A0A077ZEN1_TRITR Loading...

Selenocysteine-specific elongation factor

Translation factor necessary for the incorporation of selenocysteine into proteins. It probably replaces EF-Tu for the insertion of selenocysteine directed by the UGA codon. SelB binds GTP and GDP.

AlphaFold DB , UniProt , Accession A0A077ZEN1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 579 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	60.7	Low	82.7	Confident	201 Å²	201	69.2 Å²	69.2	99%	0.99	37%	0.374	S	S	*	.				0	120.4	0	-178	-174.2	-66.5	0	0	107.2
2	T	69.9	Low	83.5	Confident	52 Å²	52	66.2 Å²	66.2	32%	0.319	36%	0.356	S	S	.	.			trans	-79.2	118	173.6	-58	0	0	0	0	107.7	D4 D22 P24	T2-D4 WeakPolarHBondContact CG2-O 3.38Å; T2-D22 PolarHBondContact OG1-OD2 3.18Å; T2-P24 WeakPolarHBondContact O-CB 3.47Å
3	I	75.3	Confident	83.8	Confident	111 Å²	111	71.6 Å²	71.6	57%	0.569	40%	0.397	S	S	*	.			trans	-91.7	-33.9	-175.5	-61.4	173.8	0	0	0	111.4	F29	I3-F29 HydrophobicContact CG2-CE1 4.16Å; I3-F29 HydrophobicContact CG2-CZ 4.05Å
4	D	80	Confident	84.2	Confident	48 Å²	48	74.8 Å²	74.8	26%	0.257	41%	0.413	S	S	.	.	S	Bend	trans	-139.9	171.5	177.1	-171.7	33.5	0	0	0	108	T2 G6 N32 R146 R217	T2-D4 WeakPolarHBondContact CG2-O 3.38Å; D4-G6 PolarHBondContact O-N 3.32Å; D4-N32 PolarHBondContact OD1-ND2 3.4Å; D4-R146 IonicContact OD2-CZ 3.67Å; D4-R146 IonicContact OD2-NE 2.96Å; D4-R146 IonicContact OD2-NH2 3.83Å; D4-R146 PolarHBondContact OD2-NH2 3.33Å; D4-R217 IonicContact OD1-NH1 3.88Å; D4-R217 PolarHBondContact OD1-NH1 2.91Å; D4-R217 IonicContact OD1-NH2 3.15Å; D4-R217 IonicContact OD2-NH2 3.36Å; D4-R217 PolarHBondContact OD2-NH2 2.83Å
5	L	82.6	Confident	84.3	Confident	5 Å²	5	73.6 Å²	73.6	3%	0.026	43%	0.425	C	S	.	.			trans	-55	129.8	-173.1	-61.9	75.7	0	0	0	112.1	Y7 I21 D22 N32 G36 R146	L5-Y7 HydrophobicContact CB-CE1 4.28Å; L5-Y7 HydrophobicContact CB-CE2 4.5Å; L5-Y7 HydrophobicContact CD2-CE1 4.31Å; L5-I21 HydrophobicContact CB-CG2 4.45Å; L5-I21 HydrophobicContact CD2-CG2 3.88Å; L5-I21 HydrophobicContact CG-CG2 4.46Å; L5-D22 WeakPolarHBondContact CA-O 3.29Å; L5-N32 HydrophobicContact CD1-CB 3.87Å; L5-N32 WeakPolarHBondContact CD1-O 3.38Å; L5-G36 VanDerWaalsContact CD2-CA 3.41Å; L5-R146 PolarHBondContact O-NH2 2.85Å
6	G	85.6	Confident	84.5	Confident	27 Å²	27	73.9 Å²	73.9	28%	0.278	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	141.8	167.2	0	0	0	0	0	110.1	D4 I21 D22	D4-G6 PolarHBondContact O-N 3.32Å; G6-I21 CarbonylContact O-C 3.54Å; G6-I21 WeakPolarHBondContact O-CA 3.49Å; G6-D22 PolarHBondContact N-O 3.46Å; G6-D22 PolarHBondContact O-N 3.04Å
7	Y	88.1	Confident	84.8	Confident	56 Å²	56	70 Å²	70	22%	0.22	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.6	174.4	-56	-67.7	0	0	0	109.3	L5 F20 I21 D145 R201	L5-Y7 HydrophobicContact CB-CE1 4.28Å; L5-Y7 HydrophobicContact CB-CE2 4.5Å; L5-Y7 HydrophobicContact CD2-CE1 4.31Å; Y7-F20 WeakPolarHBondContact CA-O 3.36Å; Y7-I21 HydrophobicContact CD1-CG1 4.07Å; Y7-I21 HydrophobicContact CD1-CG2 4.29Å; Y7-I21 HydrophobicContact CE1-CD1 4.45Å; Y7-I21 HydrophobicContact CE1-CG1 4.17Å; Y7-I21 HydrophobicContact CE1-CG2 4Å; Y7-D145 PolarHBondContact OH-OD1 3.1Å; Y7-R201 PolarHBondContact OH-NH2 2.84Å; Y7-R201 VanDerWaalsContact OH-NH2 3.11Å
8	A	91.5	Very high	85.2	Confident	55 Å²	55	67.5 Å²	67.5	46%	0.455	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.6	172.4	0	0	0	0	0	109.5	F20	A8-F20 HydrophobicContact CB-CB 4.17Å; A8-F20 PolarHBondContact N-O 2.73Å; A8-F20 PolarHBondContact O-N 2.62Å
9	Y	92.1	Very high	85.4	Confident	52 Å²	52	66.1 Å²	66.1	20%	0.204	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	142.4	-177.9	-61	-77.5	0	0	0	108.6	P11 V17 Q189 N190 R201	Y9-P11 WeakPolarHBondContact O-CD 3.39Å; Y9-V17 HydrophobicContact CD1-CG1 4.31Å; Y9-V17 HydrophobicContact CG-CG1 4.47Å; Y9-Q189 HydrophobicContact CD1-CB 3.59Å; Y9-Q189 HydrophobicContact CD1-CG 4.06Å; Y9-Q189 HydrophobicContact CE1-CB 3.57Å; Y9-Q189 HydrophobicContact CE1-CG 3.74Å; Y9-Q189 HydrophobicContact CG-CB 4.46Å; Y9-N190 HydrophobicContact CD2-CB 4.15Å; Y9-N190 WeakPolarHBondContact CD2-ND2 3.2Å; Y9-N190 HydrophobicContact CE2-CB 4.34Å; Y9-N190 WeakPolarHBondContact CE2-ND2 3.19Å; Y9-R201 HydrophobicContact CE1-CB 4.49Å; Y9-R201 WeakPolarHBondContact OH-CB 3.36Å
10	W	92.5	Very high	85.7	Confident	74 Å²	74	66.4 Å²	66.4	28%	0.28	38%	0.38	S	S	.	.			trans	-123.9	77.4	-176.3	-176.4	40.4	0	0	0	111.6	Q12 P18 F20 R123 L127	W10-Q12 VanDerWaalsContact CZ2-NE2 3.3Å; W10-Q12 VanDerWaalsContact NE1-NE2 3.19Å; W10-Q12 PolarHBondContact O-N 3.38Å; W10-Q12 PolarHBondContact O-NE2 2.99Å; W10-P18 HydrophobicContact CE3-CB 4.48Å; W10-P18 HydrophobicContact CE3-CG 4.11Å; W10-P18 PolarHBondContact N-O 2.99Å; W10-P18 VanDerWaalsContact N-O 3.1Å; W10-P18 VanDerWaalsContact O-CD 3.31Å; W10-P18 WeakPolarHBondContact O-CD 3.37Å; W10-F20 HydrophobicContact CB-CD2 4.48Å; W10-F20 HydrophobicContact CB-CE2 3.78Å; W10-R123 HydrophobicContact CH2-CB 4.08Å; W10-R123 HydrophobicContact CH2-CG 4.06Å; W10-R123 HydrophobicContact CZ2-CG 4.24Å; W10-L127 HydrophobicContact CE3-CD2 4.46Å; W10-L127 HydrophobicContact CH2-CD1 4.08Å; W10-L127 HydrophobicContact CH2-CD2 3.89Å; W10-L127 HydrophobicContact CH2-CG 3.98Å; W10-L127 HydrophobicContact CZ3-CD2 3.56Å; W10-L127 HydrophobicContact CZ3-CG 3.93Å
11	P	91.8	Very high	85.9	Confident	80 Å²	80	65.7 Å²	65.7	52%	0.519	38%	0.375	S	S	.	.			trans	-56.9	129	-178.5	-23	33.2	0	0	0	112.3	Y9 V17	Y9-P11 WeakPolarHBondContact O-CD 3.39Å; P11-V17 HydrophobicContact CB-CG2 4.31Å; P11-V17 HydrophobicContact CG-CG1 4.24Å
12	Q	91.5	Very high	87.3	Confident	33 Å²	33	60.2 Å²	60.2	15%	0.154	35%	0.349	C	S	.	.			trans	-103.7	154.7	178.5	-68	-46	-72.2	0	0	112.3	W10 D14 G15 R16 L127	W10-Q12 VanDerWaalsContact CZ2-NE2 3.3Å; W10-Q12 VanDerWaalsContact NE1-NE2 3.19Å; W10-Q12 PolarHBondContact O-N 3.38Å; W10-Q12 PolarHBondContact O-NE2 2.99Å; Q12-D14 WeakPolarHBondContact CB-OD1 3.41Å; Q12-D14 PolarHBondContact O-N 3.2Å; Q12-G15 PolarHBondContact O-N 3.34Å; Q12-R16 WeakPolarHBondContact CB-O 3.38Å; Q12-R16 PolarHBondContact N-O 2.8Å; Q12-L127 HydrophobicContact CG-CD2 3.69Å
13	P	88.1	Confident	88.1	Confident	137 Å²	137	59.7 Å²	59.7	89%	0.89	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20	173.9	-23.7	34.7	0	0	0	114.8	G15	P13-G15 PolarHBondContact O-N 3.04Å
14	D	89.1	Confident	88.6	Confident	116 Å²	116	54.6 Å²	54.6	62%	0.62	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-5.2	175	67.9	-0.2	0	0	0	113.2	Q12 R16	Q12-D14 WeakPolarHBondContact CB-OD1 3.41Å; Q12-D14 PolarHBondContact O-N 3.2Å; D14-R16 WeakPolarHBondContact OD1-CB 3.46Å; D14-R16 PolarHBondContact OD1-N 3.18Å
15	G	86.1	Confident	88.4	Confident	57 Å²	57	53.5 Å²	53.5	59%	0.588	32%	0.321	S	S	*	.	S	Bend	trans	92.1	-13	-178.7	0	0	0	0	0	114.4	Q12 P13	Q12-G15 PolarHBondContact O-N 3.34Å; P13-G15 PolarHBondContact O-N 3.04Å
16	R	87.2	Confident	88.1	Confident	78 Å²	78	57.4 Å²	57.4	29%	0.294	34%	0.338	S	S	.	.			trans	-75.6	147.3	177.1	-166.7	174.6	-173.2	-154.5	-6.1	110.3	Q12 D14 L129 E131	Q12-R16 WeakPolarHBondContact CB-O 3.38Å; Q12-R16 PolarHBondContact N-O 2.8Å; D14-R16 WeakPolarHBondContact OD1-CB 3.46Å; D14-R16 PolarHBondContact OD1-N 3.18Å; R16-L129 PolarHBondContact NH1-O 3.44Å; R16-E131 IonicContact CZ-OE2 2.99Å; R16-E131 IonicContact NE-OE2 3.9Å; R16-E131 PolarHBondContact NE-OE2 2.78Å; R16-E131 IonicContact NH2-OE2 2.62Å; R16-E131 PolarHBondContact NH2-OE2 2.93Å; R16-E131 VanDerWaalsContact NH2-OE2 3.15Å
17	V	90.3	Very high	87.5	Confident	8 Å²	8	61 Å²	61	5%	0.048	35%	0.348	C	S	.	.			trans	-126.9	94.7	176.1	-171.8	0	0	0	0	109.8	Y9 P11 G19 Q189	Y9-V17 HydrophobicContact CD1-CG1 4.31Å; Y9-V17 HydrophobicContact CG-CG1 4.47Å; P11-V17 HydrophobicContact CB-CG2 4.31Å; P11-V17 HydrophobicContact CG-CG1 4.24Å; V17-G19 PolarHBondContact O-N 3.04Å; V17-Q189 HydrophobicContact CB-CB 4.43Å; V17-Q189 HydrophobicContact CG1-CB 4.23Å; V17-Q189 PolarHBondContact O-NE2 3.47Å; V17-Q189 VanDerWaalsContact O-NE2 3.14Å; V17-Q189 PolarHBondContact O-OE1 3.35Å
18	P	91.1	Very high	86.9	Confident	25 Å²	25	66.5 Å²	66.5	16%	0.162	37%	0.373	C	S	.	.			trans	-56.3	124.8	168.6	-27.7	36.6	0	0	0	111.2	W10 F20	W10-P18 HydrophobicContact CE3-CB 4.48Å; W10-P18 HydrophobicContact CE3-CG 4.11Å; W10-P18 PolarHBondContact N-O 2.99Å; W10-P18 VanDerWaalsContact N-O 3.1Å; W10-P18 VanDerWaalsContact O-CD 3.31Å; W10-P18 WeakPolarHBondContact O-CD 3.37Å; P18-F20 HydrophobicContact CB-CE2 3.98Å; P18-F20 HydrophobicContact CB-CZ 4.38Å
19	G	89.8	Confident	86.3	Confident	40 Å²	40	66.4 Å²	66.4	41%	0.412	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	128.4	174.8	0	0	0	0	0	111.1	V17	V17-G19 PolarHBondContact O-N 3.04Å
20	F	91.3	Very high	85.7	Confident	73 Å²	73	64 Å²	64	32%	0.32	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.1	177.3	-65.4	-91.6	0	0	0	109.9	Y7 A8 W10 P18 L126	Y7-F20 WeakPolarHBondContact CA-O 3.36Å; A8-F20 HydrophobicContact CB-CB 4.17Å; A8-F20 PolarHBondContact N-O 2.73Å; A8-F20 PolarHBondContact O-N 2.62Å; W10-F20 HydrophobicContact CB-CD2 4.48Å; W10-F20 HydrophobicContact CB-CE2 3.78Å; P18-F20 HydrophobicContact CB-CE2 3.98Å; P18-F20 HydrophobicContact CB-CZ 4.38Å; F20-L126 HydrophobicContact CE1-CD1 4.12Å; F20-L126 HydrophobicContact CZ-CD1 4.09Å
21	I	89.6	Confident	85.1	Confident	51 Å²	51	63 Å²	63	26%	0.262	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	106.4	174	-52.7	179.9	0	0	0	107.4	L5 G6 Y7 V23	L5-I21 HydrophobicContact CB-CG2 4.45Å; L5-I21 HydrophobicContact CD2-CG2 3.88Å; L5-I21 HydrophobicContact CG-CG2 4.46Å; G6-I21 CarbonylContact O-C 3.54Å; G6-I21 WeakPolarHBondContact O-CA 3.49Å; Y7-I21 HydrophobicContact CD1-CG1 4.07Å; Y7-I21 HydrophobicContact CD1-CG2 4.29Å; Y7-I21 HydrophobicContact CE1-CD1 4.45Å; Y7-I21 HydrophobicContact CE1-CG1 4.17Å; Y7-I21 HydrophobicContact CE1-CG2 4Å; I21-V23 HydrophobicContact CG2-CG1 3.93Å
22	D	90.8	Very high	84.6	Confident	86 Å²	86	60.9 Å²	60.9	46%	0.46	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.2	172	-178	31.6	0	0	0	109	T2 L5 G6	T2-D22 PolarHBondContact OG1-OD2 3.18Å; L5-D22 WeakPolarHBondContact CA-O 3.29Å; G6-D22 PolarHBondContact N-O 3.46Å; G6-D22 PolarHBondContact O-N 3.04Å
23	V	86.7	Confident	84.3	Confident	42 Å²	42	59.7 Å²	59.7	26%	0.255	34%	0.336	S	S	.	.			trans	-109.2	142.7	-174.8	-64.8	0	0	0	0	111.3	I21 M33	I21-V23 HydrophobicContact CG2-CG1 3.93Å; V23-M33 HydrophobicContact CB-CB 4.17Å; V23-M33 HydrophobicContact CB-CG 3.75Å; V23-M33 HydrophobicContact CG1-CG 4.05Å; V23-M33 HydrophobicContact CG2-CG 3.89Å; V23-M33 HydrophobicContact CG2-SD 4.18Å
24	P	84.9	Confident	83.9	Confident	3 Å²	3	53.5 Å²	53.5	2%	0.019	30%	0.296	C	S	.	.			trans	-70.9	134.3	178.5	30.3	-35.2	0	0	0	111	T2 F29 N32	T2-P24 WeakPolarHBondContact O-CB 3.47Å; P24-F29 HydrophobicContact CB-CB 3.65Å; P24-F29 HydrophobicContact CB-CD2 4.16Å; P24-F29 HydrophobicContact CB-CG 4.28Å; P24-F29 HydrophobicContact CG-CB 3.5Å; P24-F29 HydrophobicContact CG-CG 4.48Å; P24-N32 HydrophobicContact CG-CB 4.26Å
25	G	76.7	Confident	83.4	Confident	26 Å²	26	48.4 Å²	48.4	27%	0.268	27%	0.27	S	S	.	.			trans	-89	-5.2	179.5	0	0	0	0	0	115.9	Q56	G25-Q56 WeakPolarHBondContact O-CG 3.45Å; G25-Q56 PolarHBondContact O-NE2 3.34Å; G25-Q56 PolarHBondContact O-OE1 2.85Å; G25-Q56 VanDerWaalsContact O-OE1 3.13Å
26	H	76	Confident	82.8	Confident	86 Å²	86	45.8 Å²	45.8	40%	0.398	24%	0.243	S	C	.	.	S	Bend	trans	-82.6	135.8	-177.9	-165.2	-46.5	0	0	0	110.9	K28 F29	H26-K28 PolarHBondContact ND1-N 2.86Å; H26-K28 PolarHBondContact O-N 3.5Å; H26-F29 HydrophobicContact CB-CD2 3.93Å; H26-F29 HydrophobicContact CB-CE2 4.43Å; H26-F29 WeakPolarHBondContact O-CA 3.33Å; H26-F29 PolarHBondContact O-N 3.28Å
27	E	72.2	Confident	82.3	Confident	104 Å²	104	43 Å²	43	49%	0.486	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-46.9	-40.5	-178.9	-62.8	171.6	-171.3	0	0	114.5	F29 L30	E27-F29 PolarHBondContact O-N 3.42Å; E27-L30 WeakPolarHBondContact O-CB 3.46Å; E27-L30 PolarHBondContact O-N 3.19Å
28	K	75.3	Confident	81.4	Confident	170 Å²	170	43.6 Å²	43.6	74%	0.739	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-62.3	-21.5	177.7	-70.3	-174.7	177.6	-179.6	0	114.2	H26	H26-K28 PolarHBondContact ND1-N 2.86Å; H26-K28 PolarHBondContact O-N 3.5Å
29	F	80.1	Confident	80.7	Confident	54 Å²	54	44.2 Å²	44.2	24%	0.237	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-109.4	11.4	-178.3	-54.9	-50.3	0	0	0	112.6	I3 P24 H26 E27 S31 N32 M33	I3-F29 HydrophobicContact CG2-CE1 4.16Å; I3-F29 HydrophobicContact CG2-CZ 4.05Å; P24-F29 HydrophobicContact CB-CB 3.65Å; P24-F29 HydrophobicContact CB-CD2 4.16Å; P24-F29 HydrophobicContact CB-CG 4.28Å; P24-F29 HydrophobicContact CG-CB 3.5Å; P24-F29 HydrophobicContact CG-CG 4.48Å; H26-F29 HydrophobicContact CB-CD2 3.93Å; H26-F29 HydrophobicContact CB-CE2 4.43Å; H26-F29 WeakPolarHBondContact O-CA 3.33Å; H26-F29 PolarHBondContact O-N 3.28Å; E27-F29 PolarHBondContact O-N 3.42Å; F29-S31 PolarHBondContact O-N 3.02Å; F29-N32 WeakPolarHBondContact O-CA 3.4Å; F29-N32 VanDerWaalsContact O-CB 3.31Å; F29-N32 WeakPolarHBondContact O-CB 3.41Å; F29-N32 PolarHBondContact O-N 3.01Å; F29-M33 PolarHBondContact O-N 3.03Å; F29-M33 VanDerWaalsContact O-N 3.11Å
30	L	79.5	Confident	80.3	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-62.3	-32.6	179.6	-163	82	0	0	0	112.5	E27 N32 M33 L34 I63	E27-L30 WeakPolarHBondContact O-CB 3.46Å; E27-L30 PolarHBondContact O-N 3.19Å; L30-N32 PolarHBondContact O-N 3.3Å; L30-M33 HydrophobicContact CD1-CE 3.46Å; L30-M33 VanDerWaalsContact CD1-CE 3.46Å; L30-M33 HydrophobicContact CD1-SD 4.06Å; L30-M33 HydrophobicContact CG-CE 4.22Å; L30-M33 WeakPolarHBondContact O-CB 3.19Å; L30-M33 PolarHBondContact O-N 3.44Å; L30-M33 VanDerWaalsContact O-N 3.15Å; L30-L34 HydrophobicContact CD2-CD1 4.26Å; L30-L34 HydrophobicContact CG-CD1 4.28Å; L30-L34 HydrophobicContact CG-CG 4.48Å; L30-L34 VanDerWaalsContact O-CG 3.3Å; L30-L34 WeakPolarHBondContact O-CG 3.29Å; L30-L34 PolarHBondContact O-N 2.97Å; L30-I63 HydrophobicContact CD1-CD1 3.73Å; L30-I63 HydrophobicContact CD2-CD1 3.85Å; L30-I63 HydrophobicContact CG-CD1 4.12Å
31	S	79	Confident	79.9	Confident	54 Å²	54	42.8 Å²	42.8	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-58.1	-37.5	172.9	52.9	0	0	0	0	112.2	F29 L34 A35	F29-S31 PolarHBondContact O-N 3.02Å; S31-L34 PolarHBondContact O-N 3.11Å; S31-A35 PolarHBondContact O-N 2.8Å
32	N	82.1	Confident	80	Confident	35 Å²	35	42 Å²	42	19%	0.187	23%	0.234	C	C	.	.	H	α-helix	trans	-69.9	-44.7	174.7	-68.2	-22.1	0	0	0	110.5	D4 L5 P24 F29 L30 L34 A35 G36 R217	D4-N32 PolarHBondContact OD1-ND2 3.4Å; L5-N32 HydrophobicContact CD1-CB 3.87Å; L5-N32 WeakPolarHBondContact CD1-O 3.38Å; P24-N32 HydrophobicContact CG-CB 4.26Å; F29-N32 WeakPolarHBondContact O-CA 3.4Å; F29-N32 VanDerWaalsContact O-CB 3.31Å; F29-N32 WeakPolarHBondContact O-CB 3.41Å; F29-N32 PolarHBondContact O-N 3.01Å; L30-N32 PolarHBondContact O-N 3.3Å; N32-L34 VanDerWaalsContact C-N 3.28Å; N32-L34 PolarHBondContact O-N 3.02Å; N32-A35 VanDerWaalsContact O-CB 3.28Å; N32-A35 WeakPolarHBondContact O-CB 3.43Å; N32-A35 PolarHBondContact O-N 3.22Å; N32-G36 PolarHBondContact O-N 3.15Å; N32-R217 PolarHBondContact OD1-NH1 2.8Å
33	M	83.6	Confident	80.1	Confident	7 Å²	7	38.4 Å²	38.4	3%	0.034	22%	0.216	C	C	.	.	H	α-helix	trans	-55	-45.9	173.3	-179.1	-175.2	90.1	0	0	111.6	V23 F29 L30 A35 G36 V37 H60 I63	V23-M33 HydrophobicContact CB-CB 4.17Å; V23-M33 HydrophobicContact CB-CG 3.75Å; V23-M33 HydrophobicContact CG1-CG 4.05Å; V23-M33 HydrophobicContact CG2-CG 3.89Å; V23-M33 HydrophobicContact CG2-SD 4.18Å; F29-M33 PolarHBondContact O-N 3.03Å; F29-M33 VanDerWaalsContact O-N 3.11Å; L30-M33 HydrophobicContact CD1-CE 3.46Å; L30-M33 VanDerWaalsContact CD1-CE 3.46Å; L30-M33 HydrophobicContact CD1-SD 4.06Å; L30-M33 HydrophobicContact CG-CE 4.22Å; L30-M33 WeakPolarHBondContact O-CB 3.19Å; L30-M33 PolarHBondContact O-N 3.44Å; L30-M33 VanDerWaalsContact O-N 3.15Å; M33-A35 PolarHBondContact O-N 3.3Å; M33-A35 VanDerWaalsContact O-N 3.16Å; M33-G36 WeakPolarHBondContact O-CA 3.44Å; M33-G36 PolarHBondContact O-N 3.48Å; M33-V37 HydrophobicContact CG-CG1 4.22Å; M33-V37 WeakPolarHBondContact O-CG1 3.31Å; M33-V37 PolarHBondContact O-N 3.4Å; M33-V37 VanDerWaalsContact O-N 3.16Å; M33-H60 VanDerWaalsContact SD-CD2 3.54Å; M33-H60 PolarHBondContact SD-NE2 2.86Å; M33-H60 VanDerWaalsContact SD-NE2 3.41Å; M33-I63 HydrophobicContact CE-CB 4.18Å; M33-I63 HydrophobicContact CE-CD1 3.39Å; M33-I63 HydrophobicContact CE-CG1 4.36Å; M33-I63 HydrophobicContact CE-CG2 3.85Å
34	L	81.2	Confident	80.4	Confident	8 Å²	8	39.7 Å²	39.7	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-64.3	-18.5	179.9	-69.3	167.2	0	0	0	113.4	L30 S31 N32 V37 I63 H252 V287	L30-L34 HydrophobicContact CD2-CD1 4.26Å; L30-L34 HydrophobicContact CG-CD1 4.28Å; L30-L34 HydrophobicContact CG-CG 4.48Å; L30-L34 VanDerWaalsContact O-CG 3.3Å; L30-L34 WeakPolarHBondContact O-CG 3.29Å; L30-L34 PolarHBondContact O-N 2.97Å; S31-L34 PolarHBondContact O-N 3.11Å; N32-L34 VanDerWaalsContact C-N 3.28Å; N32-L34 PolarHBondContact O-N 3.02Å; L34-V37 HydrophobicContact CD2-CG2 4.22Å; L34-V37 WeakPolarHBondContact O-CG2 3.35Å; L34-I63 HydrophobicContact CD2-CD1 4.49Å; L34-I63 HydrophobicContact CD2-CG2 3.71Å; L34-H252 HydrophobicContact CB-CB 4.22Å; L34-H252 HydrophobicContact CD1-CB 3.63Å; L34-H252 HydrophobicContact CG-CB 4.36Å; L34-V287 HydrophobicContact CD2-CB 4.13Å; L34-V287 HydrophobicContact CD2-CG1 4.4Å; L34-V287 HydrophobicContact CD2-CG2 3.92Å
35	A	77.1	Confident	80.9	Confident	9 Å²	9	40.2 Å²	40.2	7%	0.074	22%	0.223	C	C	.	.	H	α-helix	trans	-73.3	-31.1	168.9	0	0	0	0	0	112.8	S31 N32 M33 A255	S31-A35 PolarHBondContact O-N 2.8Å; N32-A35 VanDerWaalsContact O-CB 3.28Å; N32-A35 WeakPolarHBondContact O-CB 3.43Å; N32-A35 PolarHBondContact O-N 3.22Å; M33-A35 PolarHBondContact O-N 3.3Å; M33-A35 VanDerWaalsContact O-N 3.16Å; A35-A255 HydrophobicContact CB-CB 3.6Å
36	G	74.3	Confident	81.8	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-89.6	-16.3	-177.6	0	0	0	0	0	114.9	L5 N32 M33 G38	L5-G36 VanDerWaalsContact CD2-CA 3.41Å; N32-G36 PolarHBondContact O-N 3.15Å; M33-G36 WeakPolarHBondContact O-CA 3.44Å; M33-G36 PolarHBondContact O-N 3.48Å; G36-G38 VanDerWaalsContact C-N 3.27Å; G36-G38 PolarHBondContact O-N 3.34Å
37	V	76.9	Confident	82.8	Confident	20 Å²	20	38.9 Å²	38.9	12%	0.121	22%	0.216	C	C	.	.	S	Bend	trans	-75.9	-14.5	-179.6	-60	0	0	0	0	114	M33 L34 G39 I40 T67	M33-V37 HydrophobicContact CG-CG1 4.22Å; M33-V37 WeakPolarHBondContact O-CG1 3.31Å; M33-V37 PolarHBondContact O-N 3.4Å; M33-V37 VanDerWaalsContact O-N 3.16Å; L34-V37 HydrophobicContact CD2-CG2 4.22Å; L34-V37 WeakPolarHBondContact O-CG2 3.35Å; V37-G39 PolarHBondContact O-N 3.18Å; V37-I40 HydrophobicContact CB-CD1 4.14Å; V37-I40 HydrophobicContact CG1-CD1 4.23Å; V37-T67 HydrophobicContact CG2-CG2 4.11Å
38	G	72.1	Confident	83.9	Confident	19 Å²	19	35 Å²	35	20%	0.196	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	121.3	176.1	0	0	0	0	0	111.1	G36	G36-G38 VanDerWaalsContact C-N 3.27Å; G36-G38 PolarHBondContact O-N 3.34Å
39	G	74.6	Confident	84.9	Confident	38 Å²	38	26.9 Å²	26.9	39%	0.392	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.9	21.9	177.1	0	0	0	0	0	115.1	V37 D41	V37-G39 PolarHBondContact O-N 3.18Å; G39-D41 PolarHBondContact O-N 3.35Å
40	I	81.9	Confident	85.6	Confident	40 Å²	40	26.9 Å²	26.9	21%	0.205	17%	0.169	C	C	.	.			trans	-71.8	123.9	173.1	-67.1	-178.7	0	0	0	110.2	V37 H42 A43	V37-I40 HydrophobicContact CB-CD1 4.14Å; V37-I40 HydrophobicContact CG1-CD1 4.23Å; I40-H42 VanDerWaalsContact CG2-C 3.4Å; I40-H42 WeakPolarHBondContact CG2-O 3.5Å; I40-A43 HydrophobicContact CG2-CB 4.47Å
41	D	83.4	Confident	86.2	Confident	43 Å²	43	31.5 Å²	31.5	23%	0.23	19%	0.193	C	C	.	.	S	Bend	trans	-75.7	-44.1	168.8	-65.7	-31.3	0	0	0	111.7	G39 R132	G39-D41 PolarHBondContact O-N 3.35Å; D41-R132 HydrophobicContact CB-CG 4.41Å; D41-R132 VanDerWaalsContact OD1-CB 3.31Å; D41-R132 WeakPolarHBondContact OD1-CB 3.46Å; D41-R132 WeakPolarHBondContact OD1-CD 3.02Å; D41-R132 VanDerWaalsContact OD1-CG 3.27Å; D41-R132 WeakPolarHBondContact OD1-CG 3.41Å
42	H	91	Very high	87	Confident	36 Å²	36	29 Å²	29	17%	0.167	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	138.4	-175.6	-171	86.9	0	0	0	111.9	I40 M71 L72 T73 L129	I40-H42 VanDerWaalsContact CG2-C 3.4Å; I40-H42 WeakPolarHBondContact CG2-O 3.5Å; H42-M71 WeakPolarHBondContact CA-O 3.32Å; H42-M71 WeakPolarHBondContact ND1-CB 3.32Å; H42-M71 PolarHBondContact ND1-O 3.25Å; H42-M71 VanDerWaalsContact ND1-O 3.13Å; H42-L72 VanDerWaalsContact CE1-C 3.43Å; H42-T73 PolarHBondContact CE1-OG1 3.24Å; H42-T73 WeakPolarHBondContact NE2-CB 3.47Å; H42-T73 PolarHBondContact NE2-N 3.42Å; H42-T73 PolarHBondContact NE2-OG1 3.26Å; H42-L129 HydrophobicContact CB-CD1 3.91Å; H42-L129 WeakPolarHBondContact CD2-CD1 3.23Å; H42-L129 VanDerWaalsContact CE1-CD2 3.47Å; H42-L129 WeakPolarHBondContact CE1-CD2 3.5Å; H42-L129 VanDerWaalsContact CG-CD1 3.46Å; H42-L129 WeakPolarHBondContact ND1-CD2 3.43Å
43	A	92.5	Very high	87.6	Confident	9 Å²	9	28.1 Å²	28.1	7%	0.074	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.6	-180	0	0	0	0	0	112.3	I40 L64 P70 M71 L72 T73	I40-A43 HydrophobicContact CG2-CB 4.47Å; A43-L64 HydrophobicContact CB-CD1 3.64Å; A43-L64 HydrophobicContact CB-CD2 3.87Å; A43-L64 HydrophobicContact CB-CG 4.41Å; A43-P70 HydrophobicContact CB-CG 4.48Å; A43-M71 PolarHBondContact N-O 3.47Å; A43-L72 HydrophobicContact CB-CB 4.29Å; A43-L72 CarbonylContact O-C 3.56Å; A43-L72 WeakPolarHBondContact O-CA 3.2Å; A43-T73 PolarHBondContact O-N 2.98Å
44	L	94.6	Very high	88	Confident	70 Å²	70	32.1 Å²	32.1	37%	0.366	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	110.2	172	-165.7	71.1	0	0	0	109.8	T73 V75 L122	L44-T73 WeakPolarHBondContact CA-O 3.39Å; L44-T73 HydrophobicContact CD1-CG2 3.76Å; L44-V75 HydrophobicContact CD1-CG2 3.38Å; L44-V75 HydrophobicContact CD2-CG2 4.08Å; L44-V75 HydrophobicContact CG-CG2 3.82Å; L44-L122 HydrophobicContact CD1-CD1 4.22Å
45	L	94.8	Very high	88.4	Confident	13 Å²	13	35.6 Å²	35.6	7%	0.068	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	111.7	178.8	-169.5	71.5	0	0	0	110.3	V47 T57 H60 L61 T73 V74 V75	L45-V47 HydrophobicContact CD2-CG2 4.47Å; L45-V47 HydrophobicContact CG-CG2 4.38Å; L45-T57 HydrophobicContact CD1-CG2 4.17Å; L45-T57 HydrophobicContact CD2-CG2 3.68Å; L45-T57 HydrophobicContact CG-CG2 4.05Å; L45-H60 HydrophobicContact CD1-CB 4.2Å; L45-L61 HydrophobicContact CD2-CD1 3.88Å; L45-L61 HydrophobicContact CD2-CD2 3.61Å; L45-L61 HydrophobicContact CD2-CG 3.58Å; L45-T73 PolarHBondContact N-O 3.41Å; L45-V74 HydrophobicContact CB-CG2 4.47Å; L45-V74 WeakPolarHBondContact O-CA 2.75Å; L45-V75 PolarHBondContact O-N 3.33Å
46	V	95.5	Very high	88.9	Confident	82 Å²	82	38.9 Å²	38.9	50%	0.497	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.3	178.9	-176.5	0	0	0	0	109.9	V75 T77	V46-V75 WeakPolarHBondContact CA-O 2.89Å; V46-T77 HydrophobicContact CG1-CG2 3.49Å; V46-T77 VanDerWaalsContact CG1-CG2 3.49Å
47	V	96.5	Very high	89.8	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.018	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	131.2	178.2	-176.8	0	0	0	0	108.1	L45 G52 V53 T57 V74 V75 L76 T77 V90 V94	L45-V47 HydrophobicContact CD2-CG2 4.47Å; L45-V47 HydrophobicContact CG-CG2 4.38Å; V47-G52 VanDerWaalsContact CG1-O 3.31Å; V47-G52 WeakPolarHBondContact CG1-O 3.21Å; V47-V53 HydrophobicContact CG1-CG2 4.38Å; V47-T57 HydrophobicContact CG2-CG2 3.83Å; V47-V74 HydrophobicContact CG2-CG1 3.95Å; V47-V75 PolarHBondContact N-O 3.45Å; V47-L76 HydrophobicContact CB-CD2 3.94Å; V47-L76 HydrophobicContact CG1-CD2 4.32Å; V47-L76 CarbonylContact O-C 3.41Å; V47-L76 VanDerWaalsContact O-CA 3.29Å; V47-L76 WeakPolarHBondContact O-CA 3.39Å; V47-T77 PolarHBondContact O-N 3.08Å; V47-T77 PolarHBondContact O-OG1 3.11Å; V47-V90 HydrophobicContact CG1-CG1 4.41Å; V47-V94 HydrophobicContact CG1-CG2 4.35Å
48	A	96.2	Very high	90.5	Very high	21 Å²	21	42.4 Å²	42.4	17%	0.174	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	133	178.2	0	0	0	0	0	110.2	D50 G52 T77 K78	A48-D50 VanDerWaalsContact C-N 3.25Å; A48-D50 WeakPolarHBondContact CB-OD1 3.14Å; A48-D50 PolarHBondContact O-N 3.41Å; A48-G52 WeakPolarHBondContact O-CA 3.37Å; A48-G52 PolarHBondContact O-N 3.36Å; A48-T77 WeakPolarHBondContact CA-OG1 3.41Å; A48-K78 HydrophobicContact CB-CD 3.93Å; A48-K78 HydrophobicContact CB-CG 4.25Å
49	C	96.2	Very high	91.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-20.2	-177	-63.5	0	0	0	0	113.9	T77 V82 R86	C49-T77 PolarHBondContact N-O 3.34Å; C49-T77 PolarHBondContact SG-O 3.22Å; C49-T77 VanDerWaalsContact SG-O 3.34Å; C49-V82 HydrophobicContact CB-CG1 4.45Å; C49-V82 HydrophobicContact CB-CG2 3.61Å; C49-R86 PolarHBondContact O-NE 2.88Å; C49-R86 VanDerWaalsContact O-NE 3.11Å
50	D	94.1	Very high	92	Very high	55 Å²	55	42.3 Å²	42.3	29%	0.294	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-54.4	176.5	55.8	-9.8	0	0	0	110.9	A48 K78 V82 R86	A48-D50 VanDerWaalsContact C-N 3.25Å; A48-D50 WeakPolarHBondContact CB-OD1 3.14Å; A48-D50 PolarHBondContact O-N 3.41Å; D50-K78 WeakPolarHBondContact OD1-CD 3.44Å; D50-K78 IonicContact OD1-NZ 2.73Å; D50-K78 PolarHBondContact OD1-NZ 2.87Å; D50-K78 WeakPolarHBondContact OD2-CD 3.45Å; D50-K78 IonicContact OD2-NZ 3.29Å; D50-K78 PolarHBondContact OD2-NZ 2.94Å; D50-V82 HydrophobicContact CB-CG1 4.21Å; D50-R86 PolarHBondContact O-NH2 2.85Å
51	D	93.5	Very high	92.4	Very high	97 Å²	97	40.5 Å²	40.5	52%	0.519	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-23.8	-178.9	-66.6	-32.9	0	0	0	113.2	M54	D51-M54 HydrophobicContact CB-CE 4.48Å; D51-M54 HydrophobicContact CB-CG 4.06Å; D51-M54 HydrophobicContact CB-SD 3.83Å
52	G	94.3	Very high	92.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.01	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	69.8	-150.7	-171.6	0	0	0	0	0	112	V47 A48 M54	V47-G52 VanDerWaalsContact CG1-O 3.31Å; V47-G52 WeakPolarHBondContact CG1-O 3.21Å; A48-G52 WeakPolarHBondContact O-CA 3.37Å; A48-G52 PolarHBondContact O-N 3.36Å; G52-M54 PolarHBondContact O-N 3.33Å
53	V	94.9	Very high	92.6	Very high	17 Å²	17	37.2 Å²	37.2	10%	0.103	21%	0.207	C	C	.	.	S	Bend	trans	-77.5	115.3	-178.3	-167.9	0	0	0	0	110.2	V47 T57 R58 V94 V97	V47-V53 HydrophobicContact CG1-CG2 4.38Å; V53-T57 HydrophobicContact CG1-CG2 3.76Å; V53-R58 VanDerWaalsContact C-NH1 3.32Å; V53-R58 HydrophobicContact CG1-CG 4.26Å; V53-R58 PolarHBondContact O-NH1 2.99Å; V53-V94 HydrophobicContact CG2-CG2 3.51Å; V53-V97 HydrophobicContact CG1-CG1 4.29Å; V53-V97 HydrophobicContact CG1-CG2 4.4Å; V53-V97 HydrophobicContact CG2-CG2 4.49Å
54	M	93.1	Very high	92.5	Very high	92 Å²	92	37.5 Å²	37.5	45%	0.453	21%	0.207	S	C	.	.			trans	-90.4	169.6	-179.1	-66.4	-64.4	-89.5	0	0	112.9	D51 G52 Q56 T57 R58	D51-M54 HydrophobicContact CB-CE 4.48Å; D51-M54 HydrophobicContact CB-CG 4.06Å; D51-M54 HydrophobicContact CB-SD 3.83Å; G52-M54 PolarHBondContact O-N 3.33Å; M54-Q56 VanDerWaalsContact C-N 3.33Å; M54-Q56 PolarHBondContact O-N 3Å; M54-T57 PolarHBondContact N-OG1 3.36Å; M54-T57 WeakPolarHBondContact O-CB 3.42Å; M54-T57 PolarHBondContact O-N 2.85Å; M54-R58 PolarHBondContact O-N 3.41Å; M54-R58 VanDerWaalsContact O-N 3.16Å; M54-R58 PolarHBondContact O-NH1 2.77Å
55	A	89.4	Confident	92.2	Very high	80 Å²	80	35.3 Å²	35.3	66%	0.661	20%	0.195	S	C	*	.	H	α-helix	trans	-61.2	-40.1	176.1	0	0	0	0	0	112.3	T57 R58 E59	A55-T57 VanDerWaalsContact C-N 3.33Å; A55-T57 PolarHBondContact O-N 3.33Å; A55-R58 WeakPolarHBondContact O-CB 3.35Å; A55-R58 PolarHBondContact O-N 3.32Å; A55-E59 PolarHBondContact O-N 3.25Å
56	Q	87.9	Confident	91.9	Very high	78 Å²	78	35 Å²	35	36%	0.364	19%	0.193	S	C	.	.	H	α-helix	trans	-62.9	-39.2	175.1	-70.5	171.5	-0.5	0	0	111.9	G25 M54 R58 E59 H60	G25-Q56 WeakPolarHBondContact O-CG 3.45Å; G25-Q56 PolarHBondContact O-NE2 3.34Å; G25-Q56 PolarHBondContact O-OE1 2.85Å; G25-Q56 VanDerWaalsContact O-OE1 3.13Å; M54-Q56 VanDerWaalsContact C-N 3.33Å; M54-Q56 PolarHBondContact O-N 3Å; Q56-R58 VanDerWaalsContact C-N 3.29Å; Q56-R58 PolarHBondContact O-N 2.62Å; Q56-E59 PolarHBondContact O-N 3.31Å; Q56-H60 PolarHBondContact O-CD2 3.34Å; Q56-H60 PolarHBondContact O-N 2.92Å
57	T	91.6	Very high	91.3	Very high	17 Å²	17	32.7 Å²	32.7	10%	0.104	18%	0.18	C	C	.	.	H	α-helix	trans	-59.5	-41.3	174.2	-48.9	0	0	0	0	111.4	L45 V47 V53 M54 A55 H60 L61	L45-T57 HydrophobicContact CD1-CG2 4.17Å; L45-T57 HydrophobicContact CD2-CG2 3.68Å; L45-T57 HydrophobicContact CG-CG2 4.05Å; V47-T57 HydrophobicContact CG2-CG2 3.83Å; V53-T57 HydrophobicContact CG1-CG2 3.76Å; M54-T57 PolarHBondContact N-OG1 3.36Å; M54-T57 WeakPolarHBondContact O-CB 3.42Å; M54-T57 PolarHBondContact O-N 2.85Å; A55-T57 VanDerWaalsContact C-N 3.33Å; A55-T57 PolarHBondContact O-N 3.33Å; T57-H60 PolarHBondContact O-N 3.14Å; T57-L61 WeakPolarHBondContact O-CG 3.24Å; T57-L61 PolarHBondContact O-N 3.45Å
58	R	92	Very high	90.4	Very high	80 Å²	80	33.8 Å²	33.8	30%	0.302	19%	0.192	S	C	.	.	H	α-helix	trans	-67	-41.4	174.8	-76.1	-179.8	-179	68.2	-0.2	112.5	V53 M54 A55 Q56 H60 L61 A62 V97 Y101	V53-R58 VanDerWaalsContact C-NH1 3.32Å; V53-R58 HydrophobicContact CG1-CG 4.26Å; V53-R58 PolarHBondContact O-NH1 2.99Å; M54-R58 PolarHBondContact O-N 3.41Å; M54-R58 VanDerWaalsContact O-N 3.16Å; M54-R58 PolarHBondContact O-NH1 2.77Å; A55-R58 WeakPolarHBondContact O-CB 3.35Å; A55-R58 PolarHBondContact O-N 3.32Å; Q56-R58 VanDerWaalsContact C-N 3.29Å; Q56-R58 PolarHBondContact O-N 2.62Å; R58-H60 VanDerWaalsContact C-N 3.33Å; R58-H60 PolarHBondContact O-N 3.22Å; R58-L61 PolarHBondContact O-N 3.37Å; R58-A62 WeakPolarHBondContact O-CB 3.49Å; R58-A62 PolarHBondContact O-N 3.12Å; R58-V97 HydrophobicContact CG-CG1 4.36Å; R58-Y101 HydrophobicContact CB-CE2 4.37Å; R58-Y101 WeakPolarHBondContact CB-OH 3.45Å; R58-Y101 HydrophobicContact CG-CE2 4.17Å
