 3.18Å; I168-Q170 VanDerWaalsContact C-N 3.33Å; I168-Q170 PolarHBondContact O-N 3.13Å; Q170-N173 PolarHBondContact O-N 3.01Å; Q170-S174 WeakPolarHBondContact O-CB 3.31Å; Q170-S174 PolarHBondContact O-N 2.95Å
171	L	94.8	Very high	92.2	Very high	45 Å²	45	77.7 Å²	77.7	24%	0.236	40%	0.395	C	S	.	.	H	α-helix	trans	-64.5	-42.4	178.2	-70.5	170	0	0	0	111.9	F149 Y152 L167 I168 N173 S174 H175	F149-L171 HydrophobicContact CB-CD1 4.43Å; F149-L171 HydrophobicContact CD1-CB 4.13Å; F149-L171 HydrophobicContact CD1-CD1 4.25Å; F149-L171 HydrophobicContact CD2-CB 4.34Å; F149-L171 HydrophobicContact CE1-CB 4.3Å; F149-L171 HydrophobicContact CE2-CB 4.48Å; F149-L171 HydrophobicContact CG-CB 4.15Å; F149-L171 HydrophobicContact CG-CD1 4.47Å; F149-L171 HydrophobicContact CZ-CB 4.47Å; Y152-L171 HydrophobicContact CD1-CD1 3.59Å; Y152-L171 HydrophobicContact CE1-CD1 3.98Å; L167-L171 HydrophobicContact CD1-CD1 4.14Å; L167-L171 HydrophobicContact CD1-CG 4.12Å; L167-L171 HydrophobicContact CG-CD1 3.98Å; L167-L171 HydrophobicContact CG-CG 4.41Å; L167-L171 WeakPolarHBondContact O-CG 3.01Å; L167-L171 PolarHBondContact O-N 2.83Å; I168-L171 PolarHBondContact O-N 3.15Å; L171-N173 PolarHBondContact O-N 3.35Å; L171-S174 PolarHBondContact O-N 3.49Å; L171-H175 WeakPolarHBondContact O-CB 3.26Å; L171-H175 PolarHBondContact O-N 3.3Å
172	Q	95.1	Very high	91.8	Very high	23 Å²	23	80.8 Å²	80.8	11%	0.107	40%	0.403	C	S	.	.	H	α-helix	trans	-58.8	-46	174.9	-77.7	176.1	-23.2	0	0	112.2	N142 F149 I168 H175 F176	N142-Q172 VanDerWaalsContact OD1-CB 3.31Å; N142-Q172 WeakPolarHBondContact OD1-CB 3.19Å; N142-Q172 VanDerWaalsContact OD1-CG 3.28Å; N142-Q172 WeakPolarHBondContact OD1-CG 3.14Å; F149-Q172 HydrophobicContact CD2-CG 3.63Å; F149-Q172 HydrophobicContact CE2-CG 3.8Å; I168-Q172 HydrophobicContact CG2-CG 4.3Å; I168-Q172 WeakPolarHBondContact O-CB 3.48Å; I168-Q172 VanDerWaalsContact O-CG 3.24Å; I168-Q172 WeakPolarHBondContact O-CG 3.47Å; I168-Q172 PolarHBondContact O-N 2.93Å; Q172-H175 PolarHBondContact O-N 3.26Å; Q172-F176 WeakPolarHBondContact O-CB 3.43Å; Q172-F176 PolarHBondContact O-N 3.42Å
173	N	92	Very high	91	Very high	80 Å²	80	76.7 Å²	76.7	43%	0.428	38%	0.383	S	S	.	.	H	α-helix	trans	-65.3	-47.1	178	-70.5	-14.3	0	0	0	111.8	K169 Q170 L171 H175 F176 E177	K169-N173 VanDerWaalsContact O-CG 3.26Å; K169-N173 PolarHBondContact O-N 3.09Å; K169-N173 PolarHBondContact O-ND2 2.97Å; Q170-N173 PolarHBondContact O-N 3.01Å; L171-N173 PolarHBondContact O-N 3.35Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 PolarHBondContact O-N 3.34Å; N173-F176 PolarHBondContact O-N 2.83Å; N173-E177 WeakPolarHBondContact O-CG 3.46Å; N173-E177 PolarHBondContact O-N 3.36Å
174	S	93.7	Very high	89.9	Confident	68 Å²	68	78.5 Å²	78.5	48%	0.476	39%	0.391	S	S	.	.	H	α-helix	trans	-59.7	-42.8	177.5	-171.6	0	0	0	0	111.6	Q170 L171 E177 E178	Q170-S174 WeakPolarHBondContact O-CB 3.31Å; Q170-S174 PolarHBondContact O-N 2.95Å; L171-S174 PolarHBondContact O-N 3.49Å; S174-E177 PolarHBondContact O-N 3.45Å; S174-E178 WeakPolarHBondContact O-CB 3.33Å; S174-E178 PolarHBondContact O-N 3.21Å
175	H	92.6	Very high	88.8	Confident	57 Å²	57	79.8 Å²	79.8	26%	0.264	40%	0.404	S	S	.	.	H	α-helix	trans	-65.7	-40.4	178.1	-178.6	-95	0	0	0	112	N145 F149 L171 Q172 N173 Y179	N145-H175 PolarHBondContact ND2-CE1 2.93Å; N145-H175 PolarHBondContact ND2-ND1 3.23Å; N145-H175 PolarHBondContact ND2-NE2 3.46Å; N145-H175 VanDerWaalsContact ND2-NE2 3.11Å; F149-H175 HydrophobicContact CE2-CB 4.4Å; F149-H175 HydrophobicContact CZ-CB 3.9Å; L171-H175 WeakPolarHBondContact O-CB 3.26Å; L171-H175 PolarHBondContact O-N 3.3Å; Q172-H175 PolarHBondContact O-N 3.26Å; N173-H175 VanDerWaalsContact C-N 3.31Å; N173-H175 PolarHBondContact O-N 3.34Å; H175-Y179 VanDerWaalsContact O-CB 3.31Å; H175-Y179 WeakPolarHBondContact O-CB 3.44Å; H175-Y179 PolarHBondContact O-N 3.31Å
176	F	92.7	Very high	87	Confident	38 Å²	38	77.8 Å²	77.8	17%	0.167	41%	0.411	C	S	.	.	H	α-helix	trans	-63.3	-44.2	175.5	175	-100.6	0	0	0	112.1	A134 V137 R138 L141 Q172 N173 Y179 M180	A134-F176 HydrophobicContact CB-CZ 4.12Å; A134-F176 WeakPolarHBondContact O-CE2 3.33Å; V137-F176 HydrophobicContact CB-CE2 4.17Å; V137-F176 HydrophobicContact CG1-CD2 4.37Å; V137-F176 HydrophobicContact CG1-CE2 3.95Å; R138-F176 HydrophobicContact CB-CD2 3.8Å; R138-F176 HydrophobicContact CB-CE2 3.86Å; R138-F176 HydrophobicContact CB-CG 4.4Å; R138-F176 HydrophobicContact CG-CD2 4.25Å; R138-F176 HydrophobicContact CG-CG 4.41Å; L141-F176 HydrophobicContact CD1-CD2 4.1Å; Q172-F176 WeakPolarHBondContact O-CB 3.43Å; Q172-F176 PolarHBondContact O-N 3.42Å; N173-F176 PolarHBondContact O-N 2.83Å; F176-Y179 PolarHBondContact O-N 2.89Å; F176-M180 HydrophobicContact CD1-CG 4.35Å; F176-M180 HydrophobicContact CD2-CG 4.22Å; F176-M180 HydrophobicContact CE1-CG 3.87Å; F176-M180 HydrophobicContact CE2-CG 3.73Å; F176-M180 HydrophobicContact CE2-SD 4.03Å; F176-M180 HydrophobicContact CZ-CG 3.53Å; F176-M180 HydrophobicContact CZ-SD 4.05Å; F176-M180 WeakPolarHBondContact O-CB 3.37Å; F176-M180 VanDerWaalsContact O-CG 3.31Å; F176-M180 WeakPolarHBondContact O-CG 3.27Å; F176-M180 PolarHBondContact O-N 2.73Å
177	E	89.7	Confident	85.3	Confident	135 Å²	135	82.7 Å²	82.7	63%	0.631	42%	0.417	S	S	*	.	H	α-helix	trans	-61.8	-44.9	177.5	-72.9	174.5	-175.8	0	0	111.8	N173 S174 M180 A181	N173-E177 WeakPolarHBondContact O-CG 3.46Å; N173-E177 PolarHBondContact O-N 3.36Å; S174-E177 PolarHBondContact O-N 3.45Å; E177-M180 PolarHBondContact O-N 2.88Å; E177-A181 WeakPolarHBondContact O-CB 3.11Å; E177-A181 PolarHBondContact O-N 2.91Å
178	E	89.3	Confident	83.2	Confident	136 Å²	136	86.2 Å²	86.2	64%	0.636	44%	0.439	S	S	*	.	H	α-helix	trans	-62.6	-45	176.6	-173.1	174.8	-172.5	0	0	111.8	S174 M180 A181 Q182	S174-E178 WeakPolarHBondContact O-CB 3.33Å; S174-E178 PolarHBondContact O-N 3.21Å; E178-M180 PolarHBondContact O-N 2.97Å; E178-A181 PolarHBondContact O-N 3.34Å; E178-Q182 PolarHBondContact O-N 2.8Å
179	Y	89.8	Confident	80.2	Confident	91 Å²	91	88 Å²	88	36%	0.357	46%	0.462	S	S	.	.	H	α-helix	trans	-59.4	-47.7	175.9	178.7	-93.5	0	0	0	112	V137 L141 H175 F176 A181 Q182 V183	V137-Y179 HydrophobicContact CG1-CD1 3.84Å; V137-Y179 HydrophobicContact CG1-CE1 3.53Å; L141-Y179 HydrophobicContact CD1-CD1 3.77Å; L141-Y179 HydrophobicContact CD1-CD2 4.37Å; L141-Y179 HydrophobicContact CD1-CE1 4.33Å; L141-Y179 HydrophobicContact CD1-CG 3.79Å; L141-Y179 HydrophobicContact CD2-CD2 4.25Å; L141-Y179 HydrophobicContact CD2-CE2 4.4Å; L141-Y179 HydrophobicContact CD2-CG 4.48Å; H175-Y179 VanDerWaalsContact O-CB 3.31Å; H175-Y179 WeakPolarHBondContact O-CB 3.44Å; H175-Y179 PolarHBondContact O-N 3.31Å; F176-Y179 PolarHBondContact O-N 2.89Å; Y179-A181 VanDerWaalsContact C-N 3.32Å; Y179-A181 PolarHBondContact O-N 2.98Å; Y179-Q182 PolarHBondContact O-N 3.07Å; Y179-V183 HydrophobicContact CD1-CG2 4.03Å; Y179-V183 HydrophobicContact CE1-CG2 3.58Å; Y179-V183 HydrophobicContact CE2-CG2 4.22Å; Y179-V183 WeakPolarHBondContact O-CG2 3.45Å; Y179-V183 PolarHBondContact O-N 3.34Å
180	M	82.1	Confident	76.9	Confident	75 Å²	75	85.6 Å²	85.6	37%	0.369	47%	0.469	S	S	.	.	H	α-helix	trans	-64.6	-36.5	179.8	-71.5	-59.6	-63.2	0	0	112.2	V137 F176 E177 E178 F184	V137-M180 HydrophobicContact CG1-SD 4.37Å; F176-M180 HydrophobicContact CD1-CG 4.35Å; F176-M180 HydrophobicContact CD2-CG 4.22Å; F176-M180 HydrophobicContact CE1-CG 3.87Å; F176-M180 HydrophobicContact CE2-CG 3.73Å; F176-M180 HydrophobicContact CE2-SD 4.03Å; F176-M180 HydrophobicContact CZ-CG 3.53Å; F176-M180 HydrophobicContact CZ-SD 4.05Å; F176-M180 WeakPolarHBondContact O-CB 3.37Å; F176-M180 VanDerWaalsContact O-CG 3.31Å; F176-M180 WeakPolarHBondContact O-CG 3.27Å; F176-M180 PolarHBondContact O-N 2.73Å; E177-M180 PolarHBondContact O-N 2.88Å; E178-M180 PolarHBondContact O-N 2.97Å; M180-F184 WeakPolarHBondContact O-CB 3.43Å; M180-F184 PolarHBondContact O-N 2.87Å
181	A	82.8	Confident	73.9	Confident	53 Å²	53	85.2 Å²	85.2	44%	0.438	48%	0.478	S	S	.	.	H	α-helix	trans	-64.5	-42.1	173.2	0	0	0	0	0	111.9	E177 E178 Y179 F184 N185	E177-A181 WeakPolarHBondContact O-CB 3.11Å; E177-A181 PolarHBondContact O-N 2.91Å; E178-A181 PolarHBondContact O-N 3.34Å; Y179-A181 VanDerWaalsContact C-N 3.32Å; Y179-A181 PolarHBondContact O-N 2.98Å; A181-F184 PolarHBondContact O-N 3.3Å; A181-N185 PolarHBondContact O-N 3.4Å
182	Q	83.2	Confident	70.7	Confident	139 Å²	139	91 Å²	91	65%	0.65	51%	0.508	S	S	*	.	H	α-helix	trans	-65.1	-44.1	176.9	-169.9	179.8	17.2	0	0	112.2	E178 Y179 F184 N185 G186	E178-Q182 PolarHBondContact O-N 2.8Å; Y179-Q182 PolarHBondContact O-N 3.07Å; Q182-F184 VanDerWaalsContact C-N 3.33Å; Q182-F184 PolarHBondContact O-N 2.79Å; Q182-N185 PolarHBondContact O-N 3.18Å; Q182-G186 PolarHBondContact O-N 3.44Å
183	V	77.7	Confident	67.5	Low	43 Å²	43	97.5 Å²	97.5	26%	0.261	54%	0.544	S	S	.	.	H	α-helix	trans	-61.4	-42.3	176.2	171.6	0	0	0	0	111	Y179 G186 R187	Y179-V183 HydrophobicContact CD1-CG2 4.03Å; Y179-V183 HydrophobicContact CE1-CG2 3.58Å; Y179-V183 HydrophobicContact CE2-CG2 4.22Å; Y179-V183 WeakPolarHBondContact O-CG2 3.45Å; Y179-V183 PolarHBondContact O-N 3.34Å; V183-G186 PolarHBondContact O-N 3.08Å; V183-R187 WeakPolarHBondContact O-CG 3.16Å; V183-R187 PolarHBondContact O-N 3.11Å; V183-R187 VanDerWaalsContact O-N 3.16Å
184	F	69.8	Low	64.5	Low	138 Å²	138	98.8 Å²	98.8	61%	0.605	56%	0.559	S	S	*	*	H	α-helix	trans	-63.4	-46.6	177.6	-174.2	-96.6	0	0	0	111.9	M180 A181 Q182 G186 R187 T188	M180-F184 WeakPolarHBondContact O-CB 3.43Å; M180-F184 PolarHBondContact O-N 2.87Å; A181-F184 PolarHBondContact O-N 3.3Å; Q182-F184 VanDerWaalsContact C-N 3.33Å; Q182-F184 PolarHBondContact O-N 2.79Å; F184-G186 VanDerWaalsContact C-N 3.33Å; F184-G186 PolarHBondContact O-N 2.86Å; F184-R187 PolarHBondContact O-N 3.5Å; F184-T188 PolarHBondContact O-N 3Å
185	N	69.7	Low	61.2	Low	109 Å²	109	99 Å²	99	58%	0.583	57%	0.571	S	S	*	*	H	α-helix	trans	-63	-37.9	177.5	-72.9	-15.6	0	0	0	112.5	A181 Q182 R187 T188	A181-N185 PolarHBondContact O-N 3.4Å; Q182-N185 PolarHBondContact O-N 3.18Å; N185-R187 VanDerWaalsContact C-N 3.31Å; N185-R187 PolarHBondContact O-N 3.27Å; N185-T188 PolarHBondContact O-N 3.48Å; N185-T188 PolarHBondContact O-OG1 3.36Å
186	G	57.9	Low	58.1	Low	60 Å²	60	105 Å²	105	62%	0.619	60%	0.6	S	S	*	*	H	α-helix	trans	-65.7	-29.8	175.9	0	0	0	0	0	113.7	Q182 V183 F184	Q182-G186 PolarHBondContact O-N 3.44Å; V183-G186 PolarHBondContact O-N 3.08Å; F184-G186 VanDerWaalsContact C-N 3.33Å; F184-G186 PolarHBondContact O-N 2.86Å
187	R	57.3	Low	55	Low	161 Å²	161	112 Å²	112	61%	0.608	63%	0.633	S	S	*	*	H	α-helix	trans	-73.6	-30.2	178.2	-73.6	171.8	179	-150.3	-3.7	113	E131 V183 F184 N185 G189	E131-R187 IonicContact OE1-NH2 2.68Å; E131-R187 IonicContact OE2-CZ 2.66Å; E131-R187 IonicContact OE2-NH1 2.8Å; E131-R187 PolarHBondContact OE2-NH1 2.87Å; E131-R187 VanDerWaalsContact OE2-NH1 3.13Å; E131-R187 IonicContact OE2-NH2 3.15Å; E131-R187 PolarHBondContact OE2-NH2 3.29Å; V183-R187 WeakPolarHBondContact O-CG 3.16Å; V183-R187 PolarHBondContact O-N 3.11Å; V183-R187 VanDerWaalsContact O-N 3.16Å; F184-R187 PolarHBondContact O-N 3.5Å; N185-R187 VanDerWaalsContact C-N 3.31Å; N185-R187 PolarHBondContact O-N 3.27Å; R187-G189 VanDerWaalsContact C-N 3.3Å
188	T	50.3	Low	51.9	Low	98 Å²	98	113.7 Å²	113.7	60%	0.601	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	-5.9	177.7	45.1	0	0	0	0	114.1	F184 N185 G190	F184-T188 PolarHBondContact O-N 3Å; N185-T188 PolarHBondContact O-N 3.48Å; N185-T188 PolarHBondContact O-OG1 3.36Å; T188-G190 VanDerWaalsContact C-N 3.31Å; T188-G190 PolarHBondContact O-N 3.37Å
189	G	32.8	Very low	49	Very low	56 Å²	56	111.6 Å²	111.6	58%	0.577	65%	0.65	S	S	*	*			trans	-82.4	23.7	-171.5	0	0	0	0	0	117.1	R187 P191	R187-G189 VanDerWaalsContact C-N 3.3Å; G189-P191 WeakPolarHBondContact O-CD 3.46Å
190	G	26.7	Very low	45.9	Very low	59 Å²	59	113.6 Å²	113.6	61%	0.608	67%	0.667	S	S	*	*			trans	-79	114.1	169.5	0	0	0	0	0	109.9	T188 L192	T188-G190 VanDerWaalsContact C-N 3.31Å; T188-G190 PolarHBondContact O-N 3.37Å; G190-L192 PolarHBondContact O-N 2.83Å
191	P	31.3	Very low	43.5	Very low	125 Å²	125	115.3 Å²	115.3	81%	0.812	69%	0.687	S	S	*	*			trans	-63.1	108.5	179	-15.8	29.6	0	0	0	109.1	G189 N193	G189-P191 WeakPolarHBondContact O-CD 3.46Å; P191-N193 PolarHBondContact O-N 3.01Å; P191-N193 VanDerWaalsContact O-N 3.13Å
192	L	28	Very low	40.8	Very low	168 Å²	168	121.6 Å²	121.6	88%	0.88	71%	0.707	S	S	*	*			trans	-60.5	112.8	163.3	-97.4	151.1	0	0	0	107.2	G190 S194	G190-L192 PolarHBondContact O-N 2.83Å; L192-S194 PolarHBondContact O-N 3.45Å
193	N	27.7	Very low	38.2	Very low	159 Å²	159	118.7 Å²	118.7	85%	0.85	71%	0.714	S	S	*	*			trans	-33.5	98.5	167.9	-71.9	-43	0	0	0	111.7	P191 G195	P191-N193 PolarHBondContact O-N 3.01Å; P191-N193 VanDerWaalsContact O-N 3.13Å; N193-G195 PolarHBondContact O-N 3.26Å
194	S	29	Very low	35.7	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	74%	0.742	S	S	*	*			trans	-72.5	100.9	152.9	50.3	0	0	0	0	105.9	L192 E196	L192-S194 PolarHBondContact O-N 3.45Å; S194-E196 PolarHBondContact O-N 3.37Å
195	G	24.2	Very low	33.7	Very low	72 Å²	72	130 Å²	130	74%	0.742	76%	0.756	S	S	*	*			trans	-60.3	114.7	172.2	0	0	0	0	0	109.8	N193	N193-G195 PolarHBondContact O-N 3.26Å
196	E	29	Very low	31.5	Very low	184 Å²	184	129.7 Å²	129.7	86%	0.86	76%	0.758	S	S	*	*			trans	-107.1	94.9	161	-79.2	-179.2	138.3	0	0	107.6	S194	S194-E196 PolarHBondContact O-N 3.37Å
197	E	26.1	Very low	30	Very low	186 Å²	186	132.8 Å²	132.8	87%	0.869	77%	0.765	S	S	*	*			trans	27	109.1	140.3	-62.6	-175.3	149.9	0	0	118.1	A199	E197-A199 PolarHBondContact O-N 3.45Å
198	I	25	Very low	28.4	Very low	169 Å²	169	129.8 Å²	129.8	87%	0.867	78%	0.775	S	S	*	*			trans	-64.2	108.6	161.4	-63.6	166.5	0	0	0	107.7	D200	I198-D200 PolarHBondContact O-N 2.99Å
199	A	29.1	Very low	27.2	Very low	92 Å²	92	131.1 Å²	131.1	76%	0.76	78%	0.783	S	S	*	*			trans	-80.9	105.4	164.2	0	0	0	0	0	108.9	E197	E197-A199 PolarHBondContact O-N 3.45Å
200	D	24	Very low	26.8	Very low	133 Å²	133	134.1 Å²	134.1	71%	0.711	79%	0.794	S	S	*	*			trans	-61.9	132.7	167	-164.1	1.9	0	0	0	109.7	I198	I198-D200 PolarHBondContact O-N 2.99Å
201	S	32.4	Very low	26.9	Very low	111 Å²	111	136 Å²	136	78%	0.776	80%	0.799	S	S	*	*			trans	-142.3	93.1	170.9	-79.4	0	0	0	0	108.5	G203	S201-G203 PolarHBondContact O-N 2.82Å
202	E	26.1	Very low	26.7	Very low	186 Å²	186	135.2 Å²	135.2	87%	0.869	80%	0.802	S	S	*	*			trans	-50.4	115	167.1	-63	-179.5	123.1	0	0	110.7
203	G	28.7	Very low	26.8	Very low	77 Å²	77	134.6 Å²	134.6	79%	0.794	80%	0.799	S	S	*	*			trans	-125	78.8	177	0	0	0	0	0	111.3	S201 R205	S201-G203 PolarHBondContact O-N 2.82Å; G203-R205 PolarHBondContact O-N 2.8Å
204	Q	25.6	Very low	26.6	Very low	184 Å²	184	134.5 Å²	134.5	86%	0.86	80%	0.799	S	S	*	*			trans	-49.5	122.5	172.5	-175.9	120	5.5	0	0	113.9
205	R	27.7	Very low	26.5	Very low	234 Å²	234	135.9 Å²	135.9	88%	0.883	80%	0.802	S	S	*	*			trans	-158.6	120.5	143.4	-153.4	167.5	172	179.3	-3.2	115.1	G203	G203-R205 PolarHBondContact O-N 2.8Å
206	V	22.8	Very low	26.7	Very low	104 Å²	104	137.4 Å²	137.4	63%	0.63	80%	0.802	S	S	*	*			trans	-54.9	143.8	164.4	-74.8	0	0	0	0	113.9
207	T	26.7	Very low	26.6	Very low	124 Å²	124	137 Å²	137	76%	0.761	80%	0.8	S	S	*	*				169.8	122.5	104.3	33.9	0	0	0	0	110.4
208	A	23	Very low	26.7	Very low	99 Å²	99	136 Å²	136	82%	0.818	80%	0.8	S	S	*	*			trans	-71.4	127.7	166.8	0	0	0	0	0	109.7
209	V	26	Very low	26.7	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	80%	0.796	S	S	*	*			trans	-117.3	101	166.6	-172.4	0	0	0	0	107.1	S211	V209-S211 PolarHBondContact O-N 2.91Å
210	S	24.8	Very low	26.7	Very low	118 Å²	118	136.1 Å²	136.1	83%	0.825	80%	0.798	S	S	*	*			trans	-77	104.7	167.6	-44	0	0	0	0	107.5
211	S	28.1	Very low	26.8	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	80%	0.803	S	S	*	*			trans	-107.5	97.3	164.1	71	0	0	0	0	109.3	V209 L213	V209-S211 PolarHBondContact O-N 2.91Å; S211-L213 PolarHBondContact O-N 3.39Å
212	A	27.5	Very low	26.6	Very low	107 Å²	107	137.6 Å²	137.6	88%	0.884	81%	0.806	S	S	*	*			trans	-64.1	111.6	160.9	0	0	0	0	0	107.5
213	L	29	Very low	26.8	Very low	156 Å²	156	133.2 Å²	133.2	82%	0.817	80%	0.802	S	S	*	*			trans	-93	110.2	173	-157.7	76.2	0	0	0	107.6	S211 T215	S211-L213 PolarHBondContact O-N 3.39Å; L213-T215 PolarHBondContact O-N 2.93Å
214	D	24.6	Very low	27	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	81%	0.805	S	S	*	*			trans	-54.4	119.6	171.4	-102.6	-31.1	0	0	0	109.7	S216	D214-S216 PolarHBondContact O-N 3.44Å
215	T	26.6	Very low	27.6	Very low	134 Å²	134	132.6 Å²	132.6	82%	0.822	79%	0.793	S	S	*	*			trans	-87.5	100.8	173.3	-59.3	0	0	0	0	108	L213 Q217	L213-T215 PolarHBondContact O-N 2.93Å; T215-Q217 PolarHBondContact O-N 3.26Å
216	S	27.9	Very low	28	Very low	104 Å²	104	131 Å²	131	73%	0.727	80%	0.796	S	S	*	*			trans	-60.5	117.8	176.6	-52.5	0	0	0	0	111.1	D214 L218	D214-S216 PolarHBondContact O-N 3.44Å; S216-L218 PolarHBondContact O-N 3.19Å
217	Q	27.9	Very low	29	Very low	176 Å²	176	132.6 Å²	132.6	82%	0.822	80%	0.796	S	S	*	*			trans	-64.1	113.7	174.1	-71.3	171.2	-16.6	0	0	110.7	T215	T215-Q217 PolarHBondContact O-N 3.26Å
218	L	27.1	Very low	29.9	Very low	166 Å²	166	137.6 Å²	137.6	87%	0.869	80%	0.801	S	S	*	*			trans	-88.6	99.6	162.3	-67	179.2	0	0	0	108.1	S216 V220	S216-L218 PolarHBondContact O-N 3.19Å; L218-V220 PolarHBondContact O-N 3.01Å
219	V	26.1	Very low	31.3	Very low	128 Å²	128	140 Å²	140	78%	0.776	80%	0.8	S	S	*	*			trans	-85.1	96.5	172.5	-76.6	0	0	0	0	108.9
220	V	28.4	Very low	33.4	Very low	134 Å²	134	137.3 Å²	137.3	81%	0.812	78%	0.784	S	S	*	*			trans	-97	103.2	163.2	-173.3	0	0	0	0	106.8	L218 D222	L218-V220 PolarHBondContact O-N 3.01Å; V220-D222 PolarHBondContact O-N 3.44Å
221	S	25.2	Very low	36	Very low	116 Å²	116	135.4 Å²	135.4	81%	0.811	78%	0.775	S	S	*	*			trans	-72.5	107.5	175.3	45.7	0	0	0	0	109.9
222	D	29.1	Very low	38.8	Very low	159 Å²	159	133 Å²	133	85%	0.85	75%	0.753	S	S	*	*			trans	-122.5	124.3	157.9	-152.5	-5.1	0	0	0	109.5	V220	V220-D222 PolarHBondContact O-N 3.44Å
223	A	30.4	Very low	41.8	Very low	94 Å²	94	133.3 Å²	133.3	78%	0.777	74%	0.737	S	S	*	*			trans	-104.9	80.8	-161.6	0	0	0	0	0	109.9
224	N	32.3	Very low	44.8	Very low	160 Å²	160	130.9 Å²	130.9	86%	0.856	73%	0.731	S	S	*	*			trans	-164.9	4.3	156.7	-141.5	18	0	0	0	119.3
225	S	38	Very low	48.1	Very low	88 Å²	88	124.7 Å²	124.7	62%	0.615	70%	0.701	S	S	*	*			trans	-112.9	115.3	175.8	-58.7	0	0	0	0	108.6	E227	S225-E227 PolarHBondContact O-N 3.38Å
226	Q	36	Very low	51.3	Low	202 Å²	202	121.5 Å²	121.5	94%	0.944	68%	0.684	S	S	*	*			trans	-68.4	53.6	169.3	-165.7	106.3	-36.9	0	0	109.3	R228	Q226-R228 PolarHBondContact O-N 3.49Å
227	E	44.7	Very low	54.5	Low	136 Å²	136	119.5 Å²	119.5	64%	0.636	66%	0.664	S	S	*	*			trans	-66.8	106.2	170.3	-75.4	175.1	-162.7	0	0	105.3	S225 L229	S225-E227 PolarHBondContact O-N 3.38Å; E227-L229 PolarHBondContact O-N 3Å
228	R	44.5	Very low	57.7	Low	229 Å²	229	116.1 Å²	116.1	86%	0.864	64%	0.644	S	S	*	*			trans	-65.4	82.9	171.8	-167	-172.6	-57	-136.8	2.2	105.6	Q226 V230	Q226-R228 PolarHBondContact O-N 3.49Å; R228-V230 VanDerWaalsContact C-N 3.34Å; R228-V230 PolarHBondContact O-N 2.92Å
229	L	54.1	Low	61	Low	150 Å²	150	111 Å²	111	79%	0.785	62%	0.62	S	S	*	*			trans	-55.6	101.1	179.6	-68.2	171.9	0	0	0	106.9	E227 A231	E227-L229 PolarHBondContact O-N 3Å; L229-A231 PolarHBondContact O-N 3.03Å; L229-A231 VanDerWaalsContact O-N 3.09Å
230	V	69.9	Low	64.3	Low	70 Å²	70	108.4 Å²	108.4	42%	0.424	60%	0.596	S	S	.	*			trans	-72.3	107.9	174.2	-177.9	0	0	0	0	105.4	R228 I232 W300 P370	R228-V230 VanDerWaalsContact C-N 3.34Å; R228-V230 PolarHBondContact O-N 2.92Å; V230-I232 PolarHBondContact O-N 3.36Å; V230-W300 HydrophobicContact CB-CH2 4.04Å; V230-W300 HydrophobicContact CB-CZ2 4.23Å; V230-W300 HydrophobicContact CG1-CH2 3.72Å; V230-W300 HydrophobicContact CG1-CZ2 4.21Å; V230-W300 HydrophobicContact CG2-CH2 4.19Å; V230-P370 HydrophobicContact CG1-CB 4.36Å
231	A	79.6	Confident	67.5	Low	78 Å²	78	112 Å²	112	65%	0.645	60%	0.595	S	S	*	*			trans	-70.2	96.6	178.3	0	0	0	0	0	109.5	L229 Q233	L229-A231 PolarHBondContact O-N 3.03Å; L229-A231 VanDerWaalsContact O-N 3.09Å; A231-Q233 PolarHBondContact O-N 2.88Å
232	I	86.9	Confident	70.9	Confident	48 Å²	48	109.1 Å²	109.1	25%	0.246	57%	0.57	C	S	.	*	P	Polyproline II helix	trans	-68.4	122.2	174.7	-63.4	172.8	0	0	0	108.4	V230 W300 D348 I350 P370	V230-I232 PolarHBondContact O-N 3.36Å; I232-W300 HydrophobicContact CD1-CZ2 4.29Å; I232-W300 HydrophobicContact CG1-CZ2 4.45Å; I232-D348 HydrophobicContact CD1-CB 3.35Å; I232-D348 WeakPolarHBondContact CD1-OD2 3.33Å; I232-I350 HydrophobicContact CG2-CG1 3.99Å; I232-P370 HydrophobicContact CG1-CB 4.01Å
233	Q	89.4	Confident	74.2	Confident	114 Å²	114	102.5 Å²	102.5	53%	0.533	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-71.7	151.4	177.8	-67.2	-62.8	-52.9	0	0	110.5	A231 H367	A231-Q233 PolarHBondContact O-N 2.88Å; Q233-H367 PolarHBondContact O-CD2 3.21Å; Q233-H367 PolarHBondContact O-NE2 3.43Å
234	P	91.9	Very high	77.4	Confident	106 Å²	106	106.3 Å²	106.3	69%	0.688	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-65.3	144	172.7	27.3	-33.8	0	0	0	111
235	A	94.4	Very high	80.5	Confident	26 Å²	26	104 Å²	104	22%	0.215	51%	0.513	C	S	.	.	P	Polyproline II helix	trans	-72.7	149.4	170.8	0	0	0	0	0	111.6	W283 I350 I351 H367	A235-W283 HydrophobicContact CB-CH2 4Å; A235-I350 HydrophobicContact CB-CG2 3.77Å; A235-I351 HydrophobicContact CB-CD1 3.62Å; A235-I351 HydrophobicContact CB-CG1 3.72Å; A235-H367 HydrophobicContact CB-CB 4.2Å
236	S	93.2	Very high	83.3	Confident	68 Å²	68	100.2 Å²	100.2	48%	0.476	49%	0.486	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	139.9	169.4	-64.2	0	0	0	0	110.1	G365 S366	S236-G365 CarbonylContact O-C 3.51Å; S236-G365 WeakPolarHBondContact O-CA 3.48Å; S236-S366 PolarHBondContact N-O 2.95Å; S236-S366 PolarHBondContact O-N 3.47Å
237	M	94.3	Very high	86.2	Confident	61 Å²	61	91.9 Å²	91.9	30%	0.3	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	144.3	176.6	-76.5	-171.7	56.8	0	0	111	W283 I351 F363 A364	M237-W283 HydrophobicContact CG-CZ2 4.25Å; M237-I351 HydrophobicContact CG-CD1 4.22Å; M237-I351 HydrophobicContact SD-CD1 3.86Å; M237-I351 HydrophobicContact SD-CG2 4.33Å; M237-F363 HydrophobicContact CE-CD1 3.75Å; M237-F363 HydrophobicContact CE-CE1 4.34Å; M237-A364 WeakPolarHBondContact CA-O 3.28Å
238	W	95.4	Very high	88.7	Confident	105 Å²	105	90.6 Å²	90.6	40%	0.398	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	171.3	175.6	61.7	94.3	0	0	0	110.6	F282 A364	W238-F282 HydrophobicContact CH2-CD1 4.49Å; W238-A364 HydrophobicContact CD2-CB 4.22Å; W238-A364 HydrophobicContact CG-CB 4.41Å; W238-A364 HydrophobicContact CZ2-CB 3.93Å; W238-A364 PolarHBondContact N-O 3.42Å; W238-A364 PolarHBondContact O-N 2.92Å; W238-A364 VanDerWaalsContact O-O 3.05Å
239	T	96.4	Very high	91.2	Very high	59 Å²	59	81.8 Å²	81.8	36%	0.362	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	157.6	176.6	63.8	0	0	0	0	112.2	E361 V362 F363	T239-E361 WeakPolarHBondContact CB-OE2 3.5Å; T239-E361 PolarHBondContact OG1-OE2 3.13Å; T239-V362 CarbonylContact C-O 3.55Å; T239-V362 WeakPolarHBondContact CA-O 3.32Å; T239-F363 HydrophobicContact CG2-CD1 3.95Å; T239-F363 HydrophobicContact CG2-CD2 4.05Å; T239-F363 HydrophobicContact CG2-CE1 3.73Å; T239-F363 HydrophobicContact CG2-CE2 3.85Å; T239-F363 HydrophobicContact CG2-CG 4.12Å; T239-F363 HydrophobicContact CG2-CZ 3.69Å
240	R	96.4	Very high	93.2	Very high	74 Å²	74	74.7 Å²	74.7	28%	0.279	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.8	173.5	-59.4	160.6	51.6	-179.7	0.5	110.4	D242 E284 E361 V362	R240-D242 WeakPolarHBondContact CB-OD1 3.46Å; R240-D242 IonicContact CZ-OD1 3.53Å; R240-D242 IonicContact CZ-OD2 2.72Å; R240-D242 IonicContact NE-OD1 3.54Å; R240-D242 PolarHBondContact NE-OD1 2.92Å; R240-D242 IonicContact NE-OD2 3.52Å; R240-D242 IonicContact NH2-OD1 3.63Å; R240-D242 PolarHBondContact NH2-OD1 3.34Å; R240-D242 IonicContact NH2-OD2 3.42Å; R240-D242 PolarHBondContact NH2-OD2 3.17Å; R240-E284 VanDerWaalsContact NH1-CD 3.31Å; R240-E284 IonicContact NH1-OE1 3.51Å; R240-E284 PolarHBondContact NH1-OE1 2.78Å; R240-E284 IonicContact NH1-OE2 2.77Å; R240-E284 PolarHBondContact NH1-OE2 2.9Å; R240-E361 CarbonylContact O-C 3.58Å; R240-E361 WeakPolarHBondContact O-CA 3.46Å; R240-E361 WeakPolarHBondContact O-CB 3.45Å; R240-V362 HydrophobicContact CB-CB 4.29Å; R240-V362 PolarHBondContact N-O 3.41Å; R240-V362 PolarHBondContact O-N 3.39Å
241	R	96.1	Very high	94.3	Very high	210 Å²	210	77.3 Å²	77.3	79%	0.792	39%	0.385	S	S	*	.	S	Bend	trans	-96.2	-7.3	-174	-65.6	-175.6	176.6	-176.6	2.8	114.8	I243 E361	R241-I243 PolarHBondContact O-N 2.89Å; R241-E361 HydrophobicContact CG-CG 4.48Å; R241-E361 WeakPolarHBondContact CG-OE1 3.44Å; R241-E361 IonicContact NE-OE1 3.76Å; R241-E361 PolarHBondContact NE-OE1 2.98Å
242	D	96.7	Very high	95	Very high	54 Å²	54	81.8 Å²	81.8	29%	0.289	39%	0.392	S	S	.	.			trans	-83.9	48.2	-178	62.2	-39.9	0	0	0	112.4	R240 R244 E245 F246	R240-D242 WeakPolarHBondContact CB-OD1 3.46Å; R240-D242 IonicContact CZ-OD1 3.53Å; R240-D242 IonicContact CZ-OD2 2.72Å; R240-D242 IonicContact NE-OD1 3.54Å; R240-D242 PolarHBondContact NE-OD1 2.92Å; R240-D242 IonicContact NE-OD2 3.52Å; R240-D242 IonicContact NH2-OD1 3.63Å; R240-D242 PolarHBondContact NH2-OD1 3.34Å; R240-D242 IonicContact NH2-OD2 3.42Å; R240-D242 PolarHBondContact NH2-OD2 3.17Å; D242-R244 VanDerWaalsContact C-N 3.3Å; D242-R244 PolarHBondContact O-N 3.14Å; D242-E245 WeakPolarHBondContact CA-OE2 3.44Å; D242-E245 HydrophobicContact CB-CB 4.49Å; D242-F246 VanDerWaalsContact O-CB 3.3Å; D242-F246 WeakPolarHBondContact O-CB 3.48Å; D242-F246 PolarHBondContact O-N 3.18Å
243	I	97.2	Very high	95.1	Very high	21 Å²	21	83.6 Å²	83.6	11%	0.108	40%	0.4	C	S	.	.	H	α-helix	trans	-65.9	-31.3	-174.5	-170.2	171.6	0	0	0	113	R241 K247 A286 Y359 V362	R241-I243 PolarHBondContact O-N 2.89Å; I243-K247 HydrophobicContact CG1-CD 4.16Å; I243-K247 HydrophobicContact CG1-CG 4.49Å; I243-K247 WeakPolarHBondContact O-CB 3.48Å; I243-K247 VanDerWaalsContact O-CG 3.25Å; I243-K247 WeakPolarHBondContact O-CG 3.37Å; I243-K247 PolarHBondContact O-N 3.17Å; I243-A286 HydrophobicContact CD1-CB 4.12Å; I243-A286 HydrophobicContact CG1-CB 4Å; I243-Y359 VanDerWaalsContact CD1-C 3.47Å; I243-Y359 WeakPolarHBondContact CD1-O 3.36Å; I243-V362 HydrophobicContact CB-CG2 3.98Å; I243-V362 HydrophobicContact CG1-CG2 4.16Å
244	R	97	Very high	94.8	Very high	174 Å²	174	86.6 Å²	86.6	66%	0.657	41%	0.414	S	S	*	.	H	α-helix	trans	-70.2	-51.5	180	-71.1	-179.1	57.7	-162.3	-8.1	110.5	D242 F246 K247 E248	D242-R244 VanDerWaalsContact C-N 3.3Å; D242-R244 PolarHBondContact O-N 3.14Å; R244-F246 VanDerWaalsContact C-N 3.31Å; R244-F246 PolarHBondContact O-N 3.46Å; R244-K247 PolarHBondContact O-N 3.32Å; R244-E248 WeakPolarHBondContact O-CG 3.39Å; R244-E248 PolarHBondContact O-N 3.38Å
245	E	97.4	Very high	94.3	Very high	112 Å²	112	87.2 Å²	87.2	52%	0.523	41%	0.411	S	S	.	.	H	α-helix	trans	-60.3	-43	178.4	-63.2	76	-170.2	0	0	110.5	D242 E248 A249	D242-E245 WeakPolarHBondContact CA-OE2 3.44Å; D242-E245 HydrophobicContact CB-CB 4.49Å; E245-E248 PolarHBondContact O-N 3.3Å; E245-A249 WeakPolarHBondContact O-CB 3.41Å; E245-A249 PolarHBondContact O-N 3.43Å
246	F	97.8	Very high	94	Very high	8 Å²	8	86.1 Å²	86.1	4%	0.035	40%	0.403	C	S	.	.	H	α-helix	trans	-58.2	-52.3	174.3	175.6	-102.6	0	0	0	112.2	D242 R244 E248 A249 I250 E284 A286 V362 R394	D242-F246 VanDerWaalsContact O-CB 3.3Å; D242-F246 WeakPolarHBondContact O-CB 3.48Å; D242-F246 PolarHBondContact O-N 3.18Å; R244-F246 VanDerWaalsContact C-N 3.31Å; R244-F246 PolarHBondContact O-N 3.46Å; F246-E248 VanDerWaalsContact C-N 3.3Å; F246-E248 PolarHBondContact O-N 3.32Å; F246-A249 PolarHBondContact O-N 3.24Å; F246-I250 HydrophobicContact CD1-CG1 4.33Å; F246-I250 HydrophobicContact CD2-CG1 4.1Å; F246-I250 HydrophobicContact CE1-CG1 3.95Å; F246-I250 HydrophobicContact CE2-CD1 3.85Å; F246-I250 HydrophobicContact CE2-CG1 3.7Å; F246-I250 HydrophobicContact CG-CG1 4.4Å; F246-I250 HydrophobicContact CZ-CD1 3.98Å; F246-I250 HydrophobicContact CZ-CG1 3.62Å; F246-I250 VanDerWaalsContact O-CG1 3.31Å; F246-I250 WeakPolarHBondContact O-CG1 3.4Å; F246-I250 PolarHBondContact O-N 3.07Å; F246-E284 HydrophobicContact CE2-CB 3.76Å; F246-E284 WeakPolarHBondContact CE2-OE2 3.38Å; F246-E284 HydrophobicContact CZ-CB 3.99Å; F246-A286 HydrophobicContact CD1-CB 3.79Å; F246-A286 HydrophobicContact CE1-CB 3.74Å; F246-V362 HydrophobicContact CB-CG2 3.67Å; F246-V362 HydrophobicContact CD1-CG1 4.02Å; F246-V362 HydrophobicContact CD1-CG2 3.81Å; F246-V362 HydrophobicContact CD2-CG1 4.09Å; F246-V362 HydrophobicContact CE1-CG1 4.11Å; F246-V362 HydrophobicContact CE2-CG1 4.17Å; F246-V362 HydrophobicContact CG-CG1 4.01Å; F246-V362 HydrophobicContact CG-CG2 3.74Å; F246-V362 HydrophobicContact CZ-CG1 4.18Å; F246-R394 HydrophobicContact CE2-CG 4.17Å
247	K	97.1	Very high	93.9	Very high	26 Å²	26	85.9 Å²	85.9	11%	0.113	40%	0.398	C	S	.	.	H	α-helix	trans	-61.8	-37.9	-180	-73.7	171.6	178.6	169.2	0	112.3	I243 R244 K251 T287 Y392	I243-K247 HydrophobicContact CG1-CD 4.16Å; I243-K247 HydrophobicContact CG1-CG 4.49Å; I243-K247 WeakPolarHBondContact O-CB 3.48Å; I243-K247 VanDerWaalsContact O-CG 3.25Å; I243-K247 WeakPolarHBondContact O-CG 3.37Å; I243-K247 PolarHBondContact O-N 3.17Å; R244-K247 PolarHBondContact O-N 3.32Å; K247-K251 WeakPolarHBondContact O-CD 3.44Å; K247-K251 VanDerWaalsContact O-CG 3.22Å; K247-K251 WeakPolarHBondContact O-CG 3.48Å; K247-K251 PolarHBondContact O-N 3.1Å; K247-T287 WeakPolarHBondContact CE-O 3.41Å; K247-T287 PolarHBondContact NZ-O 3.49Å; K247-Y392 HydrophobicContact CB-CD1 4.28Å; K247-Y392 HydrophobicContact CB-CE1 4.37Å; K247-Y392 HydrophobicContact CB-CG 4.44Å; K247-Y392 HydrophobicContact CD-CD2 4.27Å; K247-Y392 HydrophobicContact CD-CE2 4.13Å; K247-Y392 HydrophobicContact CG-CD1 4.24Å; K247-Y392 HydrophobicContact CG-CD2 3.82Å; K247-Y392 HydrophobicContact CG-CE1 4.47Å; K247-Y392 HydrophobicContact CG-CE2 4.06Å; K247-Y392 HydrophobicContact CG-CG 3.91Å
248	E	96.9	Very high	93.6	Very high	110 Å²	110	84.1 Å²	84.1	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-67	-40.6	176.8	-74.7	177.3	-170.7	0	0	112.1	R244 E245 F246	R244-E248 WeakPolarHBondContact O-CG 3.39Å; R244-E248 PolarHBondContact O-N 3.38Å; E245-E248 PolarHBondContact O-N 3.3Å; F246-E248 VanDerWaalsContact C-N 3.3Å; F246-E248 PolarHBondContact O-N 3.32Å
249	A	96.7	Very high	93.1	Very high	43 Å²	43	86.1 Å²	86.1	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-64.7	-49	175.4	0	0	0	0	0	111.8	E245 F246 K251 Q252	E245-A249 WeakPolarHBondContact O-CB 3.41Å; E245-A249 PolarHBondContact O-N 3.43Å; F246-A249 PolarHBondContact O-N 3.24Å; A249-K251 VanDerWaalsContact C-N 3.25Å; A249-K251 PolarHBondContact O-N 3.31Å; A249-Q252 WeakPolarHBondContact O-CB 3.42Å; A249-Q252 PolarHBondContact O-N 2.85Å