59	E	88.4	Confident	89.4	Confident	27 Å²	27	36.1 Å²	36.1	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-62	-41.8	175.5	-173.5	173.3	-156.7	0	0	111.5	A55 Q56 A62 I63 R289 T296	A55-E59 PolarHBondContact O-N 3.25Å; Q56-E59 PolarHBondContact O-N 3.31Å; E59-A62 PolarHBondContact O-N 2.96Å; E59-I63 HydrophobicContact CG-CD1 3.98Å; E59-I63 WeakPolarHBondContact O-CG1 3.35Å; E59-I63 PolarHBondContact O-N 3.48Å; E59-R289 IonicContact OE1-CZ 3.5Å; E59-R289 IonicContact OE1-NE 3.56Å; E59-R289 IonicContact OE1-NH2 3.37Å; E59-R289 PolarHBondContact OE1-NH2 3.35Å; E59-T296 PolarHBondContact OE1-OG1 3.23Å
60	H	89.4	Confident	88.7	Confident	28 Å²	28	36.4 Å²	36.4	13%	0.13	20%	0.203	C	C	.	.	H	α-helix	trans	-65.4	-42	176.3	-69.4	-171.6	0	0	0	112.3	M33 L45 Q56 T57 R58 I63 L64	M33-H60 VanDerWaalsContact SD-CD2 3.54Å; M33-H60 PolarHBondContact SD-NE2 2.86Å; M33-H60 VanDerWaalsContact SD-NE2 3.41Å; L45-H60 HydrophobicContact CD1-CB 4.2Å; Q56-H60 PolarHBondContact O-CD2 3.34Å; Q56-H60 PolarHBondContact O-N 2.92Å; T57-H60 PolarHBondContact O-N 3.14Å; R58-H60 VanDerWaalsContact C-N 3.33Å; R58-H60 PolarHBondContact O-N 3.22Å; H60-I63 PolarHBondContact O-N 2.56Å; H60-L64 WeakPolarHBondContact O-CG 3.15Å; H60-L64 PolarHBondContact O-N 3.46Å
61	L	91.5	Very high	88.3	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-60.9	-44.2	174.4	-79.9	172.3	0	0	0	112	L45 T57 R58 I63 L64 Q65 L72 V97 L98 Y101 F103	L45-L61 HydrophobicContact CD2-CD1 3.88Å; L45-L61 HydrophobicContact CD2-CD2 3.61Å; L45-L61 HydrophobicContact CD2-CG 3.58Å; T57-L61 WeakPolarHBondContact O-CG 3.24Å; T57-L61 PolarHBondContact O-N 3.45Å; R58-L61 PolarHBondContact O-N 3.37Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 PolarHBondContact O-N 3.03Å; L61-L64 PolarHBondContact O-N 3.46Å; L61-Q65 WeakPolarHBondContact O-CB 3.34Å; L61-Q65 PolarHBondContact O-N 2.92Å; L61-L72 HydrophobicContact CD2-CD2 3.61Å; L61-V97 HydrophobicContact CD1-CG1 3.7Å; L61-L98 HydrophobicContact CD1-CD2 4.47Å; L61-L98 HydrophobicContact CD2-CD2 3.97Å; L61-Y101 HydrophobicContact CB-CD1 4.4Å; L61-Y101 HydrophobicContact CB-CD2 3.77Å; L61-Y101 HydrophobicContact CB-CE2 4.09Å; L61-Y101 HydrophobicContact CB-CG 3.94Å; L61-Y101 HydrophobicContact CD1-CD2 3.9Å; L61-Y101 HydrophobicContact CD1-CE2 4.26Å; L61-Y101 HydrophobicContact CG-CD2 4.44Å; L61-F103 HydrophobicContact CD2-CD2 3.99Å; L61-F103 HydrophobicContact CD2-CE2 3.8Å
62	A	89.7	Confident	88.3	Confident	8 Å²	8	34 Å²	34	7%	0.066	19%	0.189	C	C	.	.	H	α-helix	trans	-58.1	-48.3	174.3	0	0	0	0	0	110.6	R58 E59 L64 Q65 L66 Y101	R58-A62 WeakPolarHBondContact O-CB 3.49Å; R58-A62 PolarHBondContact O-N 3.12Å; E59-A62 PolarHBondContact O-N 2.96Å; A62-L64 PolarHBondContact O-N 2.91Å; A62-Q65 WeakPolarHBondContact O-CB 3.45Å; A62-Q65 PolarHBondContact O-N 2.77Å; A62-L66 WeakPolarHBondContact O-CB 3.35Å; A62-L66 WeakPolarHBondContact O-CG 3.46Å; A62-L66 PolarHBondContact O-N 3.47Å; A62-Y101 HydrophobicContact CB-CD1 4.32Å; A62-Y101 HydrophobicContact CB-CE1 3.78Å
63	I	88.8	Confident	88.4	Confident	1 Å²	1	34 Å²	34	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-45.1	179.5	-71.2	164.1	0	0	0	111.7	L30 M33 L34 E59 H60 L61 Q65 L66 T67 V287 T296	L30-I63 HydrophobicContact CD1-CD1 3.73Å; L30-I63 HydrophobicContact CD2-CD1 3.85Å; L30-I63 HydrophobicContact CG-CD1 4.12Å; M33-I63 HydrophobicContact CE-CB 4.18Å; M33-I63 HydrophobicContact CE-CD1 3.39Å; M33-I63 HydrophobicContact CE-CG1 4.36Å; M33-I63 HydrophobicContact CE-CG2 3.85Å; L34-I63 HydrophobicContact CD2-CD1 4.49Å; L34-I63 HydrophobicContact CD2-CG2 3.71Å; E59-I63 HydrophobicContact CG-CD1 3.98Å; E59-I63 WeakPolarHBondContact O-CG1 3.35Å; E59-I63 PolarHBondContact O-N 3.48Å; H60-I63 PolarHBondContact O-N 2.56Å; L61-I63 VanDerWaalsContact C-N 3.34Å; L61-I63 PolarHBondContact O-N 3.03Å; I63-Q65 VanDerWaalsContact C-N 3.32Å; I63-Q65 PolarHBondContact O-N 2.9Å; I63-L66 PolarHBondContact O-N 3.33Å; I63-T67 HydrophobicContact CG2-CG2 4.29Å; I63-T67 WeakPolarHBondContact O-CG2 3.48Å; I63-T67 PolarHBondContact O-N 3.2Å; I63-T67 PolarHBondContact O-OG1 2.76Å; I63-V287 HydrophobicContact CG1-CG1 4.49Å; I63-V287 HydrophobicContact CG2-CG2 4.33Å; I63-T296 HydrophobicContact CG1-CG2 3.92Å
64	L	89.8	Confident	88.5	Confident	16 Å²	16	33.2 Å²	33.2	8%	0.084	18%	0.183	C	C	.	.	H	α-helix	trans	-62.8	-38.3	177.6	-71.9	172.7	0	0	0	112.4	A43 H60 L61 A62 L66 T67 N69 P70 F103	A43-L64 HydrophobicContact CB-CD1 3.64Å; A43-L64 HydrophobicContact CB-CD2 3.87Å; A43-L64 HydrophobicContact CB-CG 4.41Å; H60-L64 WeakPolarHBondContact O-CG 3.15Å; H60-L64 PolarHBondContact O-N 3.46Å; L61-L64 PolarHBondContact O-N 3.46Å; A62-L64 PolarHBondContact O-N 2.91Å; L64-L66 VanDerWaalsContact C-N 3.35Å; L64-T67 WeakPolarHBondContact CA-OG1 3.3Å; L64-T67 PolarHBondContact O-N 3.27Å; L64-T67 PolarHBondContact O-OG1 3.44Å; L64-N69 PolarHBondContact O-N 3.4Å; L64-P70 HydrophobicContact CD2-CG 4.16Å; L64-P70 VanDerWaalsContact O-CD 3.24Å; L64-P70 WeakPolarHBondContact O-CD 3.47Å; L64-F103 HydrophobicContact CB-CZ 4.01Å
65	Q	89.5	Confident	88.7	Confident	23 Å²	23	29.1 Å²	29.1	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-61.8	-47.4	174.1	-172.3	-173.4	21.9	0	0	110.3	L61 A62 I63 T67 G68 N69 Y101 F103 H240	L61-Q65 WeakPolarHBondContact O-CB 3.34Å; L61-Q65 PolarHBondContact O-N 2.92Å; A62-Q65 WeakPolarHBondContact O-CB 3.45Å; A62-Q65 PolarHBondContact O-N 2.77Å; I63-Q65 VanDerWaalsContact C-N 3.32Å; I63-Q65 PolarHBondContact O-N 2.9Å; Q65-T67 VanDerWaalsContact C-N 3.33Å; Q65-T67 PolarHBondContact O-N 3.17Å; Q65-G68 PolarHBondContact O-N 3.18Å; Q65-G68 VanDerWaalsContact O-N 3.15Å; Q65-N69 PolarHBondContact O-N 3.46Å; Q65-Y101 WeakPolarHBondContact CG-O 3.45Å; Q65-Y101 PolarHBondContact NE2-O 3.21Å; Q65-F103 HydrophobicContact CB-CE2 4.23Å; Q65-F103 HydrophobicContact CB-CZ 4.32Å; Q65-H240 PolarHBondContact OE1-CE1 3.39Å; Q65-H240 PolarHBondContact OE1-NE2 2.89Å
66	L	86.5	Confident	89.1	Confident	6 Å²	6	25.3 Å²	25.3	3%	0.031	13%	0.132	C	C	.	.	H	α-helix	trans	-68.6	-27.2	-178.6	-65.9	177.1	0	0	0	113.5	A62 I63 L64 G68 Q238 T296 A298	A62-L66 WeakPolarHBondContact O-CB 3.35Å; A62-L66 WeakPolarHBondContact O-CG 3.46Å; A62-L66 PolarHBondContact O-N 3.47Å; I63-L66 PolarHBondContact O-N 3.33Å; L64-L66 VanDerWaalsContact C-N 3.35Å; L66-G68 PolarHBondContact O-N 3.16Å; L66-Q238 HydrophobicContact CD2-CB 4.26Å; L66-Q238 HydrophobicContact CD2-CG 4.28Å; L66-Q238 VanDerWaalsContact CD2-O 3.27Å; L66-Q238 WeakPolarHBondContact CD2-O 3.35Å; L66-T296 HydrophobicContact CD1-CG2 3.72Å; L66-A298 VanDerWaalsContact CD1-C 3.43Å
67	T	83.9	Confident	89.5	Confident	34 Å²	34	22.7 Å²	22.7	21%	0.209	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	7.5	174.3	58.6	0	0	0	0	113.5	V37 I63 L64 Q65 R285 V287	V37-T67 HydrophobicContact CG2-CG2 4.11Å; I63-T67 HydrophobicContact CG2-CG2 4.29Å; I63-T67 WeakPolarHBondContact O-CG2 3.48Å; I63-T67 PolarHBondContact O-N 3.2Å; I63-T67 PolarHBondContact O-OG1 2.76Å; L64-T67 WeakPolarHBondContact CA-OG1 3.3Å; L64-T67 PolarHBondContact O-N 3.27Å; L64-T67 PolarHBondContact O-OG1 3.44Å; Q65-T67 VanDerWaalsContact C-N 3.33Å; Q65-T67 PolarHBondContact O-N 3.17Å; T67-R285 WeakPolarHBondContact O-CD 3.42Å; T67-V287 HydrophobicContact CG2-CG2 3.74Å
68	G	78.2	Confident	89.7	Confident	27 Å²	27	25.7 Å²	25.7	28%	0.278	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	113.9	20.4	170	0	0	0	0	0	115.3	Q65 L66	Q65-G68 PolarHBondContact O-N 3.18Å; Q65-G68 VanDerWaalsContact O-N 3.15Å; L66-G68 PolarHBondContact O-N 3.16Å
69	N	75.1	Confident	89.8	Confident	69 Å²	69	22.3 Å²	22.3	37%	0.369	12%	0.123	S	C	.	.			trans	51.1	59.8	173	-166.9	-9.8	0	0	0	112	L64 Q65 G102 F103	L64-N69 PolarHBondContact O-N 3.4Å; Q65-N69 PolarHBondContact O-N 3.46Å; N69-G102 PolarHBondContact ND2-O 3.02Å; N69-G102 VanDerWaalsContact ND2-O 3.1Å; N69-F103 HydrophobicContact CB-CE1 4.42Å; N69-F103 WeakPolarHBondContact OD1-CD1 3.27Å; N69-F103 WeakPolarHBondContact OD1-CE1 3.48Å
70	P	80.6	Confident	90.1	Very high	7 Å²	7	23.5 Å²	23.5	5%	0.045	13%	0.13	C	C	.	.			trans	-61.7	156.8	173.3	30.2	-34.2	0	0	0	109.4	A43 L64 L72 F103	A43-P70 HydrophobicContact CB-CG 4.48Å; L64-P70 HydrophobicContact CD2-CG 4.16Å; L64-P70 VanDerWaalsContact O-CD 3.24Å; L64-P70 WeakPolarHBondContact O-CD 3.47Å; P70-L72 PolarHBondContact O-N 2.93Å; P70-F103 WeakPolarHBondContact O-CE1 3.4Å
71	M	86.8	Confident	90.3	Very high	96 Å²	96	31.2 Å²	31.2	47%	0.473	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	141	169.3	-70.1	-174.6	74.2	0	0	109.1	H42 A43	H42-M71 WeakPolarHBondContact CA-O 3.32Å; H42-M71 WeakPolarHBondContact ND1-CB 3.32Å; H42-M71 PolarHBondContact ND1-O 3.25Å; H42-M71 VanDerWaalsContact ND1-O 3.13Å; A43-M71 PolarHBondContact N-O 3.47Å
72	L	93.6	Very high	90.5	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	156.9	179.3	74.6	71.8	0	0	0	111.9	H42 A43 L61 P70 V74 L98 F103 A106	H42-L72 VanDerWaalsContact CE1-C 3.43Å; A43-L72 HydrophobicContact CB-CB 4.29Å; A43-L72 CarbonylContact O-C 3.56Å; A43-L72 WeakPolarHBondContact O-CA 3.2Å; L61-L72 HydrophobicContact CD2-CD2 3.61Å; P70-L72 PolarHBondContact O-N 2.93Å; L72-V74 HydrophobicContact CD1-CG2 3.65Å; L72-L98 HydrophobicContact CD1-CD2 3.81Å; L72-L98 HydrophobicContact CD2-CD2 3.92Å; L72-L98 HydrophobicContact CG-CD2 4.48Å; L72-F103 HydrophobicContact CD2-CB 4.06Å; L72-F103 HydrophobicContact CD2-CD1 3.27Å; L72-F103 HydrophobicContact CD2-CD2 3.63Å; L72-F103 HydrophobicContact CD2-CE1 3.44Å; L72-F103 VanDerWaalsContact CD2-CE1 3.44Å; L72-F103 HydrophobicContact CD2-CE2 3.79Å; L72-F103 HydrophobicContact CD2-CG 3.38Å; L72-F103 HydrophobicContact CD2-CZ 3.72Å; L72-F103 HydrophobicContact CG-CB 4.39Å; L72-F103 HydrophobicContact CG-CD1 3.68Å; L72-F103 HydrophobicContact CG-CE1 4.07Å; L72-F103 HydrophobicContact CG-CG 4.05Å; L72-A106 HydrophobicContact CD1-CB 3.51Å
73	T	95.9	Very high	90.8	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	135.5	171.1	-65.5	0	0	0	0	108.2	H42 A43 L44 L45 F109 L122 H125	H42-T73 PolarHBondContact CE1-OG1 3.24Å; H42-T73 WeakPolarHBondContact NE2-CB 3.47Å; H42-T73 PolarHBondContact NE2-N 3.42Å; H42-T73 PolarHBondContact NE2-OG1 3.26Å; A43-T73 PolarHBondContact O-N 2.98Å; L44-T73 WeakPolarHBondContact CA-O 3.39Å; L44-T73 HydrophobicContact CD1-CG2 3.76Å; L45-T73 PolarHBondContact N-O 3.41Å; T73-F109 HydrophobicContact CG2-CD2 3.53Å; T73-F109 HydrophobicContact CG2-CE2 3.6Å; T73-L122 HydrophobicContact CG2-CD1 4.34Å; T73-H125 PolarHBondContact OG1-NE2 3.22Å
74	V	96.9	Very high	91.1	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	131.5	178.6	-176.9	0	0	0	0	109.5	L45 V47 L72 L76 V94 L98 K107 L108 F109	L45-V74 HydrophobicContact CB-CG2 4.47Å; L45-V74 WeakPolarHBondContact O-CA 2.75Å; V47-V74 HydrophobicContact CG2-CG1 3.95Å; L72-V74 HydrophobicContact CD1-CG2 3.65Å; V74-L76 HydrophobicContact CG1-CD2 4.01Å; V74-V94 HydrophobicContact CB-CG1 4.19Å; V74-V94 HydrophobicContact CG1-CG1 3.79Å; V74-V94 HydrophobicContact CG2-CG1 4.05Å; V74-L98 HydrophobicContact CG2-CD1 3.97Å; V74-L98 HydrophobicContact CG2-CD2 4.1Å; V74-L98 HydrophobicContact CG2-CG 4.5Å; V74-K107 PolarHBondContact N-O 3.47Å; V74-L108 HydrophobicContact CB-CG 4.15Å; V74-L108 CarbonylContact O-C 3.53Å; V74-L108 WeakPolarHBondContact O-CA 3.48Å; V74-F109 PolarHBondContact O-N 2.87Å
75	V	97.2	Very high	91.4	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	110.1	178.1	-177.1	0	0	0	0	108.8	L44 L45 V46 V47 T77 F109 T111 L122	L44-V75 HydrophobicContact CD1-CG2 3.38Å; L44-V75 HydrophobicContact CD2-CG2 4.08Å; L44-V75 HydrophobicContact CG-CG2 3.82Å; L45-V75 PolarHBondContact O-N 3.33Å; V46-V75 WeakPolarHBondContact CA-O 2.89Å; V47-V75 PolarHBondContact N-O 3.45Å; V75-T77 HydrophobicContact CG1-CG2 4.06Å; V75-T77 PolarHBondContact O-N 3.24Å; V75-F109 CarbonylContact C-O 3.52Å; V75-F109 WeakPolarHBondContact CA-O 3.36Å; V75-T111 HydrophobicContact CG1-CG2 3.31Å; V75-L122 HydrophobicContact CG1-CD2 4.4Å; V75-L122 HydrophobicContact CG2-CD1 3.98Å; V75-L122 HydrophobicContact CG2-CD2 3.99Å
76	L	97.3	Very high	91.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	105.2	176.2	-59.8	-170.3	0	0	0	109.2	V47 V74 V90 E91 V94 F109 I110 T111	V47-L76 HydrophobicContact CB-CD2 3.94Å; V47-L76 HydrophobicContact CG1-CD2 4.32Å; V47-L76 CarbonylContact O-C 3.41Å; V47-L76 VanDerWaalsContact O-CA 3.29Å; V47-L76 WeakPolarHBondContact O-CA 3.39Å; V74-L76 HydrophobicContact CG1-CD2 4.01Å; L76-V90 HydrophobicContact CD1-CG1 4.5Å; L76-V90 HydrophobicContact CD2-CG1 4.02Å; L76-E91 HydrophobicContact CD1-CB 4.08Å; L76-E91 HydrophobicContact CD1-CG 4.33Å; L76-V94 HydrophobicContact CD2-CG2 4Å; L76-F109 PolarHBondContact N-O 3.2Å; L76-I110 HydrophobicContact CB-CG1 4.27Å; L76-I110 HydrophobicContact CD1-CG1 4.07Å; L76-T111 WeakPolarHBondContact O-CG2 3.47Å; L76-T111 PolarHBondContact O-N 2.96Å
77	T	96.7	Very high	92.2	Very high	24 Å²	24	49.5 Å²	49.5	15%	0.147	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	170.7	-177.2	56.3	0	0	0	0	112.4	V46 V47 A48 C49 V75 A79 T111	V46-T77 HydrophobicContact CG1-CG2 3.49Å; V46-T77 VanDerWaalsContact CG1-CG2 3.49Å; V47-T77 PolarHBondContact O-N 3.08Å; V47-T77 PolarHBondContact O-OG1 3.11Å; A48-T77 WeakPolarHBondContact CA-OG1 3.41Å; C49-T77 PolarHBondContact N-O 3.34Å; C49-T77 PolarHBondContact SG-O 3.22Å; C49-T77 VanDerWaalsContact SG-O 3.34Å; V75-T77 HydrophobicContact CG1-CG2 4.06Å; V75-T77 PolarHBondContact O-N 3.24Å; T77-A79 PolarHBondContact O-N 3.44Å; T77-T111 CarbonylContact C-O 3.49Å; T77-T111 WeakPolarHBondContact CA-O 3.42Å; T77-T111 HydrophobicContact CG2-CG2 3.87Å
78	K	95.4	Very high	92.8	Very high	79 Å²	79	51.6 Å²	51.6	34%	0.343	27%	0.266	S	S	.	.			trans	59.5	31.3	-177.5	-51.6	-174.1	-167.3	162.3	0	113.5	A48 D50 D80 R81 T111	A48-K78 HydrophobicContact CB-CD 3.93Å; A48-K78 HydrophobicContact CB-CG 4.25Å; D50-K78 WeakPolarHBondContact OD1-CD 3.44Å; D50-K78 IonicContact OD1-NZ 2.73Å; D50-K78 PolarHBondContact OD1-NZ 2.87Å; D50-K78 WeakPolarHBondContact OD2-CD 3.45Å; D50-K78 IonicContact OD2-NZ 3.29Å; D50-K78 PolarHBondContact OD2-NZ 2.94Å; K78-D80 WeakPolarHBondContact CA-OD1 3.34Å; K78-D80 PolarHBondContact O-N 3.15Å; K78-R81 HydrophobicContact CB-CB 4.35Å; K78-R81 HydrophobicContact CB-CG 4.24Å; K78-R81 PolarHBondContact O-N 3.3Å; K78-T111 PolarHBondContact N-O 3.15Å
79	A	94.1	Very high	93.7	Very high	10 Å²	10	53.5 Å²	53.5	8%	0.083	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-18.1	174.1	0	0	0	0	0	113	T77 R81 I110 T111	T77-A79 PolarHBondContact O-N 3.44Å; A79-R81 VanDerWaalsContact C-N 3.28Å; A79-I110 HydrophobicContact CB-CG2 3.59Å; A79-T111 WeakPolarHBondContact CB-O 3.48Å; A79-T111 PolarHBondContact N-O 3.44Å
80	D	94.2	Very high	94.8	Very high	52 Å²	52	50.2 Å²	50.2	28%	0.278	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-16.8	172.9	60.1	-61.7	0	0	0	113.7	K78 A112	K78-D80 WeakPolarHBondContact CA-OD1 3.34Å; K78-D80 PolarHBondContact O-N 3.15Å; D80-A112 HydrophobicContact CB-CB 3.86Å; D80-A112 WeakPolarHBondContact OD1-CB 3.5Å
81	R	94.8	Very high	95.6	Very high	189 Å²	189	52 Å²	52	71%	0.713	26%	0.258	S	S	*	.	S	Bend	trans	-101.2	-8.9	-172.2	-61.6	-60.5	179.1	147.4	2.5	114.6	K78 A79	K78-R81 HydrophobicContact CB-CB 4.35Å; K78-R81 HydrophobicContact CB-CG 4.24Å; K78-R81 PolarHBondContact O-N 3.3Å; A79-R81 VanDerWaalsContact C-N 3.28Å
82	V	95.6	Very high	96	Very high	35 Å²	35	54.8 Å²	54.8	21%	0.212	26%	0.263	C	S	.	.	S	Bend	trans	-129.3	161.8	-177.2	-60.1	0	0	0	0	109.8	C49 D50 R86 V87	C49-V82 HydrophobicContact CB-CG1 4.45Å; C49-V82 HydrophobicContact CB-CG2 3.61Å; D50-V82 HydrophobicContact CB-CG1 4.21Å; V82-R86 HydrophobicContact CB-CB 3.87Å; V82-R86 HydrophobicContact CB-CG 3.77Å; V82-R86 HydrophobicContact CG1-CG 3.9Å; V82-R86 HydrophobicContact CG2-CB 4.18Å; V82-R86 HydrophobicContact CG2-CG 4.08Å; V82-V87 HydrophobicContact CG2-CG2 3.79Å
83	D	95.6	Very high	96.2	Very high	108 Å²	108	57.4 Å²	57.4	58%	0.578	28%	0.276	S	S	*	.			trans	-77.5	166.1	171.4	61.6	9.6	0	0	0	111.5	A85 R86 V87	D83-A85 PolarHBondContact O-N 2.89Å; D83-R86 PolarHBondContact O-N 2.78Å; D83-R86 WeakPolarHBondContact OD1-CB 3.34Å; D83-R86 PolarHBondContact OD1-N 3.38Å; D83-V87 PolarHBondContact O-N 2.82Å
84	E	95	Very high	96.2	Very high	157 Å²	157	57.6 Å²	57.6	73%	0.734	28%	0.277	S	S	*	.	H	α-helix	trans	-61	-33.5	179.9	-169.4	173	-165.2	0	0	112	R86 V87 D88	E84-R86 VanDerWaalsContact C-N 3.32Å; E84-R86 PolarHBondContact O-N 3.2Å; E84-V87 WeakPolarHBondContact O-CB 3.49Å; E84-V87 PolarHBondContact O-N 2.79Å; E84-V87 VanDerWaalsContact O-N 3.1Å; E84-D88 PolarHBondContact O-N 3.35Å
85	A	96.5	Very high	96.1	Very high	65 Å²	65	62 Å²	62	54%	0.537	30%	0.296	S	S	.	.	H	α-helix	trans	-60.9	-40.4	176.4	0	0	0	0	0	112.4	D83 D88 E89	D83-A85 PolarHBondContact O-N 2.89Å; A85-D88 PolarHBondContact O-N 2.94Å; A85-E89 PolarHBondContact O-N 3.36Å
86	R	96.9	Very high	96.1	Very high	60 Å²	60	67.5 Å²	67.5	23%	0.226	32%	0.321	C	S	.	.	H	α-helix	trans	-69	-35.9	174	179.8	57.4	176	-178.1	-1.4	112.2	C49 D50 V82 D83 E84 E89 V90	C49-R86 PolarHBondContact O-NE 2.88Å; C49-R86 VanDerWaalsContact O-NE 3.11Å; D50-R86 PolarHBondContact O-NH2 2.85Å; V82-R86 HydrophobicContact CB-CB 3.87Å; V82-R86 HydrophobicContact CB-CG 3.77Å; V82-R86 HydrophobicContact CG1-CG 3.9Å; V82-R86 HydrophobicContact CG2-CB 4.18Å; V82-R86 HydrophobicContact CG2-CG 4.08Å; D83-R86 PolarHBondContact O-N 2.78Å; D83-R86 WeakPolarHBondContact OD1-CB 3.34Å; D83-R86 PolarHBondContact OD1-N 3.38Å; E84-R86 VanDerWaalsContact C-N 3.32Å; E84-R86 PolarHBondContact O-N 3.2Å; R86-E89 WeakPolarHBondContact CD-OE2 3.36Å; R86-E89 IonicContact CZ-OE2 2.56Å; R86-E89 IonicContact NH1-OE1 2.8Å; R86-E89 PolarHBondContact NH1-OE1 2.93Å; R86-E89 IonicContact NH1-OE2 3.08Å; R86-E89 PolarHBondContact NH1-OE2 3.03Å; R86-E89 PolarHBondContact O-N 3.48Å; R86-V90 HydrophobicContact CG-CG2 4.49Å; R86-V90 WeakPolarHBondContact O-CG2 3.4Å; R86-V90 PolarHBondContact O-N 2.9Å
87	V	96.4	Very high	96	Very high	15 Å²	15	67.9 Å²	67.9	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-58.7	-48.9	173.5	176.1	0	0	0	0	110.4	V82 D83 E84 E89 V90 E91 I110	V82-V87 HydrophobicContact CG2-CG2 3.79Å; D83-V87 PolarHBondContact O-N 2.82Å; E84-V87 WeakPolarHBondContact O-CB 3.49Å; E84-V87 PolarHBondContact O-N 2.79Å; E84-V87 VanDerWaalsContact O-N 3.1Å; V87-E89 VanDerWaalsContact C-N 3.33Å; V87-E89 PolarHBondContact O-N 3.1Å; V87-V90 PolarHBondContact O-N 2.93Å; V87-E91 WeakPolarHBondContact O-CB 3.47Å; V87-E91 PolarHBondContact O-N 3.26Å; V87-I110 HydrophobicContact CG1-CB 4.45Å; V87-I110 HydrophobicContact CG1-CG1 3.81Å; V87-I110 HydrophobicContact CG1-CG2 3.78Å
88	D	96.8	Very high	95.9	Very high	78 Å²	78	67 Å²	67	42%	0.417	32%	0.318	S	S	.	.	H	α-helix	trans	-64.9	-34.2	178.3	-72	-16.3	0	0	0	113.1	E84 A85 R92	E84-D88 PolarHBondContact O-N 3.35Å; A85-D88 PolarHBondContact O-N 2.94Å; D88-R92 WeakPolarHBondContact O-CG 3.37Å; D88-R92 PolarHBondContact O-N 3.37Å; D88-R92 PolarHBondContact O-NE 2.93Å
89	E	97.2	Very high	95.8	Very high	68 Å²	68	72.4 Å²	72.4	32%	0.318	34%	0.336	S	S	.	.	H	α-helix	trans	-63.3	-50.8	173.2	-168.9	-161.4	159.9	0	0	111.1	A85 R86 V87 E91 R92 Q93	A85-E89 PolarHBondContact O-N 3.36Å; R86-E89 WeakPolarHBondContact CD-OE2 3.36Å; R86-E89 IonicContact CZ-OE2 2.56Å; R86-E89 IonicContact NH1-OE1 2.8Å; R86-E89 PolarHBondContact NH1-OE1 2.93Å; R86-E89 IonicContact NH1-OE2 3.08Å; R86-E89 PolarHBondContact NH1-OE2 3.03Å; R86-E89 PolarHBondContact O-N 3.48Å; V87-E89 VanDerWaalsContact C-N 3.33Å; V87-E89 PolarHBondContact O-N 3.1Å; E89-E91 VanDerWaalsContact C-N 3.34Å; E89-E91 PolarHBondContact O-N 3.48Å; E89-R92 PolarHBondContact O-N 3.21Å; E89-Q93 WeakPolarHBondContact O-CG 3.39Å; E89-Q93 PolarHBondContact O-N 2.99Å; E89-Q93 PolarHBondContact OE1-NE2 3.34Å
90	V	97.2	Very high	95.7	Very high	0 Å²	0	78.3 Å²	78.3	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-66.3	-37.9	-179.8	174	0	0	0	0	111	V47 L76 R86 V87 R92 Q93 V94	V47-V90 HydrophobicContact CG1-CG1 4.41Å; L76-V90 HydrophobicContact CD1-CG1 4.5Å; L76-V90 HydrophobicContact CD2-CG1 4.02Å; R86-V90 HydrophobicContact CG-CG2 4.49Å; R86-V90 WeakPolarHBondContact O-CG2 3.4Å; R86-V90 PolarHBondContact O-N 2.9Å; V87-V90 PolarHBondContact O-N 2.93Å; V90-R92 VanDerWaalsContact C-N 3.34Å; V90-R92 PolarHBondContact O-N 3.35Å; V90-Q93 PolarHBondContact O-N 2.59Å; V90-V94 HydrophobicContact CG1-CG2 4.32Å; V90-V94 WeakPolarHBondContact O-CB 3.44Å; V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 3.27Å
91	E	97.1	Very high	95.6	Very high	43 Å²	43	77.5 Å²	77.5	20%	0.201	36%	0.355	C	S	.	.	H	α-helix	trans	-59.4	-44.4	175.5	-164.7	-170.6	151.5	0	0	111.7	L76 V87 E89 V94 K95 L108	L76-E91 HydrophobicContact CD1-CB 4.08Å; L76-E91 HydrophobicContact CD1-CG 4.33Å; V87-E91 WeakPolarHBondContact O-CB 3.47Å; V87-E91 PolarHBondContact O-N 3.26Å; E89-E91 VanDerWaalsContact C-N 3.34Å; E89-E91 PolarHBondContact O-N 3.48Å; E91-V94 PolarHBondContact O-N 3.48Å; E91-K95 WeakPolarHBondContact O-CG 3.45Å; E91-K95 PolarHBondContact O-N 2.91Å; E91-K95 WeakPolarHBondContact OE1-CE 3.36Å; E91-K95 IonicContact OE1-NZ 2.68Å; E91-K95 PolarHBondContact OE1-NZ 2.95Å; E91-L108 HydrophobicContact CB-CD2 4.47Å; E91-L108 HydrophobicContact CG-CD2 3.45Å; E91-L108 VanDerWaalsContact CG-CD2 3.45Å
92	R	96.2	Very high	95.4	Very high	155 Å²	155	70.5 Å²	70.5	59%	0.585	34%	0.342	S	S	*	.	H	α-helix	trans	-63.6	-46.9	175.3	-74.9	-179.3	-70	164.4	-1.8	111.9	D88 E89 V90 V94 K95 E96	D88-R92 WeakPolarHBondContact O-CG 3.37Å; D88-R92 PolarHBondContact O-N 3.37Å; D88-R92 PolarHBondContact O-NE 2.93Å; E89-R92 PolarHBondContact O-N 3.21Å; V90-R92 VanDerWaalsContact C-N 3.34Å; V90-R92 PolarHBondContact O-N 3.35Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 3.13Å; R92-K95 PolarHBondContact O-N 3.46Å; R92-E96 PolarHBondContact O-N 3.35Å
93	Q	96.4	Very high	95.2	Very high	61 Å²	61	69.3 Å²	69.3	29%	0.285	33%	0.334	S	S	.	.	H	α-helix	trans	-58.1	-43.9	177.1	-72.7	173.9	4	0	0	111.8	E89 V90 E96 V97	E89-Q93 WeakPolarHBondContact O-CG 3.39Å; E89-Q93 PolarHBondContact O-N 2.99Å; E89-Q93 PolarHBondContact OE1-NE2 3.34Å; V90-Q93 PolarHBondContact O-N 2.59Å; Q93-E96 PolarHBondContact O-N 2.85Å; Q93-V97 VanDerWaalsContact O-CG2 3.29Å; Q93-V97 WeakPolarHBondContact O-CG2 3.44Å; Q93-V97 PolarHBondContact O-N 3.18Å
94	V	96.8	Very high	94.6	Very high	5 Å²	5	68.7 Å²	68.7	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-62.1	-46.9	176.9	164.6	0	0	0	0	111	V47 V53 V74 L76 V90 E91 R92 E96 V97 L98 L108	V47-V94 HydrophobicContact CG1-CG2 4.35Å; V53-V94 HydrophobicContact CG2-CG2 3.51Å; V74-V94 HydrophobicContact CB-CG1 4.19Å; V74-V94 HydrophobicContact CG1-CG1 3.79Å; V74-V94 HydrophobicContact CG2-CG1 4.05Å; L76-V94 HydrophobicContact CD2-CG2 4Å; V90-V94 HydrophobicContact CG1-CG2 4.32Å; V90-V94 WeakPolarHBondContact O-CB 3.44Å; V90-V94 WeakPolarHBondContact O-CG2 3.48Å; V90-V94 PolarHBondContact O-N 3.27Å; E91-V94 PolarHBondContact O-N 3.48Å; R92-V94 VanDerWaalsContact C-N 3.32Å; R92-V94 PolarHBondContact O-N 3.13Å; V94-E96 VanDerWaalsContact C-N 3.27Å; V94-E96 PolarHBondContact O-N 3.22Å; V94-V97 PolarHBondContact O-N 3.23Å; V94-L98 HydrophobicContact CG1-CD1 3.72Å; V94-L98 HydrophobicContact CG1-CG 4.12Å; V94-L98 WeakPolarHBondContact O-CB 3.45Å; V94-L98 WeakPolarHBondContact O-CG 3.2Å; V94-L98 PolarHBondContact O-N 3.35Å; V94-L108 HydrophobicContact CB-CD2 4.21Å; V94-L108 HydrophobicContact CG1-CD2 3.77Å; V94-L108 HydrophobicContact CG1-CG 4.23Å
95	K	95.9	Very high	94	Very high	91 Å²	91	69.2 Å²	69.2	40%	0.396	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-37.5	178.5	-74.2	175.1	-176.5	169.7	0	112.6	E91 R92 R99 L108	E91-K95 WeakPolarHBondContact O-CG 3.45Å; E91-K95 PolarHBondContact O-N 2.91Å; E91-K95 WeakPolarHBondContact OE1-CE 3.36Å; E91-K95 IonicContact OE1-NZ 2.68Å; E91-K95 PolarHBondContact OE1-NZ 2.95Å; R92-K95 PolarHBondContact O-N 3.46Å; K95-R99 WeakPolarHBondContact O-CG 3.35Å; K95-R99 PolarHBondContact O-N 3.36Å; K95-L108 HydrophobicContact CG-CD1 4.5Å; K95-L108 HydrophobicContact CG-CD2 4.08Å
96	E	95.3	Very high	93.8	Very high	122 Å²	122	67.2 Å²	67.2	57%	0.57	33%	0.33	S	S	*	.	H	α-helix	trans	-66.2	-50.4	174.9	-72	177.4	171.9	0	0	111.4	R92 Q93 V94 L98 R99 E100	R92-E96 PolarHBondContact O-N 3.35Å; Q93-E96 PolarHBondContact O-N 2.85Å; V94-E96 VanDerWaalsContact C-N 3.27Å; V94-E96 PolarHBondContact O-N 3.22Å; E96-L98 VanDerWaalsContact C-N 3.31Å; E96-L98 PolarHBondContact O-N 2.9Å; E96-R99 WeakPolarHBondContact O-CB 3.24Å; E96-R99 PolarHBondContact O-N 3.06Å; E96-R99 VanDerWaalsContact O-N 3.11Å; E96-E100 PolarHBondContact O-N 3.37Å
97	V	95.7	Very high	93.7	Very high	8 Å²	8	69.1 Å²	69.1	5%	0.048	34%	0.34	C	S	.	.	H	α-helix	trans	-61.1	-39.1	179.5	173.6	0	0	0	0	111.9	V53 R58 L61 Q93 V94 R99 E100 Y101	V53-V97 HydrophobicContact CG1-CG1 4.29Å; V53-V97 HydrophobicContact CG1-CG2 4.4Å; V53-V97 HydrophobicContact CG2-CG2 4.49Å; R58-V97 HydrophobicContact CG-CG1 4.36Å; L61-V97 HydrophobicContact CD1-CG1 3.7Å; Q93-V97 VanDerWaalsContact O-CG2 3.29Å; Q93-V97 WeakPolarHBondContact O-CG2 3.44Å; Q93-V97 PolarHBondContact O-N 3.18Å; V94-V97 PolarHBondContact O-N 3.23Å; V97-R99 VanDerWaalsContact C-N 3.28Å; V97-R99 PolarHBondContact O-N 3.34Å; V97-E100 WeakPolarHBondContact O-CB 3.16Å; V97-E100 PolarHBondContact O-N 3.24Å; V97-E100 VanDerWaalsContact O-N 3.14Å; V97-Y101 HydrophobicContact CG1-CD2 3.87Å; V97-Y101 HydrophobicContact CG1-CE2 3.78Å; V97-Y101 VanDerWaalsContact O-CD2 3.3Å; V97-Y101 WeakPolarHBondContact O-CD2 3.42Å; V97-Y101 PolarHBondContact O-N 2.97Å
98	L	95.3	Very high	93.7	Very high	6 Å²	6	69.8 Å²	69.8	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-61.1	-37.9	177.3	-72.4	171.9	0	0	0	112.4	L61 L72 V74 V94 E96 E100 Y101 G102 F103 A106 L108	L61-L98 HydrophobicContact CD1-CD2 4.47Å; L61-L98 HydrophobicContact CD2-CD2 3.97Å; L72-L98 HydrophobicContact CD1-CD2 3.81Å; L72-L98 HydrophobicContact CD2-CD2 3.92Å; L72-L98 HydrophobicContact CG-CD2 4.48Å; V74-L98 HydrophobicContact CG2-CD1 3.97Å; V74-L98 HydrophobicContact CG2-CD2 4.1Å; V74-L98 HydrophobicContact CG2-CG 4.5Å; V94-L98 HydrophobicContact CG1-CD1 3.72Å; V94-L98 HydrophobicContact CG1-CG 4.12Å; V94-L98 WeakPolarHBondContact O-CB 3.45Å; V94-L98 WeakPolarHBondContact O-CG 3.2Å; V94-L98 PolarHBondContact O-N 3.35Å; E96-L98 VanDerWaalsContact C-N 3.31Å; E96-L98 PolarHBondContact O-N 2.9Å; L98-E100 VanDerWaalsContact C-N 3.34Å; L98-Y101 PolarHBondContact O-N 3.4Å; L98-G102 PolarHBondContact O-N 3.13Å; L98-F103 HydrophobicContact CB-CB 4.27Å; L98-F103 HydrophobicContact CD2-CB 4.06Å; L98-F103 HydrophobicContact CD2-CD2 4.46Å; L98-F103 PolarHBondContact O-N 2.86Å; L98-A106 HydrophobicContact CD1-CB 3.44Å; L98-A106 VanDerWaalsContact CD1-CB 3.44Å; L98-A106 HydrophobicContact CD2-CB 4.49Å; L98-L108 HydrophobicContact CD1-CD1 4.22Å
99	R	92.7	Very high	93.7	Very high	193 Å²	193	67.7 Å²	67.7	73%	0.728	33%	0.33	S	S	*	.	H	α-helix	trans	-65.9	-36.8	175	-69.3	172.3	-180	173.5	0.8	111.9	K95 E96 V97 Y101 G102	K95-R99 WeakPolarHBondContact O-CG 3.35Å; K95-R99 PolarHBondContact O-N 3.36Å; E96-R99 WeakPolarHBondContact O-CB 3.24Å; E96-R99 PolarHBondContact O-N 3.06Å; E96-R99 VanDerWaalsContact O-N 3.11Å; V97-R99 VanDerWaalsContact C-N 3.28Å; V97-R99 PolarHBondContact O-N 3.34Å; R99-Y101 VanDerWaalsContact C-N 3.27Å; R99-Y101 PolarHBondContact O-N 3.11Å; R99-G102 PolarHBondContact O-N 3.28Å
100	E	92.3	Very high	93.7	Very high	134 Å²	134	67.3 Å²	67.3	63%	0.626	33%	0.33	S	S	*	.	H	α-helix	trans	-60	-37.7	176.1	-63.9	176	169.1	0	0	112	E96 V97 L98	E96-E100 PolarHBondContact O-N 3.37Å; V97-E100 WeakPolarHBondContact O-CB 3.16Å; V97-E100 PolarHBondContact O-N 3.24Å; V97-E100 VanDerWaalsContact O-N 3.14Å; L98-E100 VanDerWaalsContact C-N 3.34Å
101	Y	91.5	Very high	93.6	Very high	35 Å²	35	67.5 Å²	67.5	14%	0.137	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	10	178.7	-67.1	-74	0	0	0	114	R58 L61 A62 Q65 V97 L98 R99 F103	R58-Y101 HydrophobicContact CB-CE2 4.37Å; R58-Y101 WeakPolarHBondContact CB-OH 3.45Å; R58-Y101 HydrophobicContact CG-CE2 4.17Å; L61-Y101 HydrophobicContact CB-CD1 4.4Å; L61-Y101 HydrophobicContact CB-CD2 3.77Å; L61-Y101 HydrophobicContact CB-CE2 4.09Å; L61-Y101 HydrophobicContact CB-CG 3.94Å; L61-Y101 HydrophobicContact CD1-CD2 3.9Å; L61-Y101 HydrophobicContact CD1-CE2 4.26Å; L61-Y101 HydrophobicContact CG-CD2 4.44Å; A62-Y101 HydrophobicContact CB-CD1 4.32Å; A62-Y101 HydrophobicContact CB-CE1 3.78Å; Q65-Y101 WeakPolarHBondContact CG-O 3.45Å; Q65-Y101 PolarHBondContact NE2-O 3.21Å; V97-Y101 HydrophobicContact CG1-CD2 3.87Å; V97-Y101 HydrophobicContact CG1-CE2 3.78Å; V97-Y101 VanDerWaalsContact O-CD2 3.3Å; V97-Y101 WeakPolarHBondContact O-CD2 3.42Å; V97-Y101 PolarHBondContact O-N 2.97Å; L98-Y101 PolarHBondContact O-N 3.4Å; R99-Y101 VanDerWaalsContact C-N 3.27Å; R99-Y101 PolarHBondContact O-N 3.11Å; Y101-F103 PolarHBondContact O-N 3.42Å
102	G	90.3	Very high	93.5	Very high	42 Å²	42	65.4 Å²	65.4	43%	0.433	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	21.6	175.3	0	0	0	0	0	115.3	N69 L98 R99	N69-G102 PolarHBondContact ND2-O 3.02Å; N69-G102 VanDerWaalsContact ND2-O 3.1Å; L98-G102 PolarHBondContact O-N 3.13Å; R99-G102 PolarHBondContact O-N 3.28Å