250	I	95.8	Very high	92.3	Very high	1 Å²	1	83.3 Å²	83.3	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-61.5	-32.5	-179.4	-66.1	-61.2	0	0	0	112.3	F246 Q252 E253 G256 V257 Y392 R394	F246-I250 HydrophobicContact CD1-CG1 4.33Å; F246-I250 HydrophobicContact CD2-CG1 4.1Å; F246-I250 HydrophobicContact CE1-CG1 3.95Å; F246-I250 HydrophobicContact CE2-CD1 3.85Å; F246-I250 HydrophobicContact CE2-CG1 3.7Å; F246-I250 HydrophobicContact CG-CG1 4.4Å; F246-I250 HydrophobicContact CZ-CD1 3.98Å; F246-I250 HydrophobicContact CZ-CG1 3.62Å; F246-I250 VanDerWaalsContact O-CG1 3.31Å; F246-I250 WeakPolarHBondContact O-CG1 3.4Å; F246-I250 PolarHBondContact O-N 3.07Å; I250-Q252 PolarHBondContact O-N 3.24Å; I250-E253 PolarHBondContact O-N 3.01Å; I250-E253 VanDerWaalsContact O-N 3.07Å; I250-G256 VanDerWaalsContact CG2-C 3.47Å; I250-G256 WeakPolarHBondContact CG2-O 3.49Å; I250-V257 HydrophobicContact CG2-CG2 4Å; I250-Y392 HydrophobicContact CB-CD1 4.37Å; I250-Y392 HydrophobicContact CG2-CD1 4.1Å; I250-R394 HydrophobicContact CD1-CB 3.73Å; I250-R394 HydrophobicContact CD1-CG 3.88Å
251	K	94.2	Very high	91.1	Very high	125 Å²	125	80.7 Å²	80.7	54%	0.543	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-20.4	175.1	-77	170.4	-174.7	178.2	0	113.7	K247 A249 V257 Y392	K247-K251 WeakPolarHBondContact O-CD 3.44Å; K247-K251 VanDerWaalsContact O-CG 3.22Å; K247-K251 WeakPolarHBondContact O-CG 3.48Å; K247-K251 PolarHBondContact O-N 3.1Å; A249-K251 VanDerWaalsContact C-N 3.25Å; A249-K251 PolarHBondContact O-N 3.31Å; K251-V257 HydrophobicContact CG-CG2 4.33Å; K251-Y392 HydrophobicContact CD-CE1 4.26Å; K251-Y392 VanDerWaalsContact CE-CE1 3.42Å; K251-Y392 WeakPolarHBondContact CE-OH 3.32Å; K251-Y392 HydrophobicContact CG-CD1 4.4Å; K251-Y392 HydrophobicContact CG-CE1 3.85Å
252	Q	93.1	Very high	89.9	Confident	173 Å²	173	74.7 Å²	74.7	81%	0.808	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-13.6	176.3	-58.7	177.4	14.5	0	0	112	A249 I250	A249-Q252 WeakPolarHBondContact O-CB 3.42Å; A249-Q252 PolarHBondContact O-N 2.85Å; I250-Q252 PolarHBondContact O-N 3.24Å
253	E	89.6	Confident	88	Confident	86 Å²	86	72.5 Å²	72.5	40%	0.402	35%	0.348	S	S	.	.	S	Bend	trans	-85.3	144.4	177.4	-62.4	-178.4	-165.4	0	0	110.9	I250	I250-E253 PolarHBondContact O-N 3.01Å; I250-E253 VanDerWaalsContact O-N 3.07Å
254	E	82.4	Confident	85.8	Confident	177 Å²	177	72.9 Å²	72.9	83%	0.827	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	129.1	174.1	-164	178.4	173.5	0	0	109.7	G256	E254-G256 VanDerWaalsContact C-N 3.27Å; E254-G256 PolarHBondContact O-N 3.15Å
255	N	82.3	Confident	83.5	Confident	119 Å²	119	66.7 Å²	66.7	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	10.8	179.1	-52.5	-44.6	0	0	0	117	V257 Y393	N255-V257 VanDerWaalsContact C-N 3.28Å; N255-V257 PolarHBondContact O-N 3.18Å; N255-Y393 WeakPolarHBondContact O-CE1 3.38Å; N255-Y393 PolarHBondContact O-OH 3.01Å
256	G	88.4	Confident	81.5	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	31%	0.312	C	S	.	.			trans	-76.1	-9.1	177.8	0	0	0	0	0	115.2	I250 E254 Y392 Y393	I250-G256 VanDerWaalsContact CG2-C 3.47Å; I250-G256 WeakPolarHBondContact CG2-O 3.49Å; E254-G256 VanDerWaalsContact C-N 3.27Å; E254-G256 PolarHBondContact O-N 3.15Å; G256-Y392 WeakPolarHBondContact O-CA 3.43Å; G256-Y393 WeakPolarHBondContact CA-O 3.18Å; G256-Y393 WeakPolarHBondContact O-CD1 3.31Å; G256-Y393 PolarHBondContact O-N 2.95Å
257	V	91.6	Very high	79.9	Confident	63 Å²	63	62.3 Å²	62.3	38%	0.382	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	121.3	-177.3	-172.8	0	0	0	0	110.7	I250 K251 N255 T390 L391 Y392	I250-V257 HydrophobicContact CG2-CG2 4Å; K251-V257 HydrophobicContact CG-CG2 4.33Å; N255-V257 VanDerWaalsContact C-N 3.28Å; N255-V257 PolarHBondContact O-N 3.18Å; V257-T390 HydrophobicContact CG1-CG2 3.66Å; V257-L391 CarbonylContact C-O 3.47Å; V257-L391 WeakPolarHBondContact CA-O 3.38Å; V257-Y392 HydrophobicContact CG1-CD1 4.37Å; V257-Y392 HydrophobicContact CG1-CE1 4.17Å; V257-Y392 HydrophobicContact CG2-CD1 3.71Å; V257-Y392 HydrophobicContact CG2-CE1 3.92Å
258	I	86.6	Confident	79.1	Confident	23 Å²	23	61.1 Å²	61.1	12%	0.118	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	141.4	178	-62.2	167.2	0	0	0	109.8	V268 V270 V310 L391 Y393	I258-V268 HydrophobicContact CD1-CG1 3.98Å; I258-V268 HydrophobicContact CG2-CG1 4.18Å; I258-V268 HydrophobicContact CG2-CG2 4.03Å; I258-V270 HydrophobicContact CD1-CG2 4.48Å; I258-V310 HydrophobicContact CD1-CB 4.39Å; I258-V310 HydrophobicContact CD1-CG1 3.61Å; I258-V310 HydrophobicContact CD1-CG2 3.84Å; I258-L391 PolarHBondContact N-O 3.49Å; I258-L391 PolarHBondContact O-N 2.84Å; I258-Y393 HydrophobicContact CD1-CD1 3.97Å; I258-Y393 HydrophobicContact CD1-CE1 3.19Å; I258-Y393 HydrophobicContact CG1-CD1 4.39Å; I258-Y393 HydrophobicContact CG1-CE1 3.73Å
259	K	84.9	Confident	78.4	Confident	148 Å²	148	57.3 Å²	57.3	64%	0.643	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	108	170.7	-167.9	175.8	-175.2	178.1	0	110.1	G261 S388 K389	K259-G261 PolarHBondContact O-N 2.8Å; K259-S388 WeakPolarHBondContact CE-OG 3.25Å; K259-K389 CarbonylContact C-O 3.5Å; K259-K389 WeakPolarHBondContact CA-O 3.24Å
260	V	80.2	Confident	77.9	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	113.7	174	-166.7	0	0	0	0	108	V266 V268 I292 N381 S388 K389 L391	V260-V266 HydrophobicContact CG1-CG1 4.06Å; V260-V266 WeakPolarHBondContact CG1-O 3.33Å; V260-V268 HydrophobicContact CB-CG2 4.44Å; V260-V268 HydrophobicContact CG1-CG2 4.17Å; V260-V268 HydrophobicContact CG2-CG2 3.97Å; V260-I292 HydrophobicContact CB-CD1 4.06Å; V260-I292 HydrophobicContact CG1-CD1 4.09Å; V260-I292 HydrophobicContact CG2-CD1 3.73Å; V260-N381 HydrophobicContact CB-CB 4.42Å; V260-N381 HydrophobicContact CG1-CB 3.59Å; V260-S388 CarbonylContact O-C 3.54Å; V260-S388 WeakPolarHBondContact O-CA 3.28Å; V260-S388 VanDerWaalsContact O-CB 3.28Å; V260-S388 WeakPolarHBondContact O-CB 3.43Å; V260-K389 HydrophobicContact CB-CB 4.28Å; V260-K389 PolarHBondContact N-O 3.38Å; V260-K389 PolarHBondContact O-N 3.04Å; V260-L391 HydrophobicContact CG2-CB 4Å; V260-L391 HydrophobicContact CG2-CD2 4.31Å
261	G	71.8	Confident	77.6	Confident	19 Å²	19	57.8 Å²	57.8	20%	0.196	28%	0.283	C	S	.	.			trans	-66.1	-173	174.9	0	0	0	0	0	112.6	K259 N381	K259-G261 PolarHBondContact O-N 2.8Å; G261-N381 WeakPolarHBondContact O-CB 3.33Å; G261-N381 PolarHBondContact O-ND2 3.36Å
262	Y	70.7	Confident	77.4	Confident	83 Å²	83	52.3 Å²	52.3	33%	0.325	26%	0.26	S	S	.	.	S	Bend	trans	-129.4	162	-177.9	60.6	-95.8	0	0	0	109.4	S384 L385 W386	Y262-S384 WeakPolarHBondContact CB-O 3.39Å; Y262-L385 VanDerWaalsContact CD2-C 3.43Å; Y262-L385 WeakPolarHBondContact CD2-O 3.49Å; Y262-L385 WeakPolarHBondContact CE2-O 3.36Å; Y262-W386 VanDerWaalsContact CD1-C 3.48Å; Y262-W386 WeakPolarHBondContact CE1-O 3.35Å; Y262-W386 AromaticContact CE2-CE3 3.92Å; Y262-W386 HydrophobicContact CE2-CE3 3.92Å; Y262-W386 HydrophobicContact CE2-CZ3 4.47Å
263	G	57.1	Low	77.4	Confident	9 Å²	9	44.9 Å²	44.9	9%	0.093	23%	0.227	C	C	.	.	S	Bend	trans	78.3	152.8	-161.2	0	0	0	0	0	110.9	T265 V266 S384	G263-T265 PolarHBondContact O-N 3.45Å; G263-V266 PolarHBondContact O-N 3.34Å; G263-S384 PolarHBondContact N-O 2.82Å; G263-S384 VanDerWaalsContact N-O 3.13Å
264	E	50.5	Low	77.4	Confident	28 Å²	28	42 Å²	42	13%	0.131	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-21.6	-167.1	-85.8	-177.8	136.8	0	0	117.7	V68 R78 V266	V68-E264 WeakPolarHBondContact CA-OE1 3.36Å; V68-E264 WeakPolarHBondContact CB-OE1 3.29Å; V68-E264 WeakPolarHBondContact CG1-OE1 3.39Å; V68-E264 VanDerWaalsContact CG1-OE2 3.3Å; V68-E264 WeakPolarHBondContact CG1-OE2 3.34Å; R78-E264 IonicContact CZ-OE2 3.92Å; R78-E264 IonicContact NH2-OE2 2.76Å; R78-E264 PolarHBondContact NH2-OE2 3.18Å; E264-V266 PolarHBondContact O-N 3.39Å; E264-V266 VanDerWaalsContact O-N 3.15Å
265	T	48.4	Very low	77.7	Confident	45 Å²	45	36.5 Å²	36.5	28%	0.276	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	12.1	-171.5	53.6	0	0	0	0	113.6	G263 S313 E314	G263-T265 PolarHBondContact O-N 3.45Å; T265-S313 CarbonylContact C-O 3.48Å; T265-S313 CarbonylContact O-C 3.42Å; T265-E314 HydrophobicContact CG2-CB 4.4Å; T265-E314 WeakPolarHBondContact O-CA 3.39Å; T265-E314 PolarHBondContact O-N 3Å
266	V	55.4	Low	77.8	Confident	21 Å²	21	38 Å²	38	13%	0.127	19%	0.192	C	C	.	.			trans	-128.1	64.5	177.5	-161.1	0	0	0	0	111.3	V260 G263 E264 V268 V312	V260-V266 HydrophobicContact CG1-CG1 4.06Å; V260-V266 WeakPolarHBondContact CG1-O 3.33Å; G263-V266 PolarHBondContact O-N 3.34Å; E264-V266 PolarHBondContact O-N 3.39Å; E264-V266 VanDerWaalsContact O-N 3.15Å; V266-V268 HydrophobicContact CG1-CG2 4.27Å; V266-V312 HydrophobicContact CG1-CG1 3.94Å
267	T	65	Low	77.7	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.037	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	122.8	153.7	-62	0	0	0	0	107.8	L269 S313 K378 F379	T267-L269 HydrophobicContact CG2-CD2 4.38Å; T267-L269 HydrophobicContact CG2-CG 4.16Å; T267-S313 PolarHBondContact O-N 3.46Å; T267-K378 HydrophobicContact CG2-CD 3.92Å; T267-K378 HydrophobicContact CG2-CG 3.49Å; T267-K378 VanDerWaalsContact CG2-CG 3.49Å; T267-F379 WeakPolarHBondContact CA-O 3.4Å
268	V	79	Confident	77.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.4	171.2	175.6	0	0	0	0	108	I258 V260 V266 V270 V310 V312 F379	I258-V268 HydrophobicContact CD1-CG1 3.98Å; I258-V268 HydrophobicContact CG2-CG1 4.18Å; I258-V268 HydrophobicContact CG2-CG2 4.03Å; V260-V268 HydrophobicContact CB-CG2 4.44Å; V260-V268 HydrophobicContact CG1-CG2 4.17Å; V260-V268 HydrophobicContact CG2-CG2 3.97Å; V266-V268 HydrophobicContact CG1-CG2 4.27Å; V268-V270 HydrophobicContact CG1-CG2 4.32Å; V268-V310 HydrophobicContact CG1-CG1 3.7Å; V268-V312 HydrophobicContact CG2-CG2 4.44Å; V268-F379 HydrophobicContact CB-CB 4.32Å; V268-F379 PolarHBondContact N-O 3.45Å; V268-F379 PolarHBondContact O-N 3.41Å
269	L	83.2	Confident	77.7	Confident	31 Å²	31	42.5 Å²	42.5	16%	0.162	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	111.2	173.4	-72.3	170.3	0	0	0	109.3	T267 H311 L376 L377 K378	T267-L269 HydrophobicContact CG2-CD2 4.38Å; T267-L269 HydrophobicContact CG2-CG 4.16Å; L269-H311 HydrophobicContact CB-CB 4.4Å; L269-H311 PolarHBondContact N-O 3.01Å; L269-H311 PolarHBondContact O-N 3.37Å; L269-L376 HydrophobicContact CD2-CB 4.27Å; L269-L377 WeakPolarHBondContact CA-O 3.28Å; L269-K378 HydrophobicContact CD2-CB 3.67Å; L269-K378 HydrophobicContact CD2-CD 4.43Å; L269-K378 HydrophobicContact CD2-CG 3.96Å
270	V	85.1	Confident	78.1	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	113.1	170.2	-173.6	0	0	0	0	108	I258 V268 V272 V308 V310 L377 F379 Y393	I258-V270 HydrophobicContact CD1-CG2 4.48Å; V268-V270 HydrophobicContact CG1-CG2 4.32Å; V270-V272 HydrophobicContact CG1-CG2 3.99Å; V270-V308 HydrophobicContact CG1-CG1 3.53Å; V270-V310 HydrophobicContact CG2-CG2 4.45Å; V270-L377 HydrophobicContact CB-CB 4.15Å; V270-L377 PolarHBondContact N-O 2.98Å; V270-L377 PolarHBondContact O-N 2.96Å; V270-F379 HydrophobicContact CG2-CD2 4.32Å; V270-F379 HydrophobicContact CG2-CE2 4.13Å; V270-Y393 HydrophobicContact CB-CE2 4.37Å; V270-Y393 HydrophobicContact CG1-CE2 3.8Å; V270-Y393 HydrophobicContact CG2-CD2 4.37Å; V270-Y393 HydrophobicContact CG2-CE2 3.82Å
271	R	90.8	Very high	78.8	Confident	54 Å²	54	36.7 Å²	36.7	20%	0.204	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.6	178.2	-64.9	-176.4	63.1	87.6	-2	109.8	E299 V308 S309 H311 V374 Y375 L376	R271-E299 IonicContact CZ-OE1 3.93Å; R271-E299 IonicContact CZ-OE2 2.65Å; R271-E299 IonicContact NH1-OE1 2.68Å; R271-E299 PolarHBondContact NH1-OE1 3.21Å; R271-E299 IonicContact NH1-OE2 3.07Å; R271-E299 PolarHBondContact NH1-OE2 3.08Å; R271-E299 IonicContact NH2-OE1 2.72Å; R271-E299 PolarHBondContact NH2-OE1 2.78Å; R271-E299 IonicContact NH2-OE2 2.82Å; R271-V308 WeakPolarHBondContact O-CA 3.37Å; R271-S309 WeakPolarHBondContact CB-OG 3.31Å; R271-S309 PolarHBondContact N-O 3.42Å; R271-S309 PolarHBondContact O-N 3.41Å; R271-H311 VanDerWaalsContact CD-CE1 3.44Å; R271-H311 WeakPolarHBondContact CD-CE1 3.31Å; R271-H311 WeakPolarHBondContact CD-ND1 3.5Å; R271-V374 HydrophobicContact CB-CG1 3.93Å; R271-V374 HydrophobicContact CG-CG1 4.49Å; R271-Y375 CarbonylContact C-O 3.57Å; R271-Y375 WeakPolarHBondContact CA-O 3.38Å; R271-L376 HydrophobicContact CB-CD2 4.4Å; R271-L376 HydrophobicContact CG-CD2 3.68Å
272	V	89.8	Confident	79.9	Confident	9 Å²	9	38.1 Å²	38.1	6%	0.055	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	99	-175.8	-177.2	0	0	0	0	108.6	V270 I281 V308 Y375 L377 V395	V270-V272 HydrophobicContact CG1-CG2 3.99Å; V272-I281 HydrophobicContact CB-CD1 4.06Å; V272-I281 HydrophobicContact CG1-CD1 3.86Å; V272-I281 HydrophobicContact CG2-CD1 4.42Å; V272-V308 HydrophobicContact CG1-CG2 4.2Å; V272-V308 HydrophobicContact CG2-CG1 4.01Å; V272-V308 HydrophobicContact CG2-CG2 4.21Å; V272-Y375 PolarHBondContact N-O 3.49Å; V272-Y375 PolarHBondContact O-N 3.08Å; V272-L377 HydrophobicContact CG2-CD1 4.12Å; V272-V395 HydrophobicContact CB-CG1 4.41Å; V272-V395 HydrophobicContact CG1-CG1 3.86Å; V272-V395 HydrophobicContact CG2-CB 4.32Å; V272-V395 HydrophobicContact CG2-CG1 3.86Å; V272-V395 HydrophobicContact CG2-CG2 4.3Å
273	P	91.6	Very high	81.1	Confident	18 Å²	18	34.2 Å²	34.2	12%	0.117	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.1	141.9	174.6	-24.4	35.1	0	0	0	111.7	H275 T305 G307	P273-H275 PolarHBondContact O-N 2.89Å; P273-T305 VanDerWaalsContact CG-O 3.3Å; P273-T305 WeakPolarHBondContact CG-O 3.43Å; P273-G307 WeakPolarHBondContact CD-O 3.42Å
274	T	91.2	Very high	83	Confident	24 Å²	24	34.1 Å²	34.1	15%	0.147	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-66	131.7	172.4	53.7	0	0	0	0	110.4	F298 Y369 K372 G373 Y375	T274-F298 HydrophobicContact CG2-CE2 3.77Å; T274-F298 HydrophobicContact CG2-CZ 4.13Å; T274-Y369 HydrophobicContact CG2-CD1 4.22Å; T274-Y369 HydrophobicContact CG2-CD2 4.24Å; T274-Y369 HydrophobicContact CG2-CE1 4.36Å; T274-Y369 HydrophobicContact CG2-CE2 4.38Å; T274-Y369 HydrophobicContact CG2-CG 4.15Å; T274-K372 WeakPolarHBondContact OG1-CA 3.39Å; T274-G373 PolarHBondContact N-O 3.27Å; T274-G373 PolarHBondContact OG1-N 2.76Å; T274-G373 PolarHBondContact OG1-O 3.42Å; T274-Y375 HydrophobicContact CG2-CD2 4.25Å; T274-Y375 HydrophobicContact CG2-CE2 3.93Å
275	H	87.5	Confident	85.3	Confident	63 Å²	63	32.8 Å²	32.8	29%	0.292	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-83.7	140.1	177.7	-169.2	-88.9	0	0	0	111	P273 N277 G278 Y397	P273-H275 PolarHBondContact O-N 2.89Å; H275-N277 VanDerWaalsContact C-N 3.29Å; H275-N277 PolarHBondContact ND1-N 3.45Å; H275-N277 VanDerWaalsContact ND1-N 3.17Å; H275-N277 PolarHBondContact O-N 3.29Å; H275-G278 WeakPolarHBondContact O-CA 3.41Å; H275-G278 PolarHBondContact O-N 3.47Å; H275-Y397 HydrophobicContact CB-CD1 4.19Å; H275-Y397 HydrophobicContact CB-CD2 3.97Å; H275-Y397 HydrophobicContact CB-CE1 4.1Å; H275-Y397 HydrophobicContact CB-CE2 3.88Å; H275-Y397 HydrophobicContact CB-CG 4.14Å; H275-Y397 AromaticContact CD2-CZ 3.57Å; H275-Y397 PolarHBondContact CD2-OH 3.11Å; H275-Y397 AromaticContact CG-CE2 3.57Å; H275-Y397 AromaticContact CG-CZ 3.56Å; H275-Y397 AromaticContact ND1-CE2 3.65Å; H275-Y397 PolarHBondContact NE2-OH 3.05Å