103	F	92.5	Very high	93.3	Very high	10 Å²	10	61.4 Å²	61.4	4%	0.044	32%	0.321	C	S	.	.			trans	-95.2	96.1	172.5	-65.3	-79.4	0	0	0	109.8	L61 L64 Q65 N69 P70 L72 L98 Y101	L61-F103 HydrophobicContact CD2-CD2 3.99Å; L61-F103 HydrophobicContact CD2-CE2 3.8Å; L64-F103 HydrophobicContact CB-CZ 4.01Å; Q65-F103 HydrophobicContact CB-CE2 4.23Å; Q65-F103 HydrophobicContact CB-CZ 4.32Å; N69-F103 HydrophobicContact CB-CE1 4.42Å; N69-F103 WeakPolarHBondContact OD1-CD1 3.27Å; N69-F103 WeakPolarHBondContact OD1-CE1 3.48Å; P70-F103 WeakPolarHBondContact O-CE1 3.4Å; L72-F103 HydrophobicContact CD2-CB 4.06Å; L72-F103 HydrophobicContact CD2-CD1 3.27Å; L72-F103 HydrophobicContact CD2-CD2 3.63Å; L72-F103 HydrophobicContact CD2-CE1 3.44Å; L72-F103 VanDerWaalsContact CD2-CE1 3.44Å; L72-F103 HydrophobicContact CD2-CE2 3.79Å; L72-F103 HydrophobicContact CD2-CG 3.38Å; L72-F103 HydrophobicContact CD2-CZ 3.72Å; L72-F103 HydrophobicContact CG-CB 4.39Å; L72-F103 HydrophobicContact CG-CD1 3.68Å; L72-F103 HydrophobicContact CG-CE1 4.07Å; L72-F103 HydrophobicContact CG-CG 4.05Å; L98-F103 HydrophobicContact CB-CB 4.27Å; L98-F103 HydrophobicContact CD2-CB 4.06Å; L98-F103 HydrophobicContact CD2-CD2 4.46Å; L98-F103 PolarHBondContact O-N 2.86Å; Y101-F103 PolarHBondContact O-N 3.42Å
104	A	82.6	Confident	93.1	Very high	95 Å²	95	64.8 Å²	64.8	79%	0.785	35%	0.346	S	S	*	.			trans	-80.8	-38.8	-177.2	0	0	0	0	0	113.5
105	E	83.2	Confident	92.9	Very high	167 Å²	167	69.7 Å²	69.7	78%	0.78	37%	0.369	S	S	*	.			trans	-110.9	67.6	-171.3	-65.5	-172.1	169.7	0	0	112.2
106	A	91.4	Very high	92.7	Very high	24 Å²	24	67 Å²	67	20%	0.198	37%	0.366	C	S	.	.			trans	-101.7	126.3	173.7	0	0	0	0	0	111	L72 L98 L108	L72-A106 HydrophobicContact CD1-CB 3.51Å; L98-A106 HydrophobicContact CD1-CB 3.44Å; L98-A106 VanDerWaalsContact CD1-CB 3.44Å; L98-A106 HydrophobicContact CD2-CB 4.49Å; A106-L108 HydrophobicContact CB-CD1 4.26Å; A106-L108 WeakPolarHBondContact O-CD1 3.35Å
107	K	94.5	Very high	92.5	Very high	99 Å²	99	67.7 Å²	67.7	43%	0.43	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	135.1	164.9	-65.3	-167.1	-165	161.9	0	109.7	V74 F109 H125	V74-K107 PolarHBondContact N-O 3.47Å; K107-F109 HydrophobicContact CB-CE2 3.82Å; K107-F109 HydrophobicContact CB-CZ 4.32Å; K107-F109 HydrophobicContact CD-CZ 4.33Å; K107-H125 WeakPolarHBondContact CD-ND1 3.36Å; K107-H125 PolarHBondContact NZ-ND1 3.49Å
108	L	96.6	Very high	92.4	Very high	30 Å²	30	68.7 Å²	68.7	16%	0.157	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.3	176.7	-77.8	68.9	0	0	0	108.8	V74 E91 V94 K95 L98 A106	V74-L108 HydrophobicContact CB-CG 4.15Å; V74-L108 CarbonylContact O-C 3.53Å; V74-L108 WeakPolarHBondContact O-CA 3.48Å; E91-L108 HydrophobicContact CB-CD2 4.47Å; E91-L108 HydrophobicContact CG-CD2 3.45Å; E91-L108 VanDerWaalsContact CG-CD2 3.45Å; V94-L108 HydrophobicContact CB-CD2 4.21Å; V94-L108 HydrophobicContact CG1-CD2 3.77Å; V94-L108 HydrophobicContact CG1-CG 4.23Å; K95-L108 HydrophobicContact CG-CD1 4.5Å; K95-L108 HydrophobicContact CG-CD2 4.08Å; L98-L108 HydrophobicContact CD1-CD1 4.22Å; A106-L108 HydrophobicContact CB-CD1 4.26Å; A106-L108 WeakPolarHBondContact O-CD1 3.35Å
109	F	97.1	Very high	92.3	Very high	33 Å²	33	70.3 Å²	70.3	15%	0.145	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.6	174.9	-67.8	-83.9	0	0	0	110.2	T73 V74 V75 L76 K107 A121 L122 H125	T73-F109 HydrophobicContact CG2-CD2 3.53Å; T73-F109 HydrophobicContact CG2-CE2 3.6Å; V74-F109 PolarHBondContact O-N 2.87Å; V75-F109 CarbonylContact C-O 3.52Å; V75-F109 WeakPolarHBondContact CA-O 3.36Å; L76-F109 PolarHBondContact N-O 3.2Å; K107-F109 HydrophobicContact CB-CE2 3.82Å; K107-F109 HydrophobicContact CB-CZ 4.32Å; K107-F109 HydrophobicContact CD-CZ 4.33Å; F109-A121 HydrophobicContact CD1-CB 4.19Å; F109-A121 HydrophobicContact CE1-CB 4.11Å; F109-L122 HydrophobicContact CD1-CB 4.49Å; F109-L122 HydrophobicContact CD2-CD1 3.83Å; F109-L122 HydrophobicContact CE2-CD1 4.21Å; F109-L122 HydrophobicContact CG-CB 4.43Å; F109-L122 HydrophobicContact CG-CD1 4.21Å; F109-H125 HydrophobicContact CE1-CB 4.33Å; F109-H125 HydrophobicContact CE2-CB 3.89Å; F109-H125 AromaticContact CE2-CD2 3.57Å; F109-H125 AromaticContact CE2-CG 3.7Å; F109-H125 HydrophobicContact CZ-CB 3.42Å; F109-H125 VanDerWaalsContact CZ-CB 3.42Å; F109-H125 AromaticContact CZ-CG 3.66Å
110	I	96.5	Very high	92.3	Very high	61 Å²	61	66.4 Å²	66.4	31%	0.313	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	125.7	175.1	-55.7	98.6	0	0	0	109.3	L76 A79 V87	L76-I110 HydrophobicContact CB-CG1 4.27Å; L76-I110 HydrophobicContact CD1-CG1 4.07Å; A79-I110 HydrophobicContact CB-CG2 3.59Å; V87-I110 HydrophobicContact CG1-CB 4.45Å; V87-I110 HydrophobicContact CG1-CG1 3.81Å; V87-I110 HydrophobicContact CG1-CG2 3.78Å
111	T	95.4	Very high	92.5	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.018	37%	0.367	C	S	.	.			trans	-144.8	151.3	-174	-177.6	0	0	0	0	113.2	V75 L76 T77 K78 A79 R117 I119	V75-T111 HydrophobicContact CG1-CG2 3.31Å; L76-T111 WeakPolarHBondContact O-CG2 3.47Å; L76-T111 PolarHBondContact O-N 2.96Å; T77-T111 CarbonylContact C-O 3.49Å; T77-T111 WeakPolarHBondContact CA-O 3.42Å; T77-T111 HydrophobicContact CG2-CG2 3.87Å; K78-T111 PolarHBondContact N-O 3.15Å; A79-T111 WeakPolarHBondContact CB-O 3.48Å; A79-T111 PolarHBondContact N-O 3.44Å; T111-R117 VanDerWaalsContact CA-O 3.24Å; T111-R117 WeakPolarHBondContact CA-O 3.32Å; T111-R117 WeakPolarHBondContact CB-O 3.02Å; T111-R117 PolarHBondContact OG1-O 2.78Å; T111-I119 WeakPolarHBondContact OG1-CD1 3.38Å
112	A	95.2	Very high	92.7	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-117.6	98.2	159.8	0	0	0	0	0	106.9	D80 T114 E115 G116 R117	D80-A112 HydrophobicContact CB-CB 3.86Å; D80-A112 WeakPolarHBondContact OD1-CB 3.5Å; A112-T114 PolarHBondContact O-N 3.25Å; A112-T114 VanDerWaalsContact O-N 3.12Å; A112-E115 HydrophobicContact CB-CB 4.16Å; A112-E115 HydrophobicContact CB-CG 4.09Å; A112-E115 PolarHBondContact O-N 3.16Å; A112-G116 PolarHBondContact O-N 3.43Å; A112-R117 HydrophobicContact CB-CB 4.4Å; A112-R117 PolarHBondContact N-O 3.18Å; A112-R117 PolarHBondContact O-N 2.79Å
113	A	91.7	Very high	92.8	Very high	70 Å²	70	65.2 Å²	65.2	58%	0.579	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-32.7	-173.5	0	0	0	0	0	112.8	E115 G116	A113-E115 VanDerWaalsContact C-N 3.32Å; A113-E115 PolarHBondContact O-N 3.18Å; A113-G116 PolarHBondContact O-N 3.41Å
114	T	92	Very high	92.9	Very high	133 Å²	133	70.5 Å²	70.5	82%	0.816	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-33.4	176.1	-42.9	0	0	0	0	113	A112	A112-T114 PolarHBondContact O-N 3.25Å; A112-T114 VanDerWaalsContact O-N 3.12Å
115	E	92.5	Very high	93.5	Very high	108 Å²	108	66.6 Å²	66.6	51%	0.505	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-13.1	179.7	-59.6	-176.3	166.8	0	0	112.6	A112 A113 R117	A112-E115 HydrophobicContact CB-CB 4.16Å; A112-E115 HydrophobicContact CB-CG 4.09Å; A112-E115 PolarHBondContact O-N 3.16Å; A113-E115 VanDerWaalsContact C-N 3.32Å; A113-E115 PolarHBondContact O-N 3.18Å; E115-R117 HydrophobicContact CB-CB 4.4Å; E115-R117 PolarHBondContact O-N 3.4Å; E115-R117 IonicContact OE1-NH2 3.04Å; E115-R117 IonicContact OE2-CZ 3.81Å; E115-R117 VanDerWaalsContact OE2-CZ 3.29Å; E115-R117 IonicContact OE2-NE 2.62Å; E115-R117 PolarHBondContact OE2-NE 2.99Å; E115-R117 VanDerWaalsContact OE2-NE 3.15Å; E115-R117 IonicContact OE2-NH2 2.8Å; E115-R117 PolarHBondContact OE2-NH2 3.45Å
116	G	91.6	Very high	94	Very high	34 Å²	34	59.9 Å²	59.9	35%	0.351	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.6	3.7	-170.4	0	0	0	0	0	114.3	A112 A113 G118 I119	A112-G116 PolarHBondContact O-N 3.43Å; A113-G116 PolarHBondContact O-N 3.41Å; G116-G118 PolarHBondContact O-N 3.2Å; G116-I119 WeakPolarHBondContact O-CB 3.38Å; G116-I119 WeakPolarHBondContact O-CG1 3.26Å; G116-I119 PolarHBondContact O-N 3.01Å
117	R	92.1	Very high	94	Very high	136 Å²	136	62.1 Å²	62.1	51%	0.513	33%	0.334	S	S	.	.	B	Isolated β-bridge	trans	-59.1	128.5	179.4	-172.1	-172.9	-56.5	-166.6	2.9	110.5	T111 A112 E115 I119	T111-R117 VanDerWaalsContact CA-O 3.24Å; T111-R117 WeakPolarHBondContact CA-O 3.32Å; T111-R117 WeakPolarHBondContact CB-O 3.02Å; T111-R117 PolarHBondContact OG1-O 2.78Å; A112-R117 HydrophobicContact CB-CB 4.4Å; A112-R117 PolarHBondContact N-O 3.18Å; A112-R117 PolarHBondContact O-N 2.79Å; E115-R117 HydrophobicContact CB-CB 4.4Å; E115-R117 PolarHBondContact O-N 3.4Å; E115-R117 IonicContact OE1-NH2 3.04Å; E115-R117 IonicContact OE2-CZ 3.81Å; E115-R117 VanDerWaalsContact OE2-CZ 3.29Å; E115-R117 IonicContact OE2-NE 2.62Å; E115-R117 PolarHBondContact OE2-NE 2.99Å; E115-R117 VanDerWaalsContact OE2-NE 3.15Å; E115-R117 IonicContact OE2-NH2 2.8Å; E115-R117 PolarHBondContact OE2-NH2 3.45Å; R117-I119 PolarHBondContact O-N 3.02Å
118	G	92.6	Very high	93.9	Very high	29 Å²	29	62.7 Å²	62.7	30%	0.299	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.6	-4	177	0	0	0	0	0	115.4	G116 D120 L122	G116-G118 PolarHBondContact O-N 3.2Å; G118-D120 PolarHBondContact O-N 3.06Å; G118-L122 PolarHBondContact O-N 3.03Å; G118-L122 VanDerWaalsContact O-N 3.15Å
119	I	93.9	Very high	93.6	Very high	41 Å²	41	62.2 Å²	62.2	21%	0.21	34%	0.336	C	S	.	.	H	α-helix	trans	-66.9	-36.4	179.7	-63.6	-61.5	0	0	0	111.6	T111 G116 R117 L122 R123	T111-I119 WeakPolarHBondContact OG1-CD1 3.38Å; G116-I119 WeakPolarHBondContact O-CB 3.38Å; G116-I119 WeakPolarHBondContact O-CG1 3.26Å; G116-I119 PolarHBondContact O-N 3.01Å; R117-I119 PolarHBondContact O-N 3.02Å; I119-L122 PolarHBondContact O-N 3.2Å; I119-R123 HydrophobicContact CG2-CG 4.33Å; I119-R123 WeakPolarHBondContact O-CG 3.27Å; I119-R123 PolarHBondContact O-N 3.05Å
120	D	94	Very high	93	Very high	110 Å²	110	64.8 Å²	64.8	59%	0.588	36%	0.356	S	S	*	.	H	α-helix	trans	-67.2	-41.7	179.8	-67.4	-31.1	0	0	0	112.4	G118 L122 R123 E124	G118-D120 PolarHBondContact O-N 3.06Å; D120-L122 VanDerWaalsContact C-N 3.31Å; D120-L122 PolarHBondContact O-N 2.82Å; D120-R123 WeakPolarHBondContact O-CB 3.31Å; D120-R123 PolarHBondContact O-N 3.22Å; D120-R123 IonicContact OD1-CZ 3.85Å; D120-R123 IonicContact OD1-NH1 3.15Å; D120-R123 PolarHBondContact OD1-NH1 2.73Å; D120-E124 PolarHBondContact O-N 3.22Å; D120-E124 VanDerWaalsContact O-N 3.08Å
121	A	94.6	Very high	92.4	Very high	49 Å²	49	66.2 Å²	66.2	41%	0.405	36%	0.361	S	S	.	.	H	α-helix	trans	-63.2	-38.3	173.8	0	0	0	0	0	111.8	F109 H125	F109-A121 HydrophobicContact CD1-CB 4.19Å; F109-A121 HydrophobicContact CE1-CB 4.11Å; A121-H125 PolarHBondContact O-N 3.16Å
122	L	95.5	Very high	91.6	Very high	18 Å²	18	72.2 Å²	72.2	9%	0.094	38%	0.383	C	S	.	.	H	α-helix	trans	-64.6	-44.1	174.1	178	60.8	0	0	0	111.5	L44 T73 V75 F109 G118 I119 D120 E124 H125 L126	L44-L122 HydrophobicContact CD1-CD1 4.22Å; T73-L122 HydrophobicContact CG2-CD1 4.34Å; V75-L122 HydrophobicContact CG1-CD2 4.4Å; V75-L122 HydrophobicContact CG2-CD1 3.98Å; V75-L122 HydrophobicContact CG2-CD2 3.99Å; F109-L122 HydrophobicContact CD1-CB 4.49Å; F109-L122 HydrophobicContact CD2-CD1 3.83Å; F109-L122 HydrophobicContact CE2-CD1 4.21Å; F109-L122 HydrophobicContact CG-CB 4.43Å; F109-L122 HydrophobicContact CG-CD1 4.21Å; G118-L122 PolarHBondContact O-N 3.03Å; G118-L122 VanDerWaalsContact O-N 3.15Å; I119-L122 PolarHBondContact O-N 3.2Å; D120-L122 VanDerWaalsContact C-N 3.31Å; D120-L122 PolarHBondContact O-N 2.82Å; L122-E124 PolarHBondContact O-N 3Å; L122-H125 PolarHBondContact O-N 3.13Å; L122-L126 HydrophobicContact CD1-CD1 4.38Å; L122-L126 HydrophobicContact CD1-CD2 4.42Å; L122-L126 HydrophobicContact CD1-CG 4.16Å; L122-L126 HydrophobicContact CG-CD1 4.12Å; L122-L126 HydrophobicContact CG-CG 4.33Å; L122-L126 VanDerWaalsContact O-CG 3.32Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 3.4Å
123	R	94.3	Very high	91	Very high	119 Å²	119	81.4 Å²	81.4	45%	0.449	43%	0.426	S	S	.	.	H	α-helix	trans	-57.3	-47.3	177.8	-76.7	170.1	179.3	159.8	-3.6	111.7	W10 I119 D120 H125 L126 L127	W10-R123 HydrophobicContact CH2-CB 4.08Å; W10-R123 HydrophobicContact CH2-CG 4.06Å; W10-R123 HydrophobicContact CZ2-CG 4.24Å; I119-R123 HydrophobicContact CG2-CG 4.33Å; I119-R123 WeakPolarHBondContact O-CG 3.27Å; I119-R123 PolarHBondContact O-N 3.05Å; D120-R123 WeakPolarHBondContact O-CB 3.31Å; D120-R123 PolarHBondContact O-N 3.22Å; D120-R123 IonicContact OD1-CZ 3.85Å; D120-R123 IonicContact OD1-NH1 3.15Å; D120-R123 PolarHBondContact OD1-NH1 2.73Å; R123-H125 VanDerWaalsContact C-N 3.31Å; R123-H125 PolarHBondContact O-N 3.41Å; R123-L126 PolarHBondContact O-N 2.97Å; R123-L127 WeakPolarHBondContact O-CG 3.11Å; R123-L127 PolarHBondContact O-N 3.15Å; R123-L127 VanDerWaalsContact O-N 3.11Å
124	E	94	Very high	90.3	Very high	122 Å²	122	81.8 Å²	81.8	57%	0.57	42%	0.416	S	S	*	.	H	α-helix	trans	-58.6	-45	178.7	-170	-174.3	167	0	0	111.2	D120 L122 L127 Q128	D120-E124 PolarHBondContact O-N 3.22Å; D120-E124 VanDerWaalsContact O-N 3.08Å; L122-E124 PolarHBondContact O-N 3Å; E124-L127 PolarHBondContact O-N 2.92Å; E124-Q128 WeakPolarHBondContact O-CG 3.5Å; E124-Q128 PolarHBondContact O-N 2.71Å; E124-Q128 PolarHBondContact OE1-NE2 3.35Å
125	H	94.5	Very high	89.5	Confident	13 Å²	13	77.9 Å²	77.9	6%	0.06	40%	0.397	C	S	.	.	H	α-helix	trans	-63.9	-42.1	177	173.1	66.6	0	0	0	113	T73 K107 F109 A121 L122 R123 L127 Q128 L129	T73-H125 PolarHBondContact OG1-NE2 3.22Å; K107-H125 WeakPolarHBondContact CD-ND1 3.36Å; K107-H125 PolarHBondContact NZ-ND1 3.49Å; F109-H125 HydrophobicContact CE1-CB 4.33Å; F109-H125 HydrophobicContact CE2-CB 3.89Å; F109-H125 AromaticContact CE2-CD2 3.57Å; F109-H125 AromaticContact CE2-CG 3.7Å; F109-H125 HydrophobicContact CZ-CB 3.42Å; F109-H125 VanDerWaalsContact CZ-CB 3.42Å; F109-H125 AromaticContact CZ-CG 3.66Å; A121-H125 PolarHBondContact O-N 3.16Å; L122-H125 PolarHBondContact O-N 3.13Å; R123-H125 VanDerWaalsContact C-N 3.31Å; R123-H125 PolarHBondContact O-N 3.41Å; H125-L127 VanDerWaalsContact C-N 3.26Å; H125-L127 PolarHBondContact O-N 3.29Å; H125-Q128 WeakPolarHBondContact O-CB 3.44Å; H125-Q128 PolarHBondContact O-N 2.97Å; H125-L129 PolarHBondContact O-N 3.19Å
126	L	93.5	Very high	89	Confident	26 Å²	26	76.7 Å²	76.7	14%	0.136	40%	0.401	C	S	.	.	H	α-helix	trans	-61.6	-34.9	178.2	-68.3	176.7	0	0	0	112.3	F20 L122 R123 Q128 L129	F20-L126 HydrophobicContact CE1-CD1 4.12Å; F20-L126 HydrophobicContact CZ-CD1 4.09Å; L122-L126 HydrophobicContact CD1-CD1 4.38Å; L122-L126 HydrophobicContact CD1-CD2 4.42Å; L122-L126 HydrophobicContact CD1-CG 4.16Å; L122-L126 HydrophobicContact CG-CD1 4.12Å; L122-L126 HydrophobicContact CG-CG 4.33Å; L122-L126 VanDerWaalsContact O-CG 3.32Å; L122-L126 WeakPolarHBondContact O-CG 3.41Å; L122-L126 PolarHBondContact O-N 3.4Å; R123-L126 PolarHBondContact O-N 2.97Å; L126-Q128 VanDerWaalsContact C-N 3.32Å; L126-L129 HydrophobicContact CD2-CD1 3.78Å; L126-L129 WeakPolarHBondContact O-CB 3.41Å; L126-L129 PolarHBondContact O-N 3.1Å
127	L	92.4	Very high	88.7	Confident	71 Å²	71	77.9 Å²	77.9	37%	0.372	40%	0.397	S	S	.	.	H	α-helix	trans	-71.8	-25.8	175.4	-65.2	177	0	0	0	112.9	W10 Q12 R123 E124 H125 L129	W10-L127 HydrophobicContact CE3-CD2 4.46Å; W10-L127 HydrophobicContact CH2-CD1 4.08Å; W10-L127 HydrophobicContact CH2-CD2 3.89Å; W10-L127 HydrophobicContact CH2-CG 3.98Å; W10-L127 HydrophobicContact CZ3-CD2 3.56Å; W10-L127 HydrophobicContact CZ3-CG 3.93Å; Q12-L127 HydrophobicContact CG-CD2 3.69Å; R123-L127 WeakPolarHBondContact O-CG 3.11Å; R123-L127 PolarHBondContact O-N 3.15Å; R123-L127 VanDerWaalsContact O-N 3.11Å; E124-L127 PolarHBondContact O-N 2.92Å; H125-L127 VanDerWaalsContact C-N 3.26Å; H125-L127 PolarHBondContact O-N 3.29Å; L127-L129 VanDerWaalsContact C-N 3.29Å
128	Q	91.7	Very high	88.7	Confident	111 Å²	111	73.9 Å²	73.9	52%	0.519	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-10.5	175.9	-68.9	170.2	5.2	0	0	113.4	E124 H125 L126	E124-Q128 WeakPolarHBondContact O-CG 3.5Å; E124-Q128 PolarHBondContact O-N 2.71Å; E124-Q128 PolarHBondContact OE1-NE2 3.35Å; H125-Q128 WeakPolarHBondContact O-CB 3.44Å; H125-Q128 PolarHBondContact O-N 2.97Å; L126-Q128 VanDerWaalsContact C-N 3.32Å
129	L	90.2	Very high	88.7	Confident	20 Å²	20	73.2 Å²	73.2	11%	0.105	38%	0.375	C	S	.	.	S	Bend	trans	-67.8	131.7	-177.7	-66.6	174.9	0	0	0	111.1	R16 H42 H125 L126 L127	R16-L129 PolarHBondContact NH1-O 3.44Å; H42-L129 HydrophobicContact CB-CD1 3.91Å; H42-L129 WeakPolarHBondContact CD2-CD1 3.23Å; H42-L129 VanDerWaalsContact CE1-CD2 3.47Å; H42-L129 WeakPolarHBondContact CE1-CD2 3.5Å; H42-L129 VanDerWaalsContact CG-CD1 3.46Å; H42-L129 WeakPolarHBondContact ND1-CD2 3.43Å; H125-L129 PolarHBondContact O-N 3.19Å; L126-L129 HydrophobicContact CD2-CD1 3.78Å; L126-L129 WeakPolarHBondContact O-CB 3.41Å; L126-L129 PolarHBondContact O-N 3.1Å; L127-L129 VanDerWaalsContact C-N 3.29Å
130	P	85	Confident	88.8	Confident	87 Å²	87	71.6 Å²	71.6	57%	0.565	37%	0.366	S	S	*	.	P	Polyproline II helix	trans	-66.3	144.6	178.3	29.1	-34.3	0	0	0	110.4
131	E	83.5	Confident	88.8	Confident	91 Å²	91	67.4 Å²	67.4	43%	0.425	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-80.1	138.8	161.4	-158.2	152.7	147.8	0	0	108.2	R16 E133	R16-E131 IonicContact CZ-OE2 2.99Å; R16-E131 IonicContact NE-OE2 3.9Å; R16-E131 PolarHBondContact NE-OE2 2.78Å; R16-E131 IonicContact NH2-OE2 2.62Å; R16-E131 PolarHBondContact NH2-OE2 2.93Å; R16-E131 VanDerWaalsContact NH2-OE2 3.15Å; E131-E133 PolarHBondContact O-N 2.96Å
132	R	79.9	Confident	88.8	Confident	128 Å²	128	65.1 Å²	65.1	48%	0.483	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-71.7	125.3	172.8	-75.8	-174.1	157.7	172.8	-5	109.2	D41 H134	D41-R132 HydrophobicContact CB-CG 4.41Å; D41-R132 VanDerWaalsContact OD1-CB 3.31Å; D41-R132 WeakPolarHBondContact OD1-CB 3.46Å; D41-R132 WeakPolarHBondContact OD1-CD 3.02Å; D41-R132 VanDerWaalsContact OD1-CG 3.27Å; D41-R132 WeakPolarHBondContact OD1-CG 3.41Å; R132-H134 PolarHBondContact O-CD2 3.03Å; R132-H134 VanDerWaalsContact O-CD2 3.27Å
133	E	81.5	Confident	88.7	Confident	193 Å²	193	64.6 Å²	64.6	90%	0.902	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-71.1	134.4	169.8	-67.1	-174.7	176.7	0	0	109.5	E131	E131-E133 PolarHBondContact O-N 2.96Å
134	H	76.2	Confident	88.6	Confident	79 Å²	79	59 Å²	59	37%	0.366	30%	0.3	S	S	.	.			trans	-110.2	133.4	173.5	-64	-83.5	0	0	0	108.4	R132 S136 A198 G199	R132-H134 PolarHBondContact O-CD2 3.03Å; R132-H134 VanDerWaalsContact O-CD2 3.27Å; H134-S136 PolarHBondContact O-N 3.12Å; H134-A198 HydrophobicContact CB-CB 3.91Å; H134-G199 WeakPolarHBondContact NE2-CA 3.37Å; H134-G199 PolarHBondContact NE2-N 3.35Å
135	A	77	Confident	88.3	Confident	50 Å²	50	53.4 Å²	53.4	41%	0.413	27%	0.274	S	S	.	.			trans	-65.7	135.6	179	0	0	0	0	0	110.4	Q137 H138	A135-Q137 PolarHBondContact O-N 2.85Å; A135-H138 PolarHBondContact O-CD2 2.84Å; A135-H138 PolarHBondContact O-N 3.44Å
136	S	80	Confident	88	Confident	84 Å²	84	56.7 Å²	56.7	59%	0.587	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.2	-178.6	-172.3	0	0	0	0	112.6	H134 H138 N355	H134-S136 PolarHBondContact O-N 3.12Å; S136-H138 VanDerWaalsContact C-N 3.28Å; S136-H138 PolarHBondContact O-N 3.12Å; S136-N355 PolarHBondContact O-ND2 3.48Å
137	Q	86.4	Confident	87.9	Confident	58 Å²	58	56.6 Å²	56.6	27%	0.271	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88	14.8	-173.3	-64	77.2	16	0	0	113.8	A135 N355 E357	A135-Q137 PolarHBondContact O-N 2.85Å; Q137-N355 VanDerWaalsContact C-CG 3.41Å; Q137-N355 WeakPolarHBondContact CA-ND2 3.4Å; Q137-N355 PolarHBondContact O-N 2.67Å; Q137-N355 PolarHBondContact O-OD1 2.78Å; Q137-E357 HydrophobicContact CG-CB 4.42Å
138	H	91	Very high	87.9	Confident	52 Å²	52	57.1 Å²	57.1	24%	0.241	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-97.6	148.6	176.9	-70.2	-63.2	0	0	0	113.3	A135 S136 R352 Q353	A135-H138 PolarHBondContact O-CD2 2.84Å; A135-H138 PolarHBondContact O-N 3.44Å; S136-H138 VanDerWaalsContact C-N 3.28Å; S136-H138 PolarHBondContact O-N 3.12Å; H138-R352 PolarHBondContact ND1-O 3.42Å; H138-Q353 CarbonylContact C-O 3.59Å; H138-Q353 VanDerWaalsContact CA-O 3.23Å; H138-Q353 WeakPolarHBondContact CA-O 3.34Å; H138-Q353 PolarHBondContact ND1-O 3.16Å
139	S	93.3	Very high	87.9	Confident	16 Å²	16	56.2 Å²	56.2	11%	0.112	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-66.7	143.1	171.5	-62.7	0	0	0	0	110.8	R141 S163 Q353 L354	S139-R141 PolarHBondContact O-N 3.16Å; S139-S163 CarbonylContact O-C 3.59Å; S139-S163 PolarHBondContact O-OG 2.88Å; S139-Q353 PolarHBondContact N-O 2.86Å; S139-L354 PolarHBondContact OG-O 3.08Å
140	F	95.5	Very high	87.9	Confident	6 Å²	6	58.2 Å²	58.2	3%	0.026	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-64.2	128.6	175.2	-177.1	-102.6	0	0	0	110.3	L142 A161 S163 V166 L172 I202 L204 L222 A223	F140-L142 HydrophobicContact CE1-CB 3.76Å; F140-L142 HydrophobicContact CZ-CB 3.81Å; F140-L142 HydrophobicContact CZ-CD1 4.16Å; F140-L142 HydrophobicContact CZ-CG 4.5Å; F140-A161 HydrophobicContact CE2-CB 4.03Å; F140-A161 HydrophobicContact CZ-CB 4.49Å; F140-S163 VanDerWaalsContact CA-O 3.3Å; F140-S163 WeakPolarHBondContact CA-O 3.37Å; F140-V166 HydrophobicContact CD1-CB 4.24Å; F140-V166 HydrophobicContact CD2-CB 3.81Å; F140-V166 HydrophobicContact CD2-CG1 4.1Å; F140-V166 HydrophobicContact CE1-CB 4.08Å; F140-V166 HydrophobicContact CE1-CG1 4.23Å; F140-V166 HydrophobicContact CE1-CG2 4.41Å; F140-V166 HydrophobicContact CE2-CB 3.63Å; F140-V166 HydrophobicContact CE2-CG1 3.41Å; F140-V166 VanDerWaalsContact CE2-CG1 3.41Å; F140-V166 HydrophobicContact CG-CB 4.11Å; F140-V166 HydrophobicContact CZ-CB 3.76Å; F140-V166 HydrophobicContact CZ-CG1 3.47Å; F140-V166 VanDerWaalsContact CZ-CG1 3.47Å; F140-V166 HydrophobicContact CZ-CG2 4.45Å; F140-L172 HydrophobicContact CD1-CD1 4.24Å; F140-L172 HydrophobicContact CD1-CD2 3.75Å; F140-L172 HydrophobicContact CE1-CD1 3.89Å; F140-L172 HydrophobicContact CE1-CD2 4.25Å; F140-I202 HydrophobicContact CE2-CD1 4.15Å; F140-I202 HydrophobicContact CZ-CD1 4.32Å; F140-L204 HydrophobicContact CE1-CD1 4.32Å; F140-L204 HydrophobicContact CZ-CD1 4.31Å; F140-L222 WeakPolarHBondContact O-CA 3.17Å; F140-L222 WeakPolarHBondContact O-CB 3.42Å; F140-A223 HydrophobicContact CB-CB 4.39Å; F140-A223 PolarHBondContact O-N 2.89Å
141	R	94.7	Very high	88.1	Confident	23 Å²	23	64.3 Å²	64.3	9%	0.087	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	115.2	179.3	-173.8	170.3	65.5	150	2	110.7	S139 L162 S163 W220 D284	S139-R141 PolarHBondContact O-N 3.16Å; R141-L162 PolarHBondContact O-N 3.14Å; R141-S163 WeakPolarHBondContact CB-OG 3.27Å; R141-S163 PolarHBondContact N-O 3.42Å; R141-W220 HydrophobicContact CG-CE3 3.59Å; R141-W220 HydrophobicContact CG-CZ3 3.68Å; R141-D284 IonicContact CZ-OD1 3.76Å; R141-D284 IonicContact CZ-OD2 3.08Å; R141-D284 IonicContact NH1-OD1 3.29Å; R141-D284 PolarHBondContact NH1-OD1 2.95Å; R141-D284 IonicContact NH1-OD2 2.87Å; R141-D284 PolarHBondContact NH1-OD2 2.95Å; R141-D284 IonicContact NH2-OD1 2.8Å; R141-D284 PolarHBondContact NH2-OD1 3.29Å; R141-D284 IonicContact NH2-OD2 3.5Å
142	L	94.3	Very high	88.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.6	-179.3	-175.5	93.6	0	0	0	110.6	F140 T160 A161 I202 L204 W220 L221	F140-L142 HydrophobicContact CE1-CB 3.76Å; F140-L142 HydrophobicContact CZ-CB 3.81Å; F140-L142 HydrophobicContact CZ-CD1 4.16Å; F140-L142 HydrophobicContact CZ-CG 4.5Å; L142-T160 WeakPolarHBondContact CA-O 3.46Å; L142-A161 HydrophobicContact CD1-CB 3.98Å; L142-I202 HydrophobicContact CD1-CB 4.16Å; L142-I202 HydrophobicContact CD1-CD1 4.36Å; L142-L204 HydrophobicContact CD2-CD1 3.7Å; L142-L204 HydrophobicContact CD2-CG 4.41Å; L142-W220 WeakPolarHBondContact O-CA 3.42Å; L142-L221 HydrophobicContact CB-CB 4.16Å; L142-L221 HydrophobicContact CD2-CB 4.2Å; L142-L221 HydrophobicContact CD2-CD1 4.02Å; L142-L221 PolarHBondContact N-O 3.06Å; L142-L221 PolarHBondContact O-N 2.77Å
143	A	93.3	Very high	88.3	Confident	7 Å²	7	59.1 Å²	59.1	6%	0.058	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.6	171.4	0	0	0	0	0	110	D145 G159 T160 L162 W220 A254	A143-D145 PolarHBondContact O-N 2.88Å; A143-G159 CarbonylContact O-C 3.5Å; A143-G159 WeakPolarHBondContact O-CA 3.31Å; A143-T160 PolarHBondContact N-O 3.08Å; A143-T160 PolarHBondContact O-N 2.89Å; A143-L162 HydrophobicContact CB-CD1 3.86Å; A143-W220 HydrophobicContact CB-CE3 4.13Å; A143-W220 HydrophobicContact CB-CH2 4.08Å; A143-W220 HydrophobicContact CB-CZ3 3.66Å; A143-A254 HydrophobicContact CB-CB 4.28Å
144	I	92.9	Very high	88.7	Confident	1 Å²	1	51.1 Å²	51.1	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	124.7	-179.8	-61.3	178.4	0	0	0	110.2	V157 L174 I215 G218 D219 L221	I144-V157 HydrophobicContact CG2-CB 4.4Å; I144-L174 HydrophobicContact CD1-CD1 3.58Å; I144-I215 HydrophobicContact CD1-CG2 4.19Å; I144-I215 HydrophobicContact CG2-CG2 4.3Å; I144-G218 PolarHBondContact O-N 2.9Å; I144-D219 VanDerWaalsContact CB-O 3.29Å; I144-D219 WeakPolarHBondContact CB-O 3.47Å; I144-D219 HydrophobicContact CD1-CB 4.04Å; I144-D219 VanDerWaalsContact CG1-O 3.32Å; I144-D219 WeakPolarHBondContact CG1-O 3.44Å; I144-D219 PolarHBondContact N-O 3.06Å; I144-L221 HydrophobicContact CD1-CD1 4.18Å; I144-L221 HydrophobicContact CD1-CG 4.08Å; I144-L221 HydrophobicContact CG1-CD1 4.46Å
145	D	87	Confident	89.6	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.027	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	-35.8	174.7	76.5	98.6	0	0	0	113.2	Y7 A143 T158 G159 R201 R217	Y7-D145 PolarHBondContact OH-OD1 3.1Å; A143-D145 PolarHBondContact O-N 2.88Å; D145-T158 PolarHBondContact N-O 2.85Å; D145-T158 PolarHBondContact OD1-OG1 3.3Å; D145-T158 WeakPolarHBondContact OD2-CB 3.45Å; D145-T158 PolarHBondContact OD2-OG1 2.8Å; D145-G159 WeakPolarHBondContact OD2-CA 3.49Å; D145-G159 PolarHBondContact OD2-N 2.77Å; D145-R201 VanDerWaalsContact CG-NH1 3.29Å; D145-R201 IonicContact OD1-CZ 2.79Å; D145-R201 IonicContact OD1-NH2 2.76Å; D145-R201 PolarHBondContact OD1-NH2 3.27Å; D145-R201 VanDerWaalsContact OD1-NH2 3.16Å; D145-R201 IonicContact OD2-CZ 3.81Å; D145-R201 IonicContact OD2-NH1 3.62Å; D145-R201 PolarHBondContact OD2-NH1 3.36Å; D145-R201 IonicContact OD2-NH2 3.13Å; D145-R201 PolarHBondContact OD2-NH2 2.94Å; D145-R217 PolarHBondContact O-NE 2.8Å; D145-R217 PolarHBondContact O-NH2 2.85Å
146	R	87.8	Confident	90.5	Very high	83 Å²	83	46.5 Å²	46.5	31%	0.313	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	143.4	-177.6	-72	170.2	178	167.3	7.3	110	D4 L5 V157 T158	D4-R146 IonicContact OD2-CZ 3.67Å; D4-R146 IonicContact OD2-NE 2.96Å; D4-R146 IonicContact OD2-NH2 3.83Å; D4-R146 PolarHBondContact OD2-NH2 3.33Å; L5-R146 PolarHBondContact O-NH2 2.85Å; R146-V157 CarbonylContact O-C 3.56Å; R146-V157 WeakPolarHBondContact O-CA 3.3Å; R146-T158 WeakPolarHBondContact CB-OG1 3.28Å; R146-T158 PolarHBondContact N-O 2.96Å; R146-T158 PolarHBondContact O-N 2.91Å
147	A	92.5	Very high	91.2	Very high	24 Å²	24	42.5 Å²	42.5	20%	0.198	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	130.4	172.5	0	0	0	0	0	109.3	V157 K212 I215	A147-V157 HydrophobicContact CB-CG1 3.93Å; A147-K212 HydrophobicContact CB-CG 4.44Å; A147-K212 VanDerWaalsContact O-CE 3.24Å; A147-K212 WeakPolarHBondContact O-CE 3.4Å; A147-I215 HydrophobicContact CB-CB 4.26Å; A147-I215 HydrophobicContact CB-CG2 3.78Å
148	F	92.3	Very high	91.5	Very high	82 Å²	82	40.7 Å²	40.7	36%	0.36	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	155.4	177.7	54.3	-89.4	0	0	0	111.1	V150 V156 T158	F148-V150 HydrophobicContact CD2-CG2 3.66Å; F148-V150 HydrophobicContact CE2-CG2 3.56Å; F148-V156 HydrophobicContact CD2-CB 4.21Å; F148-V156 HydrophobicContact CE2-CB 3.81Å; F148-V156 HydrophobicContact CE2-CG1 3.91Å; F148-V156 HydrophobicContact CZ-CB 4.16Å; F148-V156 HydrophobicContact CZ-CG1 3.81Å; F148-V156 PolarHBondContact N-O 2.96Å; F148-V156 CarbonylContact O-C 3.59Å; F148-V156 PolarHBondContact O-N 2.86Å; F148-T158 HydrophobicContact CE1-CG2 3.76Å; F148-T158 HydrophobicContact CZ-CG2 4.03Å
149	T	92.1	Very high	91.5	Very high	91 Å²	91	38.2 Å²	38.2	56%	0.558	22%	0.223	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	124.8	178.4	-51.8	0	0	0	0	108.8	G154	T149-G154 WeakPolarHBondContact CA-O 3.48Å
150	V	90.6	Very high	91.3	Very high	62 Å²	62	37.9 Å²	37.9	38%	0.376	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	126.2	174.8	-179.7	0	0	0	0	108.6	F148 G152 A153 G154 V156	F148-V150 HydrophobicContact CD2-CG2 3.66Å; F148-V150 HydrophobicContact CE2-CG2 3.56Å; V150-G152 PolarHBondContact O-N 3.49Å; V150-G152 VanDerWaalsContact O-N 3.14Å; V150-A153 HydrophobicContact CB-CB 4.12Å; V150-A153 HydrophobicContact CG1-CB 4.23Å; V150-A153 PolarHBondContact O-N 3.15Å; V150-A153 VanDerWaalsContact O-N 3.08Å; V150-G154 PolarHBondContact N-O 3.49Å; V150-G154 PolarHBondContact O-N 3.11Å; V150-G154 VanDerWaalsContact O-N 3.08Å; V150-V156 HydrophobicContact CB-CG2 4.29Å; V150-V156 HydrophobicContact CG2-CB 4.32Å; V150-V156 HydrophobicContact CG2-CG2 3.83Å
151	K	87.9	Confident	91.2	Very high	215 Å²	215	37.6 Å²	37.6	94%	0.935	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.5	120.5	-179.9	-172.1	180	-179	-178.7	0	110.1	A153	K151-A153 PolarHBondContact O-N 3.04Å
152	G	85.2	Confident	91	Very high	80 Å²	80	38.1 Å²	38.1	83%	0.825	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	91	-27.2	179.7	0	0	0	0	0	115.3	V150	V150-G152 PolarHBondContact O-N 3.49Å; V150-G152 VanDerWaalsContact O-N 3.14Å
153	A	83	Confident	90.8	Very high	31 Å²	31	38.6 Å²	38.6	26%	0.256	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-35.6	179.4	0	0	0	0	0	112.6	V150 K151 R184 N205	V150-A153 HydrophobicContact CB-CB 4.12Å; V150-A153 HydrophobicContact CG1-CB 4.23Å; V150-A153 PolarHBondContact O-N 3.15Å; V150-A153 VanDerWaalsContact O-N 3.08Å; K151-A153 PolarHBondContact O-N 3.04Å; A153-R184 PolarHBondContact O-NH1 3.32Å; A153-N205 PolarHBondContact O-ND2 3.12Å; A153-N205 PolarHBondContact O-OD1 3.28Å
154	G	90.8	Very high	90.8	Very high	25 Å²	25	38.8 Å²	38.8	26%	0.258	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	107.6	-151.4	-176.4	0	0	0	0	0	112.4	T149 V150 V156	T149-G154 WeakPolarHBondContact CA-O 3.48Å; V150-G154 PolarHBondContact N-O 3.49Å; V150-G154 PolarHBondContact O-N 3.11Å; V150-G154 VanDerWaalsContact O-N 3.08Å; G154-V156 PolarHBondContact O-N 3.03Å
155	L	94.9	Very high	90.8	Very high	17 Å²	17	43.2 Å²	43.2	9%	0.089	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	119.4	179.2	175.1	64.2	0	0	0	109.9	V157 M181 N205 I206 K212 I215	L155-V157 HydrophobicContact CD1-CG1 4.35Å; L155-V157 HydrophobicContact CG-CG1 4.29Å; L155-M181 HydrophobicContact CD2-CE 4.17Å; L155-N205 WeakPolarHBondContact O-CA 3.37Å; L155-N205 PolarHBondContact O-OD1 3Å; L155-I206 HydrophobicContact CD2-CD1 4.09Å; L155-I206 HydrophobicContact CD2-CG1 4.01Å; L155-I206 HydrophobicContact CG-CG1 4.17Å; L155-I206 PolarHBondContact O-N 3.29Å; L155-K212 HydrophobicContact CD1-CB 4.1Å; L155-I215 HydrophobicContact CD1-CD1 4.24Å; L155-I215 HydrophobicContact CD2-CD1 3.42Å; L155-I215 VanDerWaalsContact CD2-CD1 3.42Å; L155-I215 HydrophobicContact CG-CD1 4.34Å
156	V	94.6	Very high	91.2	Very high	15 Å²	15	43 Å²	43	9%	0.091	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.4	173.5	-177.6	0	0	0	0	108.1	F148 V150 G154 A203 L204 N205	F148-V156 HydrophobicContact CD2-CB 4.21Å; F148-V156 HydrophobicContact CE2-CB 3.81Å; F148-V156 HydrophobicContact CE2-CG1 3.91Å; F148-V156 HydrophobicContact CZ-CB 4.16Å; F148-V156 HydrophobicContact CZ-CG1 3.81Å; F148-V156 PolarHBondContact N-O 2.96Å; F148-V156 CarbonylContact O-C 3.59Å; F148-V156 PolarHBondContact O-N 2.86Å; V150-V156 HydrophobicContact CB-CG2 4.29Å; V150-V156 HydrophobicContact CG2-CB 4.32Å; V150-V156 HydrophobicContact CG2-CG2 3.83Å; G154-V156 PolarHBondContact O-N 3.03Å; V156-A203 HydrophobicContact CG1-CB 4.18Å; V156-L204 WeakPolarHBondContact CA-O 3.45Å; V156-N205 HydrophobicContact CG2-CB 4.16Å
157	V	94.7	Very high	91.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	137.9	171.2	-59.8	0	0	0	0	108.6	I144 R146 A147 L155 A203 L204 I206 I215 L221	I144-V157 HydrophobicContact CG2-CB 4.4Å; R146-V157 CarbonylContact O-C 3.56Å; R146-V157 WeakPolarHBondContact O-CA 3.3Å; A147-V157 HydrophobicContact CB-CG1 3.93Å; L155-V157 HydrophobicContact CD1-CG1 4.35Å; L155-V157 HydrophobicContact CG-CG1 4.29Å; V157-A203 CarbonylContact O-C 3.55Å; V157-L204 HydrophobicContact CG2-CB 4.09Å; V157-L204 PolarHBondContact N-O 2.74Å; V157-L204 PolarHBondContact O-N 3.16Å; V157-I206 HydrophobicContact CG1-CD1 3.99Å; V157-I206 HydrophobicContact CG2-CD1 3.87Å; V157-I206 HydrophobicContact CG2-CG1 4.42Å; V157-I215 HydrophobicContact CG1-CD1 4.21Å; V157-L221 HydrophobicContact CG2-CD1 3.54Å
158	T	92.6	Very high	91.8	Very high	19 Å²	19	46 Å²	46	12%	0.117	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	148.8	170.7	61.4	0	0	0	0	109.1	D145 R146 F148 I202 A203	D145-T158 PolarHBondContact N-O 2.85Å; D145-T158 PolarHBondContact OD1-OG1 3.3Å; D145-T158 WeakPolarHBondContact OD2-CB 3.45Å; D145-T158 PolarHBondContact OD2-OG1 2.8Å; R146-T158 WeakPolarHBondContact CB-OG1 3.28Å; R146-T158 PolarHBondContact N-O 2.96Å; R146-T158 PolarHBondContact O-N 2.91Å; F148-T158 HydrophobicContact CE1-CG2 3.76Å; F148-T158 HydrophobicContact CZ-CG2 4.03Å; T158-I202 WeakPolarHBondContact CA-O 3.22Å; T158-A203 HydrophobicContact CG2-CB 3.79Å
159	G	91.3	Very high	91.9	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.7	169	179.2	0	0	0	0	0	112.1	A143 D145 R201 I202	A143-G159 CarbonylContact O-C 3.5Å; A143-G159 WeakPolarHBondContact O-CA 3.31Å; D145-G159 WeakPolarHBondContact OD2-CA 3.49Å; D145-G159 PolarHBondContact OD2-N 2.77Å; G159-R201 VanDerWaalsContact CA-NH1 3.32Å; G159-R201 WeakPolarHBondContact O-CA 3.42Å; G159-R201 PolarHBondContact O-NH1 3.09Å; G159-I202 PolarHBondContact N-O 3.46Å; G159-I202 PolarHBondContact O-N 3.44Å
160	T	90	Very high	92.1	Very high	10 Å²	10	42.1 Å²	42.1	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.1	168.8	-52.9	0	0	0	0	108.2	L142 A143 L162 R201	L142-T160 WeakPolarHBondContact CA-O 3.46Å; A143-T160 PolarHBondContact N-O 3.08Å; A143-T160 PolarHBondContact O-N 2.89Å; T160-L162 VanDerWaalsContact O-CD1 3.28Å; T160-L162 WeakPolarHBondContact O-CD1 3.37Å; T160-L162 PolarHBondContact O-N 2.95Å; T160-R201 WeakPolarHBondContact OG1-CD 3.37Å; T160-R201 PolarHBondContact OG1-NH1 2.89Å
161	A	92.4	Very high	92.4	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.8	174	0	0	0	0	0	109.3	F140 L142 G199 Q200 I202	F140-A161 HydrophobicContact CE2-CB 4.03Å; F140-A161 HydrophobicContact CZ-CB 4.49Å; L142-A161 HydrophobicContact CD1-CB 3.98Å; A161-G199 PolarHBondContact O-N 3.44Å; A161-Q200 PolarHBondContact N-O 2.91Å; A161-Q200 VanDerWaalsContact N-O 3.08Å; A161-I202 HydrophobicContact CB-CD1 3.48Å; A161-I202 VanDerWaalsContact CB-CD1 3.48Å; A161-I202 HydrophobicContact CB-CG1 4.2Å
162	L	89.9	Confident	92.9	Very high	33 Å²	33	32.7 Å²	32.7	17%	0.173	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-34.9	-179.8	-79.8	69.3	0	0	0	111.1	R141 A143 T160 W220	R141-L162 PolarHBondContact O-N 3.14Å; A143-L162 HydrophobicContact CB-CD1 3.86Å; T160-L162 VanDerWaalsContact O-CD1 3.28Å; T160-L162 WeakPolarHBondContact O-CD1 3.37Å; T160-L162 PolarHBondContact O-N 2.95Å; L162-W220 HydrophobicContact CD1-CZ3 4.09Å; L162-W220 HydrophobicContact CD2-CH2 3.88Å; L162-W220 HydrophobicContact CD2-CZ3 3.89Å
163	S	91.6	Very high	93.5	Very high	10 Å²	10	31.1 Å²	31.1	7%	0.07	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	161.6	-177.1	58.5	0	0	0	0	111.9	S139 F140 R141	S139-S163 CarbonylContact O-C 3.59Å; S139-S163 PolarHBondContact O-OG 2.88Å; F140-S163 VanDerWaalsContact CA-O 3.3Å; F140-S163 WeakPolarHBondContact CA-O 3.37Å; R141-S163 WeakPolarHBondContact CB-OG 3.27Å; R141-S163 PolarHBondContact N-O 3.42Å
164	G	91.7	Very high	94.1	Very high	11 Å²	11	29.6 Å²	29.6	11%	0.113	18%	0.176	C	C	.	.	S	Bend	trans	76.4	-175.1	174.6	0	0	0	0	0	115.2	A198	G164-A198 PolarHBondContact O-N 3.07Å
165	E	93.5	Very high	94.4	Very high	94 Å²	94	28.4 Å²	28.4	44%	0.439	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	148.9	176.6	179.1	178.2	169.7	0	0	109.5	A196 H197	E165-A196 WeakPolarHBondContact CA-O 3.46Å; E165-H197 IonicContact OE1-CE1 3.6Å; E165-H197 PolarHBondContact OE1-CE1 2.75Å; E165-H197 IonicContact OE2-CE1 3.28Å; E165-H197 PolarHBondContact OE2-CE1 2.76Å; E165-H197 IonicContact OE2-ND1 3.58Å
166	V	95.3	Very high	94.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	141.2	172.6	62.5	0	0	0	0	110.2	F140 D170 L172 V183 L186 T195 A196 I202 L204	F140-V166 HydrophobicContact CD1-CB 4.24Å; F140-V166 HydrophobicContact CD2-CB 3.81Å; F140-V166 HydrophobicContact CD2-CG1 4.1Å; F140-V166 HydrophobicContact CE1-CB 4.08Å; F140-V166 HydrophobicContact CE1-CG1 4.23Å; F140-V166 HydrophobicContact CE1-CG2 4.41Å; F140-V166 HydrophobicContact CE2-CB 3.63Å; F140-V166 HydrophobicContact CE2-CG1 3.41Å; F140-V166 VanDerWaalsContact CE2-CG1 3.41Å; F140-V166 HydrophobicContact CG-CB 4.11Å; F140-V166 HydrophobicContact CZ-CB 3.76Å; F140-V166 HydrophobicContact CZ-CG1 3.47Å; F140-V166 VanDerWaalsContact CZ-CG1 3.47Å; F140-V166 HydrophobicContact CZ-CG2 4.45Å; V166-D170 HydrophobicContact CG2-CB 4.31Å; V166-L172 HydrophobicContact CG2-CD1 4.17Å; V166-L172 HydrophobicContact CG2-CD2 4.29Å; V166-V183 HydrophobicContact CG2-CG2 3.89Å; V166-L186 HydrophobicContact CG1-CD2 4.27Å; V166-T195 CarbonylContact O-C 3.53Å; V166-T195 WeakPolarHBondContact O-CA 3.1Å; V166-A196 HydrophobicContact CG1-CB 4.25Å; V166-A196 PolarHBondContact N-O 2.96Å; V166-A196 PolarHBondContact O-N 3.47Å; V166-I202 HydrophobicContact CG1-CD1 4.23Å; V166-L204 HydrophobicContact CG1-CD2 4.11Å
167	K	96.3	Very high	94.1	Very high	111 Å²	111	30.3 Å²	30.3	48%	0.483	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	162.7	174.1	63.2	178.1	174	-165.9	0	112.6	G169 D170 E194 T195	K167-G169 PolarHBondContact O-N 3.06Å; K167-D170 WeakPolarHBondContact CE-OD1 3.39Å; K167-D170 WeakPolarHBondContact CG-OD1 3.43Å; K167-D170 VanDerWaalsContact CG-OD2 3.24Å; K167-D170 WeakPolarHBondContact CG-OD2 3.31Å; K167-D170 PolarHBondContact N-OD2 3.42Å; K167-D170 WeakPolarHBondContact O-CB 3.36Å; K167-D170 PolarHBondContact O-N 3.22Å; K167-E194 CarbonylContact C-O 3.56Å; K167-E194 VanDerWaalsContact CA-O 3.26Å; K167-E194 WeakPolarHBondContact CA-O 3.26Å; K167-T195 HydrophobicContact CB-CG2 3.96Å
168	V	96.6	Very high	94.1	Very high	61 Å²	61	34.1 Å²	34.1	37%	0.37	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	131.2	169.3	178.1	0	0	0	0	109.8	R184 L186 E194	V168-R184 WeakPolarHBondContact CG1-O 3.08Å; V168-L186 HydrophobicContact CG2-CD2 4.28Å; V168-L186 HydrophobicContact CG2-CG 4.22Å; V168-E194 PolarHBondContact N-O 3.08Å
169	G	95.4	Very high	94.3	Very high	46 Å²	46	36.6 Å²	36.6	47%	0.474	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	100	-17.3	-176.3	0	0	0	0	0	114.5	K167 V183	K167-G169 PolarHBondContact O-N 3.06Å; G169-V183 PolarHBondContact N-O 2.87Å
170	D	96.2	Very high	94.6	Very high	44 Å²	44	40 Å²	40	24%	0.235	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-63.7	148	175.2	-70.8	-14.5	0	0	0	111.5	V166 K167 R182 V183	V166-D170 HydrophobicContact CG2-CB 4.31Å; K167-D170 WeakPolarHBondContact CE-OD1 3.39Å; K167-D170 WeakPolarHBondContact CG-OD1 3.43Å; K167-D170 VanDerWaalsContact CG-OD2 3.24Å; K167-D170 WeakPolarHBondContact CG-OD2 3.31Å; K167-D170 PolarHBondContact N-OD2 3.42Å; K167-D170 WeakPolarHBondContact O-CB 3.36Å; K167-D170 PolarHBondContact O-N 3.22Å; D170-R182 CarbonylContact O-C 3.42Å; D170-R182 WeakPolarHBondContact O-CA 3.25Å; D170-V183 PolarHBondContact O-N 3.01Å
171	S	96.9	Very high	94.9	Very high	75 Å²	75	39.6 Å²	39.6	52%	0.524	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.3	171.4	-178.6	0	0	0	0	108.3
172	L	97.2	Very high	95.1	Very high	5 Å²	5	45.8 Å²	45.8	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	159.6	177.2	-58.1	178.7	0	0	0	110.1	F140 V166 P180 M181 V183 L204 L221 L222	F140-L172 HydrophobicContact CD1-CD1 4.24Å; F140-L172 HydrophobicContact CD1-CD2 3.75Å; F140-L172 HydrophobicContact CE1-CD1 3.89Å; F140-L172 HydrophobicContact CE1-CD2 4.25Å; V166-L172 HydrophobicContact CG2-CD1 4.17Å; V166-L172 HydrophobicContact CG2-CD2 4.29Å; L172-P180 CarbonylContact O-C 3.59Å; L172-P180 VanDerWaalsContact O-CA 3.23Å; L172-P180 WeakPolarHBondContact O-CA 3.47Å; L172-M181 PolarHBondContact N-O 2.89Å; L172-M181 PolarHBondContact O-N 2.97Å; L172-V183 HydrophobicContact CD1-CG2 3.81Å; L172-V183 HydrophobicContact CG-CG2 4.08Å; L172-L204 HydrophobicContact CD1-CD1 3.86Å; L172-L221 HydrophobicContact CB-CD2 4Å; L172-L221 HydrophobicContact CD1-CB 4.2Å; L172-L221 HydrophobicContact CD1-CD2 4.42Å; L172-L222 CarbonylContact C-O 3.47Å; L172-L222 WeakPolarHBondContact CA-O 3.38Å
173	W	97.9	Very high	95.4	Very high	46 Å²	46	44.2 Å²	44.2	17%	0.174	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125	170.8	-172.2	-95.1	0	0	0	110.5	N178 P180 L221 L222 V225	W173-N178 VanDerWaalsContact CH2-O 3.26Å; W173-N178 WeakPolarHBondContact CH2-O 3.45Å; W173-N178 HydrophobicContact CZ2-CB 3.74Å; W173-N178 VanDerWaalsContact CZ2-O 3.28Å; W173-N178 WeakPolarHBondContact CZ2-O 3.26Å; W173-P180 HydrophobicContact CE3-CB 4.41Å; W173-L221 WeakPolarHBondContact O-CA 3Å; W173-L222 HydrophobicContact CB-CD1 3.77Å; W173-L222 HydrophobicContact CG-CD1 4.32Å; W173-L222 PolarHBondContact N-O 2.87Å; W173-L222 PolarHBondContact O-N 2.85Å; W173-L222 VanDerWaalsContact O-N 3.11Å; W173-V225 HydrophobicContact CD2-CG2 3.94Å; W173-V225 HydrophobicContact CE3-CG2 3.72Å; W173-V225 HydrophobicContact CH2-CG1 4.46Å; W173-V225 HydrophobicContact CH2-CG2 4.13Å; W173-V225 HydrophobicContact CZ2-CG1 4.02Å; W173-V225 HydrophobicContact CZ2-CG2 4.33Å; W173-V225 HydrophobicContact CZ3-CG2 3.82Å
174	L	97.2	Very high	95.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	116.8	175.1	176.7	64.4	0	0	0	110	I144 V177 N178 K179 M181 A210 I215 D219 W220 L221	I144-L174 HydrophobicContact CD1-CD1 3.58Å; L174-V177 HydrophobicContact CD2-CB 4.02Å; L174-V177 HydrophobicContact CD2-CG2 3.78Å; L174-V177 HydrophobicContact CG-CB 4.33Å; L174-V177 HydrophobicContact CG-CG2 4.28Å; L174-N178 VanDerWaalsContact O-CA 3.24Å; L174-N178 WeakPolarHBondContact O-CA 3.39Å; L174-N178 PolarHBondContact O-N 2.8Å; L174-K179 PolarHBondContact N-O 3.27Å; L174-K179 PolarHBondContact O-N 2.68Å; L174-M181 HydrophobicContact CB-CG 3.85Å; L174-M181 HydrophobicContact CD2-CG 4.29Å; L174-A210 HydrophobicContact CD2-CB 3.5Å; L174-I215 HydrophobicContact CD2-CD1 4.04Å; L174-I215 HydrophobicContact CD2-CG1 3.89Å; L174-D219 HydrophobicContact CD1-CB 4.31Å; L174-W220 WeakPolarHBondContact CA-O 3.45Å; L174-L221 HydrophobicContact CB-CD2 3.81Å; L174-L221 HydrophobicContact CD1-CD2 3.99Å; L174-L221 HydrophobicContact CD1-CG 4.12Å; L174-L221 HydrophobicContact CG-CD2 4.48Å
175	T	95.4	Very high	95.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	163.1	175.1	70.5	0	0	0	0	111.6	V177 W220 L222 P226 W279	T175-V177 PolarHBondContact O-N 3.14Å; T175-W220 HydrophobicContact CG2-CB 3.79Å; T175-W220 PolarHBondContact N-O 2.8Å; T175-W220 PolarHBondContact OG1-N 3.2Å; T175-W220 PolarHBondContact OG1-O 2.79Å; T175-L222 HydrophobicContact CG2-CD2 3.92Å; T175-L222 HydrophobicContact CG2-CG 4.42Å; T175-P226 HydrophobicContact CG2-CG 4.14Å; T175-W279 HydrophobicContact CG2-CD2 4.09Å; T175-W279 HydrophobicContact CG2-CE3 4.19Å; T175-W279 HydrophobicContact CG2-CZ2 4.39Å; T175-W279 HydrophobicContact CG2-CZ3 4.42Å
176	G	90.6	Very high	95.9	Very high	44 Å²	44	46.5 Å²	46.5	45%	0.454	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-52.2	-174.1	0	0	0	0	0	112.1
177	V	93.7	Very high	95.9	Very high	27 Å²	27	50.2 Å²	50.2	16%	0.164	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-28	173.4	-167.6	0	0	0	0	111.9	L174 T175 K179 A210 Q214	L174-V177 HydrophobicContact CD2-CB 4.02Å; L174-V177 HydrophobicContact CD2-CG2 3.78Å; L174-V177 HydrophobicContact CG-CB 4.33Å; L174-V177 HydrophobicContact CG-CG2 4.28Å; T175-V177 PolarHBondContact O-N 3.14Å; V177-K179 HydrophobicContact CG1-CB 4.47Å; V177-K179 HydrophobicContact CG1-CD 4.01Å; V177-K179 HydrophobicContact CG1-CG 4.02Å; V177-A210 HydrophobicContact CB-CB 4.34Å; V177-A210 HydrophobicContact CG1-CB 3.88Å; V177-A210 HydrophobicContact CG2-CB 4.31Å; V177-Q214 HydrophobicContact CG2-CB 3.8Å
178	N	95.2	Very high	95.6	Very high	81 Å²	81	45.4 Å²	45.4	43%	0.433	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	53.9	179.5	-65.1	-46.8	0	0	0	112.9	W173 L174	W173-N178 VanDerWaalsContact CH2-O 3.26Å; W173-N178 WeakPolarHBondContact CH2-O 3.45Å; W173-N178 HydrophobicContact CZ2-CB 3.74Å; W173-N178 VanDerWaalsContact CZ2-O 3.28Å; W173-N178 WeakPolarHBondContact CZ2-O 3.26Å; L174-N178 VanDerWaalsContact O-CA 3.24Å; L174-N178 WeakPolarHBondContact O-CA 3.39Å; L174-N178 PolarHBondContact O-N 2.8Å
179	K	96	Very high	95.1	Very high	70 Å²	70	43.9 Å²	43.9	30%	0.304	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	150	180	-64.9	-169	-164.9	177.1	0	112.2	L174 V177 D209	L174-K179 PolarHBondContact N-O 3.27Å; L174-K179 PolarHBondContact O-N 2.68Å; V177-K179 HydrophobicContact CG1-CB 4.47Å; V177-K179 HydrophobicContact CG1-CD 4.01Å; V177-K179 HydrophobicContact CG1-CG 4.02Å; K179-D209 HydrophobicContact CD-CB 3.67Å; K179-D209 VanDerWaalsContact NZ-CB 3.32Å; K179-D209 PolarHBondContact NZ-O 3.29Å
180	P	97.3	Very high	94.6	Very high	73 Å²	73	47.3 Å²	47.3	47%	0.474	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.8	171.7	31.5	-33.4	0	0	0	111	L172 W173	L172-P180 CarbonylContact O-C 3.59Å; L172-P180 VanDerWaalsContact O-CA 3.23Å; L172-P180 WeakPolarHBondContact O-CA 3.47Å; W173-P180 HydrophobicContact CE3-CB 4.41Å
181	M	96.7	Very high	94.3	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	121.8	-177.4	-63.3	-63.1	-72.4	0	0	109	L155 L172 L174 I206 A207 G208 A210 L221	L155-M181 HydrophobicContact CD2-CE 4.17Å; L172-M181 PolarHBondContact N-O 2.89Å; L172-M181 PolarHBondContact O-N 2.97Å; L174-M181 HydrophobicContact CB-CG 3.85Å; L174-M181 HydrophobicContact CD2-CG 4.29Å; M181-I206 HydrophobicContact CB-CB 4.25Å; M181-I206 HydrophobicContact CB-CD1 4.35Å; M181-I206 HydrophobicContact CE-CB 4.13Å; M181-I206 HydrophobicContact CE-CD1 3.62Å; M181-I206 HydrophobicContact CE-CG1 3.7Å; M181-I206 HydrophobicContact CG-CD1 4.35Å; M181-A207 CarbonylContact C-O 3.36Å; M181-A207 WeakPolarHBondContact CA-O 3.43Å; M181-G208 VanDerWaalsContact SD-CA 3.59Å; M181-A210 HydrophobicContact CE-CB 3.91Å; M181-A210 HydrophobicContact SD-CB 3.64Å; M181-L221 HydrophobicContact CB-CD2 4.49Å
182	R	96.8	Very high	94.2	Very high	130 Å²	130	50.2 Å²	50.2	49%	0.491	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	132.4	179.7	-174.5	174.9	59.3	79.5	-2.1	111.6	D170 R184 I206 A207	D170-R182 CarbonylContact O-C 3.42Å; D170-R182 WeakPolarHBondContact O-CA 3.25Å; R182-R184 PolarHBondContact O-N 2.91Å; R182-I206 CarbonylContact O-C 3.34Å; R182-I206 WeakPolarHBondContact O-CA 3.08Å; R182-A207 PolarHBondContact N-O 3.24Å; R182-A207 PolarHBondContact O-N 3.38Å
183	V	96.8	Very high	94	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	122.1	175.9	-174.9	0	0	0	0	110.1	V166 G169 D170 L172 L186 L204	V166-V183 HydrophobicContact CG2-CG2 3.89Å; G169-V183 PolarHBondContact N-O 2.87Å; D170-V183 PolarHBondContact O-N 3.01Å; L172-V183 HydrophobicContact CD1-CG2 3.81Å; L172-V183 HydrophobicContact CG-CG2 4.08Å; V183-L186 HydrophobicContact CG1-CB 4.45Å; V183-L186 HydrophobicContact CG1-CD2 4.23Å; V183-L204 HydrophobicContact CG1-CD2 4.19Å
184	R	95.4	Very high	93.9	Very high	123 Å²	123	57.8 Å²	57.8	46%	0.464	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-37.8	178.6	-71.6	-171.9	64.2	-168.5	3.4	113.3	A153 V168 R182 N205 A207	A153-R184 PolarHBondContact O-NH1 3.32Å; V168-R184 WeakPolarHBondContact CG1-O 3.08Å; R182-R184 PolarHBondContact O-N 2.91Å; R184-N205 PolarHBondContact N-O 3.27Å; R184-A207 HydrophobicContact CG-CB 3.86Å
185	A	95.8	Very high	93.8	Very high	37 Å²	37	60.5 Å²	60.5	31%	0.306	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	156.4	178.4	0	0	0	0	0	107.5	N205	A185-N205 HydrophobicContact CB-CB 4.12Å; A185-N205 WeakPolarHBondContact O-CB 3.31Å; A185-N205 PolarHBondContact O-N 3.17Å
186	L	95.9	Very high	93.7	Very high	3 Å²	3	60.5 Å²	60.5	2%	0.016	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	149.1	175.9	61.6	84.6	0	0	0	110.5	V166 V168 V183 T193 T195 A196 I202 A203 L204	V166-L186 HydrophobicContact CG1-CD2 4.27Å; V168-L186 HydrophobicContact CG2-CD2 4.28Å; V168-L186 HydrophobicContact CG2-CG 4.22Å; V183-L186 HydrophobicContact CG1-CB 4.45Å; V183-L186 HydrophobicContact CG1-CD2 4.23Å; L186-T193 WeakPolarHBondContact CD1-O 3.22Å; L186-T193 WeakPolarHBondContact CD1-OG1 3.46Å; L186-T193 WeakPolarHBondContact CG-O 3.37Å; L186-T193 PolarHBondContact O-N 3.34Å; L186-T193 VanDerWaalsContact O-N 3.13Å; L186-T193 VanDerWaalsContact O-O 3.13Å; L186-T195 WeakPolarHBondContact CD1-O 3.4Å; L186-A196 HydrophobicContact CD1-CB 3.76Å; L186-A196 HydrophobicContact CD2-CB 4.48Å; L186-I202 HydrophobicContact CB-CG2 4.45Å; L186-A203 CarbonylContact C-O 3.6Å; L186-A203 VanDerWaalsContact CA-O 3.25Å; L186-A203 WeakPolarHBondContact CA-O 3.36Å; L186-L204 HydrophobicContact CB-CD2 3.59Å; L186-L204 HydrophobicContact CD2-CD2 4.25Å
187	H	93.8	Very high	93.7	Very high	78 Å²	78	62.5 Å²	62.5	36%	0.361	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	122.7	170.6	-64.4	-162.2	0	0	0	108.6	Q191 A203	H187-Q191 CarbonylContact C-O 3.53Å; H187-Q191 WeakPolarHBondContact CA-O 3.48Å; H187-A203 HydrophobicContact CB-CB 4.24Å; H187-A203 PolarHBondContact N-O 3.31Å; H187-A203 PolarHBondContact O-N 2.92Å
188	A	91.4	Very high	93.5	Very high	9 Å²	9	61.5 Å²	61.5	7%	0.074	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	117.6	167.9	0	0	0	0	0	108.9	N190 Q191 A196	A188-N190 VanDerWaalsContact C-N 3.33Å; A188-N190 PolarHBondContact O-N 3.46Å; A188-Q191 PolarHBondContact N-O 2.88Å; A188-Q191 WeakPolarHBondContact O-CB 3.35Å; A188-Q191 PolarHBondContact O-N 3.23Å; A188-A196 HydrophobicContact CB-CB 4.28Å
189	Q	86.3	Confident	93	Very high	29 Å²	29	58.4 Å²	58.4	14%	0.136	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	47.3	174.8	-61.6	175.5	-35	0	0	114.3	Y9 V17 Q191 Q200 R201	Y9-Q189 HydrophobicContact CD1-CB 3.59Å; Y9-Q189 HydrophobicContact CD1-CG 4.06Å; Y9-Q189 HydrophobicContact CE1-CB 3.57Å; Y9-Q189 HydrophobicContact CE1-CG 3.74Å; Y9-Q189 HydrophobicContact CG-CB 4.46Å; V17-Q189 HydrophobicContact CB-CB 4.43Å; V17-Q189 HydrophobicContact CG1-CB 4.23Å; V17-Q189 PolarHBondContact O-NE2 3.47Å; V17-Q189 VanDerWaalsContact O-NE2 3.14Å; V17-Q189 PolarHBondContact O-OE1 3.35Å; Q189-Q191 VanDerWaalsContact C-N 3.27Å; Q189-Q191 PolarHBondContact O-N 2.82Å; Q189-Q200 HydrophobicContact CG-CB 4.25Å; Q189-R201 PolarHBondContact N-O 2.92Å
190	N	85.1	Confident	92.6	Very high	118 Å²	118	56.7 Å²	56.7	63%	0.631	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	7.5	-174.4	-75	-17.6	0	0	0	116.8	Y9 A188	Y9-N190 HydrophobicContact CD2-CB 4.15Å; Y9-N190 WeakPolarHBondContact CD2-ND2 3.2Å; Y9-N190 HydrophobicContact CE2-CB 4.34Å; Y9-N190 WeakPolarHBondContact CE2-ND2 3.19Å; A188-N190 VanDerWaalsContact C-N 3.33Å; A188-N190 PolarHBondContact O-N 3.46Å
191	Q	89.9	Confident	92.2	Very high	83 Å²	83	54.2 Å²	54.2	39%	0.388	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.3	172.4	-60.8	-169.8	-3.8	0	0	110.6	H187 A188 Q189 T193	H187-Q191 CarbonylContact C-O 3.53Å; H187-Q191 WeakPolarHBondContact CA-O 3.48Å; A188-Q191 PolarHBondContact N-O 2.88Å; A188-Q191 WeakPolarHBondContact O-CB 3.35Å; A188-Q191 PolarHBondContact O-N 3.23Å; Q189-Q191 VanDerWaalsContact C-N 3.27Å; Q189-Q191 PolarHBondContact O-N 2.82Å; Q191-T193 PolarHBondContact O-N 2.87Å
192	P	93.3	Very high	92	Very high	98 Å²	98	54.2 Å²	54.2	64%	0.636	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.9	124.1	172	-18.7	30.2	0	0	0	110.9
193	T	94.5	Very high	91.9	Very high	49 Å²	49	49 Å²	49	30%	0.301	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	160.6	179.8	52.7	0	0	0	0	110.8	L186 Q191 T195	L186-T193 WeakPolarHBondContact CD1-O 3.22Å; L186-T193 WeakPolarHBondContact CD1-OG1 3.46Å; L186-T193 WeakPolarHBondContact CG-O 3.37Å; L186-T193 PolarHBondContact O-N 3.34Å; L186-T193 VanDerWaalsContact O-N 3.13Å; L186-T193 VanDerWaalsContact O-O 3.13Å; Q191-T193 PolarHBondContact O-N 2.87Å; T193-T195 VanDerWaalsContact CB-O 3.3Å; T193-T195 WeakPolarHBondContact CB-O 3.4Å; T193-T195 PolarHBondContact OG1-O 3.38Å
194	E	95.2	Very high	91.8	Very high	161 Å²	161	49 Å²	49	75%	0.752	26%	0.259	S	S	*	.	S	Bend	trans	-85	-26.1	174.9	-67	-169.9	169.1	0	0	112.4	K167 V168	K167-E194 CarbonylContact C-O 3.56Å; K167-E194 VanDerWaalsContact CA-O 3.26Å; K167-E194 WeakPolarHBondContact CA-O 3.26Å; V168-E194 PolarHBondContact N-O 3.08Å
195	T	94.7	Very high	91.9	Very high	56 Å²	56	43.9 Å²	43.9	34%	0.344	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	154	178.1	61	0	0	0	0	110.3	V166 K167 L186 T193	V166-T195 CarbonylContact O-C 3.53Å; V166-T195 WeakPolarHBondContact O-CA 3.1Å; K167-T195 HydrophobicContact CB-CG2 3.96Å; L186-T195 WeakPolarHBondContact CD1-O 3.4Å; T193-T195 VanDerWaalsContact CB-O 3.3Å; T193-T195 WeakPolarHBondContact CB-O 3.4Å; T193-T195 PolarHBondContact OG1-O 3.38Å
196	A	92.6	Very high	91.9	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.9	170.1	0	0	0	0	0	111.2	E165 V166 L186 A188 I202	E165-A196 WeakPolarHBondContact CA-O 3.46Å; V166-A196 HydrophobicContact CG1-CB 4.25Å; V166-A196 PolarHBondContact N-O 2.96Å; V166-A196 PolarHBondContact O-N 3.47Å; L186-A196 HydrophobicContact CD1-CB 3.76Å; L186-A196 HydrophobicContact CD2-CB 4.48Å; A188-A196 HydrophobicContact CB-CB 4.28Å; A196-I202 HydrophobicContact CB-CD1 3.54Å; A196-I202 HydrophobicContact CB-CG1 3.97Å; A196-I202 HydrophobicContact CB-CG2 4.07Å
197	H	91.1	Very high	91.8	Very high	85 Å²	85	43.7 Å²	43.7	39%	0.394	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	164.7	-172	-53.9	-78.8	0	0	0	111.3	E165	E165-H197 IonicContact OE1-CE1 3.6Å; E165-H197 PolarHBondContact OE1-CE1 2.75Å; E165-H197 IonicContact OE2-CE1 3.28Å; E165-H197 PolarHBondContact OE2-CE1 2.76Å; E165-H197 IonicContact OE2-ND1 3.58Å
198	A	89.9	Confident	91.8	Very high	6 Å²	6	42 Å²	42	5%	0.05	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	158.6	172.7	0	0	0	0	0	113.1	H134 G164 Q200	H134-A198 HydrophobicContact CB-CB 3.91Å; G164-A198 PolarHBondContact O-N 3.07Å; A198-Q200 PolarHBondContact O-N 3.45Å
199	G	84.9	Confident	91.9	Very high	16 Å²	16	47.8 Å²	47.8	17%	0.165	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	86	-12.4	-177	0	0	0	0	0	113.5	H134 A161	H134-G199 WeakPolarHBondContact NE2-CA 3.37Å; H134-G199 PolarHBondContact NE2-N 3.35Å; A161-G199 PolarHBondContact O-N 3.44Å
200	Q	86.3	Confident	92.2	Very high	35 Å²	35	46.7 Å²	46.7	16%	0.164	27%	0.269	C	S	.	.	S	Bend	trans	-105.5	155.3	-177.3	-60.6	179.5	-1.9	0	0	112.6	A161 Q189 A198	A161-Q200 PolarHBondContact N-O 2.91Å; A161-Q200 VanDerWaalsContact N-O 3.08Å; Q189-Q200 HydrophobicContact CG-CB 4.25Å; A198-Q200 PolarHBondContact O-N 3.45Å
201	R	89.5	Confident	92.5	Very high	21 Å²	21	46.9 Å²	46.9	8%	0.079	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	116.4	167.4	-69.7	-75.9	-65.9	150.8	13.6	108.2	Y7 Y9 D145 G159 T160 Q189	Y7-R201 PolarHBondContact OH-NH2 2.84Å; Y7-R201 VanDerWaalsContact OH-NH2 3.11Å; Y9-R201 HydrophobicContact CE1-CB 4.49Å; Y9-R201 WeakPolarHBondContact OH-CB 3.36Å; D145-R201 VanDerWaalsContact CG-NH1 3.29Å; D145-R201 IonicContact OD1-CZ 2.79Å; D145-R201 IonicContact OD1-NH2 2.76Å; D145-R201 PolarHBondContact OD1-NH2 3.27Å; D145-R201 VanDerWaalsContact OD1-NH2 3.16Å; D145-R201 IonicContact OD2-CZ 3.81Å; D145-R201 IonicContact OD2-NH1 3.62Å; D145-R201 PolarHBondContact OD2-NH1 3.36Å; D145-R201 IonicContact OD2-NH2 3.13Å; D145-R201 PolarHBondContact OD2-NH2 2.94Å; G159-R201 VanDerWaalsContact CA-NH1 3.32Å; G159-R201 WeakPolarHBondContact O-CA 3.42Å; G159-R201 PolarHBondContact O-NH1 3.09Å; T160-R201 WeakPolarHBondContact OG1-CD 3.37Å; T160-R201 PolarHBondContact OG1-NH1 2.89Å; Q189-R201 PolarHBondContact N-O 2.92Å
202	I	93.4	Very high	92.6	Very high	1 Å²	1	48 Å²	48	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	130.8	-174.7	-51.3	177.2	0	0	0	108.9	F140 L142 T158 G159 A161 V166 L186 A196 L204	F140-I202 HydrophobicContact CE2-CD1 4.15Å; F140-I202 HydrophobicContact CZ-CD1 4.32Å; L142-I202 HydrophobicContact CD1-CB 4.16Å; L142-I202 HydrophobicContact CD1-CD1 4.36Å; T158-I202 WeakPolarHBondContact CA-O 3.22Å; G159-I202 PolarHBondContact N-O 3.46Å; G159-I202 PolarHBondContact O-N 3.44Å; A161-I202 HydrophobicContact CB-CD1 3.48Å; A161-I202 VanDerWaalsContact CB-CD1 3.48Å; A161-I202 HydrophobicContact CB-CG1 4.2Å; V166-I202 HydrophobicContact CG1-CD1 4.23Å; L186-I202 HydrophobicContact CB-CG2 4.45Å; A196-I202 HydrophobicContact CB-CD1 3.54Å; A196-I202 HydrophobicContact CB-CG1 3.97Å; A196-I202 HydrophobicContact CB-CG2 4.07Å; I202-L204 HydrophobicContact CG2-CD2 3.53Å; I202-L204 HydrophobicContact CG2-CG 3.76Å
203	A	94.1	Very high	92.5	Very high	19 Å²	19	51.7 Å²	51.7	16%	0.157	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	111.7	163.3	0	0	0	0	0	108.6	V156 V157 T158 L186 H187	V156-A203 HydrophobicContact CG1-CB 4.18Å; V157-A203 CarbonylContact O-C 3.55Å; T158-A203 HydrophobicContact CG2-CB 3.79Å; L186-A203 CarbonylContact C-O 3.6Å; L186-A203 VanDerWaalsContact CA-O 3.25Å; L186-A203 WeakPolarHBondContact CA-O 3.36Å; H187-A203 HydrophobicContact CB-CB 4.24Å; H187-A203 PolarHBondContact N-O 3.31Å; H187-A203 PolarHBondContact O-N 2.92Å
204	L	95.7	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	120.5	178.2	-67.2	-179.5	0	0	0	110	F140 L142 V156 V157 V166 L172 V183 L186 I202 I206 L221	F140-L204 HydrophobicContact CE1-CD1 4.32Å; F140-L204 HydrophobicContact CZ-CD1 4.31Å; L142-L204 HydrophobicContact CD2-CD1 3.7Å; L142-L204 HydrophobicContact CD2-CG 4.41Å; V156-L204 WeakPolarHBondContact CA-O 3.45Å; V157-L204 HydrophobicContact CG2-CB 4.09Å; V157-L204 PolarHBondContact N-O 2.74Å; V157-L204 PolarHBondContact O-N 3.16Å; V166-L204 HydrophobicContact CG1-CD2 4.11Å; L172-L204 HydrophobicContact CD1-CD1 3.86Å; V183-L204 HydrophobicContact CG1-CD2 4.19Å; L186-L204 HydrophobicContact CB-CD2 3.59Å; L186-L204 HydrophobicContact CD2-CD2 4.25Å; I202-L204 HydrophobicContact CG2-CD2 3.53Å; I202-L204 HydrophobicContact CG2-CG 3.76Å; L204-I206 HydrophobicContact CB-CG2 3.94Å; L204-L221 HydrophobicContact CD1-CD1 4.11Å
205	N	96.3	Very high	92.4	Very high	16 Å²	16	46.3 Å²	46.3	9%	0.086	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	114.1	164	-178.4	-0.2	0	0	0	108.5	A153 L155 V156 R184 A185	A153-N205 PolarHBondContact O-ND2 3.12Å; A153-N205 PolarHBondContact O-OD1 3.28Å; L155-N205 WeakPolarHBondContact O-CA 3.37Å; L155-N205 PolarHBondContact O-OD1 3Å; V156-N205 HydrophobicContact CG2-CB 4.16Å; R184-N205 PolarHBondContact N-O 3.27Å; A185-N205 HydrophobicContact CB-CB 4.12Å; A185-N205 WeakPolarHBondContact O-CB 3.31Å; A185-N205 PolarHBondContact O-N 3.17Å
206	I	95.7	Very high	92.2	Very high	4 Å²	4	48.5 Å²	48.5	2%	0.021	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	147.9	-173	59.8	176.4	0	0	0	111.4	L155 V157 M181 R182 L204 L221	L155-I206 HydrophobicContact CD2-CD1 4.09Å; L155-I206 HydrophobicContact CD2-CG1 4.01Å; L155-I206 HydrophobicContact CG-CG1 4.17Å; L155-I206 PolarHBondContact O-N 3.29Å; V157-I206 HydrophobicContact CG1-CD1 3.99Å; V157-I206 HydrophobicContact CG2-CD1 3.87Å; V157-I206 HydrophobicContact CG2-CG1 4.42Å; M181-I206 HydrophobicContact CB-CB 4.25Å; M181-I206 HydrophobicContact CB-CD1 4.35Å; M181-I206 HydrophobicContact CE-CB 4.13Å; M181-I206 HydrophobicContact CE-CD1 3.62Å; M181-I206 HydrophobicContact CE-CG1 3.7Å; M181-I206 HydrophobicContact CG-CD1 4.35Å; R182-I206 CarbonylContact O-C 3.34Å; R182-I206 WeakPolarHBondContact O-CA 3.08Å; L204-I206 HydrophobicContact CB-CG2 3.94Å; I206-L221 HydrophobicContact CD1-CD1 4.12Å; I206-L221 HydrophobicContact CG2-CD1 4.47Å