276	E	86	Confident	87.7	Confident	149 Å²	149	30.6 Å²	30.6	70%	0.696	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-35.2	-175.3	-57.8	-156.4	122.9	0	0	113.6	G278 K372	E276-G278 VanDerWaalsContact C-N 3.29Å; E276-K372 IonicContact OE1-NZ 3.54Å; E276-K372 PolarHBondContact OE1-NZ 2.93Å
277	N	86.1	Confident	89.6	Confident	112 Å²	112	29.6 Å²	29.6	60%	0.599	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	12.6	175.7	-55.3	-11.7	0	0	0	112	H275	H275-N277 VanDerWaalsContact C-N 3.29Å; H275-N277 PolarHBondContact ND1-N 3.45Å; H275-N277 VanDerWaalsContact ND1-N 3.17Å; H275-N277 PolarHBondContact O-N 3.29Å
278	G	87.7	Confident	90.9	Very high	16 Å²	16	32.4 Å²	32.4	17%	0.165	17%	0.172	C	C	.	.			trans	-99.3	152.1	-179.6	0	0	0	0	0	111.9	H275 E276 Y369 S398	H275-G278 WeakPolarHBondContact O-CA 3.41Å; H275-G278 PolarHBondContact O-N 3.47Å; E276-G278 VanDerWaalsContact C-N 3.29Å; G278-Y369 VanDerWaalsContact O-CD2 3.25Å; G278-Y369 WeakPolarHBondContact O-CD2 3.38Å; G278-Y369 WeakPolarHBondContact O-CE2 3.44Å; G278-S398 WeakPolarHBondContact CA-O 3.3Å
279	S	89.9	Confident	91.2	Very high	57 Å²	57	39.5 Å²	39.5	40%	0.399	20%	0.203	S	C	.	.	S	Bend	trans	-119.6	-26.8	175.1	52.7	0	0	0	0	113.2	Y369 S398	S279-Y369 PolarHBondContact O-N 3.02Å; S279-S398 PolarHBondContact N-O 2.69Å; S279-S398 PolarHBondContact OG-OG 3.41Å
280	C	92.8	Very high	91.4	Very high	24 Å²	24	41.1 Å²	41.1	16%	0.162	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	150	-178.5	-53.7	0	0	0	0	110.9	F282 H367 Y397 S398	C280-F282 HydrophobicContact CB-CE2 3.78Å; C280-F282 HydrophobicContact CB-CZ 4.21Å; C280-H367 CarbonylContact C-O 3.58Å; C280-H367 VanDerWaalsContact CA-O 3.25Å; C280-H367 WeakPolarHBondContact CA-O 3.46Å; C280-Y397 WeakPolarHBondContact O-CA 3.12Å; C280-Y397 VanDerWaalsContact O-CB 3.26Å; C280-Y397 WeakPolarHBondContact O-CB 3.48Å; C280-S398 WeakPolarHBondContact CB-OG 3.45Å; C280-S398 PolarHBondContact N-OG 3.19Å; C280-S398 VanDerWaalsContact N-OG 3.12Å; C280-S398 PolarHBondContact O-N 2.85Å; C280-S398 VanDerWaalsContact O-N 3.08Å
281	I	94.7	Very high	91.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	146.3	165.1	-177.5	170.2	0	0	0	108.7	V272 W283 S366 H367 Y369 Y375 L377 V395	V272-I281 HydrophobicContact CB-CD1 4.06Å; V272-I281 HydrophobicContact CG1-CD1 3.86Å; V272-I281 HydrophobicContact CG2-CD1 4.42Å; I281-W283 HydrophobicContact CG1-CE3 4.38Å; I281-W283 HydrophobicContact CG2-CE3 4.27Å; I281-W283 HydrophobicContact CG2-CZ3 3.98Å; I281-S366 CarbonylContact O-C 3.51Å; I281-S366 WeakPolarHBondContact O-CA 3.35Å; I281-H367 HydrophobicContact CG2-CB 4.03Å; I281-H367 PolarHBondContact N-O 3Å; I281-H367 PolarHBondContact O-N 3.4Å; I281-Y369 HydrophobicContact CB-CE1 3.89Å; I281-Y369 HydrophobicContact CG2-CE1 4.35Å; I281-Y375 HydrophobicContact CB-CD2 4.25Å; I281-Y375 HydrophobicContact CB-CE2 4.15Å; I281-Y375 HydrophobicContact CD1-CD1 4.39Å; I281-Y375 HydrophobicContact CD1-CD2 3.83Å; I281-Y375 HydrophobicContact CD1-CG 3.73Å; I281-Y375 HydrophobicContact CG2-CD1 4.05Å; I281-Y375 HydrophobicContact CG2-CD2 3.97Å; I281-Y375 HydrophobicContact CG2-CE1 3.74Å; I281-Y375 HydrophobicContact CG2-CE2 3.67Å; I281-Y375 HydrophobicContact CG2-CG 4.15Å; I281-L377 HydrophobicContact CD1-CD1 4.12Å; I281-V395 HydrophobicContact CD1-CG1 3.63Å; I281-V395 HydrophobicContact CG1-CG1 3.69Å
282	F	95.4	Very high	91.8	Very high	49 Å²	49	39.4 Å²	39.4	22%	0.215	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	142.5	170.6	-63.7	-96.8	0	0	0	108.8	W238 C280 G365 S366 V395 Y396	W238-F282 HydrophobicContact CH2-CD1 4.49Å; C280-F282 HydrophobicContact CB-CE2 3.78Å; C280-F282 HydrophobicContact CB-CZ 4.21Å; F282-G365 WeakPolarHBondContact CA-O 3.27Å; F282-S366 VanDerWaalsContact CD1-CB 3.49Å; F282-S366 VanDerWaalsContact CE1-CB 3.47Å; F282-V395 WeakPolarHBondContact O-CA 3.14Å; F282-V395 WeakPolarHBondContact O-CG1 3.15Å; F282-Y396 HydrophobicContact CB-CD1 4.23Å; F282-Y396 HydrophobicContact CB-CD2 3.62Å; F282-Y396 HydrophobicContact CB-CE1 3.91Å; F282-Y396 HydrophobicContact CB-CE2 3.26Å; F282-Y396 HydrophobicContact CB-CG 4.09Å; F282-Y396 VanDerWaalsContact CB-CZ 3.41Å; F282-Y396 HydrophobicContact CD1-CE2 4.19Å; F282-Y396 HydrophobicContact CD2-CD2 4.08Å; F282-Y396 AromaticContact CD2-CE2 3.96Å; F282-Y396 HydrophobicContact CD2-CE2 3.96Å; F282-Y396 HydrophobicContact CG-CD2 4.03Å; F282-Y396 AromaticContact CG-CE2 3.55Å; F282-Y396 HydrophobicContact CG-CE2 3.55Å; F282-Y396 PolarHBondContact N-O 3.46Å; F282-Y396 PolarHBondContact O-N 3.18Å
283	W	96.4	Very high	91.8	Very high	1 Å²	1	39.2 Å²	39.2	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	150.7	175.2	61.2	86.7	0	0	0	110.2	A235 M237 I281 F285 F294 L296 I351 A364 G365 H367 L377 R394 V395	A235-W283 HydrophobicContact CB-CH2 4Å; M237-W283 HydrophobicContact CG-CZ2 4.25Å; I281-W283 HydrophobicContact CG1-CE3 4.38Å; I281-W283 HydrophobicContact CG2-CE3 4.27Å; I281-W283 HydrophobicContact CG2-CZ3 3.98Å; W283-F285 AromaticContact CD1-CD1 3.97Å; W283-F285 AromaticContact CD1-CE1 3.96Å; W283-F294 AromaticContact CD1-CZ 3.83Å; W283-F294 HydrophobicContact CD2-CZ 4.43Å; W283-F294 AromaticContact CE2-CZ 3.99Å; W283-F294 HydrophobicContact CG-CZ 4.34Å; W283-F294 HydrophobicContact CZ2-CE1 4.48Å; W283-F294 AromaticContact NE1-CE1 3.61Å; W283-F294 AromaticContact NE1-CZ 3.57Å; W283-L296 HydrophobicContact CE3-CD2 4.43Å; W283-L296 HydrophobicContact CH2-CD2 3.58Å; W283-L296 HydrophobicContact CZ2-CD2 4.28Å; W283-L296 HydrophobicContact CZ3-CD2 3.66Å; W283-I351 HydrophobicContact CH2-CD1 3.97Å; W283-I351 HydrophobicContact CZ2-CD1 3.55Å; W283-A364 CarbonylContact O-C 3.58Å; W283-A364 VanDerWaalsContact O-CA 3.27Å; W283-A364 WeakPolarHBondContact O-CA 3.37Å; W283-G365 PolarHBondContact N-O 2.97Å; W283-G365 PolarHBondContact O-N 3.06Å; W283-H367 HydrophobicContact CH2-CB 4.02Å; W283-H367 HydrophobicContact CZ3-CB 3.87Å; W283-L377 HydrophobicContact CB-CD2 3.78Å; W283-L377 HydrophobicContact CG-CD2 4.27Å; W283-R394 WeakPolarHBondContact CA-O 3.47Å; W283-V395 HydrophobicContact CB-CG2 4.3Å
284	E	97.5	Very high	92	Very high	7 Å²	7	38.3 Å²	38.3	3%	0.033	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.8	169.5	-58.8	-175.4	174.4	0	0	109.4	R240 F246 V362 F363 A364 Y393 R394 Y396	R240-E284 VanDerWaalsContact NH1-CD 3.31Å; R240-E284 IonicContact NH1-OE1 3.51Å; R240-E284 PolarHBondContact NH1-OE1 2.78Å; R240-E284 IonicContact NH1-OE2 2.77Å; R240-E284 PolarHBondContact NH1-OE2 2.9Å; F246-E284 HydrophobicContact CE2-CB 3.76Å; F246-E284 WeakPolarHBondContact CE2-OE2 3.38Å; F246-E284 HydrophobicContact CZ-CB 3.99Å; E284-V362 HydrophobicContact CB-CG1 4.26Å; E284-F363 CarbonylContact C-O 3.5Å; E284-F363 VanDerWaalsContact CA-O 3.24Å; E284-F363 WeakPolarHBondContact CA-O 3.48Å; E284-A364 HydrophobicContact CG-CB 3.83Å; E284-Y393 CarbonylContact O-C 3.59Å; E284-Y393 WeakPolarHBondContact O-CA 3.41Å; E284-R394 HydrophobicContact CB-CG 3.98Å; E284-R394 PolarHBondContact N-O 3.47Å; E284-R394 PolarHBondContact O-N 3.37Å; E284-R394 IonicContact OE1-CZ 3.41Å; E284-R394 IonicContact OE1-NE 3.95Å; E284-R394 IonicContact OE1-NH2 2.97Å; E284-R394 PolarHBondContact OE1-NH2 3.36Å; E284-R394 VanDerWaalsContact OE1-NH2 3.07Å; E284-R394 IonicContact OE2-CZ 2.61Å; E284-R394 IonicContact OE2-NE 3.02Å; E284-R394 PolarHBondContact OE2-NE 3.41Å; E284-R394 IonicContact OE2-NH2 3.68Å; E284-R394 PolarHBondContact OE2-NH2 3.32Å; E284-Y396 HydrophobicContact CG-CE1 4.46Å; E284-Y396 PolarHBondContact OE1-OH 2.9Å
285	F	98.1	Very high	92.1	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	155.2	177	65.3	-88.2	0	0	0	113.7	W283 I292 F294 R356 C358 F363 F379 L391 Y392	W283-F285 AromaticContact CD1-CD1 3.97Å; W283-F285 AromaticContact CD1-CE1 3.96Å; F285-I292 HydrophobicContact CE2-CG2 4.49Å; F285-F294 HydrophobicContact CE1-CB 4.4Å; F285-F294 AromaticContact CE1-CD1 3.82Å; F285-F294 HydrophobicContact CE1-CD1 3.82Å; F285-F294 AromaticContact CE1-CD2 3.93Å; F285-F294 HydrophobicContact CE1-CD2 3.93Å; F285-F294 HydrophobicContact CE1-CE1 4.01Å; F285-F294 HydrophobicContact CE1-CE2 4.11Å; F285-F294 AromaticContact CE1-CG 3.76Å; F285-F294 HydrophobicContact CE1-CG 3.76Å; F285-F294 HydrophobicContact CE1-CZ 4.15Å; F285-F294 HydrophobicContact CE2-CB 4.25Å; F285-F294 HydrophobicContact CE2-CG 4.46Å; F285-F294 HydrophobicContact CZ-CB 3.74Å; F285-F294 AromaticContact CZ-CD1 3.83Å; F285-F294 HydrophobicContact CZ-CD1 3.83Å; F285-F294 HydrophobicContact CZ-CD2 4.1Å; F285-F294 HydrophobicContact CZ-CE1 4.48Å; F285-F294 AromaticContact CZ-CG 3.6Å; F285-F294 HydrophobicContact CZ-CG 3.6Å; F285-R356 HydrophobicContact CE2-CB 4.42Å; F285-R356 HydrophobicContact CZ-CG 4.35Å; F285-C358 HydrophobicContact CD2-CB 3.93Å; F285-C358 HydrophobicContact CE2-CB 3.78Å; F285-F363 HydrophobicContact CD1-CB 4.2Å; F285-F363 HydrophobicContact CD2-CB 4.24Å; F285-F363 HydrophobicContact CE1-CB 3.7Å; F285-F363 HydrophobicContact CE2-CB 3.75Å; F285-F363 HydrophobicContact CE2-CG 4.3Å; F285-F363 HydrophobicContact CG-CB 4.45Å; F285-F363 HydrophobicContact CZ-CB 3.45Å; F285-F363 VanDerWaalsContact CZ-CB 3.45Å; F285-F363 HydrophobicContact CZ-CG 4.1Å; F285-F363 PolarHBondContact N-O 3.01Å; F285-F363 PolarHBondContact O-N 3.43Å; F285-F379 HydrophobicContact CB-CE1 3.98Å; F285-F379 HydrophobicContact CB-CZ 4.14Å; F285-F379 AromaticContact CD1-CE1 3.94Å; F285-F379 HydrophobicContact CD1-CE1 3.94Å; F285-F379 HydrophobicContact CD1-CZ 4.2Å; F285-F379 AromaticContact CD2-CE1 3.84Å; F285-F379 HydrophobicContact CD2-CE1 3.84Å; F285-F379 HydrophobicContact CE1-CE1 4.37Å; F285-F379 HydrophobicContact CE2-CE1 4.28Å; F285-F379 AromaticContact CG-CE1 3.65Å; F285-F379 HydrophobicContact CG-CE1 3.65Å; F285-F379 HydrophobicContact CG-CZ 4.13Å; F285-L391 HydrophobicContact CB-CD1 4.03Å; F285-L391 HydrophobicContact CD2-CD1 4.36Å; F285-Y392 CarbonylContact C-O 3.37Å; F285-Y392 WeakPolarHBondContact CA-O 3.37Å; F285-Y392 WeakPolarHBondContact CB-O 3.42Å
286	A	98.4	Very high	92.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	163.2	173.5	0	0	0	0	0	110.6	I243 F246 C358 V362 Y392	I243-A286 HydrophobicContact CD1-CB 4.12Å; I243-A286 HydrophobicContact CG1-CB 4Å; F246-A286 HydrophobicContact CD1-CB 3.79Å; F246-A286 HydrophobicContact CE1-CB 3.74Å; A286-C358 CarbonylContact C-O 3.54Å; A286-C358 WeakPolarHBondContact CA-O 3.39Å; A286-C358 WeakPolarHBondContact CB-O 3.34Å; A286-V362 HydrophobicContact CB-CG2 4.49Å; A286-Y392 PolarHBondContact N-O 3.01Å; A286-Y392 PolarHBondContact O-N 3.41Å
287	T	96	Very high	92.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	164.3	175.6	55.3	0	0	0	0	111.6	K247 Y290 I292 C358 Y359 K389 T390 L391	K247-T287 WeakPolarHBondContact CE-O 3.41Å; K247-T287 PolarHBondContact NZ-O 3.49Å; T287-Y290 WeakPolarHBondContact CB-O 3.4Å; T287-Y290 PolarHBondContact OG1-O 3.42Å; T287-I292 HydrophobicContact CG2-CB 4.19Å; T287-I292 HydrophobicContact CG2-CG2 3.99Å; T287-C358 PolarHBondContact N-O 2.73Å; T287-C358 PolarHBondContact OG1-SG 3.11Å; T287-C358 VanDerWaalsContact OG1-SG 3.37Å; T287-Y359 WeakPolarHBondContact O-CA 3.5Å; T287-Y359 PolarHBondContact OG1-N 3.23Å; T287-K389 HydrophobicContact CG2-CB 4.5Å; T287-T390 VanDerWaalsContact CA-O 3.22Å; T287-T390 WeakPolarHBondContact CA-O 3.41Å; T287-L391 HydrophobicContact CG2-CD1 4.14Å
288	D	91.1	Very high	93.2	Very high	65 Å²	65	23.5 Å²	23.5	35%	0.348	12%	0.122	S	C	.	.	S	Bend	trans	-69	-54.2	-176.8	-81.5	-32.8	0	0	0	114.4	T390 Y392	D288-T390 PolarHBondContact N-O 2.97Å; D288-T390 VanDerWaalsContact OD2-CB 3.24Å; D288-T390 WeakPolarHBondContact OD2-CB 3.38Å; D288-T390 PolarHBondContact OD2-OG1 3.18Å; D288-Y392 WeakPolarHBondContact OD1-CE2 3.41Å; D288-Y392 PolarHBondContact OD1-OH 3.18Å; D288-Y392 PolarHBondContact OD2-OH 3.18Å
289	K	85.6	Confident	93.4	Very high	150 Å²	150	23.7 Å²	23.7	65%	0.652	12%	0.118	S	C	*	.	S	Bend	trans	-138.5	-6.6	-164.1	-63.3	-174.3	-177.3	-175.7	0	115.8
290	Y	88.6	Confident	93.5	Very high	64 Å²	64	24 Å²	24	25%	0.251	11%	0.111	S	C	.	.	S	Bend	trans	-149.6	152.2	-168.9	-54	-72.5	0	0	0	109.7	T287 R387 K389	T287-Y290 WeakPolarHBondContact CB-O 3.4Å; T287-Y290 PolarHBondContact OG1-O 3.42Å; Y290-R387 HydrophobicContact CE2-CB 4.46Å; Y290-K389 VanDerWaalsContact CB-CD 3.47Å; Y290-K389 HydrophobicContact CD2-CD 4Å; Y290-K389 HydrophobicContact CG-CD 4.15Å
291	D	91.8	Very high	93.2	Very high	18 Å²	18	25.2 Å²	25.2	10%	0.096	12%	0.118	C	C	.	.			trans	-61.9	158.8	172.8	67.9	-65.2	0	0	0	111.8	R355 R356 Y359 Y383 K389	D291-R355 IonicContact OD1-NH2 2.85Å; D291-R355 PolarHBondContact OD1-NH2 3.32Å; D291-R355 IonicContact OD2-CZ 2.82Å; D291-R355 IonicContact OD2-NE 3.2Å; D291-R355 PolarHBondContact OD2-NE 2.87Å; D291-R355 IonicContact OD2-NH2 2.8Å; D291-R355 PolarHBondContact OD2-NH2 3.44Å; D291-R356 WeakPolarHBondContact CA-O 3.31Å; D291-R356 WeakPolarHBondContact CB-O 3.38Å; D291-Y359 HydrophobicContact CB-CD1 4.34Å; D291-Y359 HydrophobicContact CB-CE1 4.13Å; D291-Y383 PolarHBondContact O-OH 3.44Å; D291-Y383 VanDerWaalsContact O-OH 3.13Å; D291-Y383 PolarHBondContact OD2-OH 3.07Å; D291-K389 WeakPolarHBondContact O-CE 3.27Å
292	I	90.9	Very high	92.5	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	149.4	168.7	-161.7	167.1	0	0	0	108.7	V260 F285 T287 R356 F379 D380 N381 Y383 K389	V260-I292 HydrophobicContact CB-CD1 4.06Å; V260-I292 HydrophobicContact CG1-CD1 4.09Å; V260-I292 HydrophobicContact CG2-CD1 3.73Å; F285-I292 HydrophobicContact CE2-CG2 4.49Å; T287-I292 HydrophobicContact CG2-CB 4.19Å; T287-I292 HydrophobicContact CG2-CG2 3.99Å; I292-R356 PolarHBondContact N-O 3.46Å; I292-R356 PolarHBondContact O-N 2.88Å; I292-F379 HydrophobicContact CD1-CB 3.92Å; I292-F379 HydrophobicContact CG2-CD1 4.28Å; I292-D380 VanDerWaalsContact CG1-O 3.27Å; I292-D380 WeakPolarHBondContact CG1-O 3.36Å; I292-N381 HydrophobicContact CG1-CB 4.48Å; I292-Y383 WeakPolarHBondContact CA-OH 3.42Å; I292-Y383 PolarHBondContact N-OH 3.18Å; I292-K389 HydrophobicContact CD1-CB 4.35Å; I292-K389 HydrophobicContact CD1-CG 4.39Å
293	A	91.4	Very high	91.6	Very high	5 Å²	5	29.7 Å²	29.7	4%	0.041	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133.6	171.6	0	0	0	0	0	110.2	V353 Y354 R355 F379 D380 Y383	A293-V353 HydrophobicContact CB-CG1 3.69Å; A293-Y354 CarbonylContact C-O 3.54Å; A293-Y354 WeakPolarHBondContact CA-O 3.32Å; A293-R355 HydrophobicContact CB-CG 4.16Å; A293-F379 WeakPolarHBondContact O-CA 3.14Å; A293-D380 HydrophobicContact CB-CB 4.08Å; A293-D380 WeakPolarHBondContact CB-O 3.37Å; A293-D380 PolarHBondContact N-O 3.16Å; A293-D380 PolarHBondContact O-N 3.04Å; A293-Y383 HydrophobicContact CB-CD1 4.46Å; A293-Y383 HydrophobicContact CB-CE1 3.74Å; A293-Y383 PolarHBondContact N-OH 3.38Å