207	A	94.6	Very high	92.1	Very high	33 Å²	33	52.4 Å²	52.4	27%	0.273	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.4	176.6	0	0	0	0	0	111.7	M181 R182 R184	M181-A207 CarbonylContact C-O 3.36Å; M181-A207 WeakPolarHBondContact CA-O 3.43Å; R182-A207 PolarHBondContact N-O 3.24Å; R182-A207 PolarHBondContact O-N 3.38Å; R184-A207 HydrophobicContact CG-CB 3.86Å
208	G	92.6	Very high	92	Very high	43 Å²	43	48.7 Å²	48.7	44%	0.443	26%	0.259	S	S	.	.	S	Bend	trans	167	-166.8	179.6	0	0	0	0	0	109	M181 A210	M181-G208 VanDerWaalsContact SD-CA 3.59Å; G208-A210 PolarHBondContact O-N 3.03Å
209	D	93.4	Very high	92.2	Very high	129 Å²	129	49.1 Å²	49.1	69%	0.69	26%	0.26	S	S	*	.	S	Bend	trans	-85.7	9.9	-173	-53.3	-29.2	0	0	0	113.8	K179	K179-D209 HydrophobicContact CD-CB 3.67Å; K179-D209 VanDerWaalsContact NZ-CB 3.32Å; K179-D209 PolarHBondContact NZ-O 3.29Å
210	A	92.9	Very high	92.7	Very high	7 Å²	7	48.6 Å²	48.6	6%	0.058	25%	0.253	C	S	.	.			trans	-93.3	133.2	173.9	0	0	0	0	0	109.7	L174 V177 M181 G208	L174-A210 HydrophobicContact CD2-CB 3.5Å; V177-A210 HydrophobicContact CB-CB 4.34Å; V177-A210 HydrophobicContact CG1-CB 3.88Å; V177-A210 HydrophobicContact CG2-CB 4.31Å; M181-A210 HydrophobicContact CE-CB 3.91Å; M181-A210 HydrophobicContact SD-CB 3.64Å; G208-A210 PolarHBondContact O-N 3.03Å
211	E	91.4	Very high	93.2	Very high	121 Å²	121	46.9 Å²	46.9	57%	0.565	25%	0.245	S	C	*	.			trans	-105.6	170.2	173.9	-44.9	179.5	146	0	0	110	E213 Q214 I215	E211-E213 PolarHBondContact O-N 3.5Å; E211-Q214 PolarHBondContact O-N 3.29Å; E211-Q214 PolarHBondContact O-OE1 2.97Å; E211-I215 WeakPolarHBondContact O-CG1 3.23Å
212	K	91.7	Very high	93.6	Very high	108 Å²	108	46.1 Å²	46.1	47%	0.47	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-60	-34.3	-177.4	-177	-169.7	168.2	-164	0	112.5	A147 L155 Q214 I215	A147-K212 HydrophobicContact CB-CG 4.44Å; A147-K212 VanDerWaalsContact O-CE 3.24Å; A147-K212 WeakPolarHBondContact O-CE 3.4Å; L155-K212 HydrophobicContact CD1-CB 4.1Å; K212-Q214 VanDerWaalsContact C-N 3.28Å; K212-Q214 PolarHBondContact O-N 3.24Å; K212-I215 PolarHBondContact O-N 3.22Å
213	E	92.4	Very high	93.6	Very high	174 Å²	174	47.8 Å²	47.8	81%	0.813	26%	0.256	S	S	*	.	G	3₁₀ helix	trans	-70.3	-24.3	-173	-62.6	-176.3	178.2	0	0	113.3	E211	E211-E213 PolarHBondContact O-N 3.5Å
214	Q	92.5	Very high	93.6	Very high	82 Å²	82	52.3 Å²	52.3	38%	0.383	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-90.4	-9	177.2	-52	87	6.8	0	0	112.8	V177 E211 K212	V177-Q214 HydrophobicContact CG2-CB 3.8Å; E211-Q214 PolarHBondContact O-N 3.29Å; E211-Q214 PolarHBondContact O-OE1 2.97Å; K212-Q214 VanDerWaalsContact C-N 3.28Å; K212-Q214 PolarHBondContact O-N 3.24Å
215	I	94.1	Very high	93.7	Very high	15 Å²	15	57 Å²	57	8%	0.077	31%	0.306	C	S	.	.			trans	-91.4	127.3	-178	-63.6	170.4	0	0	0	110	I144 A147 L155 V157 L174 E211 K212	I144-I215 HydrophobicContact CD1-CG2 4.19Å; I144-I215 HydrophobicContact CG2-CG2 4.3Å; A147-I215 HydrophobicContact CB-CB 4.26Å; A147-I215 HydrophobicContact CB-CG2 3.78Å; L155-I215 HydrophobicContact CD1-CD1 4.24Å; L155-I215 HydrophobicContact CD2-CD1 3.42Å; L155-I215 VanDerWaalsContact CD2-CD1 3.42Å; L155-I215 HydrophobicContact CG-CD1 4.34Å; V157-I215 HydrophobicContact CG1-CD1 4.21Å; L174-I215 HydrophobicContact CD2-CD1 4.04Å; L174-I215 HydrophobicContact CD2-CG1 3.89Å; E211-I215 WeakPolarHBondContact O-CG1 3.23Å; K212-I215 PolarHBondContact O-N 3.22Å
216	N	92.2	Very high	93.6	Very high	102 Å²	102	57 Å²	57	55%	0.545	31%	0.307	S	S	.	.			trans	-111.4	153	176.9	-62.8	-67.3	0	0	0	111.1	G218 D219	N216-G218 PolarHBondContact O-N 2.81Å; N216-D219 PolarHBondContact N-OD2 3.19Å; N216-D219 WeakPolarHBondContact O-CB 3.36Å; N216-D219 PolarHBondContact O-N 2.97Å
217	R	89.4	Confident	93.5	Very high	84 Å²	84	59.1 Å²	59.1	32%	0.317	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	133.5	166.5	175.8	-179.5	-84.8	-177.7	-5.9	108.4	D4 N32 D145 A255	D4-R217 IonicContact OD1-NH1 3.88Å; D4-R217 PolarHBondContact OD1-NH1 2.91Å; D4-R217 IonicContact OD1-NH2 3.15Å; D4-R217 IonicContact OD2-NH2 3.36Å; D4-R217 PolarHBondContact OD2-NH2 2.83Å; N32-R217 PolarHBondContact OD1-NH1 2.8Å; D145-R217 PolarHBondContact O-NE 2.8Å; D145-R217 PolarHBondContact O-NH2 2.85Å; R217-A255 HydrophobicContact CG-CB 3.93Å
218	G	89.4	Confident	93.4	Very high	7 Å²	7	65.5 Å²	65.5	7%	0.072	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	91	-1.3	-175.1	0	0	0	0	0	114.7	I144 N216	I144-G218 PolarHBondContact O-N 2.9Å; N216-G218 PolarHBondContact O-N 2.81Å
219	D	93.9	Very high	93.5	Very high	15 Å²	15	65.5 Å²	65.5	8%	0.08	34%	0.337	C	S	.	.			trans	-66.8	152.7	163.1	-73.4	-27.4	0	0	0	110.2	I144 L174 N216	I144-D219 VanDerWaalsContact CB-O 3.29Å; I144-D219 WeakPolarHBondContact CB-O 3.47Å; I144-D219 HydrophobicContact CD1-CB 4.04Å; I144-D219 VanDerWaalsContact CG1-O 3.32Å; I144-D219 WeakPolarHBondContact CG1-O 3.44Å; I144-D219 PolarHBondContact N-O 3.06Å; L174-D219 HydrophobicContact CD1-CB 4.31Å; N216-D219 PolarHBondContact N-OD2 3.19Å; N216-D219 WeakPolarHBondContact O-CB 3.36Å; N216-D219 PolarHBondContact O-N 2.97Å
220	W	95.7	Very high	93.5	Very high	4 Å²	4	60.3 Å²	60.3	2%	0.015	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	141.1	179.8	-60.7	95.7	0	0	0	111	R141 L142 A143 L162 L174 T175 L222 H253 A254	R141-W220 HydrophobicContact CG-CE3 3.59Å; R141-W220 HydrophobicContact CG-CZ3 3.68Å; L142-W220 WeakPolarHBondContact O-CA 3.42Å; A143-W220 HydrophobicContact CB-CE3 4.13Å; A143-W220 HydrophobicContact CB-CH2 4.08Å; A143-W220 HydrophobicContact CB-CZ3 3.66Å; L162-W220 HydrophobicContact CD1-CZ3 4.09Å; L162-W220 HydrophobicContact CD2-CH2 3.88Å; L162-W220 HydrophobicContact CD2-CZ3 3.89Å; L174-W220 WeakPolarHBondContact CA-O 3.45Å; T175-W220 HydrophobicContact CG2-CB 3.79Å; T175-W220 PolarHBondContact N-O 2.8Å; T175-W220 PolarHBondContact OG1-N 3.2Å; T175-W220 PolarHBondContact OG1-O 2.79Å; W220-L222 HydrophobicContact CB-CD2 3.92Å; W220-L222 HydrophobicContact CB-CG 4.46Å; W220-H253 AromaticContact CH2-NE2 3.8Å; W220-H253 AromaticContact CZ2-CD2 3.91Å; W220-H253 AromaticContact CZ2-NE2 3.44Å; W220-H253 WeakPolarHBondContact CZ2-NE2 3.37Å; W220-A254 HydrophobicContact CH2-CB 3.64Å; W220-A254 HydrophobicContact CZ2-CB 4.07Å
221	L	96.5	Very high	93.6	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	124.6	159.1	-81.9	169.1	0	0	0	108.8	L142 I144 V157 L172 W173 L174 M181 L204 I206	L142-L221 HydrophobicContact CB-CB 4.16Å; L142-L221 HydrophobicContact CD2-CB 4.2Å; L142-L221 HydrophobicContact CD2-CD1 4.02Å; L142-L221 PolarHBondContact N-O 3.06Å; L142-L221 PolarHBondContact O-N 2.77Å; I144-L221 HydrophobicContact CD1-CD1 4.18Å; I144-L221 HydrophobicContact CD1-CG 4.08Å; I144-L221 HydrophobicContact CG1-CD1 4.46Å; V157-L221 HydrophobicContact CG2-CD1 3.54Å; L172-L221 HydrophobicContact CB-CD2 4Å; L172-L221 HydrophobicContact CD1-CB 4.2Å; L172-L221 HydrophobicContact CD1-CD2 4.42Å; W173-L221 WeakPolarHBondContact O-CA 3Å; L174-L221 HydrophobicContact CB-CD2 3.81Å; L174-L221 HydrophobicContact CD1-CD2 3.99Å; L174-L221 HydrophobicContact CD1-CG 4.12Å; L174-L221 HydrophobicContact CG-CD2 4.48Å; M181-L221 HydrophobicContact CB-CD2 4.49Å; L204-L221 HydrophobicContact CD1-CD1 4.11Å; I206-L221 HydrophobicContact CD1-CD1 4.12Å; I206-L221 HydrophobicContact CG2-CD1 4.47Å
222	L	96.8	Very high	93.8	Very high	4 Å²	4	60.1 Å²	60.1	2%	0.021	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	161.6	-172.1	45.1	80.9	0	0	0	111	F140 L172 W173 T175 W220 D224 P226 W350	F140-L222 WeakPolarHBondContact O-CA 3.17Å; F140-L222 WeakPolarHBondContact O-CB 3.42Å; L172-L222 CarbonylContact C-O 3.47Å; L172-L222 WeakPolarHBondContact CA-O 3.38Å; W173-L222 HydrophobicContact CB-CD1 3.77Å; W173-L222 HydrophobicContact CG-CD1 4.32Å; W173-L222 PolarHBondContact N-O 2.87Å; W173-L222 PolarHBondContact O-N 2.85Å; W173-L222 VanDerWaalsContact O-N 3.11Å; T175-L222 HydrophobicContact CG2-CD2 3.92Å; T175-L222 HydrophobicContact CG2-CG 4.42Å; W220-L222 HydrophobicContact CB-CD2 3.92Å; W220-L222 HydrophobicContact CB-CG 4.46Å; L222-D224 WeakPolarHBondContact CD1-O 3.35Å; L222-P226 HydrophobicContact CD1-CB 4.5Å; L222-P226 HydrophobicContact CD1-CG 4.38Å; L222-P226 HydrophobicContact CD2-CB 4.37Å; L222-W350 HydrophobicContact CD2-CH2 3.83Å; L222-W350 HydrophobicContact CD2-CZ3 4.05Å
223	A	94.9	Very high	94	Very high	36 Å²	36	55 Å²	55	30%	0.298	29%	0.286	S	S	.	.	S	Bend	trans	-67.4	-44.2	-171.4	0	0	0	0	0	113.7	F140	F140-A223 HydrophobicContact CB-CB 4.39Å; F140-A223 PolarHBondContact O-N 2.89Å
224	D	94.5	Very high	94.1	Very high	114 Å²	114	46.7 Å²	46.7	61%	0.61	25%	0.247	S	C	*	.	S	Bend	trans	-121.2	160.1	-169.6	-67.8	-49.7	0	0	0	112.5	L222	L222-D224 WeakPolarHBondContact CD1-O 3.35Å
225	V	96	Very high	94.2	Very high	99 Å²	99	42.8 Å²	42.8	60%	0.6	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-61.3	123.4	177.6	-176.2	0	0	0	0	110.1	W173	W173-V225 HydrophobicContact CD2-CG2 3.94Å; W173-V225 HydrophobicContact CE3-CG2 3.72Å; W173-V225 HydrophobicContact CH2-CG1 4.46Å; W173-V225 HydrophobicContact CH2-CG2 4.13Å; W173-V225 HydrophobicContact CZ2-CG1 4.02Å; W173-V225 HydrophobicContact CZ2-CG2 4.33Å; W173-V225 HydrophobicContact CZ3-CG2 3.82Å
226	P	94.9	Very high	94.2	Very high	15 Å²	15	45.7 Å²	45.7	10%	0.097	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-75.6	155.5	179.9	34.5	-35.6	0	0	0	110.1	T175 L222 W350	T175-P226 HydrophobicContact CG2-CG 4.14Å; L222-P226 HydrophobicContact CD1-CB 4.5Å; L222-P226 HydrophobicContact CD1-CG 4.38Å; L222-P226 HydrophobicContact CD2-CB 4.37Å; P226-W350 HydrophobicContact CB-CE3 4.04Å; P226-W350 HydrophobicContact CB-CH2 3.28Å; P226-W350 HydrophobicContact CB-CZ2 4.04Å; P226-W350 HydrophobicContact CB-CZ3 3.29Å
227	P	93.7	Very high	94.2	Very high	49 Å²	49	41.6 Å²	41.6	32%	0.318	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-61	168.4	164.1	30.1	-33.6	0	0	0	110.5	W279 W350	P227-W279 PolarHBondContact O-NE1 2.7Å; P227-W350 HydrophobicContact CG-CB 4.04Å; P227-W350 HydrophobicContact CG-CD2 3.62Å; P227-W350 HydrophobicContact CG-CE3 4.29Å; P227-W350 HydrophobicContact CG-CG 3.43Å; P227-W350 VanDerWaalsContact CG-CG 3.43Å
228	E	92.9	Very high	94.3	Very high	168 Å²	168	42.5 Å²	42.5	79%	0.785	23%	0.228	S	C	*	.	P	Polyproline II helix	trans	-57.7	141.1	176.5	61.8	177.7	-172.7	0	0	111.4
229	P	94.4	Very high	94.2	Very high	42 Å²	42	45 Å²	45	27%	0.273	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-65.4	142.4	178.7	27.9	-34.2	0	0	0	110.3	P277 W279	P229-P277 HydrophobicContact CB-CB 3.66Å; P229-P277 HydrophobicContact CG-CB 3.69Å; P229-W279 HydrophobicContact CB-CD2 4.05Å; P229-W279 HydrophobicContact CB-CG 4.31Å; P229-W279 HydrophobicContact CB-CZ2 4.18Å; P229-W279 HydrophobicContact CG-CH2 4.4Å; P229-W279 HydrophobicContact CG-CZ2 3.88Å
230	F	92.9	Very high	93.7	Very high	20 Å²	20	48.3 Å²	48.3	9%	0.088	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	152.5	-176.6	44.5	-85.9	0	0	0	111.5	R232 V233 L278 L280 L305	F230-R232 WeakPolarHBondContact CD2-O 3.46Å; F230-V233 HydrophobicContact CD2-CB 4.21Å; F230-V233 HydrophobicContact CE2-CB 3.99Å; F230-V233 HydrophobicContact CE2-CG2 4Å; F230-L278 PolarHBondContact N-O 3.13Å; F230-L278 PolarHBondContact O-N 3.42Å; F230-L280 HydrophobicContact CE2-CB 4.06Å; F230-L280 HydrophobicContact CE2-CD1 3.94Å; F230-L280 HydrophobicContact CE2-CG 4.15Å; F230-L280 HydrophobicContact CZ-CB 3.62Å; F230-L280 HydrophobicContact CZ-CD1 4.38Å; F230-L280 HydrophobicContact CZ-CG 4.12Å; F230-L305 HydrophobicContact CE1-CB 4.22Å; F230-L305 HydrophobicContact CE1-CD2 3.64Å; F230-L305 HydrophobicContact CE1-CG 4.09Å; F230-L305 HydrophobicContact CE2-CG 4.33Å; F230-L305 HydrophobicContact CZ-CB 4.09Å; F230-L305 HydrophobicContact CZ-CD2 3.61Å; F230-L305 HydrophobicContact CZ-CG 3.69Å
231	T	95.2	Very high	93.1	Very high	62 Å²	62	51.6 Å²	51.6	38%	0.38	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	-10.6	176.7	52.3	0	0	0	0	112.8	V273 F274 P277	T231-V273 CarbonylContact O-C 3.58Å; T231-V273 WeakPolarHBondContact O-CA 3.47Å; T231-F274 PolarHBondContact O-N 3Å; T231-P277 HydrophobicContact CG2-CB 4.23Å; T231-P277 HydrophobicContact CG2-CG 3.82Å
232	R	95.2	Very high	92.7	Very high	63 Å²	63	57 Å²	57	24%	0.238	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	136.1	-176.5	-56.1	-176.3	74.7	99.9	-1.5	109.4	F230 E271 L272 V273 P307	F230-R232 WeakPolarHBondContact CD2-O 3.46Å; R232-E271 IonicContact CZ-OE1 3.7Å; R232-E271 IonicContact CZ-OE2 3.18Å; R232-E271 IonicContact NE-OE1 3.86Å; R232-E271 PolarHBondContact NE-OE1 3.16Å; R232-E271 IonicContact NH2-OE1 2.77Å; R232-E271 PolarHBondContact NH2-OE1 3.11Å; R232-E271 IonicContact NH2-OE2 3.58Å; R232-E271 PolarHBondContact NH2-OE2 2.69Å; R232-L272 WeakPolarHBondContact CA-O 3.42Å; R232-V273 HydrophobicContact CG-CG2 4.45Å; R232-P307 HydrophobicContact CB-CG 4.02Å; R232-P307 WeakPolarHBondContact O-CD 3.35Å
233	V	95.9	Very high	92.5	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	149	-179.9	66.8	0	0	0	0	109.7	F230 V235 E271 L272 F274 L280 V302 M304	F230-V233 HydrophobicContact CD2-CB 4.21Å; F230-V233 HydrophobicContact CE2-CB 3.99Å; F230-V233 HydrophobicContact CE2-CG2 4Å; V233-V235 HydrophobicContact CG1-CG1 4.17Å; V233-E271 WeakPolarHBondContact O-CA 3.29Å; V233-L272 HydrophobicContact CG1-CB 3.81Å; V233-L272 HydrophobicContact CG1-CD1 4.39Å; V233-L272 HydrophobicContact CG1-CG 4.47Å; V233-L272 PolarHBondContact N-O 3.39Å; V233-L272 VanDerWaalsContact N-O 3.09Å; V233-L272 PolarHBondContact O-N 3.17Å; V233-F274 HydrophobicContact CB-CZ 4.48Å; V233-F274 HydrophobicContact CG1-CE1 4.15Å; V233-F274 HydrophobicContact CG1-CE2 3.82Å; V233-F274 HydrophobicContact CG1-CZ 3.38Å; V233-L280 HydrophobicContact CG1-CD1 4.4Å; V233-L280 HydrophobicContact CG2-CD1 4.49Å; V233-V302 HydrophobicContact CG2-CB 4.44Å; V233-V302 HydrophobicContact CG2-CG1 3.58Å; V233-V302 HydrophobicContact CG2-CG2 4.28Å; V233-M304 VanDerWaalsContact CG2-O 3.29Å; V233-M304 WeakPolarHBondContact CG2-O 3.23Å
234	I	95.1	Very high	92.4	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	135.4	169.7	-54.2	-57.2	0	0	0	108.9	L265 L269 A270 E271 V303 M304 P307 L321	I234-L265 HydrophobicContact CD1-CD1 3.97Å; I234-L269 HydrophobicContact CG2-CD2 4.47Å; I234-A270 WeakPolarHBondContact CA-O 3.49Å; I234-E271 HydrophobicContact CD1-CB 3.84Å; I234-E271 HydrophobicContact CD1-CG 4.2Å; I234-V303 PolarHBondContact O-N 2.78Å; I234-M304 HydrophobicContact CB-CB 4.01Å; I234-M304 HydrophobicContact CG1-CB 4.18Å; I234-M304 PolarHBondContact N-O 3.02Å; I234-M304 PolarHBondContact O-N 2.97Å; I234-P307 HydrophobicContact CD1-CB 3.84Å; I234-P307 HydrophobicContact CD1-CG 3.93Å; I234-P307 HydrophobicContact CG1-CB 3.68Å; I234-P307 HydrophobicContact CG1-CG 3.95Å; I234-L321 HydrophobicContact CG1-CD1 4.4Å; I234-L321 HydrophobicContact CG1-CD2 4.48Å; I234-L321 HydrophobicContact CG2-CD1 4.06Å; I234-L321 HydrophobicContact CG2-CD2 4.29Å
235	V	95	Very high	92.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	146.9	179	-59.4	0	0	0	0	111.3	V233 L237 L269 A270 L272 L286 A300 R301	V233-V235 HydrophobicContact CG1-CG1 4.17Å; V235-L237 HydrophobicContact CG2-CD2 3.99Å; V235-L237 HydrophobicContact CG2-CG 4.39Å; V235-L269 CarbonylContact O-C 3.52Å; V235-L269 WeakPolarHBondContact O-CA 3.47Å; V235-A270 HydrophobicContact CG2-CB 4.2Å; V235-A270 PolarHBondContact N-O 3.45Å; V235-A270 PolarHBondContact O-N 2.83Å; V235-L272 HydrophobicContact CG1-CD1 3.68Å; V235-L272 HydrophobicContact CG1-CG 4.09Å; V235-L272 HydrophobicContact CG2-CD1 4.04Å; V235-L272 HydrophobicContact CG2-CD2 4.44Å; V235-L272 HydrophobicContact CG2-CG 3.85Å; V235-L286 HydrophobicContact CG1-CD2 4.27Å; V235-A300 HydrophobicContact CB-CB 3.61Å; V235-A300 HydrophobicContact CG1-CB 4.03Å; V235-A300 HydrophobicContact CG2-CB 3.64Å; V235-R301 CarbonylContact C-O 3.5Å; V235-R301 WeakPolarHBondContact CA-O 3.21Å; V235-R301 WeakPolarHBondContact CB-O 3.31Å
236	E	93.6	Very high	92.2	Very high	75 Å²	75	61.7 Å²	61.7	35%	0.35	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.6	160.1	-179.7	-177.8	-134.5	0	0	108.4	L269 A300 R301 V303	E236-L269 HydrophobicContact CB-CD2 4.33Å; E236-A300 CarbonylContact O-C 3.56Å; E236-A300 WeakPolarHBondContact O-CA 3.45Å; E236-R301 HydrophobicContact CB-CB 4.45Å; E236-R301 PolarHBondContact N-O 3.18Å; E236-R301 PolarHBondContact O-N 3.36Å; E236-R301 IonicContact OE1-NH2 2.78Å; E236-R301 IonicContact OE2-CZ 3.8Å; E236-R301 IonicContact OE2-NE 2.85Å; E236-R301 PolarHBondContact OE2-NE 3.49Å; E236-R301 IonicContact OE2-NH2 2.78Å; E236-R301 PolarHBondContact OE2-NH2 3.16Å; E236-V303 HydrophobicContact CB-CG2 4.02Å
237	L	92.7	Very high	92.2	Very high	17 Å²	17	62.6 Å²	62.6	9%	0.089	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.9	-179.9	-68	177	0	0	0	111.4	V235 L243 L264 N268 A270 L288 A300	V235-L237 HydrophobicContact CG2-CD2 3.99Å; V235-L237 HydrophobicContact CG2-CG 4.39Å; L237-L243 HydrophobicContact CD1-CD1 3.77Å; L237-L243 HydrophobicContact CD2-CD1 4.11Å; L237-L264 HydrophobicContact CD1-CD2 3.91Å; L237-N268 WeakPolarHBondContact CB-O 3.29Å; L237-N268 PolarHBondContact N-O 3.04Å; L237-A270 HydrophobicContact CD1-CB 3.35Å; L237-A270 HydrophobicContact CD2-CB 4.26Å; L237-A270 HydrophobicContact CG-CB 3.71Å; L237-L288 HydrophobicContact CD2-CD1 3.64Å; L237-A300 HydrophobicContact CD2-CB 3.93Å
238	Q	90.2	Very high	92.3	Very high	102 Å²	102	63.3 Å²	63.3	48%	0.477	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	116.8	162.2	-172.7	176.9	2.4	0	0	107.3	L66 A298 G299	L66-Q238 HydrophobicContact CD2-CB 4.26Å; L66-Q238 HydrophobicContact CD2-CG 4.28Å; L66-Q238 VanDerWaalsContact CD2-O 3.27Å; L66-Q238 WeakPolarHBondContact CD2-O 3.35Å; Q238-A298 CarbonylContact O-C 3.59Å; Q238-A298 WeakPolarHBondContact O-CA 3.45Å; Q238-A298 WeakPolarHBondContact O-CB 3.49Å; Q238-G299 PolarHBondContact N-O 3.4Å; Q238-G299 PolarHBondContact O-N 3.33Å
239	T	87.9	Confident	92.5	Very high	60 Å²	60	55.3 Å²	55.3	37%	0.368	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.5	-170.7	-165.7	0	0	0	0	113.1	T241 L297	T239-T241 PolarHBondContact OG1-N 3.13Å; T239-T241 PolarHBondContact OG1-O 3Å; T239-L297 PolarHBondContact OG1-O 2.81Å
240	H	83.9	Confident	92.5	Very high	85 Å²	85	54.6 Å²	54.6	39%	0.394	28%	0.283	S	S	.	.	S	Bend	trans	-87.4	-33.3	167.2	-65.1	-65.8	0	0	0	111.6	Q65 L297	Q65-H240 PolarHBondContact OE1-CE1 3.39Å; Q65-H240 PolarHBondContact OE1-NE2 2.89Å; H240-L297 PolarHBondContact N-O 3.32Å
241	T	83.4	Confident	92.5	Very high	73 Å²	73	53.8 Å²	53.8	45%	0.448	28%	0.279	S	S	.	.	S	Bend	trans	-121.1	127.4	-177.9	-58.1	0	0	0	0	109.4	T239 L243	T239-T241 PolarHBondContact OG1-N 3.13Å; T239-T241 PolarHBondContact OG1-O 3Å; T241-L243 PolarHBondContact O-N 3.32Å
242	P	87.7	Confident	92.3	Very high	113 Å²	113	51.3 Å²	51.3	73%	0.734	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-52.1	126.7	176.9	-27.2	35	0	0	0	111.9
243	L	92.5	Very high	92.1	Very high	17 Å²	17	48.7 Å²	48.7	9%	0.089	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-80.3	156.9	174.9	-58.2	-175	0	0	0	109.6	L237 T241 Q247 V262 L264 L288 L297 A298	L237-L243 HydrophobicContact CD1-CD1 3.77Å; L237-L243 HydrophobicContact CD2-CD1 4.11Å; T241-L243 PolarHBondContact O-N 3.32Å; L243-Q247 VanDerWaalsContact CB-NE2 3.33Å; L243-V262 HydrophobicContact CD1-CG1 4.32Å; L243-V262 HydrophobicContact CD1-CG2 4.35Å; L243-L264 HydrophobicContact CB-CD2 4.08Å; L243-L264 WeakPolarHBondContact O-CD1 3.41Å; L243-L288 HydrophobicContact CD1-CD1 4.46Å; L243-L297 HydrophobicContact CD2-CB 3.7Å; L243-L297 HydrophobicContact CD2-CD1 4.03Å; L243-L297 HydrophobicContact CD2-CG 4.45Å; L243-A298 HydrophobicContact CD1-CB 4.03Å; L243-A298 HydrophobicContact CD2-CB 4.22Å; L243-A298 HydrophobicContact CG-CB 4.43Å
244	T	93	Very high	91.3	Very high	94 Å²	94	49.3 Å²	49.3	58%	0.577	26%	0.259	S	S	*	.	P	Polyproline II helix	trans	-103.1	149.9	174.3	-55.4	0	0	0	0	110.9	W246 Q247	T244-W246 PolarHBondContact O-N 3.49Å; T244-Q247 WeakPolarHBondContact O-CG 3.48Å; T244-Q247 PolarHBondContact O-N 3.44Å
245	Q	93.1	Very high	90.6	Very high	109 Å²	109	50 Å²	50	51%	0.509	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	131	177.2	-168.9	173.1	-26.2	0	0	111.4	Q247	Q245-Q247 VanDerWaalsContact C-N 3.31Å; Q245-Q247 PolarHBondContact O-N 2.91Å
246	W	93.2	Very high	90.2	Very high	131 Å²	131	51.1 Å²	51.1	50%	0.496	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.4	30.7	179	-154.6	-109.8	0	0	0	115.1	T244 R261 V262 V273	T244-W246 PolarHBondContact O-N 3.49Å; W246-R261 HydrophobicContact CD2-CB 4.29Å; W246-R261 VanDerWaalsContact CE2-CD 3.48Å; W246-R261 HydrophobicContact CE3-CB 4.31Å; W246-R261 HydrophobicContact CZ2-CB 4.5Å; W246-R261 HydrophobicContact CZ3-CB 4.42Å; W246-V262 WeakPolarHBondContact CA-O 3.43Å; W246-V262 PolarHBondContact N-O 2.87Å; W246-V273 HydrophobicContact CH2-CB 4.29Å; W246-V273 HydrophobicContact CH2-CG2 3.95Å; W246-V273 HydrophobicContact CZ3-CB 4.5Å; W246-V273 HydrophobicContact CZ3-CG2 3.87Å
247	Q	94.7	Very high	90.1	Very high	35 Å²	35	52.2 Å²	52.2	16%	0.164	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	142.1	176.1	70.8	-177	12.8	0	0	111.9	L243 T244 Q245 R261 V262	L243-Q247 VanDerWaalsContact CB-NE2 3.33Å; T244-Q247 WeakPolarHBondContact O-CG 3.48Å; T244-Q247 PolarHBondContact O-N 3.44Å; Q245-Q247 VanDerWaalsContact C-N 3.31Å; Q245-Q247 PolarHBondContact O-N 2.91Å; Q247-R261 VanDerWaalsContact O-CA 3.26Å; Q247-R261 WeakPolarHBondContact O-CA 3.19Å; Q247-V262 HydrophobicContact CG-CG1 3.34Å; Q247-V262 PolarHBondContact N-O 3.28Å; Q247-V262 PolarHBondContact O-N 3.5Å; Q247-V262 VanDerWaalsContact O-N 3.09Å
248	P	96.7	Very high	90.1	Very high	64 Å²	64	51.9 Å²	51.9	42%	0.416	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	142.6	170.4	32.1	-34.3	0	0	0	111.2	G260 I291	P248-G260 CarbonylContact C-O 3.46Å; P248-G260 WeakPolarHBondContact CA-O 3.37Å; P248-I291 HydrophobicContact CB-CB 4.39Å; P248-I291 HydrophobicContact CB-CD1 4.31Å; P248-I291 HydrophobicContact CB-CG1 4.22Å; P248-I291 HydrophobicContact CG-CB 4.44Å; P248-I291 HydrophobicContact CG-CG2 4.34Å
249	L	95.6	Very high	90.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	167.4	-179.6	56.1	71.9	0	0	0	112.4	I251 G260 V262 L288 R289	L249-I251 HydrophobicContact CD1-CD1 3.41Å; L249-I251 VanDerWaalsContact CD1-CD1 3.41Å; L249-I251 HydrophobicContact CD1-CG1 3.48Å; L249-I251 VanDerWaalsContact CD1-CG1 3.48Å; L249-G260 PolarHBondContact N-O 3.06Å; L249-G260 PolarHBondContact O-N 2.9Å; L249-G260 VanDerWaalsContact O-N 3.08Å; L249-V262 HydrophobicContact CD2-CB 3.72Å; L249-V262 HydrophobicContact CD2-CG1 3.45Å; L249-V262 VanDerWaalsContact CD2-CG1 3.45Å; L249-V262 HydrophobicContact CG-CG1 4.42Å; L249-L288 HydrophobicContact CD1-CD2 3.82Å; L249-L288 HydrophobicContact CD2-CB 4.24Å; L249-L288 HydrophobicContact CD2-CD1 4.19Å; L249-L288 HydrophobicContact CD2-CD2 4.38Å; L249-R289 WeakPolarHBondContact CA-O 3.07Å; L249-R289 VanDerWaalsContact CB-O 3.25Å; L249-R289 WeakPolarHBondContact CB-O 3.12Å
250	H	94.2	Very high	90.7	Very high	26 Å²	26	46.4 Å²	46.4	12%	0.12	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	133.2	167.8	-69.7	-60.9	0	0	0	110.4	H257 L288 R289 D290 I291	H250-H257 AromaticContact CE1-CE1 3.97Å; H250-H257 AromaticContact CE1-NE2 3.62Å; H250-H257 AromaticContact CG-NE2 3.48Å; H250-H257 AromaticContact ND1-CE1 3.71Å; H250-H257 AromaticContact ND1-NE2 2.95Å; H250-H257 PolarHBondContact ND1-NE2 3.08Å; H250-L288 WeakPolarHBondContact O-CA 3.49Å; H250-R289 HydrophobicContact CB-CB 4.37Å; H250-R289 PolarHBondContact N-O 3.3Å; H250-R289 PolarHBondContact O-N 2.97Å; H250-D290 PolarHBondContact CD2-O 2.56Å; H250-I291 PolarHBondContact NE2-O 3.22Å; H250-I291 VanDerWaalsContact NE2-O 3.14Å
251	I	93.8	Very high	91.3	Very high	3 Å²	3	46.6 Å²	46.6	2%	0.015	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.6	173.3	-56	94	0	0	0	107.8	L249 V258 G260 L272 F274 L286 L288	L249-I251 HydrophobicContact CD1-CD1 3.41Å; L249-I251 VanDerWaalsContact CD1-CD1 3.41Å; L249-I251 HydrophobicContact CD1-CG1 3.48Å; L249-I251 VanDerWaalsContact CD1-CG1 3.48Å; I251-V258 PolarHBondContact N-O 2.98Å; I251-V258 PolarHBondContact O-N 3.47Å; I251-G260 VanDerWaalsContact CD1-N 3.28Å; I251-L272 HydrophobicContact CG1-CD1 4.49Å; I251-F274 HydrophobicContact CD1-CD1 4.01Å; I251-F274 HydrophobicContact CD1-CE1 4.28Å; I251-F274 HydrophobicContact CG1-CD1 4.26Å; I251-F274 HydrophobicContact CG1-CE1 4.02Å; I251-F274 HydrophobicContact CG2-CE1 4.2Å; I251-L286 HydrophobicContact CG2-CD1 4.24Å; I251-L286 HydrophobicContact CG2-CD2 4.28Å; I251-L288 HydrophobicContact CB-CD2 4.36Å; I251-L288 HydrophobicContact CG1-CD2 3.82Å; I251-L288 HydrophobicContact CG2-CD2 4.29Å
252	H	91.1	Very high	91.9	Very high	10 Å²	10	43.1 Å²	43.1	5%	0.046	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.9	174.9	-64.3	-81.8	0	0	0	109.9	L34 H257 L286 V287	L34-H252 HydrophobicContact CB-CB 4.22Å; L34-H252 HydrophobicContact CD1-CB 3.63Å; L34-H252 HydrophobicContact CG-CB 4.36Å; H252-H257 AromaticContact CE1-CD2 3.3Å; H252-H257 PolarHBondContact CE1-CD2 3.46Å; H252-H257 AromaticContact CE1-CG 3.86Å; H252-H257 AromaticContact CE1-NE2 3.71Å; H252-H257 AromaticContact ND1-CD2 3.67Å; H252-H257 AromaticContact NE2-CD2 3.94Å; H252-L286 WeakPolarHBondContact O-CA 3.4Å; H252-L286 WeakPolarHBondContact O-CB 3.4Å; H252-V287 HydrophobicContact CB-CB 4.45Å; H252-V287 PolarHBondContact N-O 3.2Å; H252-V287 PolarHBondContact O-N 3.37Å
253	H	90.1	Very high	92.2	Very high	8 Å²	8	38.3 Å²	38.3	4%	0.037	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	122.6	-179.2	173.9	65.6	0	0	0	110.1	W220 A255 S256 L278 L280 D284 R285 L286	W220-H253 AromaticContact CH2-NE2 3.8Å; W220-H253 AromaticContact CZ2-CD2 3.91Å; W220-H253 AromaticContact CZ2-NE2 3.44Å; W220-H253 WeakPolarHBondContact CZ2-NE2 3.37Å; H253-A255 PolarHBondContact O-N 3.13Å; H253-A255 VanDerWaalsContact O-N 3.16Å; H253-S256 PolarHBondContact N-O 3.43Å; H253-S256 VanDerWaalsContact N-O 3.12Å; H253-S256 WeakPolarHBondContact O-CA 3.28Å; H253-S256 VanDerWaalsContact O-CB 3.23Å; H253-S256 WeakPolarHBondContact O-CB 3.47Å; H253-S256 PolarHBondContact O-N 2.9Å; H253-L278 HydrophobicContact CB-CD2 4.48Å; H253-L280 HydrophobicContact CB-CD2 4.36Å; H253-L280 WeakPolarHBondContact CD2-CD2 3.45Å; H253-L280 WeakPolarHBondContact NE2-CD2 3.17Å; H253-D284 IonicContact CE1-OD2 3.77Å; H253-D284 IonicContact NE2-OD2 3.77Å; H253-R285 PolarHBondContact ND1-O 2.81Å; H253-L286 HydrophobicContact CB-CB 4.2Å
254	A	79.2	Confident	92.2	Very high	13 Å²	13	40.1 Å²	40.1	11%	0.107	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	34.8	63.3	170.3	0	0	0	0	0	115.1	A143 W220 S256	A143-A254 HydrophobicContact CB-CB 4.28Å; W220-A254 HydrophobicContact CH2-CB 3.64Å; W220-A254 HydrophobicContact CZ2-CB 4.07Å; A254-S256 VanDerWaalsContact C-N 3.26Å; A254-S256 PolarHBondContact O-N 3.25Å
255	A	81	Confident	92	Very high	16 Å²	16	37 Å²	37	13%	0.132	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.5	2.2	-177.9	0	0	0	0	0	117.3	A35 R217 H253	A35-A255 HydrophobicContact CB-CB 3.6Å; R217-A255 HydrophobicContact CG-CB 3.93Å; H253-A255 PolarHBondContact O-N 3.13Å; H253-A255 VanDerWaalsContact O-N 3.16Å
256	S	87.3	Confident	91.6	Very high	22 Å²	22	37.7 Å²	37.7	15%	0.154	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	147.6	172	-171.9	0	0	0	0	112.4	H253 A254	H253-S256 PolarHBondContact N-O 3.43Å; H253-S256 VanDerWaalsContact N-O 3.12Å; H253-S256 WeakPolarHBondContact O-CA 3.28Å; H253-S256 VanDerWaalsContact O-CB 3.23Å; H253-S256 WeakPolarHBondContact O-CB 3.47Å; H253-S256 PolarHBondContact O-N 2.9Å; A254-S256 VanDerWaalsContact C-N 3.26Å; A254-S256 PolarHBondContact O-N 3.25Å
257	H	90.4	Very high	90.7	Very high	99 Å²	99	36.8 Å²	36.8	46%	0.458	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	119.5	175.4	175	-146.6	0	0	0	109.8	H250 H252	H250-H257 AromaticContact CE1-CE1 3.97Å; H250-H257 AromaticContact CE1-NE2 3.62Å; H250-H257 AromaticContact CG-NE2 3.48Å; H250-H257 AromaticContact ND1-CE1 3.71Å; H250-H257 AromaticContact ND1-NE2 2.95Å; H250-H257 PolarHBondContact ND1-NE2 3.08Å; H252-H257 AromaticContact CE1-CD2 3.3Å; H252-H257 PolarHBondContact CE1-CD2 3.46Å; H252-H257 AromaticContact CE1-CG 3.86Å; H252-H257 AromaticContact CE1-NE2 3.71Å; H252-H257 AromaticContact ND1-CD2 3.67Å; H252-H257 AromaticContact NE2-CD2 3.94Å
258	V	93.1	Very high	90.4	Very high	9 Å²	9	40.9 Å²	40.9	6%	0.055	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.1	-178.3	179	0	0	0	0	109.5	I251 F274 L278	I251-V258 PolarHBondContact N-O 2.98Å; I251-V258 PolarHBondContact O-N 3.47Å; V258-F274 HydrophobicContact CG1-CB 4.05Å; V258-L278 HydrophobicContact CG2-CD2 4.33Å
259	T	95.7	Very high	90.2	Very high	46 Å²	46	38 Å²	38	28%	0.282	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	151.6	168.7	55.9	0	0	0	0	110.6	D275 I291	T259-D275 WeakPolarHBondContact CB-OD2 2.95Å; T259-D275 PolarHBondContact O-N 2.76Å; T259-D275 PolarHBondContact OG1-OD2 2.83Å; T259-I291 HydrophobicContact CG2-CD1 4.26Å
260	G	96	Very high	90.1	Very high	1 Å²	1	38 Å²	38	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.3	-172.2	177.4	0	0	0	0	0	112.4	P248 L249 I251 V273	P248-G260 CarbonylContact C-O 3.46Å; P248-G260 WeakPolarHBondContact CA-O 3.37Å; L249-G260 PolarHBondContact N-O 3.06Å; L249-G260 PolarHBondContact O-N 2.9Å; L249-G260 VanDerWaalsContact O-N 3.08Å; I251-G260 VanDerWaalsContact CD1-N 3.28Å; G260-V273 CarbonylContact C-O 3.6Å; G260-V273 WeakPolarHBondContact CA-O 3.19Å
261	R	96.4	Very high	90.1	Very high	89 Å²	89	37.2 Å²	37.2	34%	0.336	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.5	177.7	-64.7	176.2	-175.9	72	2.4	110.3	W246 Q247 V273 D275	W246-R261 HydrophobicContact CD2-CB 4.29Å; W246-R261 VanDerWaalsContact CE2-CD 3.48Å; W246-R261 HydrophobicContact CE3-CB 4.31Å; W246-R261 HydrophobicContact CZ2-CB 4.5Å; W246-R261 HydrophobicContact CZ3-CB 4.42Å; Q247-R261 VanDerWaalsContact O-CA 3.26Å; Q247-R261 WeakPolarHBondContact O-CA 3.19Å; R261-V273 PolarHBondContact N-O 3.27Å; R261-V273 PolarHBondContact O-N 2.86Å; R261-D275 IonicContact NH1-OD1 3.14Å; R261-D275 PolarHBondContact NH1-OD1 3.08Å; R261-D275 VanDerWaalsContact NH1-OD1 3.13Å