294	F	94.8	Very high	90.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	133.7	-178.7	174.3	-105.1	0	0	0	110.4	W283 F285 I351 V353 Y354 R356 L377 K378 F379	W283-F294 AromaticContact CD1-CZ 3.83Å; W283-F294 HydrophobicContact CD2-CZ 4.43Å; W283-F294 AromaticContact CE2-CZ 3.99Å; W283-F294 HydrophobicContact CG-CZ 4.34Å; W283-F294 HydrophobicContact CZ2-CE1 4.48Å; W283-F294 AromaticContact NE1-CE1 3.61Å; W283-F294 AromaticContact NE1-CZ 3.57Å; F285-F294 HydrophobicContact CE1-CB 4.4Å; F285-F294 AromaticContact CE1-CD1 3.82Å; F285-F294 HydrophobicContact CE1-CD1 3.82Å; F285-F294 AromaticContact CE1-CD2 3.93Å; F285-F294 HydrophobicContact CE1-CD2 3.93Å; F285-F294 HydrophobicContact CE1-CE1 4.01Å; F285-F294 HydrophobicContact CE1-CE2 4.11Å; F285-F294 AromaticContact CE1-CG 3.76Å; F285-F294 HydrophobicContact CE1-CG 3.76Å; F285-F294 HydrophobicContact CE1-CZ 4.15Å; F285-F294 HydrophobicContact CE2-CB 4.25Å; F285-F294 HydrophobicContact CE2-CG 4.46Å; F285-F294 HydrophobicContact CZ-CB 3.74Å; F285-F294 AromaticContact CZ-CD1 3.83Å; F285-F294 HydrophobicContact CZ-CD1 3.83Å; F285-F294 HydrophobicContact CZ-CD2 4.1Å; F285-F294 HydrophobicContact CZ-CE1 4.48Å; F285-F294 AromaticContact CZ-CG 3.6Å; F285-F294 HydrophobicContact CZ-CG 3.6Å; F294-I351 HydrophobicContact CE1-CD1 4.12Å; F294-V353 WeakPolarHBondContact O-CA 3.24Å; F294-Y354 PolarHBondContact N-O 3.48Å; F294-Y354 PolarHBondContact O-N 2.89Å; F294-R356 HydrophobicContact CB-CG 4.22Å; F294-L377 HydrophobicContact CE2-CB 4.07Å; F294-L377 HydrophobicContact CE2-CD2 4.25Å; F294-L377 HydrophobicContact CE2-CG 4.1Å; F294-L377 HydrophobicContact CZ-CG 4.4Å; F294-K378 CarbonylContact C-O 3.51Å; F294-K378 VanDerWaalsContact CA-O 3.29Å; F294-K378 WeakPolarHBondContact CA-O 3.31Å; F294-F379 AromaticContact CD2-CD1 3.87Å; F294-F379 HydrophobicContact CD2-CD1 3.87Å; F294-F379 AromaticContact CD2-CE1 3.47Å; F294-F379 HydrophobicContact CD2-CE1 3.47Å; F294-F379 VanDerWaalsContact CD2-CE1 3.47Å; F294-F379 AromaticContact CD2-CZ 3.83Å; F294-F379 HydrophobicContact CD2-CZ 3.83Å; F294-F379 AromaticContact CE2-CE1 3.99Å; F294-F379 HydrophobicContact CE2-CE1 3.99Å; F294-F379 HydrophobicContact CE2-CE2 4.44Å; F294-F379 AromaticContact CE2-CZ 3.86Å; F294-F379 HydrophobicContact CE2-CZ 3.86Å; F294-F379 HydrophobicContact CG-CE1 4.4Å
295	G	93.6	Very high	89.2	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	166.3	168.8	0	0	0	0	0	111.5	I351 K378	G295-I351 WeakPolarHBondContact CA-O 3.41Å; G295-K378 PolarHBondContact N-O 3.42Å; G295-K378 PolarHBondContact O-N 3.31Å
296	L	95.1	Very high	87.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	123.6	179.4	-173.6	69.6	0	0	0	109.2	W283 I350 I351 H367 Y375 L377	W283-L296 HydrophobicContact CE3-CD2 4.43Å; W283-L296 HydrophobicContact CH2-CD2 3.58Å; W283-L296 HydrophobicContact CZ2-CD2 4.28Å; W283-L296 HydrophobicContact CZ3-CD2 3.66Å; L296-I350 HydrophobicContact CB-CB 4.41Å; L296-I350 HydrophobicContact CD2-CB 4.2Å; L296-I350 HydrophobicContact CD2-CD1 4.15Å; L296-I350 HydrophobicContact CD2-CG2 4.1Å; L296-I350 HydrophobicContact CG-CB 4.33Å; L296-I350 HydrophobicContact CG-CD1 4.33Å; L296-I350 PolarHBondContact O-N 3.24Å; L296-I351 HydrophobicContact CB-CB 3.83Å; L296-I351 HydrophobicContact CB-CD1 3.86Å; L296-I351 HydrophobicContact CB-CG1 3.95Å; L296-I351 HydrophobicContact CD2-CD1 4.07Å; L296-I351 HydrophobicContact CD2-CG1 4.48Å; L296-I351 PolarHBondContact N-O 3.13Å; L296-I351 PolarHBondContact O-N 2.95Å; L296-H367 HydrophobicContact CD2-CB 4.36Å; L296-Y375 HydrophobicContact CD1-CD1 3.87Å; L296-Y375 HydrophobicContact CD2-CD1 4.14Å; L296-Y375 HydrophobicContact CD2-CE1 4.25Å; L296-Y375 HydrophobicContact CG-CD1 4.1Å; L296-L377 HydrophobicContact CD1-CD1 3.67Å; L296-L377 HydrophobicContact CD1-CG 3.83Å
297	L	93.5	Very high	86.9	Confident	37 Å²	37	49.2 Å²	49.2	19%	0.194	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	159.9	173.9	-46.6	93.7	0	0	0	110.3	V347 D348 Y375 L376 K378	L297-V347 HydrophobicContact CB-CG1 3.7Å; L297-V347 HydrophobicContact CD2-CG1 3.73Å; L297-V347 HydrophobicContact CG-CG1 4.37Å; L297-D348 CarbonylContact C-O 3.5Å; L297-D348 VanDerWaalsContact CA-O 3.28Å; L297-D348 WeakPolarHBondContact CA-O 3.26Å; L297-Y375 WeakPolarHBondContact O-CA 3.49Å; L297-L376 HydrophobicContact CB-CB 4.15Å; L297-L376 HydrophobicContact CB-CD1 4.34Å; L297-L376 HydrophobicContact CD1-CB 4.27Å; L297-L376 PolarHBondContact N-O 2.89Å; L297-L376 PolarHBondContact O-N 2.68Å; L297-K378 HydrophobicContact CD1-CB 3.97Å; L297-K378 HydrophobicContact CD1-CD 4.49Å
298	F	94.3	Very high	86.3	Confident	0 Å²	0	53 Å²	53	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	118	174.9	-170.2	-97.9	0	0	0	109.9	T274 W300 V347 D348 I350 P370 G373 Y375	T274-F298 HydrophobicContact CG2-CE2 3.77Å; T274-F298 HydrophobicContact CG2-CZ 4.13Å; F298-W300 AromaticContact CD1-CD2 3.94Å; F298-W300 HydrophobicContact CD1-CD2 3.94Å; F298-W300 AromaticContact CD1-CE2 3.72Å; F298-W300 HydrophobicContact CD1-CE3 4.39Å; F298-W300 HydrophobicContact CD1-CG 4.32Å; F298-W300 HydrophobicContact CD1-CH2 4.41Å; F298-W300 AromaticContact CD1-CZ2 3.99Å; F298-W300 HydrophobicContact CD1-CZ2 3.99Å; F298-W300 AromaticContact CD1-NE1 3.98Å; F298-W300 AromaticContact CE1-CD2 3.72Å; F298-W300 HydrophobicContact CE1-CD2 3.72Å; F298-W300 AromaticContact CE1-CE2 3.86Å; F298-W300 AromaticContact CE1-CE3 3.71Å; F298-W300 HydrophobicContact CE1-CE3 3.71Å; F298-W300 HydrophobicContact CE1-CG 4.35Å; F298-W300 AromaticContact CE1-CH2 3.96Å; F298-W300 HydrophobicContact CE1-CH2 3.96Å; F298-W300 AromaticContact CE1-CZ2 4Å; F298-W300 HydrophobicContact CE1-CZ2 4Å; F298-W300 AromaticContact CE1-CZ3 3.83Å; F298-W300 HydrophobicContact CE1-CZ3 3.83Å; F298-V347 CarbonylContact O-C 3.58Å; F298-V347 WeakPolarHBondContact O-CA 3.49Å; F298-D348 PolarHBondContact N-O 3.31Å; F298-D348 PolarHBondContact O-N 3.1Å; F298-I350 HydrophobicContact CB-CD1 3.76Å; F298-I350 HydrophobicContact CB-CG1 4.36Å; F298-P370 HydrophobicContact CD1-CG 3.74Å; F298-P370 HydrophobicContact CD2-CG 4.02Å; F298-P370 HydrophobicContact CE1-CG 3.64Å; F298-P370 HydrophobicContact CE2-CG 3.92Å; F298-P370 HydrophobicContact CG-CG 3.91Å; F298-P370 HydrophobicContact CZ-CG 3.71Å; F298-G373 VanDerWaalsContact CZ-CA 3.48Å; F298-Y375 AromaticContact CD2-CD1 3.93Å; F298-Y375 HydrophobicContact CD2-CD1 3.93Å; F298-Y375 HydrophobicContact CD2-CD2 4.05Å; F298-Y375 AromaticContact CD2-CE1 3.76Å; F298-Y375 HydrophobicContact CD2-CE1 3.76Å; F298-Y375 AromaticContact CD2-CE2 3.87Å; F298-Y375 HydrophobicContact CD2-CE2 3.87Å; F298-Y375 HydrophobicContact CD2-CG 4.07Å; F298-Y375 AromaticContact CD2-CZ 3.7Å; F298-Y375 HydrophobicContact CE2-CD2 4.06Å; F298-Y375 HydrophobicContact CE2-CE1 4.41Å; F298-Y375 AromaticContact CE2-CE2 3.72Å; F298-Y375 HydrophobicContact CE2-CE2 3.72Å; F298-Y375 AromaticContact CE2-CZ 3.89Å
299	E	92.4	Very high	85.9	Confident	19 Å²	19	51.8 Å²	51.8	9%	0.089	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.4	177.1	-175.5	-173.5	102.4	0	0	109.2	R271 T301 P345 V347 G373 V374 L376	R271-E299 IonicContact CZ-OE1 3.93Å; R271-E299 IonicContact CZ-OE2 2.65Å; R271-E299 IonicContact NH1-OE1 2.68Å; R271-E299 PolarHBondContact NH1-OE1 3.21Å; R271-E299 IonicContact NH1-OE2 3.07Å; R271-E299 PolarHBondContact NH1-OE2 3.08Å; R271-E299 IonicContact NH2-OE1 2.72Å; R271-E299 PolarHBondContact NH2-OE1 2.78Å; R271-E299 IonicContact NH2-OE2 2.82Å; E299-T301 PolarHBondContact O-N 3.01Å; E299-P345 HydrophobicContact CG-CB 3.77Å; E299-P345 HydrophobicContact CG-CG 3.81Å; E299-V347 HydrophobicContact CB-CG2 4.12Å; E299-V347 HydrophobicContact CG-CG2 4.05Å; E299-G373 WeakPolarHBondContact O-CA 3.3Å; E299-V374 HydrophobicContact CB-CB 4.37Å; E299-V374 PolarHBondContact N-O 3.49Å; E299-V374 PolarHBondContact O-N 2.98Å; E299-L376 HydrophobicContact CB-CD1 4.24Å; E299-L376 HydrophobicContact CB-CG 4.41Å
300	W	90.8	Very high	85.7	Confident	64 Å²	64	47.6 Å²	47.6	24%	0.242	28%	0.283	C	S	.	.			trans	-79.2	55.9	-179.5	-67.2	96.2	0	0	0	112.1	V230 I232 F298 Q346 D348 P370	V230-W300 HydrophobicContact CB-CH2 4.04Å; V230-W300 HydrophobicContact CB-CZ2 4.23Å; V230-W300 HydrophobicContact CG1-CH2 3.72Å; V230-W300 HydrophobicContact CG1-CZ2 4.21Å; V230-W300 HydrophobicContact CG2-CH2 4.19Å; I232-W300 HydrophobicContact CD1-CZ2 4.29Å; I232-W300 HydrophobicContact CG1-CZ2 4.45Å; F298-W300 AromaticContact CD1-CD2 3.94Å; F298-W300 HydrophobicContact CD1-CD2 3.94Å; F298-W300 AromaticContact CD1-CE2 3.72Å; F298-W300 HydrophobicContact CD1-CE3 4.39Å; F298-W300 HydrophobicContact CD1-CG 4.32Å; F298-W300 HydrophobicContact CD1-CH2 4.41Å; F298-W300 AromaticContact CD1-CZ2 3.99Å; F298-W300 HydrophobicContact CD1-CZ2 3.99Å; F298-W300 AromaticContact CD1-NE1 3.98Å; F298-W300 AromaticContact CE1-CD2 3.72Å; F298-W300 HydrophobicContact CE1-CD2 3.72Å; F298-W300 AromaticContact CE1-CE2 3.86Å; F298-W300 AromaticContact CE1-CE3 3.71Å; F298-W300 HydrophobicContact CE1-CE3 3.71Å; F298-W300 HydrophobicContact CE1-CG 4.35Å; F298-W300 AromaticContact CE1-CH2 3.96Å; F298-W300 HydrophobicContact CE1-CH2 3.96Å; F298-W300 AromaticContact CE1-CZ2 4Å; F298-W300 HydrophobicContact CE1-CZ2 4Å; F298-W300 AromaticContact CE1-CZ3 3.83Å; F298-W300 HydrophobicContact CE1-CZ3 3.83Å; W300-Q346 HydrophobicContact CB-CB 4.24Å; W300-Q346 HydrophobicContact CG-CB 4.46Å; W300-Q346 PolarHBondContact N-O 2.82Å; W300-D348 PolarHBondContact NE1-OD2 2.82Å; W300-P370 HydrophobicContact CH2-CB 3.86Å; W300-P370 HydrophobicContact CH2-CG 4.09Å; W300-P370 HydrophobicContact CZ2-CB 4.18Å; W300-P370 HydrophobicContact CZ2-CG 4.28Å
301	T	87.1	Confident	85	Confident	50 Å²	50	48.9 Å²	48.9	31%	0.307	29%	0.291	S	S	.	.			trans	-124	131	177	-62.5	0	0	0	0	110.1	E299 S303 P345 G373	E299-T301 PolarHBondContact O-N 3.01Å; T301-S303 PolarHBondContact O-N 3.41Å; T301-P345 WeakPolarHBondContact OG1-CB 3.22Å; T301-G373 CarbonylContact O-C 3.45Å; T301-G373 VanDerWaalsContact O-CA 3.29Å; T301-G373 WeakPolarHBondContact O-CA 3.39Å
302	V	79.4	Confident	83.7	Confident	107 Å²	107	51.9 Å²	51.9	65%	0.648	31%	0.31	S	S	*	.			trans	-77.5	113.4	172.4	-174.2	0	0	0	0	107.5
303	S	77	Confident	82.1	Confident	36 Å²	36	53.3 Å²	53.3	25%	0.252	32%	0.32	S	S	.	.			trans	-76.6	134.7	174.6	-69.3	0	0	0	0	110.7	T301 T305 V374	T301-S303 PolarHBondContact O-N 3.41Å; S303-T305 WeakPolarHBondContact CB-O 3.37Å; S303-T305 PolarHBondContact O-N 3.47Å; S303-V374 WeakPolarHBondContact OG-CG2 3.41Å
304	D	71.4	Confident	80.2	Confident	171 Å²	171	59.6 Å²	59.6	91%	0.914	35%	0.349	S	S	*	.	S	Bend	trans	-71.2	-16.6	170.1	-63.6	-33.4	0	0	0	112.2
305	T	71.9	Confident	77.4	Confident	95 Å²	95	64.1 Å²	64.1	58%	0.583	37%	0.371	S	S	*	.			trans	-107.1	139.6	179.5	58.9	0	0	0	0	111	P273 S303 G307	P273-T305 VanDerWaalsContact CG-O 3.3Å; P273-T305 WeakPolarHBondContact CG-O 3.43Å; S303-T305 WeakPolarHBondContact CB-O 3.37Å; S303-T305 PolarHBondContact O-N 3.47Å; T305-G307 VanDerWaalsContact C-N 3.35Å
306	S	70.6	Confident	74.3	Confident	113 Å²	113	71.4 Å²	71.4	79%	0.79	41%	0.41	S	S	*	.			trans	-91	1.9	174.2	63.7	0	0	0	0	113.3
307	G	77.4	Confident	71.3	Confident	39 Å²	39	75.8 Å²	75.8	40%	0.402	43%	0.433	S	S	.	.	S	Bend	trans	-87.3	141.8	-172.6	0	0	0	0	0	112.9	P273 T305	P273-G307 WeakPolarHBondContact CD-O 3.42Å; T305-G307 VanDerWaalsContact C-N 3.35Å
308	V	83.2	Confident	68.1	Low	80 Å²	80	83 Å²	83	49%	0.485	47%	0.466	S	S	.	.			trans	-70.4	133	167.3	179.3	0	0	0	0	108.7	V270 R271 V272	V270-V308 HydrophobicContact CG1-CG1 3.53Å; R271-V308 WeakPolarHBondContact O-CA 3.37Å; V272-V308 HydrophobicContact CG1-CG2 4.2Å; V272-V308 HydrophobicContact CG2-CG1 4.01Å; V272-V308 HydrophobicContact CG2-CG2 4.21Å
309	S	83.5	Confident	65.1	Low	40 Å²	40	88.5 Å²	88.5	28%	0.28	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.5	178	53.9	0	0	0	0	111.4	R271 H311	R271-S309 WeakPolarHBondContact CB-OG 3.31Å; R271-S309 PolarHBondContact N-O 3.42Å; R271-S309 PolarHBondContact O-N 3.41Å; S309-H311 PolarHBondContact OG-CE1 2.95Å; S309-H311 VanDerWaalsContact OG-CE1 3.31Å
310	V	81.4	Confident	62.1	Low	62 Å²	62	93.7 Å²	93.7	38%	0.376	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.3	-179.9	-178.9	0	0	0	0	107.8	I258 V268 V270 Y393	I258-V310 HydrophobicContact CD1-CB 4.39Å; I258-V310 HydrophobicContact CD1-CG1 3.61Å; I258-V310 HydrophobicContact CD1-CG2 3.84Å; V268-V310 HydrophobicContact CG1-CG1 3.7Å; V270-V310 HydrophobicContact CG2-CG2 4.45Å; V310-Y393 WeakPolarHBondContact CG2-OH 3.35Å
311	H	72.8	Confident	59.2	Low	91 Å²	91	99.6 Å²	99.6	42%	0.421	55%	0.55	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.2	123.3	174.9	-68.5	67.6	0	0	0	108.2	L269 R271 S309	L269-H311 HydrophobicContact CB-CB 4.4Å; L269-H311 PolarHBondContact N-O 3.01Å; L269-H311 PolarHBondContact O-N 3.37Å; R271-H311 VanDerWaalsContact CD-CE1 3.44Å; R271-H311 WeakPolarHBondContact CD-CE1 3.31Å; R271-H311 WeakPolarHBondContact CD-ND1 3.5Å; S309-H311 PolarHBondContact OG-CE1 2.95Å; S309-H311 VanDerWaalsContact OG-CE1 3.31Å
312	V	66	Low	56.5	Low	81 Å²	81	105.9 Å²	105.9	49%	0.491	57%	0.574	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-94.9	98.5	169.6	-175.8	0	0	0	0	105.6	V266 V268 E314	V266-V312 HydrophobicContact CG1-CG1 3.94Å; V268-V312 HydrophobicContact CG2-CG2 4.44Å; V312-E314 PolarHBondContact O-N 2.92Å
313	S	56.8	Low	54.3	Low	30 Å²	30	108.9 Å²	108.9	21%	0.21	59%	0.586	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	100.6	179.1	-64.7	0	0	0	0	108.8	T265 T267 M315	T265-S313 CarbonylContact C-O 3.48Å; T265-S313 CarbonylContact O-C 3.42Å; T267-S313 PolarHBondContact O-N 3.46Å; S313-M315 PolarHBondContact O-N 3.09Å
314	E	50.5	Low	52	Low	136 Å²	136	114.1 Å²	114.1	64%	0.636	61%	0.611	S	S	*	*			trans	-75.3	98.3	147.3	-52.8	-169.7	169.6	0	0	104.2	T265 V312 D316	T265-E314 HydrophobicContact CG2-CB 4.4Å; T265-E314 WeakPolarHBondContact O-CA 3.39Å; T265-E314 PolarHBondContact O-N 3Å; V312-E314 PolarHBondContact O-N 2.92Å; E314-D316 PolarHBondContact O-N 2.91Å
315	M	36.5	Very low	50.2	Low	96 Å²	96	115.5 Å²	115.5	47%	0.473	61%	0.612	S	S	.	*			trans	-64	103.3	-174.9	-66.3	-87	-140.3	0	0	109.3	S313	S313-M315 PolarHBondContact O-N 3.09Å
316	D	29.1	Very low	48.3	Very low	153 Å²	153	118.2 Å²	118.2	82%	0.818	62%	0.623	S	S	*	*			trans	-100	79.2	154.7	-80.5	-31	0	0	0	106	E314	E314-D316 PolarHBondContact O-N 2.91Å
317	D	31.5	Very low	46.7	Very low	91 Å²	91	118.4 Å²	118.4	49%	0.487	62%	0.624	S	S	.	*			trans	-88.8	107.3	165.6	-100.5	-8.8	0	0	0	106.3	E319 K344	D317-E319 PolarHBondContact O-N 2.99Å; D317-E319 VanDerWaalsContact O-N 3.12Å; D317-K344 IonicContact OD1-NZ 3.97Å; D317-K344 IonicContact OD2-NZ 2.7Å; D317-K344 PolarHBondContact OD2-NZ 2.97Å
318	E	26.3	Very low	44.9	Very low	188 Å²	188	121.4 Å²	121.4	88%	0.879	64%	0.639	S	S	*	*			trans	-61.9	100.1	165.3	-67.2	-168.1	171.9	0	0	108.6
319	E	31.8	Very low	42.8	Very low	116 Å²	116	127.4 Å²	127.4	54%	0.542	66%	0.662	S	S	.	*			trans	-158.9	146.7	162.7	-110.6	162.6	-121.9	0	0	110.2	D317	D317-E319 PolarHBondContact O-N 2.99Å; D317-E319 VanDerWaalsContact O-N 3.12Å
320	D	28.9	Very low	40.6	Very low	128 Å²	128	129.8 Å²	129.8	68%	0.684	68%	0.684	S	S	*	*			trans	74.7	72.2	-179.4	-52.1	-26.5	0	0	0	116.8	F322	D320-F322 PolarHBondContact O-N 2.96Å
321	E	31	Very low	38.6	Very low	189 Å²	189	132.8 Å²	132.8	88%	0.883	70%	0.698	S	S	*	*			trans	-49.3	127.7	147.9	-158.1	163.8	-153.5	0	0	109.2	D323	E321-D323 PolarHBondContact O-N 3.31Å
322	F	29.7	Very low	37.3	Very low	182 Å²	182	137.3 Å²	137.3	80%	0.798	72%	0.724	S	S	*	*			trans	-44.3	105.2	-178.9	-60	-98	0	0	0	112.9	D320 D324	D320-F322 PolarHBondContact O-N 2.96Å; F322-D324 PolarHBondContact O-N 3Å
323	D	32.2	Very low	36.3	Very low	169 Å²	169	141.9 Å²	141.9	90%	0.904	74%	0.74	S	S	*	*			trans	-83.8	110.6	159.6	-104.6	-23.4	0	0	0	108.5	E321	E321-D323 PolarHBondContact O-N 3.31Å
324	D	30.1	Very low	35.1	Very low	146 Å²	146	150.8 Å²	150.8	78%	0.781	77%	0.769	S	S	*	*			trans	-44.7	139.7	-177.9	-79.4	-52.6	0	0	0	113.9	F322 N326	F322-D324 PolarHBondContact O-N 3Å; D324-N326 VanDerWaalsContact C-N 3.32Å; D324-N326 PolarHBondContact O-N 3.42Å
325	E	32.2	Very low	34.2	Very low	200 Å²	200	147.4 Å²	147.4	94%	0.935	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.9	80.5	169.4	-65	-177.3	155.9	0	0	112.2
326	N	32.6	Very low	34	Very low	152 Å²	152	153.5 Å²	153.5	81%	0.813	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-162.1	7.3	158.9	-146.4	32.8	0	0	0	119.5	D324 S328	D324-N326 VanDerWaalsContact C-N 3.32Å; D324-N326 PolarHBondContact O-N 3.42Å; N326-S328 PolarHBondContact O-N 2.97Å
327	S	36.5	Very low	34.3	Very low	117 Å²	117	151 Å²	151	82%	0.818	79%	0.791	S	S	*	*			trans	-83.7	89.8	177.4	56.9	0	0	0	0	111.7	Q329	S327-Q329 PolarHBondContact O-N 3.48Å
328	S	39.5	Very low	34.7	Very low	102 Å²	102	157 Å²	157	71%	0.713	81%	0.807	S	S	*	*			trans	-21.2	119.2	161	54.9	0	0	0	0	115.8	N326 A330	N326-S328 PolarHBondContact O-N 2.97Å; S328-A330 PolarHBondContact O-N 3.4Å
329	Q	40.1	Very low	35.3	Very low	207 Å²	207	156.5 Å²	156.5	97%	0.967	80%	0.804	S	S	*	*			trans	31.4	59.4	141.6	-157.8	177.6	-7.4	0	0	115.9	S327	S327-Q329 PolarHBondContact O-N 3.48Å
330	A	37.1	Very low	35.7	Very low	89 Å²	89	156.7 Å²	156.7	74%	0.736	82%	0.815	S	S	*	*			trans	-104.7	127.7	166.5	0	0	0	0	0	108.8	S328 L332	S328-A330 PolarHBondContact O-N 3.4Å; A330-L332 PolarHBondContact O-N 3.19Å
331	D	39.2	Very low	36.3	Very low	125 Å²	125	155.1 Å²	155.1	67%	0.668	81%	0.805	S	S	*	*			trans	-30.8	113.6	-179	-161.1	-8	0	0	0	115.7	E333 R334	D331-E333 PolarHBondContact O-N 2.94Å; D331-E333 VanDerWaalsContact O-N 3.09Å; D331-E333 PolarHBondContact OD1-N 3.4Å; D331-R334 PolarHBondContact O-N 2.95Å
332	L	45.1	Very low	37.3	Very low	186 Å²	186	150.8 Å²	150.8	97%	0.974	80%	0.801	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	-9.5	179.2	-89	147.8	0	0	0	114.1	A330	A330-L332 PolarHBondContact O-N 3.19Å
333	E	45.1	Very low	38.5	Very low	178 Å²	178	149.8 Å²	149.8	83%	0.832	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94	-9.4	-178.1	-144.2	178.3	178.3	0	0	113.5	D331 G335	D331-E333 PolarHBondContact O-N 2.94Å; D331-E333 VanDerWaalsContact O-N 3.09Å; D331-E333 PolarHBondContact OD1-N 3.4Å; E333-G335 VanDerWaalsContact C-N 3.35Å; E333-G335 PolarHBondContact O-N 2.9Å
334	R	33	Very low	39.8	Very low	217 Å²	217	147.6 Å²	147.6	82%	0.819	79%	0.787	S	S	*	*	S	Bend	trans	-86.5	82.3	176.9	-156.7	168.8	-175.6	136.6	-2.1	108.9	D331 Y336	D331-R334 PolarHBondContact O-N 2.95Å; R334-Y336 PolarHBondContact O-N 2.98Å; R334-Y336 VanDerWaalsContact O-N 3.15Å
335	G	29.8	Very low	42	Very low	64 Å²	64	143 Å²	143	66%	0.66	77%	0.765	S	S	*	*			trans	-42.4	123.8	174.7	0	0	0	0	0	110.5	E333 A337	E333-G335 VanDerWaalsContact C-N 3.35Å; E333-G335 PolarHBondContact O-N 2.9Å; G335-A337 PolarHBondContact O-N 3.31Å
336	Y	33.6	Very low	44.5	Very low	225 Å²	225	139.4 Å²	139.4	88%	0.882	75%	0.748	S	S	*	*			trans	-48.5	115.7	176.6	-65.8	-90.4	0	0	0	107.8	R334 R338	R334-Y336 PolarHBondContact O-N 2.98Å; R334-Y336 VanDerWaalsContact O-N 3.15Å; Y336-R338 PolarHBondContact O-N 3.02Å
337	A	36.1	Very low	47.1	Very low	100 Å²	100	135 Å²	135	83%	0.826	73%	0.727	S	S	*	*			trans	-64.7	88.6	172	0	0	0	0	0	106.3	G335 E339	G335-A337 PolarHBondContact O-N 3.31Å; A337-E339 PolarHBondContact O-N 3.38Å
338	R	37.8	Very low	49.7	Very low	218 Å²	218	131.8 Å²	131.8	82%	0.823	70%	0.701	S	S	*	*			trans	-54.7	111.5	174.6	-82.2	177.7	158.4	169.9	-6.2	106.9	Y336	Y336-R338 PolarHBondContact O-N 3.02Å
339	E	39.4	Very low	52.2	Low	176 Å²	176	132.5 Å²	132.5	82%	0.822	69%	0.693	S	S	*	*			trans	-59.2	127.4	160.5	-68.7	-148.2	159.5	0	0	106.8	A337 M341	A337-E339 PolarHBondContact O-N 3.38Å; E339-M341 PolarHBondContact O-N 3.48Å
340	P	40.3	Very low	54.8	Low	120 Å²	120	123.8 Å²	123.8	78%	0.779	65%	0.652	S	S	*	*			trans	-63.9	105.5	-179	23.1	-30.2	0	0	0	108.2	A342	P340-A342 PolarHBondContact O-N 3.01Å
341	M	42.4	Very low	57.4	Low	95 Å²	95	120.1 Å²	120.1	47%	0.468	62%	0.62	S	S	.	*			trans	-47.5	107.3	172.5	-70	177.9	-108.7	0	0	109.2	E339 N343	E339-M341 PolarHBondContact O-N 3.48Å; M341-N343 PolarHBondContact O-N 3.44Å
342	A	51	Low	59.9	Low	98 Å²	98	116.3 Å²	116.3	81%	0.81	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	-5.1	-163.2	0	0	0	0	0	115.4	P340	P340-A342 PolarHBondContact O-N 3.01Å
343	N	54.8	Low	62	Low	161 Å²	161	109.7 Å²	109.7	86%	0.861	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	0	-171.9	-80.7	-14.5	0	0	0	116.1	M341	M341-N343 PolarHBondContact O-N 3.44Å
344	K	60.4	Low	64.1	Low	123 Å²	123	107.1 Å²	107.1	54%	0.535	55%	0.553	S	S	.	*	S	Bend	trans	-84.5	127.2	173.6	-154	162.3	-170.2	161	0	108.4	D317 Q346	D317-K344 IonicContact OD1-NZ 3.97Å; D317-K344 IonicContact OD2-NZ 2.7Å; D317-K344 PolarHBondContact OD2-NZ 2.97Å; K344-Q346 PolarHBondContact O-N 3.04Å
345	P	76.7	Confident	66.9	Low	51 Å²	51	104 Å²	104	33%	0.331	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-60.4	141.4	179.6	25	-33.3	0	0	0	109.8	E299 T301 V347	E299-P345 HydrophobicContact CG-CB 3.77Å; E299-P345 HydrophobicContact CG-CG 3.81Å; T301-P345 WeakPolarHBondContact OG1-CB 3.22Å; P345-V347 WeakPolarHBondContact O-CG2 3.36Å; P345-V347 PolarHBondContact O-N 3.41Å
346	Q	84.3	Confident	70	Confident	123 Å²	123	103.8 Å²	103.8	58%	0.575	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-60.2	127.6	176.5	-179.1	-171	-17.7	0	0	109.1	W300 K344	W300-Q346 HydrophobicContact CB-CB 4.24Å; W300-Q346 HydrophobicContact CG-CB 4.46Å; W300-Q346 PolarHBondContact N-O 2.82Å; K344-Q346 PolarHBondContact O-N 3.04Å
347	V	87.7	Confident	72.9	Confident	61 Å²	61	96.9 Å²	96.9	37%	0.37	50%	0.499	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.2	178.6	-179.8	0	0	0	0	109.8	L297 F298 E299 P345	L297-V347 HydrophobicContact CB-CG1 3.7Å; L297-V347 HydrophobicContact CD2-CG1 3.73Å; L297-V347 HydrophobicContact CG-CG1 4.37Å; F298-V347 CarbonylContact O-C 3.58Å; F298-V347 WeakPolarHBondContact O-CA 3.49Å; E299-V347 HydrophobicContact CB-CG2 4.12Å; E299-V347 HydrophobicContact CG-CG2 4.05Å; P345-V347 WeakPolarHBondContact O-CG2 3.36Å; P345-V347 PolarHBondContact O-N 3.41Å
348	D	90.7	Very high	75.8	Confident	49 Å²	49	92.1 Å²	92.1	26%	0.262	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	139.3	173.7	-73.9	-48.3	0	0	0	111.6	I232 L297 F298 W300	I232-D348 HydrophobicContact CD1-CB 3.35Å; I232-D348 WeakPolarHBondContact CD1-OD2 3.33Å; L297-D348 CarbonylContact C-O 3.5Å; L297-D348 VanDerWaalsContact CA-O 3.28Å; L297-D348 WeakPolarHBondContact CA-O 3.26Å; F298-D348 PolarHBondContact N-O 3.31Å; F298-D348 PolarHBondContact O-N 3.1Å; W300-D348 PolarHBondContact NE1-OD2 2.82Å
349	Q	91.8	Very high	78.5	Confident	117 Å²	117	85.4 Å²	85.4	55%	0.547	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	119.7	175	-178.1	177.4	96	0	0	110.2
350	I	93.7	Very high	81.1	Confident	24 Å²	24	82.7 Å²	82.7	12%	0.123	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-46.7	176.6	-59.7	170.6	0	0	0	110.2	I232 A235 L296 F298 H367 Y375	I232-I350 HydrophobicContact CG2-CG1 3.99Å; A235-I350 HydrophobicContact CB-CG2 3.77Å; L296-I350 HydrophobicContact CB-CB 4.41Å; L296-I350 HydrophobicContact CD2-CB 4.2Å; L296-I350 HydrophobicContact CD2-CD1 4.15Å; L296-I350 HydrophobicContact CD2-CG2 4.1Å; L296-I350 HydrophobicContact CG-CB 4.33Å; L296-I350 HydrophobicContact CG-CD1 4.33Å; L296-I350 PolarHBondContact O-N 3.24Å; F298-I350 HydrophobicContact CB-CD1 3.76Å; F298-I350 HydrophobicContact CB-CG1 4.36Å; I350-H367 VanDerWaalsContact CD1-CE1 3.5Å; I350-H367 WeakPolarHBondContact CD1-CE1 3.37Å; I350-H367 WeakPolarHBondContact CG2-CD2 3.31Å; I350-H367 WeakPolarHBondContact CG2-NE2 3.49Å; I350-Y375 HydrophobicContact CD1-CD1 4.13Å; I350-Y375 HydrophobicContact CD1-CE1 3.54Å
351	I	93.2	Very high	83.8	Confident	12 Å²	12	79.4 Å²	79.4	6%	0.062	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.5	176.9	-59.3	170.3	0	0	0	107.5	A235 M237 W283 F294 G295 L296	A235-I351 HydrophobicContact CB-CD1 3.62Å; A235-I351 HydrophobicContact CB-CG1 3.72Å; M237-I351 HydrophobicContact CG-CD1 4.22Å; M237-I351 HydrophobicContact SD-CD1 3.86Å; M237-I351 HydrophobicContact SD-CG2 4.33Å; W283-I351 HydrophobicContact CH2-CD1 3.97Å; W283-I351 HydrophobicContact CZ2-CD1 3.55Å; F294-I351 HydrophobicContact CE1-CD1 4.12Å; G295-I351 WeakPolarHBondContact CA-O 3.41Å; L296-I351 HydrophobicContact CB-CB 3.83Å; L296-I351 HydrophobicContact CB-CD1 3.86Å; L296-I351 HydrophobicContact CB-CG1 3.95Å; L296-I351 HydrophobicContact CD2-CD1 4.07Å; L296-I351 HydrophobicContact CD2-CG1 4.48Å; L296-I351 PolarHBondContact N-O 3.13Å; L296-I351 PolarHBondContact O-N 2.95Å
352	P	91.8	Very high	86.5	Confident	44 Å²	44	74.9 Å²	74.9	29%	0.286	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	151.9	172.4	-14.2	25.6	0	0	0	111.3	Y354	P352-Y354 HydrophobicContact CB-CD2 4.15Å; P352-Y354 HydrophobicContact CB-CE2 3.53Å; P352-Y354 HydrophobicContact CG-CE2 3.81Å; P352-Y354 VanDerWaalsContact O-CD2 3.29Å; P352-Y354 WeakPolarHBondContact O-CD2 3.48Å; P352-Y354 PolarHBondContact O-N 3.41Å; P352-Y354 VanDerWaalsContact O-N 3.16Å
353	V	88.5	Confident	88.7	Confident	47 Å²	47	71.5 Å²	71.5	29%	0.285	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	111.7	-177.3	178.4	0	0	0	0	109.7	A293 F294 K378 D380	A293-V353 HydrophobicContact CB-CG1 3.69Å; F294-V353 WeakPolarHBondContact O-CA 3.24Å; V353-K378 HydrophobicContact CG2-CD 3.84Å; V353-K378 HydrophobicContact CG2-CG 4.38Å; V353-D380 HydrophobicContact CG1-CB 4.32Å
354	Y	90	Very high	90.7	Very high	125 Å²	125	63.9 Å²	63.9	49%	0.49	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	146.4	177.4	-66.9	-62.5	0	0	0	111.6	A293 F294 P352	A293-Y354 CarbonylContact C-O 3.54Å; A293-Y354 WeakPolarHBondContact CA-O 3.32Å; F294-Y354 PolarHBondContact N-O 3.48Å; F294-Y354 PolarHBondContact O-N 2.89Å; P352-Y354 HydrophobicContact CB-CD2 4.15Å; P352-Y354 HydrophobicContact CB-CE2 3.53Å; P352-Y354 HydrophobicContact CG-CE2 3.81Å; P352-Y354 VanDerWaalsContact O-CD2 3.29Å; P352-Y354 WeakPolarHBondContact O-CD2 3.48Å; P352-Y354 PolarHBondContact O-N 3.41Å; P352-Y354 VanDerWaalsContact O-N 3.16Å
355	R	91.8	Very high	92.4	Very high	151 Å²	151	58 Å²	58	57%	0.57	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.7	134.1	174.4	-65.1	176.9	65.1	-179.4	-1.1	110.5	D291 A293 Y383	D291-R355 IonicContact OD1-NH2 2.85Å; D291-R355 PolarHBondContact OD1-NH2 3.32Å; D291-R355 IonicContact OD2-CZ 2.82Å; D291-R355 IonicContact OD2-NE 3.2Å; D291-R355 PolarHBondContact OD2-NE 2.87Å; D291-R355 IonicContact OD2-NH2 2.8Å; D291-R355 PolarHBondContact OD2-NH2 3.44Å; A293-R355 HydrophobicContact CB-CG 4.16Å; R355-Y383 HydrophobicContact CG-CE1 4.25Å
356	R	94.5	Very high	93.3	Very high	59 Å²	59	56.7 Å²	56.7	22%	0.223	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.1	-179.1	-54.9	-59.7	-178.2	177.2	2.3	110.1	F285 D291 I292 F294 C358 F363	F285-R356 HydrophobicContact CE2-CB 4.42Å; F285-R356 HydrophobicContact CZ-CG 4.35Å; D291-R356 WeakPolarHBondContact CA-O 3.31Å; D291-R356 WeakPolarHBondContact CB-O 3.38Å; I292-R356 PolarHBondContact N-O 3.46Å; I292-R356 PolarHBondContact O-N 2.88Å; F294-R356 HydrophobicContact CB-CG 4.22Å; R356-C358 HydrophobicContact CB-CB 4.44Å; R356-C358 PolarHBondContact O-N 3.49Å; R356-C358 PolarHBondContact O-SG 2.87Å; R356-C358 VanDerWaalsContact O-SG 3.41Å; R356-F363 HydrophobicContact CB-CD1 4.22Å; R356-F363 HydrophobicContact CB-CD2 4.37Å; R356-F363 HydrophobicContact CB-CE1 4.03Å; R356-F363 HydrophobicContact CB-CE2 4.17Å; R356-F363 HydrophobicContact CB-CG 4.38Å; R356-F363 HydrophobicContact CB-CZ 4Å; R356-F363 HydrophobicContact CG-CD1 4.22Å; R356-F363 HydrophobicContact CG-CE1 4.15Å
357	D	94.8	Very high	93.9	Very high	81 Å²	81	51 Å²	51	43%	0.433	24%	0.241	S	C	.	.			trans	-73	47.9	174.5	-59.8	-56	0	0	0	112.5	Y359 E360	D357-Y359 HydrophobicContact CB-CD1 4.35Å; D357-Y359 HydrophobicContact CB-CE1 3.79Å; D357-Y359 PolarHBondContact O-N 3.01Å; D357-Y359 WeakPolarHBondContact OD1-CE1 3.41Å; D357-E360 PolarHBondContact O-N 3.44Å
358	C	95.5	Very high	94.2	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	8.6	-177	61.5	0	0	0	0	114.2	F285 A286 T287 R356 E361 F363	F285-C358 HydrophobicContact CD2-CB 3.93Å; F285-C358 HydrophobicContact CE2-CB 3.78Å; A286-C358 CarbonylContact C-O 3.54Å; A286-C358 WeakPolarHBondContact CA-O 3.39Å; A286-C358 WeakPolarHBondContact CB-O 3.34Å; T287-C358 PolarHBondContact N-O 2.73Å; T287-C358 PolarHBondContact OG1-SG 3.11Å; T287-C358 VanDerWaalsContact OG1-SG 3.37Å; R356-C358 HydrophobicContact CB-CB 4.44Å; R356-C358 PolarHBondContact O-N 3.49Å; R356-C358 PolarHBondContact O-SG 2.87Å; R356-C358 VanDerWaalsContact O-SG 3.41Å; C358-E361 CarbonylContact C-O 3.57Å; C358-E361 VanDerWaalsContact CA-O 3.26Å; C358-E361 WeakPolarHBondContact CA-O 3.38Å; C358-F363 HydrophobicContact CB-CD2 3.53Å; C358-F363 HydrophobicContact CB-CE2 4.11Å; C358-F363 HydrophobicContact CB-CG 4.3Å
359	Y	94.6	Very high	94.3	Very high	76 Å²	76	51.2 Å²	51.2	30%	0.298	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-16	166.8	65.1	-81.3	0	0	0	112.6	I243 T287 D291 D357	I243-Y359 VanDerWaalsContact CD1-C 3.47Å; I243-Y359 WeakPolarHBondContact CD1-O 3.36Å; T287-Y359 WeakPolarHBondContact O-CA 3.5Å; T287-Y359 PolarHBondContact OG1-N 3.23Å; D291-Y359 HydrophobicContact CB-CD1 4.34Å; D291-Y359 HydrophobicContact CB-CE1 4.13Å; D357-Y359 HydrophobicContact CB-CD1 4.35Å; D357-Y359 HydrophobicContact CB-CE1 3.79Å; D357-Y359 PolarHBondContact O-N 3.01Å; D357-Y359 WeakPolarHBondContact OD1-CE1 3.41Å
360	E	95.5	Very high	94.3	Very high	120 Å²	120	47 Å²	47	56%	0.561	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-44	176.7	-56.2	-168.8	156	0	0	111.4	D357	D357-E360 PolarHBondContact O-N 3.44Å
361	E	96.6	Very high	94.2	Very high	51 Å²	51	47.1 Å²	47.1	24%	0.238	23%	0.23	C	C	.	.	S	Bend	trans	-131.6	154.4	-178.2	-64.7	-170	141	0	0	111.2	T239 R240 R241 C358 F363	T239-E361 WeakPolarHBondContact CB-OE2 3.5Å; T239-E361 PolarHBondContact OG1-OE2 3.13Å; R240-E361 CarbonylContact O-C 3.58Å; R240-E361 WeakPolarHBondContact O-CA 3.46Å; R240-E361 WeakPolarHBondContact O-CB 3.45Å; R241-E361 HydrophobicContact CG-CG 4.48Å; R241-E361 WeakPolarHBondContact CG-OE1 3.44Å; R241-E361 IonicContact NE-OE1 3.76Å; R241-E361 PolarHBondContact NE-OE1 2.98Å; C358-E361 CarbonylContact C-O 3.57Å; C358-E361 VanDerWaalsContact CA-O 3.26Å; C358-E361 WeakPolarHBondContact CA-O 3.38Å; E361-F363 PolarHBondContact O-N 3.17Å
362	V	98	Very high	94	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	124	170.9	-175.6	0	0	0	0	108.1	T239 R240 I243 F246 E284 A286	T239-V362 CarbonylContact C-O 3.55Å; T239-V362 WeakPolarHBondContact CA-O 3.32Å; R240-V362 HydrophobicContact CB-CB 4.29Å; R240-V362 PolarHBondContact N-O 3.41Å; R240-V362 PolarHBondContact O-N 3.39Å; I243-V362 HydrophobicContact CB-CG2 3.98Å; I243-V362 HydrophobicContact CG1-CG2 4.16Å; F246-V362 HydrophobicContact CB-CG2 3.67Å; F246-V362 HydrophobicContact CD1-CG1 4.02Å; F246-V362 HydrophobicContact CD1-CG2 3.81Å; F246-V362 HydrophobicContact CD2-CG1 4.09Å; F246-V362 HydrophobicContact CE1-CG1 4.11Å; F246-V362 HydrophobicContact CE2-CG1 4.17Å; F246-V362 HydrophobicContact CG-CG1 4.01Å; F246-V362 HydrophobicContact CG-CG2 3.74Å; F246-V362 HydrophobicContact CZ-CG1 4.18Å; E284-V362 HydrophobicContact CB-CG1 4.26Å; A286-V362 HydrophobicContact CB-CG2 4.49Å