262	V	95.8	Very high	90.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	134.1	174	62	0	0	0	0	110.7	L243 W246 Q247 L249 L264 A270 E271 L272	L243-V262 HydrophobicContact CD1-CG1 4.32Å; L243-V262 HydrophobicContact CD1-CG2 4.35Å; W246-V262 WeakPolarHBondContact CA-O 3.43Å; W246-V262 PolarHBondContact N-O 2.87Å; Q247-V262 HydrophobicContact CG-CG1 3.34Å; Q247-V262 PolarHBondContact N-O 3.28Å; Q247-V262 PolarHBondContact O-N 3.5Å; Q247-V262 VanDerWaalsContact O-N 3.09Å; L249-V262 HydrophobicContact CD2-CB 3.72Å; L249-V262 HydrophobicContact CD2-CG1 3.45Å; L249-V262 VanDerWaalsContact CD2-CG1 3.45Å; L249-V262 HydrophobicContact CG-CG1 4.42Å; V262-L264 HydrophobicContact CG2-CD2 4.43Å; V262-A270 HydrophobicContact CG2-CB 3.59Å; V262-E271 CarbonylContact C-O 3.59Å; V262-E271 WeakPolarHBondContact CA-O 3.48Å; V262-L272 HydrophobicContact CB-CD2 3.74Å; V262-L272 HydrophobicContact CG2-CD2 3.81Å
263	S	93.9	Very high	90.5	Very high	13 Å²	13	37.7 Å²	37.7	9%	0.091	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123	170.5	-177.7	0	0	0	0	109.2	A270 E271	S263-A270 CarbonylContact O-C 3.59Å; S263-A270 VanDerWaalsContact O-CA 3.31Å; S263-A270 WeakPolarHBondContact O-CA 3.32Å; S263-A270 WeakPolarHBondContact O-CB 3.44Å; S263-E271 PolarHBondContact N-O 2.79Å; S263-E271 PolarHBondContact O-N 2.63Å
264	L	92.6	Very high	90.8	Very high	55 Å²	55	37.7 Å²	37.7	29%	0.288	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	140	179.9	-54.8	179.1	0	0	0	111.5	L237 L243 V262 A270	L237-L264 HydrophobicContact CD1-CD2 3.91Å; L243-L264 HydrophobicContact CB-CD2 4.08Å; L243-L264 WeakPolarHBondContact O-CD1 3.41Å; V262-L264 HydrophobicContact CG2-CD2 4.43Å; L264-A270 HydrophobicContact CD2-CB 4.33Å
265	L	88.5	Confident	91.5	Very high	29 Å²	29	41.1 Å²	41.1	15%	0.152	21%	0.213	C	C	.	.			trans	-117	-175.5	168.1	-57.6	174.6	0	0	0	108.1	I234 L269 L318	I234-L265 HydrophobicContact CD1-CD1 3.97Å; L265-L269 CarbonylContact C-O 3.54Å; L265-L269 WeakPolarHBondContact CA-O 3.47Å; L265-L269 HydrophobicContact CB-CB 3.99Å; L265-L269 WeakPolarHBondContact CB-O 3.2Å; L265-L269 HydrophobicContact CD1-CB 4.44Å; L265-L269 PolarHBondContact N-O 3.19Å; L265-L318 HydrophobicContact CB-CD2 4.14Å
266	E	83.9	Confident	92.1	Very high	123 Å²	123	44.1 Å²	44.1	58%	0.575	23%	0.229	S	C	*	.	S	Bend	trans	-77.6	166.2	176.6	-62.7	-177.2	171.4	0	0	111.6	N268 L269 L318	E266-N268 PolarHBondContact O-N 2.82Å; E266-L269 VanDerWaalsContact O-CB 3.27Å; E266-L269 WeakPolarHBondContact O-CB 3.21Å; E266-L269 PolarHBondContact O-N 3.32Å; E266-L318 HydrophobicContact CB-CD1 4.09Å; E266-L318 HydrophobicContact CG-CD1 3.99Å; E266-L318 WeakPolarHBondContact OE2-CD1 3.47Å
267	D	74.8	Confident	92.4	Very high	112 Å²	112	46 Å²	46	60%	0.599	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	45.5	173.3	-63.2	-23.5	0	0	0	115.9	L269	D267-L269 PolarHBondContact O-N 3.47Å
268	N	88.3	Confident	92.6	Very high	120 Å²	120	41.7 Å²	41.7	64%	0.642	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.8	14.6	-175.8	-60.8	-37.5	0	0	0	114.1	L237 E266	L237-N268 WeakPolarHBondContact CB-O 3.29Å; L237-N268 PolarHBondContact N-O 3.04Å; E266-N268 PolarHBondContact O-N 2.82Å
269	L	91.6	Very high	92.7	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	148	172.6	-62.3	169.8	0	0	0	110	I234 V235 E236 L265 E266 D267 L321	I234-L269 HydrophobicContact CG2-CD2 4.47Å; V235-L269 CarbonylContact O-C 3.52Å; V235-L269 WeakPolarHBondContact O-CA 3.47Å; E236-L269 HydrophobicContact CB-CD2 4.33Å; L265-L269 CarbonylContact C-O 3.54Å; L265-L269 WeakPolarHBondContact CA-O 3.47Å; L265-L269 HydrophobicContact CB-CB 3.99Å; L265-L269 WeakPolarHBondContact CB-O 3.2Å; L265-L269 HydrophobicContact CD1-CB 4.44Å; L265-L269 PolarHBondContact N-O 3.19Å; E266-L269 VanDerWaalsContact O-CB 3.27Å; E266-L269 WeakPolarHBondContact O-CB 3.21Å; E266-L269 PolarHBondContact O-N 3.32Å; D267-L269 PolarHBondContact O-N 3.47Å; L269-L321 HydrophobicContact CD1-CB 3.83Å; L269-L321 HydrophobicContact CD1-CD1 4.4Å
270	A	93.5	Very high	92.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	160	168.6	0	0	0	0	0	111.4	I234 V235 L237 V262 S263 L264	I234-A270 WeakPolarHBondContact CA-O 3.49Å; V235-A270 HydrophobicContact CG2-CB 4.2Å; V235-A270 PolarHBondContact N-O 3.45Å; V235-A270 PolarHBondContact O-N 2.83Å; L237-A270 HydrophobicContact CD1-CB 3.35Å; L237-A270 HydrophobicContact CD2-CB 4.26Å; L237-A270 HydrophobicContact CG-CB 3.71Å; V262-A270 HydrophobicContact CG2-CB 3.59Å; S263-A270 CarbonylContact O-C 3.59Å; S263-A270 VanDerWaalsContact O-CA 3.31Å; S263-A270 WeakPolarHBondContact O-CA 3.32Å; S263-A270 WeakPolarHBondContact O-CB 3.44Å; L264-A270 HydrophobicContact CD2-CB 4.33Å
271	E	95.1	Very high	92.6	Very high	9 Å²	9	40.7 Å²	40.7	4%	0.042	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	129.3	169.2	172.4	166.6	-148.7	0	0	109.6	R232 V233 I234 V262 S263 V273 K312	R232-E271 IonicContact CZ-OE1 3.7Å; R232-E271 IonicContact CZ-OE2 3.18Å; R232-E271 IonicContact NE-OE1 3.86Å; R232-E271 PolarHBondContact NE-OE1 3.16Å; R232-E271 IonicContact NH2-OE1 2.77Å; R232-E271 PolarHBondContact NH2-OE1 3.11Å; R232-E271 IonicContact NH2-OE2 3.58Å; R232-E271 PolarHBondContact NH2-OE2 2.69Å; V233-E271 WeakPolarHBondContact O-CA 3.29Å; I234-E271 HydrophobicContact CD1-CB 3.84Å; I234-E271 HydrophobicContact CD1-CG 4.2Å; V262-E271 CarbonylContact C-O 3.59Å; V262-E271 WeakPolarHBondContact CA-O 3.48Å; S263-E271 PolarHBondContact N-O 2.79Å; S263-E271 PolarHBondContact O-N 2.63Å; E271-V273 HydrophobicContact CG-CG2 4.19Å; E271-K312 IonicContact OE1-NZ 2.87Å; E271-K312 PolarHBondContact OE1-NZ 3.16Å; E271-K312 IonicContact OE2-NZ 2.87Å; E271-K312 PolarHBondContact OE2-NZ 3.01Å
272	L	96.1	Very high	92.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	135	167	-58	177.8	0	0	0	109.6	R232 V233 V235 I251 V262 F274 L286 L288	R232-L272 WeakPolarHBondContact CA-O 3.42Å; V233-L272 HydrophobicContact CG1-CB 3.81Å; V233-L272 HydrophobicContact CG1-CD1 4.39Å; V233-L272 HydrophobicContact CG1-CG 4.47Å; V233-L272 PolarHBondContact N-O 3.39Å; V233-L272 VanDerWaalsContact N-O 3.09Å; V233-L272 PolarHBondContact O-N 3.17Å; V235-L272 HydrophobicContact CG1-CD1 3.68Å; V235-L272 HydrophobicContact CG1-CG 4.09Å; V235-L272 HydrophobicContact CG2-CD1 4.04Å; V235-L272 HydrophobicContact CG2-CD2 4.44Å; V235-L272 HydrophobicContact CG2-CG 3.85Å; I251-L272 HydrophobicContact CG1-CD1 4.49Å; V262-L272 HydrophobicContact CB-CD2 3.74Å; V262-L272 HydrophobicContact CG2-CD2 3.81Å; L272-F274 HydrophobicContact CB-CD1 4.25Å; L272-F274 HydrophobicContact CB-CE1 3.6Å; L272-F274 HydrophobicContact CB-CZ 4.21Å; L272-F274 HydrophobicContact CD1-CE1 3.99Å; L272-F274 HydrophobicContact CD1-CZ 4.42Å; L272-F274 HydrophobicContact CG-CE1 4.44Å; L272-L286 HydrophobicContact CD1-CD1 4.05Å; L272-L286 HydrophobicContact CD1-CD2 3.99Å; L272-L288 HydrophobicContact CD1-CD2 4.01Å; L272-L288 HydrophobicContact CD2-CD1 4.14Å; L272-L288 HydrophobicContact CD2-CD2 4.22Å
273	V	96.3	Very high	92.2	Very high	22 Å²	22	40.1 Å²	40.1	13%	0.133	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	111.9	172.1	-176.9	0	0	0	0	107.9	T231 R232 W246 G260 R261 E271	T231-V273 CarbonylContact O-C 3.58Å; T231-V273 WeakPolarHBondContact O-CA 3.47Å; R232-V273 HydrophobicContact CG-CG2 4.45Å; W246-V273 HydrophobicContact CH2-CB 4.29Å; W246-V273 HydrophobicContact CH2-CG2 3.95Å; W246-V273 HydrophobicContact CZ3-CB 4.5Å; W246-V273 HydrophobicContact CZ3-CG2 3.87Å; G260-V273 CarbonylContact C-O 3.6Å; G260-V273 WeakPolarHBondContact CA-O 3.19Å; R261-V273 PolarHBondContact N-O 3.27Å; R261-V273 PolarHBondContact O-N 2.86Å; E271-V273 HydrophobicContact CG-CG2 4.19Å
274	F	96.5	Very high	92	Very high	7 Å²	7	40.2 Å²	40.2	3%	0.031	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	139.1	-178.6	-51	-37.4	0	0	0	111.1	T231 V233 I251 V258 L272 T276 L278 L280	T231-F274 PolarHBondContact O-N 3Å; V233-F274 HydrophobicContact CB-CZ 4.48Å; V233-F274 HydrophobicContact CG1-CE1 4.15Å; V233-F274 HydrophobicContact CG1-CE2 3.82Å; V233-F274 HydrophobicContact CG1-CZ 3.38Å; I251-F274 HydrophobicContact CD1-CD1 4.01Å; I251-F274 HydrophobicContact CD1-CE1 4.28Å; I251-F274 HydrophobicContact CG1-CD1 4.26Å; I251-F274 HydrophobicContact CG1-CE1 4.02Å; I251-F274 HydrophobicContact CG2-CE1 4.2Å; V258-F274 HydrophobicContact CG1-CB 4.05Å; L272-F274 HydrophobicContact CB-CD1 4.25Å; L272-F274 HydrophobicContact CB-CE1 3.6Å; L272-F274 HydrophobicContact CB-CZ 4.21Å; L272-F274 HydrophobicContact CD1-CE1 3.99Å; L272-F274 HydrophobicContact CD1-CZ 4.42Å; L272-F274 HydrophobicContact CG-CE1 4.44Å; F274-T276 VanDerWaalsContact C-N 3.3Å; F274-T276 WeakPolarHBondContact CB-O 3.38Å; F274-L278 HydrophobicContact CD2-CB 4.29Å; F274-L278 HydrophobicContact CE2-CB 4.39Å; F274-L280 HydrophobicContact CE2-CD1 3.71Å; F274-L280 HydrophobicContact CZ-CD1 3.73Å
275	D	95.3	Very high	91.9	Very high	85 Å²	85	42.9 Å²	42.9	46%	0.455	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	-28	170.6	-60.1	-44.2	0	0	0	110.7	T259 R261	T259-D275 WeakPolarHBondContact CB-OD2 2.95Å; T259-D275 PolarHBondContact O-N 2.76Å; T259-D275 PolarHBondContact OG1-OD2 2.83Å; R261-D275 IonicContact NH1-OD1 3.14Å; R261-D275 PolarHBondContact NH1-OD1 3.08Å; R261-D275 VanDerWaalsContact NH1-OD1 3.13Å
276	T	93.2	Very high	92.1	Very high	79 Å²	79	41.6 Å²	41.6	49%	0.485	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.5	175.1	-53.2	0	0	0	0	110.1	F274	F274-T276 VanDerWaalsContact C-N 3.3Å; F274-T276 WeakPolarHBondContact CB-O 3.38Å
277	P	94.4	Very high	92.5	Very high	61 Å²	61	35.9 Å²	35.9	40%	0.396	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	141.5	174.9	-22.1	32.2	0	0	0	112.3	P229 T231	P229-P277 HydrophobicContact CB-CB 3.66Å; P229-P277 HydrophobicContact CG-CB 3.69Å; T231-P277 HydrophobicContact CG2-CB 4.23Å; T231-P277 HydrophobicContact CG2-CG 3.82Å
278	L	93.5	Very high	93.3	Very high	9 Å²	9	30.5 Å²	30.5	5%	0.047	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	143.7	-179.5	-174.4	60.5	0	0	0	110.8	F230 H253 V258 F274 L280	F230-L278 PolarHBondContact N-O 3.13Å; F230-L278 PolarHBondContact O-N 3.42Å; H253-L278 HydrophobicContact CB-CD2 4.48Å; V258-L278 HydrophobicContact CG2-CD2 4.33Å; F274-L278 HydrophobicContact CD2-CB 4.29Å; F274-L278 HydrophobicContact CE2-CB 4.39Å; L278-L280 HydrophobicContact CD2-CD2 3.65Å; L278-L280 HydrophobicContact CD2-CG 4.25Å; L278-L280 HydrophobicContact CG-CD2 3.94Å; L278-L280 HydrophobicContact CG-CG 4.23Å
279	W	95.1	Very high	93.5	Very high	32 Å²	32	25.1 Å²	25.1	12%	0.121	13%	0.13	C	C	.	.			trans	-81.9	121.8	167.8	-64.8	-80.9	0	0	0	109.4	T175 P227 P229 W350	T175-W279 HydrophobicContact CG2-CD2 4.09Å; T175-W279 HydrophobicContact CG2-CE3 4.19Å; T175-W279 HydrophobicContact CG2-CZ2 4.39Å; T175-W279 HydrophobicContact CG2-CZ3 4.42Å; P227-W279 PolarHBondContact O-NE1 2.7Å; P229-W279 HydrophobicContact CB-CD2 4.05Å; P229-W279 HydrophobicContact CB-CG 4.31Å; P229-W279 HydrophobicContact CB-CZ2 4.18Å; P229-W279 HydrophobicContact CG-CH2 4.4Å; P229-W279 HydrophobicContact CG-CZ2 3.88Å; W279-W350 HydrophobicContact CB-CH2 4.42Å; W279-W350 HydrophobicContact CB-CZ2 3.99Å; W279-W350 AromaticContact CD1-CZ2 3.84Å; W279-W350 HydrophobicContact CG-CZ2 4.3Å
280	L	95.3	Very high	93.4	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	13%	0.133	C	C	.	.			trans	-130.9	161.7	170.4	-48.9	167.6	0	0	0	108.8	F230 V233 H253 F274 L278 V302 L305 W350	F230-L280 HydrophobicContact CE2-CB 4.06Å; F230-L280 HydrophobicContact CE2-CD1 3.94Å; F230-L280 HydrophobicContact CE2-CG 4.15Å; F230-L280 HydrophobicContact CZ-CB 3.62Å; F230-L280 HydrophobicContact CZ-CD1 4.38Å; F230-L280 HydrophobicContact CZ-CG 4.12Å; V233-L280 HydrophobicContact CG1-CD1 4.4Å; V233-L280 HydrophobicContact CG2-CD1 4.49Å; H253-L280 HydrophobicContact CB-CD2 4.36Å; H253-L280 WeakPolarHBondContact CD2-CD2 3.45Å; H253-L280 WeakPolarHBondContact NE2-CD2 3.17Å; F274-L280 HydrophobicContact CE2-CD1 3.71Å; F274-L280 HydrophobicContact CZ-CD1 3.73Å; L278-L280 HydrophobicContact CD2-CD2 3.65Å; L278-L280 HydrophobicContact CD2-CG 4.25Å; L278-L280 HydrophobicContact CG-CD2 3.94Å; L278-L280 HydrophobicContact CG-CG 4.23Å; L280-V302 HydrophobicContact CB-CG2 4.22Å; L280-V302 HydrophobicContact CD1-CG2 3.84Å; L280-L305 WeakPolarHBondContact O-CD2 3.48Å; L280-W350 PolarHBondContact O-NE1 2.73Å; L280-W350 VanDerWaalsContact O-NE1 3.07Å
281	A	94.4	Very high	93.3	Very high	2 Å²	2	29.7 Å²	29.7	2%	0.017	15%	0.153	C	C	.	.			trans	-113.2	169.7	166.1	0	0	0	0	0	110.7	D284 V302 Q353	A281-D284 PolarHBondContact N-OD2 2.82Å; A281-D284 WeakPolarHBondContact O-CB 3.35Å; A281-V302 VanDerWaalsContact O-CB 3.32Å; A281-V302 WeakPolarHBondContact O-CB 3.46Å; A281-V302 WeakPolarHBondContact O-CG1 3.5Å; A281-Q353 HydrophobicContact CB-CG 3.58Å
282	D	93.3	Very high	92.9	Very high	18 Å²	18	32.8 Å²	32.8	10%	0.096	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	149.6	170.8	-175.1	54.4	0	0	0	110.8	D284 V303 L305 A351 R352	D282-D284 PolarHBondContact O-N 3.25Å; D282-D284 VanDerWaalsContact O-N 3.08Å; D282-V303 VanDerWaalsContact OD1-CA 3.29Å; D282-V303 WeakPolarHBondContact OD1-CA 3.49Å; D282-V303 VanDerWaalsContact OD1-O 3.06Å; D282-L305 HydrophobicContact CB-CD1 4.26Å; D282-A351 HydrophobicContact CB-CB 4.39Å; D282-A351 WeakPolarHBondContact CB-O 2.67Å; D282-A351 PolarHBondContact N-O 2.78Å; D282-R352 IonicContact OD2-CZ 2.89Å; D282-R352 IonicContact OD2-NE 3.38Å; D282-R352 IonicContact OD2-NH1 2.76Å; D282-R352 PolarHBondContact OD2-NH1 2.82Å; D282-R352 IonicContact OD2-NH2 2.67Å; D282-R352 PolarHBondContact OD2-NH2 3.01Å
283	N	89.9	Confident	92.2	Very high	59 Å²	59	34.6 Å²	34.6	32%	0.316	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.5	5.9	-179.9	-157.5	16.5	0	0	0	115.4	R285 R301 V302	N283-R285 PolarHBondContact O-N 3.45Å; N283-R301 VanDerWaalsContact OD1-CD 3.26Å; N283-R301 WeakPolarHBondContact OD1-CD 3.4Å; N283-V302 WeakPolarHBondContact CA-O 3.47Å; N283-V302 PolarHBondContact N-O 2.95Å
284	D	91	Very high	91.6	Very high	14 Å²	14	42.3 Å²	42.3	8%	0.075	22%	0.218	C	C	.	.			trans	-65.4	126.3	170.9	-80.7	-19.4	0	0	0	110.1	R141 H253 A281 D282 R301 V302	R141-D284 IonicContact CZ-OD1 3.76Å; R141-D284 IonicContact CZ-OD2 3.08Å; R141-D284 IonicContact NH1-OD1 3.29Å; R141-D284 PolarHBondContact NH1-OD1 2.95Å; R141-D284 IonicContact NH1-OD2 2.87Å; R141-D284 PolarHBondContact NH1-OD2 2.95Å; R141-D284 IonicContact NH2-OD1 2.8Å; R141-D284 PolarHBondContact NH2-OD1 3.29Å; R141-D284 IonicContact NH2-OD2 3.5Å; H253-D284 IonicContact CE1-OD2 3.77Å; H253-D284 IonicContact NE2-OD2 3.77Å; A281-D284 PolarHBondContact N-OD2 2.82Å; A281-D284 WeakPolarHBondContact O-CB 3.35Å; D282-D284 PolarHBondContact O-N 3.25Å; D282-D284 VanDerWaalsContact O-N 3.08Å; D284-R301 CarbonylContact O-C 3.59Å; D284-R301 WeakPolarHBondContact O-CA 3.18Å; D284-V302 HydrophobicContact CB-CB 4.38Å; D284-V302 HydrophobicContact CB-CG2 4.14Å; D284-V302 PolarHBondContact O-N 3.46Å
285	R	90.9	Very high	91.2	Very high	111 Å²	111	46.6 Å²	46.6	42%	0.419	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	141	175.7	-67.6	177.7	-179.6	75.9	-4.3	110.5	T67 H253 N283 A300 R301	T67-R285 WeakPolarHBondContact O-CD 3.42Å; H253-R285 PolarHBondContact ND1-O 2.81Å; N283-R285 PolarHBondContact O-N 3.45Å; R285-A300 CarbonylContact C-O 3.59Å; R285-A300 WeakPolarHBondContact CA-O 3.44Å; R285-R301 HydrophobicContact CG-CB 4.45Å; R285-R301 HydrophobicContact CG-CG 4.37Å
286	L	91.5	Very high	90.7	Very high	2 Å²	2	43.5 Å²	43.5	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156.3	-176.9	62.5	80.3	0	0	0	110.2	V235 I251 H252 H253 L272 L288 G299 A300 V302	V235-L286 HydrophobicContact CG1-CD2 4.27Å; I251-L286 HydrophobicContact CG2-CD1 4.24Å; I251-L286 HydrophobicContact CG2-CD2 4.28Å; H252-L286 WeakPolarHBondContact O-CA 3.4Å; H252-L286 WeakPolarHBondContact O-CB 3.4Å; H253-L286 HydrophobicContact CB-CB 4.2Å; L272-L286 HydrophobicContact CD1-CD1 4.05Å; L272-L286 HydrophobicContact CD1-CD2 3.99Å; L286-L288 HydrophobicContact CD1-CD1 4.44Å; L286-L288 HydrophobicContact CD1-CD2 3.36Å; L286-L288 HydrophobicContact CD1-CG 3.71Å; L286-G299 WeakPolarHBondContact O-CA 3.11Å; L286-A300 HydrophobicContact CD1-CB 3.23Å; L286-A300 HydrophobicContact CD2-CB 4.45Å; L286-A300 HydrophobicContact CG-CB 3.79Å; L286-A300 WeakPolarHBondContact CG-O 3.42Å; L286-A300 PolarHBondContact N-O 3.19Å; L286-A300 PolarHBondContact O-N 2.84Å; L286-V302 HydrophobicContact CD2-CG2 4.07Å
287	V	91.7	Very high	90.5	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.018	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	131.4	-180	-179.5	0	0	0	0	109.2	L34 I63 T67 H252 R289 T296	L34-V287 HydrophobicContact CD2-CB 4.13Å; L34-V287 HydrophobicContact CD2-CG1 4.4Å; L34-V287 HydrophobicContact CD2-CG2 3.92Å; I63-V287 HydrophobicContact CG1-CG1 4.49Å; I63-V287 HydrophobicContact CG2-CG2 4.33Å; T67-V287 HydrophobicContact CG2-CG2 3.74Å; H252-V287 HydrophobicContact CB-CB 4.45Å; H252-V287 PolarHBondContact N-O 3.2Å; H252-V287 PolarHBondContact O-N 3.37Å; V287-R289 HydrophobicContact CG1-CG 4.19Å; V287-T296 HydrophobicContact CG1-CG2 3.8Å
288	L	93.2	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.8	178.9	-56	-179	0	0	0	109.8	L237 L243 L249 H250 I251 L272 L286 L297 A298 A300	L237-L288 HydrophobicContact CD2-CD1 3.64Å; L243-L288 HydrophobicContact CD1-CD1 4.46Å; L249-L288 HydrophobicContact CD1-CD2 3.82Å; L249-L288 HydrophobicContact CD2-CB 4.24Å; L249-L288 HydrophobicContact CD2-CD1 4.19Å; L249-L288 HydrophobicContact CD2-CD2 4.38Å; H250-L288 WeakPolarHBondContact O-CA 3.49Å; I251-L288 HydrophobicContact CB-CD2 4.36Å; I251-L288 HydrophobicContact CG1-CD2 3.82Å; I251-L288 HydrophobicContact CG2-CD2 4.29Å; L272-L288 HydrophobicContact CD1-CD2 4.01Å; L272-L288 HydrophobicContact CD2-CD1 4.14Å; L272-L288 HydrophobicContact CD2-CD2 4.22Å; L286-L288 HydrophobicContact CD1-CD1 4.44Å; L286-L288 HydrophobicContact CD1-CD2 3.36Å; L286-L288 HydrophobicContact CD1-CG 3.71Å; L288-L297 PolarHBondContact O-N 2.95Å; L288-A298 WeakPolarHBondContact CA-O 3.3Å; L288-A298 HydrophobicContact CB-CB 4.34Å; L288-A298 WeakPolarHBondContact CB-O 3.25Å; L288-A298 HydrophobicContact CD1-CB 4.38Å; L288-A298 PolarHBondContact N-O 2.89Å; L288-A298 PolarHBondContact O-N 3.13Å; L288-A300 HydrophobicContact CD1-CB 4.04Å; L288-A300 HydrophobicContact CG-CB 4.34Å
289	R	91.3	Very high	90.3	Very high	7 Å²	7	37.7 Å²	37.7	3%	0.026	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	155.4	177.8	-56.6	-171.4	74.1	-137.4	4.8	110.9	E59 L249 H250 V287 A293 N295 T296	E59-R289 IonicContact OE1-CZ 3.5Å; E59-R289 IonicContact OE1-NE 3.56Å; E59-R289 IonicContact OE1-NH2 3.37Å; E59-R289 PolarHBondContact OE1-NH2 3.35Å; L249-R289 WeakPolarHBondContact CA-O 3.07Å; L249-R289 VanDerWaalsContact CB-O 3.25Å; L249-R289 WeakPolarHBondContact CB-O 3.12Å; H250-R289 HydrophobicContact CB-CB 4.37Å; H250-R289 PolarHBondContact N-O 3.3Å; H250-R289 PolarHBondContact O-N 2.97Å; V287-R289 HydrophobicContact CG1-CG 4.19Å; R289-A293 PolarHBondContact NH1-O 3.43Å; R289-A293 PolarHBondContact NH2-O 3.09Å; R289-N295 WeakPolarHBondContact CA-O 3.3Å; R289-T296 PolarHBondContact NE-OG1 3.42Å
290	D	91.1	Very high	90.2	Very high	17 Å²	17	36.3 Å²	36.3	9%	0.091	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	153.9	174.2	68.8	-19.1	0	0	0	111.5	H250 S292 A293 R294 N295 L297	H250-D290 PolarHBondContact CD2-O 2.56Å; D290-S292 PolarHBondContact O-N 3.05Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 PolarHBondContact OD2-OG 2.8Å; D290-A293 PolarHBondContact O-N 2.68Å; D290-A293 VanDerWaalsContact OD1-CA 3.26Å; D290-A293 WeakPolarHBondContact OD1-CA 3.23Å; D290-A293 PolarHBondContact OD1-N 2.78Å; D290-R294 PolarHBondContact OD1-N 3.37Å; D290-N295 VanDerWaalsContact CG-N 3.32Å; D290-N295 PolarHBondContact N-O 3.38Å; D290-N295 PolarHBondContact OD1-N 3.18Å; D290-N295 PolarHBondContact OD2-N 3.23Å; D290-N295 PolarHBondContact OD2-ND2 3.49Å; D290-L297 HydrophobicContact CB-CD1 3.91Å; D290-L297 HydrophobicContact CB-CD2 4.31Å; D290-L297 HydrophobicContact CB-CG 4.14Å
291	I	90.2	Very high	90.1	Very high	83 Å²	83	37.3 Å²	37.3	43%	0.426	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-17	-178.2	-160.5	63.7	0	0	0	113.1	P248 H250 T259 A293	P248-I291 HydrophobicContact CB-CB 4.39Å; P248-I291 HydrophobicContact CB-CD1 4.31Å; P248-I291 HydrophobicContact CB-CG1 4.22Å; P248-I291 HydrophobicContact CG-CB 4.44Å; P248-I291 HydrophobicContact CG-CG2 4.34Å; H250-I291 PolarHBondContact NE2-O 3.22Å; H250-I291 VanDerWaalsContact NE2-O 3.14Å; T259-I291 HydrophobicContact CG2-CD1 4.26Å; I291-A293 VanDerWaalsContact C-N 3.32Å
292	S	87.5	Confident	90.1	Very high	74 Å²	74	37.2 Å²	37.2	52%	0.517	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-2.9	171.8	39.1	0	0	0	0	114.2	D290 R294	D290-S292 PolarHBondContact O-N 3.05Å; D290-S292 VanDerWaalsContact O-N 3.13Å; D290-S292 PolarHBondContact OD2-OG 2.8Å; S292-R294 PolarHBondContact O-N 3.5Å
293	A	81.1	Confident	90.1	Very high	39 Å²	39	36.6 Å²	36.6	32%	0.322	18%	0.184	S	C	.	.	S	Bend	trans	55.8	27.7	-179.2	0	0	0	0	0	114.9	R289 D290 I291	R289-A293 PolarHBondContact NH1-O 3.43Å; R289-A293 PolarHBondContact NH2-O 3.09Å; D290-A293 PolarHBondContact O-N 2.68Å; D290-A293 VanDerWaalsContact OD1-CA 3.26Å; D290-A293 WeakPolarHBondContact OD1-CA 3.23Å; D290-A293 PolarHBondContact OD1-N 2.78Å; I291-A293 VanDerWaalsContact C-N 3.32Å
294	R	84.1	Confident	90.3	Very high	185 Å²	185	35 Å²	35	70%	0.698	18%	0.175	S	C	*	.	S	Bend	trans	-97.2	-35.5	179.2	-66.2	-168.4	178.1	-171.9	-0.9	113	D290 S292	D290-R294 PolarHBondContact OD1-N 3.37Å; S292-R294 PolarHBondContact O-N 3.5Å
295	N	86.4	Confident	90.4	Very high	97 Å²	97	35.6 Å²	35.6	52%	0.519	18%	0.178	S	C	.	.			trans	-125.4	132.1	-172.9	-57.6	-66.6	0	0	0	110.8	R289 D290 L297	R289-N295 WeakPolarHBondContact CA-O 3.3Å; D290-N295 VanDerWaalsContact CG-N 3.32Å; D290-N295 PolarHBondContact N-O 3.38Å; D290-N295 PolarHBondContact OD1-N 3.18Å; D290-N295 PolarHBondContact OD2-N 3.23Å; D290-N295 PolarHBondContact OD2-ND2 3.49Å; N295-L297 HydrophobicContact CB-CD2 4.24Å; N295-L297 PolarHBondContact O-N 2.87Å
296	T	86.8	Confident	90.3	Very high	20 Å²	20	36 Å²	36	12%	0.123	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	115.3	167.3	-61.3	0	0	0	0	108.6	E59 I63 L66 V287 R289	E59-T296 PolarHBondContact OE1-OG1 3.23Å; I63-T296 HydrophobicContact CG1-CG2 3.92Å; L66-T296 HydrophobicContact CD1-CG2 3.72Å; V287-T296 HydrophobicContact CG1-CG2 3.8Å; R289-T296 PolarHBondContact NE-OG1 3.42Å
297	L	88.3	Confident	90.3	Very high	23 Å²	23	36.1 Å²	36.1	12%	0.12	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	-53.1	-169.6	-61.9	178.3	0	0	0	111.6	T239 H240 L243 L288 D290 N295	T239-L297 PolarHBondContact OG1-O 2.81Å; H240-L297 PolarHBondContact N-O 3.32Å; L243-L297 HydrophobicContact CD2-CB 3.7Å; L243-L297 HydrophobicContact CD2-CD1 4.03Å; L243-L297 HydrophobicContact CD2-CG 4.45Å; L288-L297 PolarHBondContact O-N 2.95Å; D290-L297 HydrophobicContact CB-CD1 3.91Å; D290-L297 HydrophobicContact CB-CD2 4.31Å; D290-L297 HydrophobicContact CB-CG 4.14Å; N295-L297 HydrophobicContact CB-CD2 4.24Å; N295-L297 PolarHBondContact O-N 2.87Å
298	A	91.5	Very high	90.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	157.6	-170.5	0	0	0	0	0	111.8	L66 Q238 L243 L288	L66-A298 VanDerWaalsContact CD1-C 3.43Å; Q238-A298 CarbonylContact O-C 3.59Å; Q238-A298 WeakPolarHBondContact O-CA 3.45Å; Q238-A298 WeakPolarHBondContact O-CB 3.49Å; L243-A298 HydrophobicContact CD1-CB 4.03Å; L243-A298 HydrophobicContact CD2-CB 4.22Å; L243-A298 HydrophobicContact CG-CB 4.43Å; L288-A298 WeakPolarHBondContact CA-O 3.3Å; L288-A298 HydrophobicContact CB-CB 4.34Å; L288-A298 WeakPolarHBondContact CB-O 3.25Å; L288-A298 HydrophobicContact CD1-CB 4.38Å; L288-A298 PolarHBondContact N-O 2.89Å; L288-A298 PolarHBondContact O-N 3.13Å
299	G	91.3	Very high	89.5	Confident	3 Å²	3	49.3 Å²	49.3	3%	0.031	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	154.9	160.7	0	0	0	0	0	109.1	Q238 L286	Q238-G299 PolarHBondContact N-O 3.4Å; Q238-G299 PolarHBondContact O-N 3.33Å; L286-G299 WeakPolarHBondContact O-CA 3.11Å
300	A	93	Very high	88.9	Confident	4 Å²	4	60 Å²	60	3%	0.033	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.7	167.3	0	0	0	0	0	111.3	V235 E236 L237 R285 L286 L288	V235-A300 HydrophobicContact CB-CB 3.61Å; V235-A300 HydrophobicContact CG1-CB 4.03Å; V235-A300 HydrophobicContact CG2-CB 3.64Å; E236-A300 CarbonylContact O-C 3.56Å; E236-A300 WeakPolarHBondContact O-CA 3.45Å; L237-A300 HydrophobicContact CD2-CB 3.93Å; R285-A300 CarbonylContact C-O 3.59Å; R285-A300 WeakPolarHBondContact CA-O 3.44Å; L286-A300 HydrophobicContact CD1-CB 3.23Å; L286-A300 HydrophobicContact CD2-CB 4.45Å; L286-A300 HydrophobicContact CG-CB 3.79Å; L286-A300 WeakPolarHBondContact CG-O 3.42Å; L286-A300 PolarHBondContact N-O 3.19Å; L286-A300 PolarHBondContact O-N 2.84Å; L288-A300 HydrophobicContact CD1-CB 4.04Å; L288-A300 HydrophobicContact CG-CB 4.34Å
301	R	93.6	Very high	88.1	Confident	23 Å²	23	60.7 Å²	60.7	9%	0.087	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	125.8	175	-178.3	178.6	67.6	88.6	-11.3	108.3	V235 E236 N283 D284 R285 V303 A325	V235-R301 CarbonylContact C-O 3.5Å; V235-R301 WeakPolarHBondContact CA-O 3.21Å; V235-R301 WeakPolarHBondContact CB-O 3.31Å; E236-R301 HydrophobicContact CB-CB 4.45Å; E236-R301 PolarHBondContact N-O 3.18Å; E236-R301 PolarHBondContact O-N 3.36Å; E236-R301 IonicContact OE1-NH2 2.78Å; E236-R301 IonicContact OE2-CZ 3.8Å; E236-R301 IonicContact OE2-NE 2.85Å; E236-R301 PolarHBondContact OE2-NE 3.49Å; E236-R301 IonicContact OE2-NH2 2.78Å; E236-R301 PolarHBondContact OE2-NH2 3.16Å; N283-R301 VanDerWaalsContact OD1-CD 3.26Å; N283-R301 WeakPolarHBondContact OD1-CD 3.4Å; D284-R301 CarbonylContact O-C 3.59Å; D284-R301 WeakPolarHBondContact O-CA 3.18Å; R285-R301 HydrophobicContact CG-CB 4.45Å; R285-R301 HydrophobicContact CG-CG 4.37Å; R301-V303 PolarHBondContact O-N 3.36Å; R301-A325 PolarHBondContact NH2-O 2.83Å
302	V	95	Very high	87.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	131.4	176.6	178	0	0	0	0	109.2	V233 L280 A281 N283 D284 L286 L305	V233-V302 HydrophobicContact CG2-CB 4.44Å; V233-V302 HydrophobicContact CG2-CG1 3.58Å; V233-V302 HydrophobicContact CG2-CG2 4.28Å; L280-V302 HydrophobicContact CB-CG2 4.22Å; L280-V302 HydrophobicContact CD1-CG2 3.84Å; A281-V302 VanDerWaalsContact O-CB 3.32Å; A281-V302 WeakPolarHBondContact O-CB 3.46Å; A281-V302 WeakPolarHBondContact O-CG1 3.5Å; N283-V302 WeakPolarHBondContact CA-O 3.47Å; N283-V302 PolarHBondContact N-O 2.95Å; D284-V302 HydrophobicContact CB-CB 4.38Å; D284-V302 HydrophobicContact CB-CG2 4.14Å; D284-V302 PolarHBondContact O-N 3.46Å; L286-V302 HydrophobicContact CD2-CG2 4.07Å; V302-L305 HydrophobicContact CG1-CD1 4.09Å; V302-L305 HydrophobicContact CG1-CG 4.44Å
303	V	93.5	Very high	86.9	Confident	4 Å²	4	61.6 Å²	61.6	2%	0.024	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	-40.7	-179.7	176.6	0	0	0	0	111.5	I234 E236 D282 R301 L324 A325	I234-V303 PolarHBondContact O-N 2.78Å; E236-V303 HydrophobicContact CB-CG2 4.02Å; D282-V303 VanDerWaalsContact OD1-CA 3.29Å; D282-V303 WeakPolarHBondContact OD1-CA 3.49Å; D282-V303 VanDerWaalsContact OD1-O 3.06Å; R301-V303 PolarHBondContact O-N 3.36Å; V303-L324 HydrophobicContact CG1-CB 4.36Å; V303-L324 HydrophobicContact CG1-CD2 4.07Å; V303-L324 HydrophobicContact CG1-CG 4.04Å; V303-L324 WeakPolarHBondContact O-CD2 3.42Å; V303-A325 HydrophobicContact CG1-CB 4.03Å; V303-A325 HydrophobicContact CG2-CB 4.19Å
304	M	93.3	Very high	87.1	Confident	27 Å²	27	66.1 Å²	66.1	13%	0.133	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	123.3	-179.1	-171.5	-167.1	178	0	0	111	V233 I234 P307 Y317 W320 L321 L324	V233-M304 VanDerWaalsContact CG2-O 3.29Å; V233-M304 WeakPolarHBondContact CG2-O 3.23Å; I234-M304 HydrophobicContact CB-CB 4.01Å; I234-M304 HydrophobicContact CG1-CB 4.18Å; I234-M304 PolarHBondContact N-O 3.02Å; I234-M304 PolarHBondContact O-N 2.97Å; M304-P307 HydrophobicContact SD-CB 4.26Å; M304-Y317 PolarHBondContact SD-OH 2.87Å; M304-W320 HydrophobicContact CE-CH2 3.66Å; M304-W320 HydrophobicContact CE-CZ3 4Å; M304-W320 HydrophobicContact CG-CH2 4.27Å; M304-W320 HydrophobicContact SD-CH2 3.53Å; M304-W320 VanDerWaalsContact SD-CH2 3.53Å; M304-W320 HydrophobicContact SD-CZ3 3.49Å; M304-W320 WeakPolarHBondContact SD-CZ3 3.24Å; M304-L321 HydrophobicContact CB-CD2 3.98Å; M304-L321 HydrophobicContact CG-CD2 4.49Å; M304-L321 HydrophobicContact SD-CD2 3.89Å; M304-L324 HydrophobicContact CB-CD2 4.33Å
305	L	93.7	Very high	87.1	Confident	26 Å²	26	61.5 Å²	61.5	14%	0.136	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142.8	172.2	-59	76.2	0	0	0	109	F230 L280 D282 V302 A351	F230-L305 HydrophobicContact CE1-CB 4.22Å; F230-L305 HydrophobicContact CE1-CD2 3.64Å; F230-L305 HydrophobicContact CE1-CG 4.09Å; F230-L305 HydrophobicContact CE2-CG 4.33Å; F230-L305 HydrophobicContact CZ-CB 4.09Å; F230-L305 HydrophobicContact CZ-CD2 3.61Å; F230-L305 HydrophobicContact CZ-CG 3.69Å; L280-L305 WeakPolarHBondContact O-CD2 3.48Å; D282-L305 HydrophobicContact CB-CD1 4.26Å; V302-L305 HydrophobicContact CG1-CD1 4.09Å; V302-L305 HydrophobicContact CG1-CG 4.44Å; L305-A351 HydrophobicContact CD1-CB 3.9Å; L305-A351 HydrophobicContact CD2-CB 4.49Å
306	N	89.1	Confident	87	Confident	120 Å²	120	63.1 Å²	63.1	64%	0.642	30%	0.296	S	S	*	.	S	Bend	trans	55	57.4	176.8	-162.8	16.8	0	0	0	116