363	F	98.3	Very high	94.1	Very high	27 Å²	27	50.3 Å²	50.3	12%	0.118	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	132.1	171.7	-84.5	-105.9	0	0	0	109.4	M237 T239 E284 F285 R356 C358 E361	M237-F363 HydrophobicContact CE-CD1 3.75Å; M237-F363 HydrophobicContact CE-CE1 4.34Å; T239-F363 HydrophobicContact CG2-CD1 3.95Å; T239-F363 HydrophobicContact CG2-CD2 4.05Å; T239-F363 HydrophobicContact CG2-CE1 3.73Å; T239-F363 HydrophobicContact CG2-CE2 3.85Å; T239-F363 HydrophobicContact CG2-CG 4.12Å; T239-F363 HydrophobicContact CG2-CZ 3.69Å; E284-F363 CarbonylContact C-O 3.5Å; E284-F363 VanDerWaalsContact CA-O 3.24Å; E284-F363 WeakPolarHBondContact CA-O 3.48Å; F285-F363 HydrophobicContact CD1-CB 4.2Å; F285-F363 HydrophobicContact CD2-CB 4.24Å; F285-F363 HydrophobicContact CE1-CB 3.7Å; F285-F363 HydrophobicContact CE2-CB 3.75Å; F285-F363 HydrophobicContact CE2-CG 4.3Å; F285-F363 HydrophobicContact CG-CB 4.45Å; F285-F363 HydrophobicContact CZ-CB 3.45Å; F285-F363 VanDerWaalsContact CZ-CB 3.45Å; F285-F363 HydrophobicContact CZ-CG 4.1Å; F285-F363 PolarHBondContact N-O 3.01Å; F285-F363 PolarHBondContact O-N 3.43Å; R356-F363 HydrophobicContact CB-CD1 4.22Å; R356-F363 HydrophobicContact CB-CD2 4.37Å; R356-F363 HydrophobicContact CB-CE1 4.03Å; R356-F363 HydrophobicContact CB-CE2 4.17Å; R356-F363 HydrophobicContact CB-CG 4.38Å; R356-F363 HydrophobicContact CB-CZ 4Å; R356-F363 HydrophobicContact CG-CD1 4.22Å; R356-F363 HydrophobicContact CG-CE1 4.15Å; C358-F363 HydrophobicContact CB-CD2 3.53Å; C358-F363 HydrophobicContact CB-CE2 4.11Å; C358-F363 HydrophobicContact CB-CG 4.3Å; E361-F363 PolarHBondContact O-N 3.17Å
364	A	96.5	Very high	94.3	Very high	0 Å²	0	48 Å²	48	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	156.3	179.2	0	0	0	0	0	110.2	M237 W238 W283 E284	M237-A364 WeakPolarHBondContact CA-O 3.28Å; W238-A364 HydrophobicContact CD2-CB 4.22Å; W238-A364 HydrophobicContact CG-CB 4.41Å; W238-A364 HydrophobicContact CZ2-CB 3.93Å; W238-A364 PolarHBondContact N-O 3.42Å; W238-A364 PolarHBondContact O-N 2.92Å; W238-A364 VanDerWaalsContact O-O 3.05Å; W283-A364 CarbonylContact O-C 3.58Å; W283-A364 VanDerWaalsContact O-CA 3.27Å; W283-A364 WeakPolarHBondContact O-CA 3.37Å; E284-A364 HydrophobicContact CG-CB 3.83Å
365	G	96.1	Very high	94.5	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	171.1	175.1	0	0	0	0	0	113.3	S236 F282 W283	S236-G365 CarbonylContact O-C 3.51Å; S236-G365 WeakPolarHBondContact O-CA 3.48Å; F282-G365 WeakPolarHBondContact CA-O 3.27Å; W283-G365 PolarHBondContact N-O 2.97Å; W283-G365 PolarHBondContact O-N 3.06Å
366	S	95.7	Very high	94.6	Very high	24 Å²	24	35.6 Å²	35.6	17%	0.168	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	151.6	178.5	64	0	0	0	0	111.8	S236 I281 F282	S236-S366 PolarHBondContact N-O 2.95Å; S236-S366 PolarHBondContact O-N 3.47Å; I281-S366 CarbonylContact O-C 3.51Å; I281-S366 WeakPolarHBondContact O-CA 3.35Å; F282-S366 VanDerWaalsContact CD1-CB 3.49Å; F282-S366 VanDerWaalsContact CE1-CB 3.47Å
367	H	96.2	Very high	94.6	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.019	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	135.1	175.6	-177.5	-89.5	0	0	0	110.8	Q233 A235 C280 I281 W283 L296 I350 Y375	Q233-H367 PolarHBondContact O-CD2 3.21Å; Q233-H367 PolarHBondContact O-NE2 3.43Å; A235-H367 HydrophobicContact CB-CB 4.2Å; C280-H367 CarbonylContact C-O 3.58Å; C280-H367 VanDerWaalsContact CA-O 3.25Å; C280-H367 WeakPolarHBondContact CA-O 3.46Å; I281-H367 HydrophobicContact CG2-CB 4.03Å; I281-H367 PolarHBondContact N-O 3Å; I281-H367 PolarHBondContact O-N 3.4Å; W283-H367 HydrophobicContact CH2-CB 4.02Å; W283-H367 HydrophobicContact CZ3-CB 3.87Å; L296-H367 HydrophobicContact CD2-CB 4.36Å; I350-H367 VanDerWaalsContact CD1-CE1 3.5Å; I350-H367 WeakPolarHBondContact CD1-CE1 3.37Å; I350-H367 WeakPolarHBondContact CG2-CD2 3.31Å; I350-H367 WeakPolarHBondContact CG2-NE2 3.49Å; H367-Y375 HydrophobicContact CB-CE1 4.48Å; H367-Y375 PolarHBondContact CE1-OH 2.89Å; H367-Y375 AromaticContact ND1-CE1 3.58Å; H367-Y375 AromaticContact ND1-CZ 3.59Å; H367-Y375 PolarHBondContact ND1-OH 3.39Å
368	V	93.9	Very high	94.5	Very high	80 Å²	80	31.2 Å²	31.2	49%	0.485	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	137.2	177.4	-178	0	0	0	0	109.2	P370 Y375	V368-P370 WeakPolarHBondContact O-CD 3.31Å; V368-Y375 PolarHBondContact O-OH 3.31Å
369	Y	93.4	Very high	94.3	Very high	33 Å²	33	31.2 Å²	31.2	13%	0.129	16%	0.158	C	C	.	.			trans	-60	121.9	179.8	-65.2	-11.1	0	0	0	111	T274 G278 S279 I281 Y375 Y397	T274-Y369 HydrophobicContact CG2-CD1 4.22Å; T274-Y369 HydrophobicContact CG2-CD2 4.24Å; T274-Y369 HydrophobicContact CG2-CE1 4.36Å; T274-Y369 HydrophobicContact CG2-CE2 4.38Å; T274-Y369 HydrophobicContact CG2-CG 4.15Å; G278-Y369 VanDerWaalsContact O-CD2 3.25Å; G278-Y369 WeakPolarHBondContact O-CD2 3.38Å; G278-Y369 WeakPolarHBondContact O-CE2 3.44Å; S279-Y369 PolarHBondContact O-N 3.02Å; I281-Y369 HydrophobicContact CB-CE1 3.89Å; I281-Y369 HydrophobicContact CG2-CE1 4.35Å; Y369-Y375 AromaticContact CD1-CE2 3.58Å; Y369-Y375 HydrophobicContact CD1-CE2 3.58Å; Y369-Y375 AromaticContact CE1-CE2 3.71Å; Y369-Y375 HydrophobicContact CE1-CE2 3.71Å; Y369-Y397 WeakPolarHBondContact OH-CB 3.44Å
370	P	91.6	Very high	93.9	Very high	28 Å²	28	28.4 Å²	28.4	18%	0.182	15%	0.148	C	C	.	.			trans	-75.1	-20.9	174.5	33.1	-34.6	0	0	0	110.9	V230 I232 F298 W300 V368 Y375	V230-P370 HydrophobicContact CG1-CB 4.36Å; I232-P370 HydrophobicContact CG1-CB 4.01Å; F298-P370 HydrophobicContact CD1-CG 3.74Å; F298-P370 HydrophobicContact CD2-CG 4.02Å; F298-P370 HydrophobicContact CE1-CG 3.64Å; F298-P370 HydrophobicContact CE2-CG 3.92Å; F298-P370 HydrophobicContact CG-CG 3.91Å; F298-P370 HydrophobicContact CZ-CG 3.71Å; W300-P370 HydrophobicContact CH2-CB 3.86Å; W300-P370 HydrophobicContact CH2-CG 4.09Å; W300-P370 HydrophobicContact CZ2-CB 4.18Å; W300-P370 HydrophobicContact CZ2-CG 4.28Å; V368-P370 WeakPolarHBondContact O-CD 3.31Å; P370-Y375 WeakPolarHBondContact CD-OH 3.2Å
371	G	90.8	Very high	93.4	Very high	28 Å²	28	22.7 Å²	22.7	29%	0.289	12%	0.121	S	C	.	.	S	Bend	trans	175.3	-163.7	178	0	0	0	0	0	110.9
372	K	90.4	Very high	92.3	Very high	120 Å²	120	21 Å²	21	52%	0.522	12%	0.115	S	C	.	.	S	Bend	trans	-79.5	128.4	170.1	-68	-168.2	177.4	-165.6	0	109.5	T274 E276	T274-K372 WeakPolarHBondContact OG1-CA 3.39Å; E276-K372 IonicContact OE1-NZ 3.54Å; E276-K372 PolarHBondContact OE1-NZ 2.93Å
373	G	92.5	Very high	91.2	Very high	2 Å²	2	23.3 Å²	23.3	2%	0.021	12%	0.124	C	C	.	.	S	Bend	trans	-179.6	-157.7	-176.8	0	0	0	0	0	112.8	T274 F298 E299 T301	T274-G373 PolarHBondContact N-O 3.27Å; T274-G373 PolarHBondContact OG1-N 2.76Å; T274-G373 PolarHBondContact OG1-O 3.42Å; F298-G373 VanDerWaalsContact CZ-CA 3.48Å; E299-G373 WeakPolarHBondContact O-CA 3.3Å; T301-G373 CarbonylContact O-C 3.45Å; T301-G373 VanDerWaalsContact O-CA 3.29Å; T301-G373 WeakPolarHBondContact O-CA 3.39Å
374	V	92.9	Very high	90	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	124.9	178.5	-171.8	0	0	0	0	110.2	R271 E299 S303 L376	R271-V374 HydrophobicContact CB-CG1 3.93Å; R271-V374 HydrophobicContact CG-CG1 4.49Å; E299-V374 HydrophobicContact CB-CB 4.37Å; E299-V374 PolarHBondContact N-O 3.49Å; E299-V374 PolarHBondContact O-N 2.98Å; S303-V374 WeakPolarHBondContact OG-CG2 3.41Å; V374-L376 HydrophobicContact CG1-CD2 4.04Å
375	Y	94.9	Very high	88.6	Confident	1 Å²	1	23.8 Å²	23.8	0%	0.004	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	136.8	167.5	-76.2	-84.1	0	0	0	110.7	R271 V272 T274 I281 L296 L297 F298 I350 H367 V368 Y369 P370	R271-Y375 CarbonylContact C-O 3.57Å; R271-Y375 WeakPolarHBondContact CA-O 3.38Å; V272-Y375 PolarHBondContact N-O 3.49Å; V272-Y375 PolarHBondContact O-N 3.08Å; T274-Y375 HydrophobicContact CG2-CD2 4.25Å; T274-Y375 HydrophobicContact CG2-CE2 3.93Å; I281-Y375 HydrophobicContact CB-CD2 4.25Å; I281-Y375 HydrophobicContact CB-CE2 4.15Å; I281-Y375 HydrophobicContact CD1-CD1 4.39Å; I281-Y375 HydrophobicContact CD1-CD2 3.83Å; I281-Y375 HydrophobicContact CD1-CG 3.73Å; I281-Y375 HydrophobicContact CG2-CD1 4.05Å; I281-Y375 HydrophobicContact CG2-CD2 3.97Å; I281-Y375 HydrophobicContact CG2-CE1 3.74Å; I281-Y375 HydrophobicContact CG2-CE2 3.67Å; I281-Y375 HydrophobicContact CG2-CG 4.15Å; L296-Y375 HydrophobicContact CD1-CD1 3.87Å; L296-Y375 HydrophobicContact CD2-CD1 4.14Å; L296-Y375 HydrophobicContact CD2-CE1 4.25Å; L296-Y375 HydrophobicContact CG-CD1 4.1Å; L297-Y375 WeakPolarHBondContact O-CA 3.49Å; F298-Y375 AromaticContact CD2-CD1 3.93Å; F298-Y375 HydrophobicContact CD2-CD1 3.93Å; F298-Y375 HydrophobicContact CD2-CD2 4.05Å; F298-Y375 AromaticContact CD2-CE1 3.76Å; F298-Y375 HydrophobicContact CD2-CE1 3.76Å; F298-Y375 AromaticContact CD2-CE2 3.87Å; F298-Y375 HydrophobicContact CD2-CE2 3.87Å; F298-Y375 HydrophobicContact CD2-CG 4.07Å; F298-Y375 AromaticContact CD2-CZ 3.7Å; F298-Y375 HydrophobicContact CE2-CD2 4.06Å; F298-Y375 HydrophobicContact CE2-CE1 4.41Å; F298-Y375 AromaticContact CE2-CE2 3.72Å; F298-Y375 HydrophobicContact CE2-CE2 3.72Å; F298-Y375 AromaticContact CE2-CZ 3.89Å; I350-Y375 HydrophobicContact CD1-CD1 4.13Å; I350-Y375 HydrophobicContact CD1-CE1 3.54Å; H367-Y375 HydrophobicContact CB-CE1 4.48Å; H367-Y375 PolarHBondContact CE1-OH 2.89Å; H367-Y375 AromaticContact ND1-CE1 3.58Å; H367-Y375 AromaticContact ND1-CZ 3.59Å; H367-Y375 PolarHBondContact ND1-OH 3.39Å; V368-Y375 PolarHBondContact O-OH 3.31Å; Y369-Y375 AromaticContact CD1-CE2 3.58Å; Y369-Y375 HydrophobicContact CD1-CE2 3.58Å; Y369-Y375 AromaticContact CE1-CE2 3.71Å; Y369-Y375 HydrophobicContact CE1-CE2 3.71Å; P370-Y375 WeakPolarHBondContact CD-OH 3.2Å
376	L	93.6	Very high	87.4	Confident	13 Å²	13	24.1 Å²	24.1	7%	0.068	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	102.2	173.6	-47	179.8	0	0	0	108.2	L269 R271 L297 E299 V374 K378	L269-L376 HydrophobicContact CD2-CB 4.27Å; R271-L376 HydrophobicContact CB-CD2 4.4Å; R271-L376 HydrophobicContact CG-CD2 3.68Å; L297-L376 HydrophobicContact CB-CB 4.15Å; L297-L376 HydrophobicContact CB-CD1 4.34Å; L297-L376 HydrophobicContact CD1-CB 4.27Å; L297-L376 PolarHBondContact N-O 2.89Å; L297-L376 PolarHBondContact O-N 2.68Å; E299-L376 HydrophobicContact CB-CD1 4.24Å; E299-L376 HydrophobicContact CB-CG 4.41Å; V374-L376 HydrophobicContact CG1-CD2 4.04Å; L376-K378 PolarHBondContact O-N 3.29Å
377	L	94.7	Very high	86.5	Confident	1 Å²	1	26.1 Å²	26.1	1%	0.005	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	111.2	171.3	-75.2	70.3	0	0	0	107.7	L269 V270 V272 I281 W283 F294 L296 F379 V395	L269-L377 WeakPolarHBondContact CA-O 3.28Å; V270-L377 HydrophobicContact CB-CB 4.15Å; V270-L377 PolarHBondContact N-O 2.98Å; V270-L377 PolarHBondContact O-N 2.96Å; V272-L377 HydrophobicContact CG2-CD1 4.12Å; I281-L377 HydrophobicContact CD1-CD1 4.12Å; W283-L377 HydrophobicContact CB-CD2 3.78Å; W283-L377 HydrophobicContact CG-CD2 4.27Å; F294-L377 HydrophobicContact CE2-CB 4.07Å; F294-L377 HydrophobicContact CE2-CD2 4.25Å; F294-L377 HydrophobicContact CE2-CG 4.1Å; F294-L377 HydrophobicContact CZ-CG 4.4Å; L296-L377 HydrophobicContact CD1-CD1 3.67Å; L296-L377 HydrophobicContact CD1-CG 3.83Å; L377-F379 HydrophobicContact CB-CE2 3.91Å; L377-F379 HydrophobicContact CD2-CE2 4.33Å; L377-F379 HydrophobicContact CD2-CZ 4.42Å; L377-V395 HydrophobicContact CD2-CG2 3.62Å
378	K	92.3	Very high	85.8	Confident	47 Å²	47	27.1 Å²	27.1	20%	0.204	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	110.9	-177.9	-178	169.1	169.7	174.3	0	110	T267 L269 F294 G295 L297 V353 L376 D380	T267-K378 HydrophobicContact CG2-CD 3.92Å; T267-K378 HydrophobicContact CG2-CG 3.49Å; T267-K378 VanDerWaalsContact CG2-CG 3.49Å; L269-K378 HydrophobicContact CD2-CB 3.67Å; L269-K378 HydrophobicContact CD2-CD 4.43Å; L269-K378 HydrophobicContact CD2-CG 3.96Å; F294-K378 CarbonylContact C-O 3.51Å; F294-K378 VanDerWaalsContact CA-O 3.29Å; F294-K378 WeakPolarHBondContact CA-O 3.31Å; G295-K378 PolarHBondContact N-O 3.42Å; G295-K378 PolarHBondContact O-N 3.31Å; L297-K378 HydrophobicContact CD1-CB 3.97Å; L297-K378 HydrophobicContact CD1-CD 4.49Å; V353-K378 HydrophobicContact CG2-CD 3.84Å; V353-K378 HydrophobicContact CG2-CG 4.38Å; L376-K378 PolarHBondContact O-N 3.29Å; K378-D380 WeakPolarHBondContact CE-OD2 3.27Å; K378-D380 HydrophobicContact CG-CB 4.49Å; K378-D380 IonicContact NZ-OD2 3.26Å
379	F	91.5	Very high	85.4	Confident	1 Å²	1	23.6 Å²	23.6	0%	0.004	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	114.6	169.7	-63.6	-80.6	0	0	0	109.5	T267 V268 V270 F285 I292 A293 F294 L377 L391	T267-F379 WeakPolarHBondContact CA-O 3.4Å; V268-F379 HydrophobicContact CB-CB 4.32Å; V268-F379 PolarHBondContact N-O 3.45Å; V268-F379 PolarHBondContact O-N 3.41Å; V270-F379 HydrophobicContact CG2-CD2 4.32Å; V270-F379 HydrophobicContact CG2-CE2 4.13Å; F285-F379 HydrophobicContact CB-CE1 3.98Å; F285-F379 HydrophobicContact CB-CZ 4.14Å; F285-F379 AromaticContact CD1-CE1 3.94Å; F285-F379 HydrophobicContact CD1-CE1 3.94Å; F285-F379 HydrophobicContact CD1-CZ 4.2Å; F285-F379 AromaticContact CD2-CE1 3.84Å; F285-F379 HydrophobicContact CD2-CE1 3.84Å; F285-F379 HydrophobicContact CE1-CE1 4.37Å; F285-F379 HydrophobicContact CE2-CE1 4.28Å; F285-F379 AromaticContact CG-CE1 3.65Å; F285-F379 HydrophobicContact CG-CE1 3.65Å; F285-F379 HydrophobicContact CG-CZ 4.13Å; I292-F379 HydrophobicContact CD1-CB 3.92Å; I292-F379 HydrophobicContact CG2-CD1 4.28Å; A293-F379 WeakPolarHBondContact O-CA 3.14Å; F294-F379 AromaticContact CD2-CD1 3.87Å; F294-F379 HydrophobicContact CD2-CD1 3.87Å; F294-F379 AromaticContact CD2-CE1 3.47Å; F294-F379 HydrophobicContact CD2-CE1 3.47Å; F294-F379 VanDerWaalsContact CD2-CE1 3.47Å; F294-F379 AromaticContact CD2-CZ 3.83Å; F294-F379 HydrophobicContact CD2-CZ 3.83Å; F294-F379 AromaticContact CE2-CE1 3.99Å; F294-F379 HydrophobicContact CE2-CE1 3.99Å; F294-F379 HydrophobicContact CE2-CE2 4.44Å; F294-F379 AromaticContact CE2-CZ 3.86Å; F294-F379 HydrophobicContact CE2-CZ 3.86Å; F294-F379 HydrophobicContact CG-CE1 4.4Å; L377-F379 HydrophobicContact CB-CE2 3.91Å; L377-F379 HydrophobicContact CD2-CE2 4.33Å; L377-F379 HydrophobicContact CD2-CZ 4.42Å; F379-L391 HydrophobicContact CB-CD2 4.01Å; F379-L391 HydrophobicContact CD1-CD1 3.82Å; F379-L391 HydrophobicContact CD1-CD2 3.65Å; F379-L391 HydrophobicContact CD1-CG 4.41Å; F379-L391 HydrophobicContact CD2-CD2 3.55Å; F379-L391 HydrophobicContact CE1-CD1 3.78Å; F379-L391 HydrophobicContact CE1-CD2 3.93Å; F379-L391 HydrophobicContact CE1-CG 4.48Å; F379-L391 HydrophobicContact CE2-CD2 3.82Å; F379-L391 HydrophobicContact CG-CD1 4.47Å; F379-L391 HydrophobicContact CG-CD2 3.45Å; F379-L391 VanDerWaalsContact CG-CD2 3.45Å; F379-L391 HydrophobicContact CZ-CD1 4.39Å; F379-L391 HydrophobicContact CZ-CD2 4Å
380	D	86.2	Confident	85.3	Confident	17 Å²	17	24 Å²	24	9%	0.091	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.5	-168.3	-172.2	-18	0	0	0	109.8	I292 A293 V353 K378 S382 Y383	I292-D380 VanDerWaalsContact CG1-O 3.27Å; I292-D380 WeakPolarHBondContact CG1-O 3.36Å; A293-D380 HydrophobicContact CB-CB 4.08Å; A293-D380 WeakPolarHBondContact CB-O 3.37Å; A293-D380 PolarHBondContact N-O 3.16Å; A293-D380 PolarHBondContact O-N 3.04Å; V353-D380 HydrophobicContact CG1-CB 4.32Å; K378-D380 WeakPolarHBondContact CE-OD2 3.27Å; K378-D380 HydrophobicContact CG-CB 4.49Å; K378-D380 IonicContact NZ-OD2 3.26Å; D380-S382 WeakPolarHBondContact OD1-CB 3.48Å; D380-S382 PolarHBondContact OD1-N 3.48Å; D380-S382 PolarHBondContact OD1-OG 3.48Å; D380-Y383 VanDerWaalsContact O-CE1 3.26Å; D380-Y383 WeakPolarHBondContact O-CE1 3.41Å