307	P	90.8	Very high	86.9	Confident	4 Å²	4	62.6 Å²	62.6	3%	0.026	29%	0.292	C	S	.	.			trans	-67.9	140.1	179.3	28.2	-33.6	0	0	0	113.1	R232 I234 M304 R309	R232-P307 HydrophobicContact CB-CG 4.02Å; R232-P307 WeakPolarHBondContact O-CD 3.35Å; I234-P307 HydrophobicContact CD1-CB 3.84Å; I234-P307 HydrophobicContact CD1-CG 3.93Å; I234-P307 HydrophobicContact CG1-CB 3.68Å; I234-P307 HydrophobicContact CG1-CG 3.95Å; M304-P307 HydrophobicContact SD-CB 4.26Å; P307-R309 PolarHBondContact O-N 2.94Å
308	P	86.5	Confident	86.6	Confident	61 Å²	61	61.9 Å²	61.9	40%	0.396	29%	0.288	S	S	.	.			trans	-66	134.4	-177.3	27.5	-36	0	0	0	111.7	R310 K312 Y317	P308-R310 VanDerWaalsContact C-N 3.25Å; P308-R310 PolarHBondContact O-N 2.89Å; P308-K312 WeakPolarHBondContact O-CE 3.41Å; P308-K312 WeakPolarHBondContact O-CG 3.32Å; P308-Y317 WeakPolarHBondContact CD-OH 3.4Å; P308-Y317 HydrophobicContact CG-CE2 3.96Å
309	R	81.7	Confident	86.3	Confident	219 Å²	219	68.4 Å²	68.4	83%	0.826	32%	0.319	S	S	*	.	S	Bend	trans	-53.5	-33.2	-174.8	-74	-176.4	171.2	-171.4	-2.5	115.5	P307	P307-R309 PolarHBondContact O-N 2.94Å
310	R	79	Confident	86.1	Confident	231 Å²	231	69.5 Å²	69.5	87%	0.872	32%	0.322	S	S	*	.	S	Bend	trans	-121	153.3	-176	-65.6	-177.9	179	177.7	0.1	110.8	P308	P308-R310 VanDerWaalsContact C-N 3.25Å; P308-R310 PolarHBondContact O-N 2.89Å
311	G	73.2	Confident	85.9	Confident	32 Å²	32	69.3 Å²	69.3	33%	0.33	32%	0.32	S	S	.	.			trans	91.7	1.2	175.5	0	0	0	0	0	115.6	R313 K314	G311-R313 PolarHBondContact O-N 3.41Å; G311-K314 WeakPolarHBondContact O-CB 3.38Å; G311-K314 WeakPolarHBondContact O-CG 3.4Å; G311-K314 PolarHBondContact O-N 2.89Å
312	K	76.5	Confident	85.4	Confident	15 Å²	15	68.8 Å²	68.8	7%	0.065	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.6	-175.7	-57.6	-179	-167.9	173	0	115.3	E271 P308 Y317 L318	E271-K312 IonicContact OE1-NZ 2.87Å; E271-K312 PolarHBondContact OE1-NZ 3.16Å; E271-K312 IonicContact OE2-NZ 2.87Å; E271-K312 PolarHBondContact OE2-NZ 3.01Å; P308-K312 WeakPolarHBondContact O-CE 3.41Å; P308-K312 WeakPolarHBondContact O-CG 3.32Å; K312-Y317 VanDerWaalsContact CA-CD1 3.48Å; K312-Y317 HydrophobicContact CB-CD1 4.27Å; K312-Y317 HydrophobicContact CB-CE1 4.03Å; K312-Y317 HydrophobicContact CG-CE1 4.11Å; K312-Y317 WeakPolarHBondContact O-CD1 3.29Å; K312-L318 WeakPolarHBondContact O-CD2 3.2Å
313	R	77.1	Confident	85.2	Confident	161 Å²	161	71.1 Å²	71.1	61%	0.608	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	4.5	178.9	-67.8	-176.2	170.5	157.5	-2.2	113	G311	G311-R313 PolarHBondContact O-N 3.41Å
314	K	85.9	Confident	84.9	Confident	133 Å²	133	71.1 Å²	71.1	58%	0.578	34%	0.337	S	S	*	.	S	Bend	trans	-71.7	135.3	173	-68.6	-175.8	175.5	-172	0	108.1	G311 E316 Y317 L318	G311-K314 WeakPolarHBondContact O-CB 3.38Å; G311-K314 WeakPolarHBondContact O-CG 3.4Å; G311-K314 PolarHBondContact O-N 2.89Å; K314-E316 VanDerWaalsContact C-N 3.26Å; K314-E316 PolarHBondContact O-N 2.97Å; K314-Y317 WeakPolarHBondContact O-CB 3.38Å; K314-Y317 PolarHBondContact O-N 3.38Å; K314-L318 PolarHBondContact O-N 3.27Å
315	P	83.4	Confident	84.6	Confident	88 Å²	88	70.2 Å²	70.2	57%	0.571	33%	0.334	S	S	*	.	H	α-helix	trans	-57.9	-39.5	-175.1	21.7	-33.1	0	0	0	112.2	Y317 L318 Q319	P315-Y317 VanDerWaalsContact C-N 3.27Å; P315-Y317 PolarHBondContact O-N 3.4Å; P315-L318 PolarHBondContact O-N 2.87Å; P315-Q319 WeakPolarHBondContact O-CG 3.4Å; P315-Q319 PolarHBondContact O-N 3.27Å
316	E	83.6	Confident	84.3	Confident	131 Å²	131	78 Å²	78	61%	0.612	36%	0.361	S	S	*	.	H	α-helix	trans	-58.6	-37.3	176.1	-63.8	176.7	-175.8	0	0	113.2	K314 W320	K314-E316 VanDerWaalsContact C-N 3.26Å; K314-E316 PolarHBondContact O-N 2.97Å; E316-W320 WeakPolarHBondContact O-CB 3.32Å; E316-W320 PolarHBondContact O-N 3.34Å; E316-W320 VanDerWaalsContact O-N 3.07Å
317	Y	85.1	Confident	84.4	Confident	9 Å²	9	72.8 Å²	72.8	4%	0.035	34%	0.336	C	S	.	.	H	α-helix	trans	-74.4	-37.6	-179.5	-179.7	-94.1	0	0	0	111.3	M304 P308 K312 K314 P315 W320 L321	M304-Y317 PolarHBondContact SD-OH 2.87Å; P308-Y317 WeakPolarHBondContact CD-OH 3.4Å; P308-Y317 HydrophobicContact CG-CE2 3.96Å; K312-Y317 VanDerWaalsContact CA-CD1 3.48Å; K312-Y317 HydrophobicContact CB-CD1 4.27Å; K312-Y317 HydrophobicContact CB-CE1 4.03Å; K312-Y317 HydrophobicContact CG-CE1 4.11Å; K312-Y317 WeakPolarHBondContact O-CD1 3.29Å; K314-Y317 WeakPolarHBondContact O-CB 3.38Å; K314-Y317 PolarHBondContact O-N 3.38Å; P315-Y317 VanDerWaalsContact C-N 3.27Å; P315-Y317 PolarHBondContact O-N 3.4Å; Y317-W320 AromaticContact CD2-CE3 3.95Å; Y317-W320 HydrophobicContact CD2-CE3 3.95Å; Y317-W320 HydrophobicContact CD2-CZ3 4.22Å; Y317-W320 AromaticContact CE2-CE3 3.8Å; Y317-W320 HydrophobicContact CE2-CE3 3.8Å; Y317-W320 AromaticContact CE2-CZ3 3.6Å; Y317-W320 HydrophobicContact CE2-CZ3 3.6Å; Y317-W320 PolarHBondContact O-N 3.09Å; Y317-L321 HydrophobicContact CD1-CD1 3.75Å; Y317-L321 HydrophobicContact CD1-CG 4.21Å; Y317-L321 HydrophobicContact CE1-CD1 3.21Å; Y317-L321 HydrophobicContact CE1-CD2 4.48Å; Y317-L321 HydrophobicContact CE1-CG 3.81Å; Y317-L321 WeakPolarHBondContact O-CG 3.49Å; Y317-L321 PolarHBondContact O-N 2.82Å
318	L	82.8	Confident	84.1	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-67.7	-41.9	175.6	-69	169.6	0	0	0	111.5	L265 E266 K312 K314 P315 W320 L321 A322	L265-L318 HydrophobicContact CB-CD2 4.14Å; E266-L318 HydrophobicContact CB-CD1 4.09Å; E266-L318 HydrophobicContact CG-CD1 3.99Å; E266-L318 WeakPolarHBondContact OE2-CD1 3.47Å; K312-L318 WeakPolarHBondContact O-CD2 3.2Å; K314-L318 PolarHBondContact O-N 3.27Å; P315-L318 PolarHBondContact O-N 2.87Å; L318-W320 VanDerWaalsContact C-N 3.33Å; L318-W320 PolarHBondContact O-N 2.83Å; L318-L321 PolarHBondContact O-N 2.78Å; L318-A322 WeakPolarHBondContact O-CB 3.45Å; L318-A322 PolarHBondContact O-N 2.85Å
319	Q	84.6	Confident	84.3	Confident	138 Å²	138	78.2 Å²	78.2	65%	0.645	36%	0.36	S	S	*	.	H	α-helix	trans	-60.7	-42.9	174	-74	177.5	-8.3	0	0	111.9	P315 A322 S323	P315-Q319 WeakPolarHBondContact O-CG 3.4Å; P315-Q319 PolarHBondContact O-N 3.27Å; Q319-A322 PolarHBondContact O-N 3.24Å; Q319-S323 PolarHBondContact O-N 3.48Å
320	W	87.2	Confident	84.7	Confident	25 Å²	25	69.6 Å²	69.6	10%	0.095	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-45.3	175	171.2	75.1	0	0	0	112.1	M304 E316 Y317 L318 A322 S323 L324 V336 H337	M304-W320 HydrophobicContact CE-CH2 3.66Å; M304-W320 HydrophobicContact CE-CZ3 4Å; M304-W320 HydrophobicContact CG-CH2 4.27Å; M304-W320 HydrophobicContact SD-CH2 3.53Å; M304-W320 VanDerWaalsContact SD-CH2 3.53Å; M304-W320 HydrophobicContact SD-CZ3 3.49Å; M304-W320 WeakPolarHBondContact SD-CZ3 3.24Å; E316-W320 WeakPolarHBondContact O-CB 3.32Å; E316-W320 PolarHBondContact O-N 3.34Å; E316-W320 VanDerWaalsContact O-N 3.07Å; Y317-W320 AromaticContact CD2-CE3 3.95Å; Y317-W320 HydrophobicContact CD2-CE3 3.95Å; Y317-W320 HydrophobicContact CD2-CZ3 4.22Å; Y317-W320 AromaticContact CE2-CE3 3.8Å; Y317-W320 HydrophobicContact CE2-CE3 3.8Å; Y317-W320 AromaticContact CE2-CZ3 3.6Å; Y317-W320 HydrophobicContact CE2-CZ3 3.6Å; Y317-W320 PolarHBondContact O-N 3.09Å; L318-W320 VanDerWaalsContact C-N 3.33Å; L318-W320 PolarHBondContact O-N 2.83Å; W320-A322 VanDerWaalsContact C-N 3.35Å; W320-A322 PolarHBondContact O-N 3.33Å; W320-S323 WeakPolarHBondContact O-CB 3.37Å; W320-S323 PolarHBondContact O-N 2.91Å; W320-L324 HydrophobicContact CH2-CD2 4.2Å; W320-L324 HydrophobicContact CZ2-CD2 4.24Å; W320-L324 PolarHBondContact O-N 2.94Å; W320-V336 PolarHBondContact NE1-O 3.31Å; W320-H337 AromaticContact CZ2-CE1 3.84Å; W320-H337 AromaticContact CZ2-ND1 3.69Å
321	L	88.4	Confident	85.2	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.3	-40.3	174.9	-78.7	177.7	0	0	0	112.6	I234 L269 M304 Y317 L318 S323 L324 A325	I234-L321 HydrophobicContact CG1-CD1 4.4Å; I234-L321 HydrophobicContact CG1-CD2 4.48Å; I234-L321 HydrophobicContact CG2-CD1 4.06Å; I234-L321 HydrophobicContact CG2-CD2 4.29Å; L269-L321 HydrophobicContact CD1-CB 3.83Å; L269-L321 HydrophobicContact CD1-CD1 4.4Å; M304-L321 HydrophobicContact CB-CD2 3.98Å; M304-L321 HydrophobicContact CG-CD2 4.49Å; M304-L321 HydrophobicContact SD-CD2 3.89Å; Y317-L321 HydrophobicContact CD1-CD1 3.75Å; Y317-L321 HydrophobicContact CD1-CG 4.21Å; Y317-L321 HydrophobicContact CE1-CD1 3.21Å; Y317-L321 HydrophobicContact CE1-CD2 4.48Å; Y317-L321 HydrophobicContact CE1-CG 3.81Å; Y317-L321 WeakPolarHBondContact O-CG 3.49Å; Y317-L321 PolarHBondContact O-N 2.82Å; L318-L321 PolarHBondContact O-N 2.78Å; L321-S323 VanDerWaalsContact C-N 3.31Å; L321-L324 PolarHBondContact O-N 2.91Å; L321-A325 WeakPolarHBondContact O-CB 3.35Å; L321-A325 PolarHBondContact O-N 3.07Å
322	A	84.1	Confident	86.1	Confident	13 Å²	13	62.7 Å²	62.7	11%	0.107	31%	0.307	C	S	.	.	H	α-helix	trans	-65.5	-37.1	176.6	0	0	0	0	0	111.4	L318 Q319 W320 A325 R326	L318-A322 WeakPolarHBondContact O-CB 3.45Å; L318-A322 PolarHBondContact O-N 2.85Å; Q319-A322 PolarHBondContact O-N 3.24Å; W320-A322 VanDerWaalsContact C-N 3.35Å; W320-A322 PolarHBondContact O-N 3.33Å; A322-A325 PolarHBondContact O-N 3.42Å; A322-R326 WeakPolarHBondContact O-CD 3.26Å; A322-R326 VanDerWaalsContact O-CG 3.23Å; A322-R326 WeakPolarHBondContact O-CG 3.37Å; A322-R326 PolarHBondContact O-N 3.12Å; A322-R326 VanDerWaalsContact O-N 3.12Å
323	S	89.3	Confident	86.9	Confident	49 Å²	49	62 Å²	62	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-63	-45.4	172	-164.2	0	0	0	0	111.2	Q319 W320 L321 A325 R326 A327 V336	Q319-S323 PolarHBondContact O-N 3.48Å; W320-S323 WeakPolarHBondContact O-CB 3.37Å; W320-S323 PolarHBondContact O-N 2.91Å; L321-S323 VanDerWaalsContact C-N 3.31Å; S323-A325 PolarHBondContact O-N 2.73Å; S323-R326 PolarHBondContact O-N 3Å; S323-A327 PolarHBondContact O-N 3.24Å; S323-V336 WeakPolarHBondContact OG-CG2 3.4Å
324	L	88.2	Confident	87.6	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	28%	0.276	C	S	.	.	H	α-helix	trans	-62.8	-41.5	177	-175.6	62.8	0	0	0	112	V303 M304 W320 L321 R326 A327 A333 V336 H337	V303-L324 HydrophobicContact CG1-CB 4.36Å; V303-L324 HydrophobicContact CG1-CD2 4.07Å; V303-L324 HydrophobicContact CG1-CG 4.04Å; V303-L324 WeakPolarHBondContact O-CD2 3.42Å; M304-L324 HydrophobicContact CB-CD2 4.33Å; W320-L324 HydrophobicContact CH2-CD2 4.2Å; W320-L324 HydrophobicContact CZ2-CD2 4.24Å; W320-L324 PolarHBondContact O-N 2.94Å; L321-L324 PolarHBondContact O-N 2.91Å; L324-R326 PolarHBondContact O-N 3.19Å; L324-A327 WeakPolarHBondContact O-CB 3.16Å; L324-A327 PolarHBondContact O-N 3.46Å; L324-A333 HydrophobicContact CD1-CB 4.09Å; L324-V336 HydrophobicContact CB-CG1 4.11Å; L324-V336 HydrophobicContact CD1-CG1 4.5Å; L324-H337 WeakPolarHBondContact CD1-NE2 3.47Å
325	A	87.1	Confident	87.9	Confident	8 Å²	8	49.9 Å²	49.9	7%	0.066	26%	0.261	C	S	.	.	H	α-helix	trans	-64.5	-30.3	177	0	0	0	0	0	112.6	R301 V303 L321 A322 S323	R301-A325 PolarHBondContact NH2-O 2.83Å; V303-A325 HydrophobicContact CG1-CB 4.03Å; V303-A325 HydrophobicContact CG2-CB 4.19Å; L321-A325 WeakPolarHBondContact O-CB 3.35Å; L321-A325 PolarHBondContact O-N 3.07Å; A322-A325 PolarHBondContact O-N 3.42Å; S323-A325 PolarHBondContact O-N 2.73Å
326	R	87.5	Confident	88.3	Confident	189 Å²	189	46.3 Å²	46.3	71%	0.713	24%	0.237	S	C	*	.	H	α-helix	trans	-79.6	-28	176.5	-71.3	170.1	-173.8	171.7	4.5	112.7	A322 S323 L324 Q328	A322-R326 WeakPolarHBondContact O-CD 3.26Å; A322-R326 VanDerWaalsContact O-CG 3.23Å; A322-R326 WeakPolarHBondContact O-CG 3.37Å; A322-R326 PolarHBondContact O-N 3.12Å; A322-R326 VanDerWaalsContact O-N 3.12Å; S323-R326 PolarHBondContact O-N 3Å; L324-R326 PolarHBondContact O-N 3.19Å; R326-Q328 PolarHBondContact O-N 2.78Å; R326-Q328 VanDerWaalsContact O-N 3.12Å; R326-Q328 PolarHBondContact O-NE2 3.5Å
327	A	89.7	Confident	88.7	Confident	12 Å²	12	42.1 Å²	42.1	10%	0.099	22%	0.218	C	C	.	.			trans	-62.5	111.2	177	0	0	0	0	0	110.5	S323 L324 D332 A333	S323-A327 PolarHBondContact O-N 3.24Å; L324-A327 WeakPolarHBondContact O-CB 3.16Å; L324-A327 PolarHBondContact O-N 3.46Å; A327-D332 HydrophobicContact CB-CB 3.86Å; A327-A333 HydrophobicContact CB-CB 4.17Å
328	Q	85.5	Confident	89	Confident	132 Å²	132	41.7 Å²	41.7	62%	0.617	22%	0.216	S	C	*	.			trans	-90.9	-26.5	179.6	-60.4	-53.7	-61.4	0	0	112.4	R326	R326-Q328 PolarHBondContact O-N 2.78Å; R326-Q328 VanDerWaalsContact O-N 3.12Å; R326-Q328 PolarHBondContact O-NE2 3.5Å
329	S	89.7	Confident	89.3	Confident	47 Å²	47	47.2 Å²	47.2	33%	0.329	24%	0.242	S	C	.	.	S	Bend	trans	-100.8	155.2	179	79.5	0	0	0	0	111.8	A331 D332 A333	S329-A331 VanDerWaalsContact C-N 3.28Å; S329-A331 PolarHBondContact O-N 3.38Å; S329-D332 PolarHBondContact O-N 3.02Å; S329-D332 WeakPolarHBondContact OG-CB 3.38Å; S329-D332 PolarHBondContact OG-N 3.47Å; S329-D332 VanDerWaalsContact OG-N 3.13Å; S329-D332 PolarHBondContact OG-OD2 3.41Å; S329-A333 WeakPolarHBondContact O-CB 3.37Å; S329-A333 PolarHBondContact O-N 3.02Å; S329-A333 VanDerWaalsContact O-N 3.08Å
330	D	90.6	Very high	89.4	Confident	37 Å²	37	47.1 Å²	47.1	20%	0.198	24%	0.235	C	C	.	.	H	α-helix	trans	-67.4	-31.1	177.5	-60.4	-24.3	0	0	0	111.8	A333 L334 F348 R352 L362	D330-A333 PolarHBondContact O-N 3.22Å; D330-L334 VanDerWaalsContact O-CB 3.31Å; D330-L334 WeakPolarHBondContact O-CB 3.21Å; D330-L334 PolarHBondContact O-N 3.31Å; D330-F348 WeakPolarHBondContact O-CZ 3.43Å; D330-R352 HydrophobicContact CB-CG 4.29Å; D330-R352 WeakPolarHBondContact OD1-CD 3.3Å; D330-R352 IonicContact OD1-CZ 2.78Å; D330-R352 IonicContact OD1-NE 3.61Å; D330-R352 IonicContact OD1-NH1 3.6Å; D330-R352 PolarHBondContact OD1-NH1 3.24Å; D330-L362 HydrophobicContact CB-CD1 4.33Å; D330-L362 HydrophobicContact CB-CD2 4.46Å
331	A	90.7	Very high	89.4	Confident	28 Å²	28	46.6 Å²	46.6	23%	0.231	24%	0.238	C	C	.	.	H	α-helix	trans	-66.7	-44.9	175.4	0	0	0	0	0	112.2	S329 A333 L334 S335 L362	S329-A331 VanDerWaalsContact C-N 3.28Å; S329-A331 PolarHBondContact O-N 3.38Å; A331-A333 VanDerWaalsContact C-N 3.33Å; A331-A333 PolarHBondContact O-N 3.35Å; A331-L334 PolarHBondContact O-N 3.41Å; A331-S335 PolarHBondContact O-N 3.35Å; A331-L362 HydrophobicContact CB-CD2 4.07Å
332	D	91.6	Very high	89.6	Confident	90 Å²	90	48.1 Å²	48.1	48%	0.481	25%	0.25	S	S	.	.	H	α-helix	trans	-63.4	-43.6	176.7	-62.9	-37.6	0	0	0	110.4	A327 S329 L334 S335 V336	A327-D332 HydrophobicContact CB-CB 3.86Å; S329-D332 PolarHBondContact O-N 3.02Å; S329-D332 WeakPolarHBondContact OG-CB 3.38Å; S329-D332 PolarHBondContact OG-N 3.47Å; S329-D332 VanDerWaalsContact OG-N 3.13Å; S329-D332 PolarHBondContact OG-OD2 3.41Å; D332-L334 PolarHBondContact O-N 3.48Å; D332-S335 WeakPolarHBondContact O-CB 3.35Å; D332-S335 PolarHBondContact O-N 3.22Å; D332-V336 WeakPolarHBondContact O-CG2 3.22Å; D332-V336 PolarHBondContact O-N 2.93Å
333	A	92.5	Very high	90	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-61.7	-43.9	177.1	0	0	0	0	0	111.9	L324 A327 S329 D330 A331 S335 V336 H337	L324-A333 HydrophobicContact CD1-CB 4.09Å; A327-A333 HydrophobicContact CB-CB 4.17Å; S329-A333 WeakPolarHBondContact O-CB 3.37Å; S329-A333 PolarHBondContact O-N 3.02Å; S329-A333 VanDerWaalsContact O-N 3.08Å; D330-A333 PolarHBondContact O-N 3.22Å; A331-A333 VanDerWaalsContact C-N 3.33Å; A331-A333 PolarHBondContact O-N 3.35Å; A333-S335 VanDerWaalsContact C-N 3.32Å; A333-S335 PolarHBondContact O-N 3.33Å; A333-V336 PolarHBondContact O-N 3.11Å; A333-H337 PolarHBondContact O-CD2 3Å; A333-H337 PolarHBondContact O-N 2.91Å
334	L	92.3	Very high	90.2	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.016	25%	0.245	C	C	.	.	H	α-helix	trans	-57.9	-45.8	175.7	-177.5	59.1	0	0	0	111	D330 A331 D332 V336 H337 L338 V343 F348 L362 Y368 L375	D330-L334 VanDerWaalsContact O-CB 3.31Å; D330-L334 WeakPolarHBondContact O-CB 3.21Å; D330-L334 PolarHBondContact O-N 3.31Å; A331-L334 PolarHBondContact O-N 3.41Å; D332-L334 PolarHBondContact O-N 3.48Å; L334-V336 PolarHBondContact O-N 3.47Å; L334-H337 PolarHBondContact O-N 3.2Å; L334-L338 HydrophobicContact CD1-CD1 4.01Å; L334-L338 HydrophobicContact CD1-CG 4.17Å; L334-L338 HydrophobicContact CG-CD1 3.78Å; L334-L338 HydrophobicContact CG-CG 4.38Å; L334-L338 WeakPolarHBondContact O-CB 3.19Å; L334-L338 WeakPolarHBondContact O-CG 3.38Å; L334-L338 PolarHBondContact O-N 2.91Å; L334-V343 HydrophobicContact CD1-CG1 4.12Å; L334-F348 HydrophobicContact CB-CE1 4.41Å; L334-F348 HydrophobicContact CB-CE2 3.96Å; L334-F348 HydrophobicContact CB-CZ 3.68Å; L334-F348 HydrophobicContact CD1-CD1 4.44Å; L334-F348 HydrophobicContact CD1-CD2 4.17Å; L334-F348 HydrophobicContact CD1-CE1 4.3Å; L334-F348 HydrophobicContact CD1-CE2 4Å; L334-F348 HydrophobicContact CD1-CG 4.4Å; L334-F348 HydrophobicContact CD1-CZ 4.07Å; L334-F348 HydrophobicContact CG-CZ 4.39Å; L334-L362 HydrophobicContact CD2-CB 4.13Å; L334-L362 HydrophobicContact CD2-CD2 4.44Å; L334-Y368 HydrophobicContact CD2-CE2 3.99Å; L334-L375 HydrophobicContact CD1-CD2 4.17Å; L334-L375 HydrophobicContact CD2-CD2 4.06Å
335	S	91.2	Very high	90.4	Very high	38 Å²	38	49.1 Å²	49.1	27%	0.266	25%	0.25	S	S	.	.	H	α-helix	trans	-58.8	-46.8	176	-170.1	0	0	0	0	111.9	A331 D332 A333 H337 L338 E339	A331-S335 PolarHBondContact O-N 3.35Å; D332-S335 WeakPolarHBondContact O-CB 3.35Å; D332-S335 PolarHBondContact O-N 3.22Å; A333-S335 VanDerWaalsContact C-N 3.32Å; A333-S335 PolarHBondContact O-N 3.33Å; S335-H337 VanDerWaalsContact C-N 3.33Å; S335-H337 PolarHBondContact O-N 2.96Å; S335-L338 PolarHBondContact O-N 2.85Å; S335-L338 VanDerWaalsContact O-N 3.16Å; S335-E339 WeakPolarHBondContact O-CG 3.36Å; S335-E339 PolarHBondContact O-N 3.49Å
336	V	92.3	Very high	90.7	Very high	12 Å²	12	51.6 Å²	51.6	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-62.3	-38.6	178.3	172.1	0	0	0	0	112	W320 S323 L324 D332 A333 L334	W320-V336 PolarHBondContact NE1-O 3.31Å; S323-V336 WeakPolarHBondContact OG-CG2 3.4Å; L324-V336 HydrophobicContact CB-CG1 4.11Å; L324-V336 HydrophobicContact CD1-CG1 4.5Å; D332-V336 WeakPolarHBondContact O-CG2 3.22Å; D332-V336 PolarHBondContact O-N 2.93Å; A333-V336 PolarHBondContact O-N 3.11Å; L334-V336 PolarHBondContact O-N 3.47Å
337	H	92	Very high	90.9	Very high	44 Å²	44	46.8 Å²	46.8	20%	0.204	26%	0.259	C	S	.	.	H	α-helix	trans	-67	-42	174.1	-82.4	-78.2	0	0	0	111.8	W320 L324 A333 L334 S335 E339 R340 G341 V343	W320-H337 AromaticContact CZ2-CE1 3.84Å; W320-H337 AromaticContact CZ2-ND1 3.69Å; L324-H337 WeakPolarHBondContact CD1-NE2 3.47Å; A333-H337 PolarHBondContact O-CD2 3Å; A333-H337 PolarHBondContact O-N 2.91Å; L334-H337 PolarHBondContact O-N 3.2Å; S335-H337 VanDerWaalsContact C-N 3.33Å; S335-H337 PolarHBondContact O-N 2.96Å; H337-E339 PolarHBondContact O-N 3.01Å; H337-R340 WeakPolarHBondContact O-CB 3.08Å; H337-R340 PolarHBondContact O-N 2.85Å; H337-R340 VanDerWaalsContact O-N 3.12Å; H337-G341 PolarHBondContact O-N 3.47Å; H337-V343 HydrophobicContact CB-CG1 4.45Å; H337-V343 HydrophobicContact CB-CG2 3.51Å
338	L	91.3	Very high	91.1	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71	-28.1	-178.6	-70.6	166.8	0	0	0	113.9	L334 S335 R340 G341 V343 Y368 L375 N377 V380	L334-L338 HydrophobicContact CD1-CD1 4.01Å; L334-L338 HydrophobicContact CD1-CG 4.17Å; L334-L338 HydrophobicContact CG-CD1 3.78Å; L334-L338 HydrophobicContact CG-CG 4.38Å; L334-L338 WeakPolarHBondContact O-CB 3.19Å; L334-L338 WeakPolarHBondContact O-CG 3.38Å; L334-L338 PolarHBondContact O-N 2.91Å; S335-L338 PolarHBondContact O-N 2.85Å; S335-L338 VanDerWaalsContact O-N 3.16Å; L338-R340 PolarHBondContact O-N 3.43Å; L338-G341 WeakPolarHBondContact CA-O 3.43Å; L338-V343 HydrophobicContact CB-CG2 4.44Å; L338-V343 HydrophobicContact CD2-CB 4.03Å; L338-V343 HydrophobicContact CD2-CG2 3.56Å; L338-V343 HydrophobicContact CG-CG2 3.73Å; L338-Y368 HydrophobicContact CD1-CD1 3.45Å; L338-Y368 VanDerWaalsContact CD1-CD1 3.45Å; L338-Y368 HydrophobicContact CD1-CE1 3.05Å; L338-Y368 HydrophobicContact CD1-CG 4.39Å; L338-L375 HydrophobicContact CD1-CD2 4.28Å; L338-L375 VanDerWaalsContact CD2-C 3.49Å; L338-L375 HydrophobicContact CD2-CB 4.08Å; L338-L375 HydrophobicContact CD2-CD2 4.5Å; L338-L375 HydrophobicContact CD2-CG 4.27Å; L338-L375 WeakPolarHBondContact CD2-O 3.47Å; L338-N377 HydrophobicContact CB-CB 3.75Å; L338-N377 HydrophobicContact CD1-CB 4.27Å; L338-N377 HydrophobicContact CG-CB 4.47Å; L338-V380 WeakPolarHBondContact O-CG2 3.49Å
339	E	88.6	Confident	91.6	Very high	123 Å²	123	41.6 Å²	41.6	58%	0.575	24%	0.237	S	C	*	.	H	α-helix	trans	-62.8	-31.5	170.2	-76.5	176.9	-173.1	0	0	111.9	S335 H337	S335-E339 WeakPolarHBondContact O-CG 3.36Å; S335-E339 PolarHBondContact O-N 3.49Å; H337-E339 PolarHBondContact O-N 3.01Å
340	R	86.7	Confident	91.8	Very high	136 Å²	136	40.8 Å²	40.8	51%	0.513	23%	0.227	S	C	.	.	H	α-helix	trans	-78.2	-37.9	-180	-175.1	61.8	-177.6	179.3	3.9	112.5	H337 L338	H337-R340 WeakPolarHBondContact O-CB 3.08Å; H337-R340 PolarHBondContact O-N 2.85Å; H337-R340 VanDerWaalsContact O-N 3.12Å; L338-R340 PolarHBondContact O-N 3.43Å
341	G	88.5	Confident	92	Very high	14 Å²	14	39.7 Å²	39.7	14%	0.144	22%	0.223	C	C	.	.	S	Bend	trans	170.6	-160.9	-177.6	0	0	0	0	0	113	H337 L338	H337-G341 PolarHBondContact O-N 3.47Å; L338-G341 WeakPolarHBondContact CA-O 3.43Å
342	A	91.8	Very high	92.2	Very high	32 Å²	32	39.3 Å²	39.3	26%	0.264	22%	0.215	S	C	.	.			trans	-66.6	142	173.4	0	0	0	0	0	111.1	L375 L376 W384 L422	A342-L375 WeakPolarHBondContact CA-O 3.41Å; A342-L376 HydrophobicContact CB-CD1 4.32Å; A342-W384 HydrophobicContact CB-CH2 3.85Å; A342-L422 HydrophobicContact CB-CD2 3.6Å
343	V	93.4	Very high	92.3	Very high	9 Å²	9	35.5 Å²	35.5	6%	0.055	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.7	-179.7	-178.6	0	0	0	0	109.3	L334 H337 L338 L345 F348 S374 L375	L334-V343 HydrophobicContact CD1-CG1 4.12Å; H337-V343 HydrophobicContact CB-CG1 4.45Å; H337-V343 HydrophobicContact CB-CG2 3.51Å; L338-V343 HydrophobicContact CB-CG2 4.44Å; L338-V343 HydrophobicContact CD2-CB 4.03Å; L338-V343 HydrophobicContact CD2-CG2 3.56Å; L338-V343 HydrophobicContact CG-CG2 3.73Å; V343-L345 PolarHBondContact O-N 2.91Å; V343-F348 HydrophobicContact CG1-CB 3.79Å; V343-F348 HydrophobicContact CG1-CD2 3.98Å; V343-F348 HydrophobicContact CG1-CG 4.08Å; V343-S374 CarbonylContact O-C 3.55Å; V343-S374 VanDerWaalsContact O-CA 3.3Å; V343-S374 WeakPolarHBondContact O-CA 3.43Å; V343-L375 PolarHBondContact N-O 2.94Å; V343-L375 PolarHBondContact O-N 3.45Å
344	N	93.5	Very high	92.4	Very high	55 Å²	55	36.2 Å²	36.2	29%	0.294	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	121	171.6	-178.5	-3.8	0	0	0	109.4	A346 D347 F348 Y373	N344-A346 VanDerWaalsContact C-N 3.26Å; N344-A346 PolarHBondContact O-N 3.05Å; N344-A346 WeakPolarHBondContact OD1-CB 3.3Å; N344-A346 PolarHBondContact OD1-N 3.34Å; N344-D347 HydrophobicContact CB-CB 4.25Å; N344-D347 WeakPolarHBondContact CB-OD2 3.41Å; N344-D347 PolarHBondContact ND2-OD2 2.88Å; N344-D347 PolarHBondContact O-N 3.45Å; N344-F348 WeakPolarHBondContact O-CB 2.73Å; N344-F348 PolarHBondContact O-N 2.98Å; N344-Y373 CarbonylContact C-O 3.44Å; N344-Y373 WeakPolarHBondContact CA-O 3.39Å; N344-Y373 PolarHBondContact OD1-O 2.87Å
345	L	92.7	Very high	92.3	Very high	23 Å²	23	37.8 Å²	37.8	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-62.8	-31.8	-179.1	-64.3	179	0	0	0	112	V343 A349 M359 L363 Q370 Y373 L375	V343-L345 PolarHBondContact O-N 2.91Å; L345-A349 WeakPolarHBondContact O-CB 3.5Å; L345-A349 PolarHBondContact O-N 2.81Å; L345-M359 HydrophobicContact CD2-SD 3.93Å; L345-L363 HydrophobicContact CD1-CD1 4.43Å; L345-L363 HydrophobicContact CD1-CD2 4.4Å; L345-L363 HydrophobicContact CD2-CD2 4.09Å; L345-Q370 HydrophobicContact CD1-CG 4.38Å; L345-Y373 WeakPolarHBondContact CB-O 3.4Å; L345-Y373 WeakPolarHBondContact CG-O 3.49Å; L345-Y373 PolarHBondContact N-O 3.19Å; L345-L375 HydrophobicContact CD2-CB 4.09Å
346	A	92	Very high	92.3	Very high	59 Å²	59	38.1 Å²	38.1	49%	0.488	22%	0.217	S	C	.	.	H	α-helix	trans	-67.4	-46.4	177.5	0	0	0	0	0	111.6	N344 W350	N344-A346 VanDerWaalsContact C-N 3.26Å; N344-A346 PolarHBondContact O-N 3.05Å; N344-A346 WeakPolarHBondContact OD1-CB 3.3Å; N344-A346 PolarHBondContact OD1-N 3.34Å; A346-W350 WeakPolarHBondContact O-CB 3.4Å; A346-W350 PolarHBondContact O-N 3.19Å
347	D	93	Very high	92.3	Very high	89 Å²	89	42.3 Å²	42.3	48%	0.476	24%	0.235	S	C	.	.	H	α-helix	trans	-66.8	-39.7	178.1	-64.4	-41	0	0	0	111.1	N344 W350 A351	N344-D347 HydrophobicContact CB-CB 4.25Å; N344-D347 WeakPolarHBondContact CB-OD2 3.41Å; N344-D347 PolarHBondContact ND2-OD2 2.88Å; N344-D347 PolarHBondContact O-N 3.45Å; D347-W350 PolarHBondContact O-N 3.24Å; D347-A351 WeakPolarHBondContact O-CB 3.43Å; D347-A351 PolarHBondContact O-N 3.11Å
348	F	94.4	Very high	92.2	Very high	7 Å²	7	40.4 Å²	40.4	3%	0.031	23%	0.228	C	C	.	.	H	α-helix	trans	-69	-44.3	177.9	-172	-91.3	0	0	0	112.3	D330 L334 V343 N344 W350 A351 R352 L354 M359 L362	D330-F348 WeakPolarHBondContact O-CZ 3.43Å; L334-F348 HydrophobicContact CB-CE1 4.41Å; L334-F348 HydrophobicContact CB-CE2 3.96Å; L334-F348 HydrophobicContact CB-CZ 3.68Å; L334-F348 HydrophobicContact CD1-CD1 4.44Å; L334-F348 HydrophobicContact CD1-CD2 4.17Å; L334-F348 HydrophobicContact CD1-CE1 4.3Å; L334-F348 HydrophobicContact CD1-CE2 4Å; L334-F348 HydrophobicContact CD1-CG 4.4Å; L334-F348 HydrophobicContact CD1-CZ 4.07Å; L334-F348 HydrophobicContact CG-CZ 4.39Å; V343-F348 HydrophobicContact CG1-CB 3.79Å; V343-F348 HydrophobicContact CG1-CD2 3.98Å; V343-F348 HydrophobicContact CG1-CG 4.08Å; N344-F348 WeakPolarHBondContact O-CB 2.73Å; N344-F348 PolarHBondContact O-N 2.98Å; F348-W350 VanDerWaalsContact C-N 3.28Å; F348-W350 PolarHBondContact O-N 2.83Å; F348-A351 PolarHBondContact O-N 2.93Å; F348-R352 HydrophobicContact CD1-CG 4.43Å; F348-R352 HydrophobicContact CE1-CB 4.49Å; F348-R352 HydrophobicContact CE1-CG 3.87Å; F348-R352 HydrophobicContact CE2-CG 4.11Å; F348-R352 HydrophobicContact CZ-CG 3.68Å; F348-R352 PolarHBondContact O-N 2.89Å; F348-L354 HydrophobicContact CD1-CD1 4.35Å; F348-L354 HydrophobicContact CE1-CD1 3.88Å; F348-M359 HydrophobicContact CD1-CE 4.18Å; F348-L362 HydrophobicContact CE1-CD1 3.69Å; F348-L362 HydrophobicContact CZ-CD1 4.44Å
349	A	94.4	Very high	92.1	Very high	27 Å²	27	41.6 Å²	41.6	22%	0.223	23%	0.234	C	C	.	.	H	α-helix	trans	-57.8	-43.2	174.5	0	0	0	0	0	111.3	L345 Q353 L354 M359	L345-A349 WeakPolarHBondContact O-CB 3.5Å; L345-A349 PolarHBondContact O-N 2.81Å; A349-Q353 VanDerWaalsContact O-CA 3.23Å; A349-Q353 WeakPolarHBondContact O-CA 3.02Å; A349-Q353 PolarHBondContact O-N 2.91Å; A349-L354 PolarHBondContact O-N 3.14Å; A349-L354 VanDerWaalsContact O-N 3.09Å; A349-M359 HydrophobicContact CB-CE 3.47Å; A349-M359 VanDerWaalsContact CB-CE 3.47Å
350	W	95.2	Very high	92.2	Very high	31 Å²	31	42.3 Å²	42.3	12%	0.117	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-47.6	176.2	177.3	-100.9	0	0	0	112	L222 P226 P227 W279 L280 A346 D347 F348 R352 Q353	L222-W350 HydrophobicContact CD2-CH2 3.83Å; L222-W350 HydrophobicContact CD2-CZ3 4.05Å; P226-W350 HydrophobicContact CB-CE3 4.04Å; P226-W350 HydrophobicContact CB-CH2 3.28Å; P226-W350 HydrophobicContact CB-CZ2 4.04Å; P226-W350 HydrophobicContact CB-CZ3 3.29Å; P227-W350 HydrophobicContact CG-CB 4.04Å; P227-W350 HydrophobicContact CG-CD2 3.62Å; P227-W350 HydrophobicContact CG-CE3 4.29Å; P227-W350 HydrophobicContact CG-CG 3.43Å; P227-W350 VanDerWaalsContact CG-CG 3.43Å; W279-W350 HydrophobicContact CB-CH2 4.42Å; W279-W350 HydrophobicContact CB-CZ2 3.99Å; W279-W350 AromaticContact CD1-CZ2 3.84Å; W279-W350 HydrophobicContact CG-CZ2 4.3Å; L280-W350 PolarHBondContact O-NE1 2.73Å; L280-W350 VanDerWaalsContact O-NE1 3.07Å; A346-W350 WeakPolarHBondContact O-CB 3.4Å; A346-W350 PolarHBondContact O-N 3.19Å; D347-W350 PolarHBondContact O-N 3.24Å; F348-W350 VanDerWaalsContact C-N 3.28Å; F348-W350 PolarHBondContact O-N 2.83Å; W350-R352 VanDerWaalsContact C-N 3.32Å; W350-R352 PolarHBondContact O-N 3.5Å; W350-Q353 PolarHBondContact O-N 3.08Å; W350-Q353 PolarHBondContact O-NE2 3.08Å
351	A	94.7	Very high	92.2	Very high	13 Å²	13	41.2 Å²	41.2	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-44.9	179.6	0	0	0	0	0	111.6	D282 L305 D347 F348	D282-A351 HydrophobicContact CB-CB 4.39Å; D282-A351 WeakPolarHBondContact CB-O 2.67Å; D282-A351 PolarHBondContact N-O 2.78Å; L305-A351 HydrophobicContact CD1-CB 3.9Å; L305-A351 HydrophobicContact CD2-CB 4.49Å; D347-A351 WeakPolarHBondContact O-CB 3.43Å; D347-A351 PolarHBondContact O-N 3.11Å; F348-A351 PolarHBondContact O-N 2.93Å
352	R	93.8	Very high	92	Very high	20 Å²	20	41.3 Å²	41.3	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-90.5	-3.5	-177.9	-60.6	-49.4	-172.1	151.8	-33.1	115	H138 D282 D330 F348 W350 L354	H138-R352 PolarHBondContact ND1-O 3.42Å; D282-R352 IonicContact OD2-CZ 2.89Å; D282-R352 IonicContact OD2-NE 3.38Å; D282-R352 IonicContact OD2-NH1 2.76Å; D282-R352 PolarHBondContact OD2-NH1 2.82Å; D282-R352 IonicContact OD2-NH2 2.67Å; D282-R352 PolarHBondContact OD2-NH2 3.01Å; D330-R352 HydrophobicContact CB-CG 4.29Å; D330-R352 WeakPolarHBondContact OD1-CD 3.3Å; D330-R352 IonicContact OD1-CZ 2.78Å; D330-R352 IonicContact OD1-NE 3.61Å; D330-R352 IonicContact OD1-NH1 3.6Å; D330-R352 PolarHBondContact OD1-NH1 3.24Å; F348-R352 HydrophobicContact CD1-CG 4.43Å; F348-R352 HydrophobicContact CE1-CB 4.49Å; F348-R352 HydrophobicContact CE1-CG 3.87Å; F348-R352 HydrophobicContact CE2-CG 4.11Å; F348-R352 HydrophobicContact CZ-CG 3.68Å; F348-R352 PolarHBondContact O-N 2.89Å; W350-R352 VanDerWaalsContact C-N 3.32Å; W350-R352 PolarHBondContact O-N 3.5Å; R352-L354 VanDerWaalsContact C-N 3.27Å; R352-L354 HydrophobicContact CB-CD1 3.74Å; R352-L354 HydrophobicContact CB-CG 3.68Å; R352-L354 HydrophobicContact CG-CD1 4.46Å; R352-L354 PolarHBondContact O-N 3.47Å