381	N	85.5	Confident	85.4	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.			trans	-127.2	20.1	175.4	-168.6	50.4	0	0	0	111.6	V260 G261 I292 Y383 S384 R387 K389	V260-N381 HydrophobicContact CB-CB 4.42Å; V260-N381 HydrophobicContact CG1-CB 3.59Å; G261-N381 WeakPolarHBondContact O-CB 3.33Å; G261-N381 PolarHBondContact O-ND2 3.36Å; I292-N381 HydrophobicContact CG1-CB 4.48Å; N381-Y383 PolarHBondContact O-N 3.28Å; N381-S384 WeakPolarHBondContact ND2-CB 3.48Å; N381-S384 WeakPolarHBondContact O-CB 3.24Å; N381-S384 PolarHBondContact O-N 2.93Å; N381-S384 VanDerWaalsContact OD1-CB 3.24Å; N381-S384 WeakPolarHBondContact OD1-CB 3.24Å; N381-S384 PolarHBondContact OD1-OG 2.99Å; N381-R387 PolarHBondContact ND2-O 3.44Å; N381-K389 HydrophobicContact CB-CG 4.31Å; N381-K389 WeakPolarHBondContact OD1-CE 3.35Å; N381-K389 WeakPolarHBondContact OD1-CG 3.11Å; N381-K389 PolarHBondContact OD1-NZ 2.98Å
382	S	72.8	Confident	85.7	Confident	16 Å²	16	21.8 Å²	21.8	11%	0.112	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-36	178.2	53.3	0	0	0	0	113	D380 S384	D380-S382 WeakPolarHBondContact OD1-CB 3.48Å; D380-S382 PolarHBondContact OD1-N 3.48Å; D380-S382 PolarHBondContact OD1-OG 3.48Å; S382-S384 VanDerWaalsContact C-N 3.26Å; S382-S384 PolarHBondContact O-N 2.91Å
383	Y	74.6	Confident	86	Confident	47 Å²	47	16.8 Å²	16.8	18%	0.184	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.2	178.6	64.4	-92.3	0	0	0	114.5	D291 I292 A293 R355 D380 N381	D291-Y383 PolarHBondContact O-OH 3.44Å; D291-Y383 VanDerWaalsContact O-OH 3.13Å; D291-Y383 PolarHBondContact OD2-OH 3.07Å; I292-Y383 WeakPolarHBondContact CA-OH 3.42Å; I292-Y383 PolarHBondContact N-OH 3.18Å; A293-Y383 HydrophobicContact CB-CD1 4.46Å; A293-Y383 HydrophobicContact CB-CE1 3.74Å; A293-Y383 PolarHBondContact N-OH 3.38Å; R355-Y383 HydrophobicContact CG-CE1 4.25Å; D380-Y383 VanDerWaalsContact O-CE1 3.26Å; D380-Y383 WeakPolarHBondContact O-CE1 3.41Å; N381-Y383 PolarHBondContact O-N 3.28Å
384	S	72.9	Confident	86.1	Confident	13 Å²	13	20.1 Å²	20.1	9%	0.091	10%	0.095	C	C	.	.			trans	-82.3	139.4	174.7	-75.4	0	0	0	0	111	Y262 G263 N381 S382 R387 K389	Y262-S384 WeakPolarHBondContact CB-O 3.39Å; G263-S384 PolarHBondContact N-O 2.82Å; G263-S384 VanDerWaalsContact N-O 3.13Å; N381-S384 WeakPolarHBondContact ND2-CB 3.48Å; N381-S384 WeakPolarHBondContact O-CB 3.24Å; N381-S384 PolarHBondContact O-N 2.93Å; N381-S384 VanDerWaalsContact OD1-CB 3.24Å; N381-S384 WeakPolarHBondContact OD1-CB 3.24Å; N381-S384 PolarHBondContact OD1-OG 2.99Å; S382-S384 VanDerWaalsContact C-N 3.26Å; S382-S384 PolarHBondContact O-N 2.91Å; S384-R387 WeakPolarHBondContact CB-O 3.35Å; S384-K389 PolarHBondContact OG-NZ 3.39Å
385	L	68.3	Low	86.1	Confident	25 Å²	25	21.7 Å²	21.7	13%	0.131	10%	0.104	C	C	.	.	S	Bend	trans	-92.3	-39.4	-175	-52.3	-173.4	0	0	0	113.4	R47 F74 Y262	R47-L385 HydrophobicContact CB-CD1 4Å; F74-L385 HydrophobicContact CD1-CD2 3.43Å; F74-L385 VanDerWaalsContact CD1-CD2 3.43Å; F74-L385 HydrophobicContact CD2-CD1 4.39Å; F74-L385 HydrophobicContact CD2-CD2 4.4Å; F74-L385 HydrophobicContact CE1-CD1 4.11Å; F74-L385 HydrophobicContact CE1-CD2 2.98Å; F74-L385 HydrophobicContact CE1-CG 4.15Å; F74-L385 HydrophobicContact CE2-CD1 3.6Å; F74-L385 HydrophobicContact CE2-CD2 4Å; F74-L385 HydrophobicContact CE2-CG 4.43Å; F74-L385 HydrophobicContact CG-CD2 4.16Å; F74-L385 HydrophobicContact CZ-CD1 3.43Å; F74-L385 VanDerWaalsContact CZ-CD1 3.43Å; F74-L385 HydrophobicContact CZ-CD2 3.28Å; F74-L385 HydrophobicContact CZ-CG 3.98Å; Y262-L385 VanDerWaalsContact CD2-C 3.43Å; Y262-L385 WeakPolarHBondContact CD2-O 3.49Å; Y262-L385 WeakPolarHBondContact CE2-O 3.36Å
386	W	70.8	Confident	85.9	Confident	7 Å²	7	25.8 Å²	25.8	3%	0.027	12%	0.12	C	C	.	.	S	Bend	trans	-138.3	-2.4	-172.7	-49.2	114	0	0	0	112.8	L32 K33 L50 A51 S54 F97 Y262	L32-W386 HydrophobicContact CD2-CD2 4.04Å; L32-W386 VanDerWaalsContact CD2-CE2 3.44Å; L32-W386 HydrophobicContact CD2-CG 4.46Å; L32-W386 HydrophobicContact CD2-CH2 4.39Å; L32-W386 HydrophobicContact CD2-CZ2 3.66Å; L32-W386 HydrophobicContact CG-CG 4.47Å; K33-W386 HydrophobicContact CB-CB 3.99Å; K33-W386 WeakPolarHBondContact CD-O 2.96Å; K33-W386 WeakPolarHBondContact CE-O 3.5Å; K33-W386 HydrophobicContact CG-CB 4.28Å; K33-W386 WeakPolarHBondContact CG-O 3.36Å; L50-W386 HydrophobicContact CB-CZ2 4.29Å; A51-W386 HydrophobicContact CB-CZ2 4.31Å; S54-W386 WeakPolarHBondContact OG-CH2 3.27Å; S54-W386 VanDerWaalsContact OG-CZ3 3.27Å; S54-W386 WeakPolarHBondContact OG-CZ3 3.45Å; F97-W386 AromaticContact CE2-CH2 3.8Å; F97-W386 HydrophobicContact CE2-CH2 3.8Å; F97-W386 HydrophobicContact CE2-CZ2 4.27Å; F97-W386 HydrophobicContact CE2-CZ3 4.48Å; F97-W386 HydrophobicContact CZ-CH2 4.34Å; Y262-W386 VanDerWaalsContact CD1-C 3.48Å; Y262-W386 WeakPolarHBondContact CE1-O 3.35Å; Y262-W386 AromaticContact CE2-CE3 3.92Å; Y262-W386 HydrophobicContact CE2-CE3 3.92Å; Y262-W386 HydrophobicContact CE2-CZ3 4.47Å
387	R	76.6	Confident	85.8	Confident	65 Å²	65	29.7 Å²	29.7	25%	0.245	14%	0.135	C	C	.	.			trans	-116.2	101.7	-165.6	-61.8	-178.5	-170.2	141.9	9.4	110.7	E36 Y290 N381 S384 K389	E36-R387 PolarHBondContact O-NH2 3.35Å; E36-R387 IonicContact OE2-CZ 3.68Å; E36-R387 IonicContact OE2-NH2 2.79Å; E36-R387 PolarHBondContact OE2-NH2 3.44Å; Y290-R387 HydrophobicContact CE2-CB 4.46Å; N381-R387 PolarHBondContact ND2-O 3.44Å; S384-R387 WeakPolarHBondContact CB-O 3.35Å; R387-K389 PolarHBondContact O-NZ 3.4Å
388	S	81.6	Confident	85.3	Confident	25 Å²	25	31 Å²	31	18%	0.175	15%	0.145	C	C	.	.			trans	-66.3	149.9	165.7	55.8	0	0	0	0	110.7	K259 V260	K259-S388 WeakPolarHBondContact CE-OG 3.25Å; V260-S388 CarbonylContact O-C 3.54Å; V260-S388 WeakPolarHBondContact O-CA 3.28Å; V260-S388 VanDerWaalsContact O-CB 3.28Å; V260-S388 WeakPolarHBondContact O-CB 3.43Å
389	K	86.1	Confident	84	Confident	7 Å²	7	39.1 Å²	39.1	3%	0.03	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	138.2	174.7	-51	-69	-179.3	-87.4	0	109.1	K259 V260 T287 Y290 D291 I292 N381 S384 R387	K259-K389 CarbonylContact C-O 3.5Å; K259-K389 WeakPolarHBondContact CA-O 3.24Å; V260-K389 HydrophobicContact CB-CB 4.28Å; V260-K389 PolarHBondContact N-O 3.38Å; V260-K389 PolarHBondContact O-N 3.04Å; T287-K389 HydrophobicContact CG2-CB 4.5Å; Y290-K389 VanDerWaalsContact CB-CD 3.47Å; Y290-K389 HydrophobicContact CD2-CD 4Å; Y290-K389 HydrophobicContact CG-CD 4.15Å; D291-K389 WeakPolarHBondContact O-CE 3.27Å; I292-K389 HydrophobicContact CD1-CB 4.35Å; I292-K389 HydrophobicContact CD1-CG 4.39Å; N381-K389 HydrophobicContact CB-CG 4.31Å; N381-K389 WeakPolarHBondContact OD1-CE 3.35Å; N381-K389 WeakPolarHBondContact OD1-CG 3.11Å; N381-K389 PolarHBondContact OD1-NZ 2.98Å; S384-K389 PolarHBondContact OG-NZ 3.39Å; R387-K389 PolarHBondContact O-NZ 3.4Å
390	T	91.2	Very high	83.6	Confident	41 Å²	41	41.1 Å²	41.1	25%	0.252	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	117.5	162.3	-48.8	0	0	0	0	106.4	V257 T287 D288 Y392	V257-T390 HydrophobicContact CG1-CG2 3.66Å; T287-T390 VanDerWaalsContact CA-O 3.22Å; T287-T390 WeakPolarHBondContact CA-O 3.41Å; D288-T390 PolarHBondContact N-O 2.97Å; D288-T390 VanDerWaalsContact OD2-CB 3.24Å; D288-T390 WeakPolarHBondContact OD2-CB 3.38Å; D288-T390 PolarHBondContact OD2-OG1 3.18Å; T390-Y392 HydrophobicContact CG2-CE1 4.49Å; T390-Y392 HydrophobicContact CG2-CE2 3.85Å
391	L	93.3	Very high	83.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.9	177.9	178	68.9	0	0	0	108.8	V257 I258 V260 F285 T287 F379 Y393	V257-L391 CarbonylContact C-O 3.47Å; V257-L391 WeakPolarHBondContact CA-O 3.38Å; I258-L391 PolarHBondContact N-O 3.49Å; I258-L391 PolarHBondContact O-N 2.84Å; V260-L391 HydrophobicContact CG2-CB 4Å; V260-L391 HydrophobicContact CG2-CD2 4.31Å; F285-L391 HydrophobicContact CB-CD1 4.03Å; F285-L391 HydrophobicContact CD2-CD1 4.36Å; T287-L391 HydrophobicContact CG2-CD1 4.14Å; F379-L391 HydrophobicContact CB-CD2 4.01Å; F379-L391 HydrophobicContact CD1-CD1 3.82Å; F379-L391 HydrophobicContact CD1-CD2 3.65Å; F379-L391 HydrophobicContact CD1-CG 4.41Å; F379-L391 HydrophobicContact CD2-CD2 3.55Å; F379-L391 HydrophobicContact CE1-CD1 3.78Å; F379-L391 HydrophobicContact CE1-CD2 3.93Å; F379-L391 HydrophobicContact CE1-CG 4.48Å; F379-L391 HydrophobicContact CE2-CD2 3.82Å; F379-L391 HydrophobicContact CG-CD1 4.47Å; F379-L391 HydrophobicContact CG-CD2 3.45Å; F379-L391 VanDerWaalsContact CG-CD2 3.45Å; F379-L391 HydrophobicContact CZ-CD1 4.39Å; F379-L391 HydrophobicContact CZ-CD2 4Å; L391-Y393 HydrophobicContact CD2-CD1 4.42Å
392	Y	97.2	Very high	83.4	Confident	9 Å²	9	44.7 Å²	44.7	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	123.7	169	-57	-94.3	0	0	0	106.2	K247 I250 K251 G256 V257 F285 A286 D288 T390	K247-Y392 HydrophobicContact CB-CD1 4.28Å; K247-Y392 HydrophobicContact CB-CE1 4.37Å; K247-Y392 HydrophobicContact CB-CG 4.44Å; K247-Y392 HydrophobicContact CD-CD2 4.27Å; K247-Y392 HydrophobicContact CD-CE2 4.13Å; K247-Y392 HydrophobicContact CG-CD1 4.24Å; K247-Y392 HydrophobicContact CG-CD2 3.82Å; K247-Y392 HydrophobicContact CG-CE1 4.47Å; K247-Y392 HydrophobicContact CG-CE2 4.06Å; K247-Y392 HydrophobicContact CG-CG 3.91Å; I250-Y392 HydrophobicContact CB-CD1 4.37Å; I250-Y392 HydrophobicContact CG2-CD1 4.1Å; K251-Y392 HydrophobicContact CD-CE1 4.26Å; K251-Y392 VanDerWaalsContact CE-CE1 3.42Å; K251-Y392 WeakPolarHBondContact CE-OH 3.32Å; K251-Y392 HydrophobicContact CG-CD1 4.4Å; K251-Y392 HydrophobicContact CG-CE1 3.85Å; G256-Y392 WeakPolarHBondContact O-CA 3.43Å; V257-Y392 HydrophobicContact CG1-CD1 4.37Å; V257-Y392 HydrophobicContact CG1-CE1 4.17Å; V257-Y392 HydrophobicContact CG2-CD1 3.71Å; V257-Y392 HydrophobicContact CG2-CE1 3.92Å; F285-Y392 CarbonylContact C-O 3.37Å; F285-Y392 WeakPolarHBondContact CA-O 3.37Å; F285-Y392 WeakPolarHBondContact CB-O 3.42Å; A286-Y392 PolarHBondContact N-O 3.01Å; A286-Y392 PolarHBondContact O-N 3.41Å; D288-Y392 WeakPolarHBondContact OD1-CE2 3.41Å; D288-Y392 PolarHBondContact OD1-OH 3.18Å; D288-Y392 PolarHBondContact OD2-OH 3.18Å; T390-Y392 HydrophobicContact CG2-CE1 4.49Å; T390-Y392 HydrophobicContact CG2-CE2 3.85Å
393	Y	96.3	Very high	84	Confident	15 Å²	15	46.4 Å²	46.4	6%	0.059	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	157.4	-177.7	82.5	-71.1	0	0	0	111.4	N255 G256 I258 V270 E284 V310 L391 V395	N255-Y393 WeakPolarHBondContact O-CE1 3.38Å; N255-Y393 PolarHBondContact O-OH 3.01Å; G256-Y393 WeakPolarHBondContact CA-O 3.18Å; G256-Y393 WeakPolarHBondContact O-CD1 3.31Å; G256-Y393 PolarHBondContact O-N 2.95Å; I258-Y393 HydrophobicContact CD1-CD1 3.97Å; I258-Y393 HydrophobicContact CD1-CE1 3.19Å; I258-Y393 HydrophobicContact CG1-CD1 4.39Å; I258-Y393 HydrophobicContact CG1-CE1 3.73Å; V270-Y393 HydrophobicContact CB-CE2 4.37Å; V270-Y393 HydrophobicContact CG1-CE2 3.8Å; V270-Y393 HydrophobicContact CG2-CD2 4.37Å; V270-Y393 HydrophobicContact CG2-CE2 3.82Å; E284-Y393 CarbonylContact O-C 3.59Å; E284-Y393 WeakPolarHBondContact O-CA 3.41Å; V310-Y393 WeakPolarHBondContact CG2-OH 3.35Å; L391-Y393 HydrophobicContact CD2-CD1 4.42Å; Y393-V395 HydrophobicContact CD2-CG2 4.16Å; Y393-V395 HydrophobicContact CE2-CG2 4.32Å
394	R	94.4	Very high	84.6	Confident	72 Å²	72	46.3 Å²	46.3	27%	0.272	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	151.6	166.7	59.8	177.7	-177.7	173.4	9.4	110.2	F246 I250 W283 E284 Y396	F246-R394 HydrophobicContact CE2-CG 4.17Å; I250-R394 HydrophobicContact CD1-CB 3.73Å; I250-R394 HydrophobicContact CD1-CG 3.88Å; W283-R394 WeakPolarHBondContact CA-O 3.47Å; E284-R394 HydrophobicContact CB-CG 3.98Å; E284-R394 PolarHBondContact N-O 3.47Å; E284-R394 PolarHBondContact O-N 3.37Å; E284-R394 IonicContact OE1-CZ 3.41Å; E284-R394 IonicContact OE1-NE 3.95Å; E284-R394 IonicContact OE1-NH2 2.97Å; E284-R394 PolarHBondContact OE1-NH2 3.36Å; E284-R394 VanDerWaalsContact OE1-NH2 3.07Å; E284-R394 IonicContact OE2-CZ 2.61Å; E284-R394 IonicContact OE2-NE 3.02Å; E284-R394 PolarHBondContact OE2-NE 3.41Å; E284-R394 IonicContact OE2-NH2 3.68Å; E284-R394 PolarHBondContact OE2-NH2 3.32Å; R394-Y396 HydrophobicContact CG-CE1 4.46Å
395	V	93.5	Very high	85.3	Confident	33 Å²	33	48.5 Å²	48.5	20%	0.2	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	138.8	175.2	-178	0	0	0	0	108.8	V272 I281 F282 W283 L377 Y393	V272-V395 HydrophobicContact CB-CG1 4.41Å; V272-V395 HydrophobicContact CG1-CG1 3.86Å; V272-V395 HydrophobicContact CG2-CB 4.32Å; V272-V395 HydrophobicContact CG2-CG1 3.86Å; V272-V395 HydrophobicContact CG2-CG2 4.3Å; I281-V395 HydrophobicContact CD1-CG1 3.63Å; I281-V395 HydrophobicContact CG1-CG1 3.69Å; F282-V395 WeakPolarHBondContact O-CA 3.14Å; F282-V395 WeakPolarHBondContact O-CG1 3.15Å; W283-V395 HydrophobicContact CB-CG2 4.3Å; L377-V395 HydrophobicContact CD2-CG2 3.62Å; Y393-V395 HydrophobicContact CD2-CG2 4.16Å; Y393-V395 HydrophobicContact CE2-CG2 4.32Å
396	Y	91.6	Very high	86.6	Confident	88 Å²	88	50.2 Å²	50.2	35%	0.345	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	172	177	53.8	-83.7	0	0	0	109.9	F282 E284 R394	F282-Y396 HydrophobicContact CB-CD1 4.23Å; F282-Y396 HydrophobicContact CB-CD2 3.62Å; F282-Y396 HydrophobicContact CB-CE1 3.91Å; F282-Y396 HydrophobicContact CB-CE2 3.26Å; F282-Y396 HydrophobicContact CB-CG 4.09Å; F282-Y396 VanDerWaalsContact CB-CZ 3.41Å; F282-Y396 HydrophobicContact CD1-CE2 4.19Å; F282-Y396 HydrophobicContact CD2-CD2 4.08Å; F282-Y396 AromaticContact CD2-CE2 3.96Å; F282-Y396 HydrophobicContact CD2-CE2 3.96Å; F282-Y396 HydrophobicContact CG-CD2 4.03Å; F282-Y396 AromaticContact CG-CE2 3.55Å; F282-Y396 HydrophobicContact CG-CE2 3.55Å; F282-Y396 PolarHBondContact N-O 3.46Å; F282-Y396 PolarHBondContact O-N 3.18Å; E284-Y396 HydrophobicContact CG-CE1 4.46Å; E284-Y396 PolarHBondContact OE1-OH 2.9Å; R394-Y396 HydrophobicContact CG-CE1 4.46Å
397	Y	89.7	Confident	87.8	Confident	94 Å²	94	53.5 Å²	53.5	37%	0.369	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	151.4	179.8	56.1	-92.9	0	0	0	111.3	H275 C280 Y369 K399	H275-Y397 HydrophobicContact CB-CD1 4.19Å; H275-Y397 HydrophobicContact CB-CD2 3.97Å; H275-Y397 HydrophobicContact CB-CE1 4.1Å; H275-Y397 HydrophobicContact CB-CE2 3.88Å; H275-Y397 HydrophobicContact CB-CG 4.14Å; H275-Y397 AromaticContact CD2-CZ 3.57Å; H275-Y397 PolarHBondContact CD2-OH 3.11Å; H275-Y397 AromaticContact CG-CE2 3.57Å; H275-Y397 AromaticContact CG-CZ 3.56Å; H275-Y397 AromaticContact ND1-CE2 3.65Å; H275-Y397 PolarHBondContact NE2-OH 3.05Å; C280-Y397 WeakPolarHBondContact O-CA 3.12Å; C280-Y397 VanDerWaalsContact O-CB 3.26Å; C280-Y397 WeakPolarHBondContact O-CB 3.48Å; Y369-Y397 WeakPolarHBondContact OH-CB 3.44Å; Y397-K399 HydrophobicContact CE2-CG 4.38Å
398	S	84.2	Confident	88.7	Confident	30 Å²	30	52.6 Å²	52.6	21%	0.21	24%	0.241	C	C	.	.			trans	-74.3	140.4	167.5	49.1	0	0	0	0	109.8	G278 S279 C280	G278-S398 WeakPolarHBondContact CA-O 3.3Å; S279-S398 PolarHBondContact N-O 2.69Å; S279-S398 PolarHBondContact OG-OG 3.41Å; C280-S398 WeakPolarHBondContact CB-OG 3.45Å; C280-S398 PolarHBondContact N-OG 3.19Å; C280-S398 VanDerWaalsContact N-OG 3.12Å; C280-S398 PolarHBondContact O-N 2.85Å; C280-S398 VanDerWaalsContact O-N 3.08Å
399	K	65.6	Low	89.4	Confident	217 Å²	217	55.1 Å²	55.1	94%	0.943	25%	0.247	S	C	*	.			trans	-84.1	0	164.6	-70.9	-175.8	-179.8	178.6	0	111.3	Y397	Y397-K399 HydrophobicContact CE2-CG 4.38Å

Retrieved 399 of 399 residues in 438 ms (Link to these results)

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