353	Q	94.8	Very high	91.8	Very high	11 Å²	11	41.6 Å²	41.6	5%	0.051	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	48.5	-175.1	-62.5	-70.1	-57.3	0	0	111.8	H138 S139 A281 A349 W350	H138-Q353 CarbonylContact C-O 3.59Å; H138-Q353 VanDerWaalsContact CA-O 3.23Å; H138-Q353 WeakPolarHBondContact CA-O 3.34Å; H138-Q353 PolarHBondContact ND1-O 3.16Å; S139-Q353 PolarHBondContact N-O 2.86Å; A281-Q353 HydrophobicContact CB-CG 3.58Å; A349-Q353 VanDerWaalsContact O-CA 3.23Å; A349-Q353 WeakPolarHBondContact O-CA 3.02Å; A349-Q353 PolarHBondContact O-N 2.91Å; W350-Q353 PolarHBondContact O-N 3.08Å; W350-Q353 PolarHBondContact O-NE2 3.08Å
354	L	93.4	Very high	91.4	Very high	14 Å²	14	48.6 Å²	48.6	7%	0.073	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-90.2	135.3	-178.4	-68.6	169.1	0	0	0	111	S139 F348 A349 R352 M359 L362	S139-L354 PolarHBondContact OG-O 3.08Å; F348-L354 HydrophobicContact CD1-CD1 4.35Å; F348-L354 HydrophobicContact CE1-CD1 3.88Å; A349-L354 PolarHBondContact O-N 3.14Å; A349-L354 VanDerWaalsContact O-N 3.09Å; R352-L354 VanDerWaalsContact C-N 3.27Å; R352-L354 HydrophobicContact CB-CD1 3.74Å; R352-L354 HydrophobicContact CB-CG 3.68Å; R352-L354 HydrophobicContact CG-CD1 4.46Å; R352-L354 PolarHBondContact O-N 3.47Å; L354-M359 HydrophobicContact CB-CE 4.24Å; L354-M359 HydrophobicContact CD1-CE 4.08Å; L354-L362 HydrophobicContact CD1-CD1 3.3Å
355	N	91.7	Very high	91.1	Very high	36 Å²	36	49.1 Å²	49.1	19%	0.193	26%	0.259	C	S	.	.			trans	-79.4	178	170.5	75.9	13.1	0	0	0	110.8	S136 Q137 E357 G358 M359	S136-N355 PolarHBondContact O-ND2 3.48Å; Q137-N355 VanDerWaalsContact C-CG 3.41Å; Q137-N355 WeakPolarHBondContact CA-ND2 3.4Å; Q137-N355 PolarHBondContact O-N 2.67Å; Q137-N355 PolarHBondContact O-OD1 2.78Å; N355-E357 PolarHBondContact O-N 2.91Å; N355-E357 WeakPolarHBondContact OD1-CA 3.24Å; N355-E357 WeakPolarHBondContact OD1-CB 3.2Å; N355-E357 PolarHBondContact OD1-N 3.49Å; N355-G358 PolarHBondContact O-N 3.16Å; N355-G358 PolarHBondContact OD1-N 3.01Å; N355-M359 PolarHBondContact O-N 3.43Å
356	G	90.8	Very high	90.8	Very high	46 Å²	46	54.2 Å²	54.2	47%	0.474	29%	0.293	S	S	.	.	H	α-helix	trans	-60.4	-27.5	-180	0	0	0	0	0	114.6	R360	G356-R360 VanDerWaalsContact O-CG 3.3Å; G356-R360 WeakPolarHBondContact O-CG 3.47Å; G356-R360 VanDerWaalsContact O-CZ 3.24Å; G356-R360 PolarHBondContact O-N 2.9Å; G356-R360 PolarHBondContact O-NH1 2.97Å
357	E	91.3	Very high	90.5	Very high	99 Å²	99	53.3 Å²	53.3	46%	0.463	29%	0.29	S	S	.	.	H	α-helix	trans	-74.6	-50.6	176.3	-71.9	165.4	-172.1	0	0	111.3	Q137 N355 M359 R360 E361	Q137-E357 HydrophobicContact CG-CB 4.42Å; N355-E357 PolarHBondContact O-N 2.91Å; N355-E357 WeakPolarHBondContact OD1-CA 3.24Å; N355-E357 WeakPolarHBondContact OD1-CB 3.2Å; N355-E357 PolarHBondContact OD1-N 3.49Å; E357-M359 VanDerWaalsContact C-N 3.26Å; E357-M359 PolarHBondContact O-N 3.08Å; E357-R360 WeakPolarHBondContact O-CB 3.37Å; E357-R360 PolarHBondContact O-N 3.36Å; E357-E361 PolarHBondContact O-N 3.32Å
358	G	90	Very high	90.3	Very high	4 Å²	4	51.2 Å²	51.2	4%	0.041	28%	0.275	C	S	.	.	H	α-helix	trans	-59	-38.7	177.2	0	0	0	0	0	112.5	N355 R360 E361 L362	N355-G358 PolarHBondContact O-N 3.16Å; N355-G358 PolarHBondContact OD1-N 3.01Å; G358-R360 PolarHBondContact O-N 3.38Å; G358-E361 PolarHBondContact O-N 3.5Å; G358-L362 PolarHBondContact O-N 3.02Å
359	M	90.3	Very high	90.1	Very high	26 Å²	26	52.8 Å²	52.8	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-40.3	174.1	-171.3	58.3	57.2	0	0	112.3	L345 F348 A349 L354 N355 E357 L362 L363	L345-M359 HydrophobicContact CD2-SD 3.93Å; F348-M359 HydrophobicContact CD1-CE 4.18Å; A349-M359 HydrophobicContact CB-CE 3.47Å; A349-M359 VanDerWaalsContact CB-CE 3.47Å; L354-M359 HydrophobicContact CB-CE 4.24Å; L354-M359 HydrophobicContact CD1-CE 4.08Å; N355-M359 PolarHBondContact O-N 3.43Å; E357-M359 VanDerWaalsContact C-N 3.26Å; E357-M359 PolarHBondContact O-N 3.08Å; M359-L362 PolarHBondContact O-N 3.49Å; M359-L363 HydrophobicContact CG-CD1 4.05Å; M359-L363 WeakPolarHBondContact O-CG 3.42Å; M359-L363 PolarHBondContact O-N 2.88Å; M359-L363 VanDerWaalsContact O-N 3.11Å
360	R	90.4	Very high	89.9	Confident	137 Å²	137	56.2 Å²	56.2	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-67	-39.7	178.1	-77	-174.5	-57.8	-95	11.2	112.2	G356 E357 G358 L362 L363 Q364	G356-R360 VanDerWaalsContact O-CG 3.3Å; G356-R360 WeakPolarHBondContact O-CG 3.47Å; G356-R360 VanDerWaalsContact O-CZ 3.24Å; G356-R360 PolarHBondContact O-N 2.9Å; G356-R360 PolarHBondContact O-NH1 2.97Å; E357-R360 WeakPolarHBondContact O-CB 3.37Å; E357-R360 PolarHBondContact O-N 3.36Å; G358-R360 PolarHBondContact O-N 3.38Å; R360-L362 VanDerWaalsContact C-N 3.32Å; R360-L362 PolarHBondContact O-N 2.94Å; R360-L363 PolarHBondContact O-N 3.34Å; R360-Q364 WeakPolarHBondContact O-CG 3.37Å; R360-Q364 PolarHBondContact O-N 3.2Å
361	E	86.8	Confident	89.6	Confident	113 Å²	113	55.2 Å²	55.2	53%	0.528	29%	0.293	S	S	.	.	H	α-helix	trans	-61.5	-41.6	177.7	-71.6	-173.9	170.5	0	0	111.8	E357 G358 Q364	E357-E361 PolarHBondContact O-N 3.32Å; G358-E361 PolarHBondContact O-N 3.5Å; E361-Q364 PolarHBondContact O-N 2.94Å
362	L	84.7	Confident	89	Confident	16 Å²	16	57 Å²	57	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-64.3	-40.3	174.5	-71	172.8	0	0	0	112.4	D330 A331 L334 F348 L354 G358 M359 R360 Q364 Q365	D330-L362 HydrophobicContact CB-CD1 4.33Å; D330-L362 HydrophobicContact CB-CD2 4.46Å; A331-L362 HydrophobicContact CB-CD2 4.07Å; L334-L362 HydrophobicContact CD2-CB 4.13Å; L334-L362 HydrophobicContact CD2-CD2 4.44Å; F348-L362 HydrophobicContact CE1-CD1 3.69Å; F348-L362 HydrophobicContact CZ-CD1 4.44Å; L354-L362 HydrophobicContact CD1-CD1 3.3Å; G358-L362 PolarHBondContact O-N 3.02Å; M359-L362 PolarHBondContact O-N 3.49Å; R360-L362 VanDerWaalsContact C-N 3.32Å; R360-L362 PolarHBondContact O-N 2.94Å; L362-Q364 VanDerWaalsContact C-N 3.29Å; L362-Q364 PolarHBondContact O-N 3.25Å; L362-Q365 WeakPolarHBondContact O-CB 3.41Å; L362-Q365 WeakPolarHBondContact O-CG 3.4Å; L362-Q365 PolarHBondContact O-N 2.88Å
363	L	85.6	Confident	88.7	Confident	39 Å²	39	64.5 Å²	64.5	20%	0.204	34%	0.343	C	S	.	.	H	α-helix	trans	-71.3	-20.3	179.6	-69.4	171.1	0	0	0	113.7	L345 M359 R360 Q365 Q370 L375	L345-L363 HydrophobicContact CD1-CD1 4.43Å; L345-L363 HydrophobicContact CD1-CD2 4.4Å; L345-L363 HydrophobicContact CD2-CD2 4.09Å; M359-L363 HydrophobicContact CG-CD1 4.05Å; M359-L363 WeakPolarHBondContact O-CG 3.42Å; M359-L363 PolarHBondContact O-N 2.88Å; M359-L363 VanDerWaalsContact O-N 3.11Å; R360-L363 PolarHBondContact O-N 3.34Å; L363-Q365 PolarHBondContact O-N 3.4Å; L363-Q370 HydrophobicContact CD2-CG 4.46Å; L363-L375 HydrophobicContact CD2-CD1 3.46Å; L363-L375 VanDerWaalsContact CD2-CD1 3.46Å; L363-L375 HydrophobicContact CD2-CD2 3.79Å; L363-L375 HydrophobicContact CD2-CG 4.24Å
364	Q	86.7	Confident	88.5	Confident	155 Å²	155	64.5 Å²	64.5	72%	0.724	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-11.8	176.2	-78.3	-180	12.1	0	0	113.3	R360 E361 L362	R360-Q364 WeakPolarHBondContact O-CG 3.37Å; R360-Q364 PolarHBondContact O-N 3.2Å; E361-Q364 PolarHBondContact O-N 2.94Å; L362-Q364 VanDerWaalsContact C-N 3.29Å; L362-Q364 PolarHBondContact O-N 3.25Å
365	Q	85.8	Confident	88.5	Confident	67 Å²	67	63.9 Å²	63.9	31%	0.313	34%	0.341	S	S	.	.	S	Bend	trans	-65.1	132.6	178	-65.9	-178.1	7	0	0	110.9	L362 L363 Y368	L362-Q365 WeakPolarHBondContact O-CB 3.41Å; L362-Q365 WeakPolarHBondContact O-CG 3.4Å; L362-Q365 PolarHBondContact O-N 2.88Å; L363-Q365 PolarHBondContact O-N 3.4Å; Q365-Y368 HydrophobicContact CB-CD2 3.89Å; Q365-Y368 HydrophobicContact CB-CE2 3.54Å; Q365-Y368 HydrophobicContact CG-CE2 4.4Å; Q365-Y368 WeakPolarHBondContact O-CD2 3.43Å; Q365-Y368 PolarHBondContact OE1-OH 3.21Å
366	P	87.4	Confident	88.5	Confident	130 Å²	130	62.2 Å²	62.2	84%	0.844	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	147.1	179.2	-20.9	31.3	0	0	0	112.5
367	G	85.5	Confident	88.6	Confident	40 Å²	40	61.5 Å²	61.5	41%	0.412	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.1	3.4	172.1	0	0	0	0	0	115.2	N377 A378	G367-N377 PolarHBondContact O-OD1 3.26Å; G367-A378 WeakPolarHBondContact O-CB 3.44Å; G367-A378 PolarHBondContact O-N 3.39Å
368	Y	89	Confident	88.6	Confident	45 Å²	45	58.9 Å²	58.9	18%	0.176	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	133.8	174	-59.7	-41.3	0	0	0	112.8	L334 L338 Q365 L375 N377	L334-Y368 HydrophobicContact CD2-CE2 3.99Å; L338-Y368 HydrophobicContact CD1-CD1 3.45Å; L338-Y368 VanDerWaalsContact CD1-CD1 3.45Å; L338-Y368 HydrophobicContact CD1-CE1 3.05Å; L338-Y368 HydrophobicContact CD1-CG 4.39Å; Q365-Y368 HydrophobicContact CB-CD2 3.89Å; Q365-Y368 HydrophobicContact CB-CE2 3.54Å; Q365-Y368 HydrophobicContact CG-CE2 4.4Å; Q365-Y368 WeakPolarHBondContact O-CD2 3.43Å; Q365-Y368 PolarHBondContact OE1-OH 3.21Å; Y368-L375 HydrophobicContact CD1-CD2 4.39Å; Y368-L375 HydrophobicContact CD2-CD2 4.08Å; Y368-L375 HydrophobicContact CG-CD2 3.92Å; Y368-L375 HydrophobicContact CG-CG 4.28Å; Y368-N377 HydrophobicContact CD1-CB 4.44Å; Y368-N377 HydrophobicContact CE1-CB 4.42Å
369	I	89	Confident	88.7	Confident	39 Å²	39	62.8 Å²	62.8	20%	0.2	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	113.2	171.1	-56.2	-177.8	0	0	0	107.2	L375 L376 A381 L422 L425 L426	I369-L375 WeakPolarHBondContact O-CA 3.33Å; I369-L376 PolarHBondContact N-O 3.03Å; I369-L376 PolarHBondContact O-N 2.83Å; I369-A381 HydrophobicContact CD1-CB 3.46Å; I369-A381 VanDerWaalsContact CD1-CB 3.46Å; I369-L422 HydrophobicContact CG2-CD1 4.14Å; I369-L425 HydrophobicContact CG2-CD2 3.65Å; I369-L425 HydrophobicContact CG2-CG 4.49Å; I369-L426 HydrophobicContact CD1-CD1 4.38Å
370	Q	91.2	Very high	88.7	Confident	99 Å²	99	62.5 Å²	62.5	46%	0.463	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	127.8	176.2	-170.9	-179.4	4.6	0	0	110.1	L345 L363 L375	L345-Q370 HydrophobicContact CD1-CG 4.38Å; L363-Q370 HydrophobicContact CD2-CG 4.46Å; Q370-L375 HydrophobicContact CB-CD1 3.62Å; Q370-L375 HydrophobicContact CG-CD1 4.03Å
371	A	87.8	Confident	88.9	Confident	10 Å²	10	56.1 Å²	56.1	8%	0.083	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	128.5	173.3	0	0	0	0	0	110.4	Y373 S374 A421 L422 L425	A371-Y373 PolarHBondContact O-N 2.98Å; A371-Y373 VanDerWaalsContact O-N 3.11Å; A371-S374 PolarHBondContact N-O 2.99Å; A371-S374 PolarHBondContact O-N 3.36Å; A371-S374 VanDerWaalsContact O-O 3.14Å; A371-A421 HydrophobicContact CB-CB 4.1Å; A371-L422 HydrophobicContact CB-CB 4.1Å; A371-L422 HydrophobicContact CB-CD1 3.88Å; A371-L425 HydrophobicContact CB-CB 4.25Å; A371-L425 HydrophobicContact CB-CD2 3.76Å
372	G	84	Confident	89.2	Confident	52 Å²	52	52.7 Å²	52.7	54%	0.536	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.2	-117.9	-177.6	0	0	0	0	0	111.2
373	Y	85.7	Confident	89.7	Confident	177 Å²	177	60.7 Å²	60.7	69%	0.694	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	2.2	-179.7	-57.6	-74.6	0	0	0	113.4	N344 L345 A371	N344-Y373 CarbonylContact C-O 3.44Å; N344-Y373 WeakPolarHBondContact CA-O 3.39Å; N344-Y373 PolarHBondContact OD1-O 2.87Å; L345-Y373 WeakPolarHBondContact CB-O 3.4Å; L345-Y373 WeakPolarHBondContact CG-O 3.49Å; L345-Y373 PolarHBondContact N-O 3.19Å; A371-Y373 PolarHBondContact O-N 2.98Å; A371-Y373 VanDerWaalsContact O-N 3.11Å
374	S	91	Very high	90.1	Very high	10 Å²	10	60 Å²	60	7%	0.07	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	147.7	-169.9	-60.4	0	0	0	0	112.8	V343 A371 D419	V343-S374 CarbonylContact O-C 3.55Å; V343-S374 VanDerWaalsContact O-CA 3.3Å; V343-S374 WeakPolarHBondContact O-CA 3.43Å; A371-S374 PolarHBondContact N-O 2.99Å; A371-S374 PolarHBondContact O-N 3.36Å; A371-S374 VanDerWaalsContact O-O 3.14Å; S374-D419 PolarHBondContact OG-OD2 2.79Å
375	L	93.1	Very high	90.5	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144.9	175	-156.3	68.5	0	0	0	110.3	L334 L338 A342 V343 L345 L363 Y368 I369 Q370	L334-L375 HydrophobicContact CD1-CD2 4.17Å; L334-L375 HydrophobicContact CD2-CD2 4.06Å; L338-L375 HydrophobicContact CD1-CD2 4.28Å; L338-L375 VanDerWaalsContact CD2-C 3.49Å; L338-L375 HydrophobicContact CD2-CB 4.08Å; L338-L375 HydrophobicContact CD2-CD2 4.5Å; L338-L375 HydrophobicContact CD2-CG 4.27Å; L338-L375 WeakPolarHBondContact CD2-O 3.47Å; A342-L375 WeakPolarHBondContact CA-O 3.41Å; V343-L375 PolarHBondContact N-O 2.94Å; V343-L375 PolarHBondContact O-N 3.45Å; L345-L375 HydrophobicContact CD2-CB 4.09Å; L363-L375 HydrophobicContact CD2-CD1 3.46Å; L363-L375 VanDerWaalsContact CD2-CD1 3.46Å; L363-L375 HydrophobicContact CD2-CD2 3.79Å; L363-L375 HydrophobicContact CD2-CG 4.24Å; Y368-L375 HydrophobicContact CD1-CD2 4.39Å; Y368-L375 HydrophobicContact CD2-CD2 4.08Å; Y368-L375 HydrophobicContact CG-CD2 3.92Å; Y368-L375 HydrophobicContact CG-CG 4.28Å; I369-L375 WeakPolarHBondContact O-CA 3.33Å; Q370-L375 HydrophobicContact CB-CD1 3.62Å; Q370-L375 HydrophobicContact CG-CD1 4.03Å
376	L	92.8	Very high	91	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	138.5	176.9	-165.3	65.8	0	0	0	111.1	A342 I369 V380 A381 W384 L422	A342-L376 HydrophobicContact CB-CD1 4.32Å; I369-L376 PolarHBondContact N-O 3.03Å; I369-L376 PolarHBondContact O-N 2.83Å; L376-V380 HydrophobicContact CD1-CB 4.11Å; L376-V380 HydrophobicContact CD1-CG1 3.72Å; L376-V380 HydrophobicContact CG-CB 4.44Å; L376-V380 HydrophobicContact CG-CG1 4.45Å; L376-A381 HydrophobicContact CD2-CB 3.68Å; L376-A381 HydrophobicContact CG-CB 4.22Å; L376-W384 HydrophobicContact CD1-CH2 4.14Å; L376-W384 HydrophobicContact CD1-CZ2 4.13Å; L376-W384 HydrophobicContact CD1-CZ3 4.42Å; L376-W384 HydrophobicContact CD2-CD2 4.09Å; L376-W384 HydrophobicContact CD2-CE3 3.74Å; L376-W384 HydrophobicContact CD2-CZ3 3.98Å; L376-L422 HydrophobicContact CB-CD1 3.88Å; L376-L422 HydrophobicContact CB-CD2 3.89Å; L376-L422 HydrophobicContact CB-CG 4.33Å; L376-L422 HydrophobicContact CD1-CD2 4.43Å; L376-L422 HydrophobicContact CD2-CD2 4.12Å; L376-L422 HydrophobicContact CD2-CG 4.34Å; L376-L422 HydrophobicContact CG-CD2 4.38Å
377	N	92.4	Very high	91.4	Very high	31 Å²	31	58.2 Å²	58.2	17%	0.166	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	140.9	175.4	-171.3	9.1	0	0	0	110.8	L338 G367 Y368 P379 V380 A381	L338-N377 HydrophobicContact CB-CB 3.75Å; L338-N377 HydrophobicContact CD1-CB 4.27Å; L338-N377 HydrophobicContact CG-CB 4.47Å; G367-N377 PolarHBondContact O-OD1 3.26Å; Y368-N377 HydrophobicContact CD1-CB 4.44Å; Y368-N377 HydrophobicContact CE1-CB 4.42Å; N377-P379 VanDerWaalsContact C-CD 3.47Å; N377-P379 VanDerWaalsContact CG-CD 3.42Å; N377-P379 WeakPolarHBondContact OD1-CD 3.44Å; N377-V380 PolarHBondContact O-N 3.22Å; N377-A381 PolarHBondContact O-N 2.82Å
378	A	91.2	Very high	91.9	Very high	45 Å²	45	56.4 Å²	56.4	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-52.1	-41.2	-175.9	0	0	0	0	0	114.9	G367 V380 A381 A382	G367-A378 WeakPolarHBondContact O-CB 3.44Å; G367-A378 PolarHBondContact O-N 3.39Å; A378-V380 VanDerWaalsContact C-N 3.34Å; A378-V380 PolarHBondContact O-N 3.04Å; A378-A381 WeakPolarHBondContact O-CB 3.47Å; A378-A381 PolarHBondContact O-N 2.76Å; A378-A382 PolarHBondContact O-N 3.46Å
379	P	91.7	Very high	92.2	Very high	86 Å²	86	56.3 Å²	56.3	56%	0.558	28%	0.283	S	S	*	.	H	α-helix	trans	-64.5	-36.7	175.4	-22.8	35.7	0	0	0	113.1	N377 A382 R383	N377-P379 VanDerWaalsContact C-CD 3.47Å; N377-P379 VanDerWaalsContact CG-CD 3.42Å; N377-P379 WeakPolarHBondContact OD1-CD 3.44Å; P379-A382 PolarHBondContact O-N 3.1Å; P379-R383 PolarHBondContact O-N 2.83Å
380	V	92	Very high	92.6	Very high	20 Å²	20	59 Å²	59	12%	0.121	30%	0.297	C	S	.	.	H	α-helix	trans	-73	-38.2	177.4	-177.5	0	0	0	0	110.2	L338 L376 N377 A378 A382 R383 W384	L338-V380 WeakPolarHBondContact O-CG2 3.49Å; L376-V380 HydrophobicContact CD1-CB 4.11Å; L376-V380 HydrophobicContact CD1-CG1 3.72Å; L376-V380 HydrophobicContact CG-CB 4.44Å; L376-V380 HydrophobicContact CG-CG1 4.45Å; N377-V380 PolarHBondContact O-N 3.22Å; A378-V380 VanDerWaalsContact C-N 3.34Å; A378-V380 PolarHBondContact O-N 3.04Å; V380-A382 PolarHBondContact O-N 3.4Å; V380-R383 WeakPolarHBondContact O-CB 3.37Å; V380-R383 PolarHBondContact O-N 2.8Å; V380-R383 VanDerWaalsContact O-N 3.16Å; V380-W384 VanDerWaalsContact O-CD1 3.28Å; V380-W384 PolarHBondContact O-N 3.01Å
381	A	93.5	Very high	92.8	Very high	2 Å²	2	55.8 Å²	55.8	2%	0.017	29%	0.285	C	S	.	.	H	α-helix	trans	-56.6	-47.8	170.3	0	0	0	0	0	111.4	I369 L376 N377 A378 R383 W384 Q385 L426	I369-A381 HydrophobicContact CD1-CB 3.46Å; I369-A381 VanDerWaalsContact CD1-CB 3.46Å; L376-A381 HydrophobicContact CD2-CB 3.68Å; L376-A381 HydrophobicContact CG-CB 4.22Å; N377-A381 PolarHBondContact O-N 2.82Å; A378-A381 WeakPolarHBondContact O-CB 3.47Å; A378-A381 PolarHBondContact O-N 2.76Å; A381-R383 VanDerWaalsContact C-N 3.3Å; A381-R383 PolarHBondContact O-N 2.99Å; A381-W384 CarbonylContact O-C 3.59Å; A381-W384 WeakPolarHBondContact O-CB 3.23Å; A381-W384 PolarHBondContact O-N 2.97Å; A381-W384 VanDerWaalsContact O-N 3.08Å; A381-Q385 WeakPolarHBondContact O-CG 3.28Å; A381-Q385 PolarHBondContact O-N 2.73Å; A381-L426 HydrophobicContact CB-CD1 3.85Å
382	A	93.4	Very high	93.1	Very high	41 Å²	41	55.3 Å²	55.3	34%	0.339	28%	0.281	S	S	.	.	H	α-helix	trans	-61.4	-36.8	176.1	0	0	0	0	0	112.7	A378 P379 V380 Q385 R386	A378-A382 PolarHBondContact O-N 3.46Å; P379-A382 PolarHBondContact O-N 3.1Å; V380-A382 PolarHBondContact O-N 3.4Å; A382-Q385 PolarHBondContact O-N 2.89Å; A382-R386 PolarHBondContact O-N 2.83Å
383	R	94.4	Very high	93.6	Very high	185 Å²	185	54.3 Å²	54.3	70%	0.698	27%	0.268	S	S	*	.	H	α-helix	trans	-63.8	-41	173	-177	-178	179	-177.3	1.7	111.7	P379 V380 A381 R386 K387	P379-R383 PolarHBondContact O-N 2.83Å; V380-R383 WeakPolarHBondContact O-CB 3.37Å; V380-R383 PolarHBondContact O-N 2.8Å; V380-R383 VanDerWaalsContact O-N 3.16Å; A381-R383 VanDerWaalsContact C-N 3.3Å; A381-R383 PolarHBondContact O-N 2.99Å; R383-R386 PolarHBondContact O-N 2.78Å; R383-K387 PolarHBondContact O-N 3.38Å; R383-K387 VanDerWaalsContact O-N 3.08Å
384	W	95	Very high	94.1	Very high	25 Å²	25	49 Å²	49	10%	0.095	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-40.5	176.6	-74.6	21.2	0	0	0	111.7	A342 L376 V380 A381 R386 K387 I388 L415 E418 L422 V423 L426	A342-W384 HydrophobicContact CB-CH2 3.85Å; L376-W384 HydrophobicContact CD1-CH2 4.14Å; L376-W384 HydrophobicContact CD1-CZ2 4.13Å; L376-W384 HydrophobicContact CD1-CZ3 4.42Å; L376-W384 HydrophobicContact CD2-CD2 4.09Å; L376-W384 HydrophobicContact CD2-CE3 3.74Å; L376-W384 HydrophobicContact CD2-CZ3 3.98Å; V380-W384 VanDerWaalsContact O-CD1 3.28Å; V380-W384 PolarHBondContact O-N 3.01Å; A381-W384 CarbonylContact O-C 3.59Å; A381-W384 WeakPolarHBondContact O-CB 3.23Å; A381-W384 PolarHBondContact O-N 2.97Å; A381-W384 VanDerWaalsContact O-N 3.08Å; W384-R386 VanDerWaalsContact C-N 3.35Å; W384-R386 PolarHBondContact O-N 2.85Å; W384-K387 PolarHBondContact O-N 2.96Å; W384-I388 VanDerWaalsContact O-CG1 3.29Å; W384-I388 WeakPolarHBondContact O-CG1 3.26Å; W384-I388 PolarHBondContact O-N 2.81Å; W384-L415 HydrophobicContact CB-CD1 3.96Å; W384-L415 HydrophobicContact CD2-CD1 3.59Å; W384-L415 HydrophobicContact CE3-CD1 3.44Å; W384-L415 VanDerWaalsContact CE3-CD1 3.44Å; W384-L415 HydrophobicContact CG-CD1 3.85Å; W384-L415 HydrophobicContact CZ3-CD1 4.14Å; W384-E418 HydrophobicContact CH2-CB 3.86Å; W384-E418 HydrophobicContact CH2-CG 3.44Å; W384-E418 VanDerWaalsContact CH2-CG 3.44Å; W384-E418 WeakPolarHBondContact CH2-OE2 3.39Å; W384-E418 HydrophobicContact CZ2-CG 3.92Å; W384-E418 HydrophobicContact CZ3-CB 3.94Å; W384-E418 HydrophobicContact CZ3-CG 3.85Å; W384-L422 HydrophobicContact CH2-CD2 4.23Å; W384-L422 HydrophobicContact CZ3-CD2 3.85Å; W384-L422 HydrophobicContact CZ3-CG 4.44Å; W384-V423 HydrophobicContact CZ3-CG2 4.29Å; W384-L426 HydrophobicContact CB-CD2 3.55Å; W384-L426 HydrophobicContact CE3-CD2 4.36Å
385	Q	95.6	Very high	94.2	Very high	47 Å²	47	49.4 Å²	49.4	22%	0.22	25%	0.254	C	S	.	.	H	α-helix	trans	-57.2	-47.9	173.2	-70.4	174.5	-25	0	0	111	A381 A382 K387 I388 L389 L426 M430	A381-Q385 WeakPolarHBondContact O-CG 3.28Å; A381-Q385 PolarHBondContact O-N 2.73Å; A382-Q385 PolarHBondContact O-N 2.89Å; Q385-K387 VanDerWaalsContact C-N 3.33Å; Q385-K387 PolarHBondContact O-N 2.87Å; Q385-I388 WeakPolarHBondContact O-CB 3.29Å; Q385-I388 PolarHBondContact O-N 3.16Å; Q385-I388 VanDerWaalsContact O-N 3.1Å; Q385-L389 WeakPolarHBondContact O-CG 3.14Å; Q385-L389 PolarHBondContact O-N 3.37Å; Q385-L426 HydrophobicContact CG-CD1 3.51Å; Q385-L426 HydrophobicContact CG-CD2 3.85Å; Q385-L426 HydrophobicContact CG-CG 3.55Å; Q385-L426 VanDerWaalsContact NE2-CD1 3.33Å; Q385-M430 HydrophobicContact CB-CE 4.1Å; Q385-M430 HydrophobicContact CB-CG 4.1Å; Q385-M430 HydrophobicContact CB-SD 3.82Å; Q385-M430 HydrophobicContact CG-CG 3.63Å; Q385-M430 HydrophobicContact CG-SD 3.67Å; Q385-M430 WeakPolarHBondContact O-CE 3.24Å
386	R	95.9	Very high	94.1	Very high	162 Å²	162	49.8 Å²	49.8	61%	0.611	26%	0.256	S	S	*	.	H	α-helix	trans	-58.2	-45.9	176.1	-171.1	175.6	-61.3	140.1	5.3	111.7	A382 R383 W384 I388 L389 D390	A382-R386 PolarHBondContact O-N 2.83Å; R383-R386 PolarHBondContact O-N 2.78Å; W384-R386 VanDerWaalsContact C-N 3.35Å; W384-R386 PolarHBondContact O-N 2.85Å; R386-I388 VanDerWaalsContact C-N 3.3Å; R386-I388 PolarHBondContact O-N 2.64Å; R386-L389 PolarHBondContact O-N 3.43Å; R386-L389 VanDerWaalsContact O-N 3.16Å; R386-D390 PolarHBondContact O-N 2.62Å
387	K	95.6	Very high	93.9	Very high	105 Å²	105	56.3 Å²	56.3	46%	0.457	29%	0.286	S	S	.	.	H	α-helix	trans	-61	-38.3	175.9	-173.8	-179.7	174.4	-167.1	0	112.1	R383 W384 Q385 T391 A414 L415	R383-K387 PolarHBondContact O-N 3.38Å; R383-K387 VanDerWaalsContact O-N 3.08Å; W384-K387 PolarHBondContact O-N 2.96Å; Q385-K387 VanDerWaalsContact C-N 3.33Å; Q385-K387 PolarHBondContact O-N 2.87Å; K387-T391 VanDerWaalsContact O-CB 3.26Å; K387-T391 WeakPolarHBondContact O-CB 3.46Å; K387-T391 PolarHBondContact O-N 3.2Å; K387-T391 PolarHBondContact O-OG1 3.41Å; K387-A414 WeakPolarHBondContact CE-O 3.38Å; K387-A414 PolarHBondContact NZ-O 2.86Å; K387-L415 HydrophobicContact CD-CD2 4.13Å
388	I	96.1	Very high	93.7	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-64.5	-44.6	175.2	-69.7	163.8	0	0	0	110.3	W384 Q385 R386 T391 L392 L410 A414 L415 V423 L426 I427 M430 I436	W384-I388 VanDerWaalsContact O-CG1 3.29Å; W384-I388 WeakPolarHBondContact O-CG1 3.26Å; W384-I388 PolarHBondContact O-N 2.81Å; Q385-I388 WeakPolarHBondContact O-CB 3.29Å; Q385-I388 PolarHBondContact O-N 3.16Å; Q385-I388 VanDerWaalsContact O-N 3.1Å; R386-I388 VanDerWaalsContact C-N 3.3Å; R386-I388 PolarHBondContact O-N 2.64Å; I388-T391 PolarHBondContact O-N 2.98Å; I388-L392 VanDerWaalsContact O-CB 3.27Å; I388-L392 WeakPolarHBondContact O-CB 3.35Å; I388-L392 PolarHBondContact O-N 2.89Å; I388-L410 HydrophobicContact CG2-CD1 4.18Å; I388-L410 HydrophobicContact CG2-CD2 3.8Å; I388-L410 HydrophobicContact CG2-CG 4.02Å; I388-A414 HydrophobicContact CB-CB 4.44Å; I388-A414 HydrophobicContact CG1-CB 3.68Å; I388-L415 HydrophobicContact CD1-CD1 4.44Å; I388-V423 HydrophobicContact CD1-CG1 4.46Å; I388-L426 HydrophobicContact CD1-CD2 3.98Å; I388-I427 HydrophobicContact CD1-CG1 4.23Å; I388-M430 HydrophobicContact CB-CE 4.16Å; I388-M430 HydrophobicContact CB-SD 4.21Å; I388-M430 HydrophobicContact CD1-SD 4.2Å; I388-M430 HydrophobicContact CG2-CE 3.96Å; I388-M430 HydrophobicContact CG2-SD 4.04Å; I388-I436 HydrophobicContact CG2-CD1 4.33Å
389	L	96	Very high	93.5	Very high	44 Å²	44	62.3 Å²	62.3	23%	0.23	31%	0.306	C	S	.	.	H	α-helix	trans	-62	-47.4	176.1	-67.7	175.2	0	0	0	112.1	Q385 R386 T391 L392 A393 M430 D435 I436 L445	Q385-L389 WeakPolarHBondContact O-CG 3.14Å; Q385-L389 PolarHBondContact O-N 3.37Å; R386-L389 PolarHBondContact O-N 3.43Å; R386-L389 VanDerWaalsContact O-N 3.16Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.33Å; L389-L392 WeakPolarHBondContact O-CB 3.4Å; L389-L392 PolarHBondContact O-N 2.99Å; L389-L392 VanDerWaalsContact O-N 3.16Å; L389-A393 WeakPolarHBondContact O-CB 3.29Å; L389-A393 PolarHBondContact O-N 2.78Å; L389-M430 HydrophobicContact CD1-CE 4.14Å; L389-M430 HydrophobicContact CD2-CE 3.39Å; L389-M430 HydrophobicContact CG-CE 3.39Å; L389-D435 HydrophobicContact CD1-CB 4.48Å; L389-D435 HydrophobicContact CD2-CB 4.22Å; L389-I436 HydrophobicContact CD2-CD1 4.15Å; L389-I436 HydrophobicContact CD2-CG1 3.83Å; L389-L445 HydrophobicContact CD2-CD2 3.98Å
390	D	96.1	Very high	93.1	Very high	94 Å²	94	66 Å²	66	50%	0.503	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-38.9	178.6	-63.2	-24.2	0	0	0	111.1	R386 T394	R386-D390 PolarHBondContact O-N 2.62Å; D390-T394 WeakPolarHBondContact O-CB 3.49Å; D390-T394 PolarHBondContact O-N 3.12Å; D390-T394 PolarHBondContact O-OG1 3.42Å
391	T	95.5	Very high	92.4	Very high	32 Å²	32	67 Å²	67	20%	0.196	31%	0.313	C	S	.	.	H	α-helix	trans	-66.9	-41.5	175.6	-56.8	0	0	0	0	111.2	K387 I388 L389 T394 Y395 M413 A414	K387-T391 VanDerWaalsContact O-CB 3.26Å; K387-T391 WeakPolarHBondContact O-CB 3.46Å; K387-T391 PolarHBondContact O-N 3.2Å; K387-T391 PolarHBondContact O-OG1 3.41Å; I388-T391 PolarHBondContact O-N 2.98Å; L389-T391 VanDerWaalsContact C-N 3.28Å; L389-T391 PolarHBondContact O-N 3.33Å; T391-T394 PolarHBondContact O-N 3.28Å; T391-Y395 PolarHBondContact O-N 3.26Å; T391-M413 HydrophobicContact CG2-CB 3.83Å; T391-A414 HydrophobicContact CG2-CB 4.33Å
392	L	95	Very high	91.9	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-43	177.2	-177.9	62.1	0	0	0	111.2	I388 L389 Y395 H396 P405 L410 I436 L445	I388-L392 VanDerWaalsContact O-CB 3.27Å; I388-L392 WeakPolarHBondContact O-CB 3.35Å; I388-L392 PolarHBondContact O-N 2.89Å; L389-L392 WeakPolarHBondContact O-CB 3.4Å; L389-L392 PolarHBondContact O-N 2.99Å; L389-L392 VanDerWaalsContact O-N 3.16Å; L392-Y395 WeakPolarHBondContact O-CB 3.45Å; L392-Y395 PolarHBondContact O-N 3.02Å; L392-H396 WeakPolarHBondContact CD1-NE2 3.35Å; L392-H396 PolarHBondContact O-CD2 3.26Å; L392-H396 PolarHBondContact O-N 2.95Å; L392-P405 VanDerWaalsContact CD1-CD 3.41Å; L392-P405 HydrophobicContact CD1-CG 3.38Å; L392-L410 HydrophobicContact CB-CD1 4.11Å; L392-L410 HydrophobicContact CD1-CD1 4.13Å; L392-I436 HydrophobicContact CD2-CD1 3.89Å; L392-I436 HydrophobicContact CD2-CG1 3.91Å; L392-I436 HydrophobicContact CD2-CG2 4.35Å; L392-L445 HydrophobicContact CD2-CD2 3.98Å; L392-L445 HydrophobicContact CD2-CG 4.09Å; L392-L445 HydrophobicContact CG-CG 4.33Å
393	A	94.2	Very high	91.5	Very high	31 Å²	31	68.6 Å²	68.6	26%	0.256	32%	0.315	S	S	.	.	H	α-helix	trans	-60.2	-46.6	174.4	0	0	0	0	0	111.1	L389 Y395 H396 E397 L445	L389-A393 WeakPolarHBondContact O-CB 3.29Å; L389-A393 PolarHBondContact O-N 2.78Å; A393-Y395 VanDerWaalsContact C-N 3.29Å; A393-Y395 PolarHBondContact O-N 3.42Å; A393-H396 PolarHBondContact O-N 3.35Å; A393-E397 WeakPolarHBondContact O-CG 3.36Å; A393-E397 PolarHBondContact O-N 3.21Å; A393-L445 HydrophobicContact CB-CD1 4.08Å
394	T	94.8	Very high	91.3	Very high	67 Å²	67	59.8 Å²	59.8	41%	0.411	28%	0.282	S	S	.	.	H	α-helix	trans	-58.7	-40.5	175.5	-56.8	0	0	0	0	111.7	D390 T391 E397 Q398	D390-T394 WeakPolarHBondContact O-CB 3.49Å; D390-T394 PolarHBondContact O-N 3.12Å; D390-T394 PolarHBondContact O-OG1 3.42Å; T391-T394 PolarHBondContact O-N 3.28Å; T394-E397 PolarHBondContact O-N 2.97Å; T394-Q398 VanDerWaalsContact O-CG 3.3Å; T394-Q398 WeakPolarHBondContact O-CG 3.21Å; T394-Q398 PolarHBondContact O-N 3.29Å; T394-Q398 VanDerWaalsContact O-N 3.08Å
395	Y	93.5	Very high	91.2	Very high	17 Å²	17	58.6 Å²	58.6	7%	0.067	28%	0.277	C	S	.	.	H	α-helix	trans	-64	-45.6	175.8	-176	-87.9	0	0	0	112.1	T391 L392 A393 E397 Q398 H399 E402 P405 R409 M413	T391-Y395 PolarHBondContact O-N 3.26Å; L392-Y395 WeakPolarHBondContact O-CB 3.45Å; L392-Y395 PolarHBondContact O-N 3.02Å; A393-Y395 VanDerWaalsContact C-N 3.29Å; A393-Y395 PolarHBondContact O-N 3.42Å; Y395-E397 VanDerWaalsContact C-N 3.3Å; Y395-E397 PolarHBondContact O-N 3.24Å; Y395-Q398 PolarHBondContact O-N 3.39Å; Y395-H399 HydrophobicContact CE1-CB 4.3Å; Y395-H399 AromaticContact CE2-CD2 3.81Å; Y395-H399 AromaticContact CZ-CD2 3.98Å; Y395-H399 PolarHBondContact O-N 2.98Å; Y395-E402 PolarHBondContact OH-OE2 3.38Å; Y395-P405 HydrophobicContact CD1-CB 4.26Å; Y395-P405 HydrophobicContact CD1-CG 4.08Å; Y395-P405 HydrophobicContact CE1-CB 4Å; Y395-P405 HydrophobicContact CE1-CG 4.25Å; Y395-P405 HydrophobicContact CE2-CB 4.39Å; Y395-P405 HydrophobicContact CG-CG 4.42Å; Y395-R409 PolarHBondContact OH-NH1 3.31Å; Y395-R409 VanDerWaalsContact OH-NH1 3.1Å; Y395-M413 HydrophobicContact CD2-CE 3.61Å; Y395-M413 HydrophobicContact CD2-SD 3.42Å; Y395-M413 WeakPolarHBondContact CD2-SD 3.48Å; Y395-M413 HydrophobicContact CE2-CE 4.05Å; Y395-M413 HydrophobicContact CE2-SD 3.78Å; Y395-M413 HydrophobicContact CG-CE 4.05Å; Y395-M413 HydrophobicContact CG-SD 4.37Å
396	H	90.7	Very high	91	Very high	10 Å²	10	57.3 Å²	57.3	5%	0.046	28%	0.276	C	S	.	.	H	α-helix	trans	-64	-34.7	177.6	-72.1	-53.4	0	0	0	112.6	L392 A393 H399 R400 G404 H444 L445 H448	L392-H396 WeakPolarHBondContact CD1-NE2 3.35Å; L392-H396 PolarHBondContact O-CD2 3.26Å; L392-H396 PolarHBondContact O-N 2.95Å; A393-H396 PolarHBondContact O-N 3.35Å; H396-H399 CarbonylContact O-C 3.57Å; H396-R400 WeakPolarHBondContact O-CA 3.23Å; H396-R400 WeakPolarHBondContact O-CG 3.48Å; H396-R400 PolarHBondContact O-N 3.49Å; H396-G404 VanDerWaalsContact CE1-CA 3.48Å; H396-G404 WeakPolarHBondContact CE1-CA 3.38Å; H396-H444 WeakPolarHBondContact NE2-CA 3.43Å; H396-L445 PolarHBondContact NE2-N 3.09Å; H396-H448 AromaticContact CE1-CD2 3.45Å; H396-H448 PolarHBondContact CE1-CD2 3.48Å; H396-H448 VanDerWaalsContact CE1-CD2 3.45Å; H396-H448 AromaticContact CE1-CG 3.67Å; H396-H448 AromaticContact CE1-NE2 3.84Å; H396-H448 AromaticContact CG-CE1 3.93Å; H396-H448 AromaticContact CG-CG 3.87Å; H396-H448 AromaticContact CG-ND1 3.69Å; H396-H448 AromaticContact ND1-CD2 3.41Å; H396-H448 PolarHBondContact ND1-CD2 3.18Å; H396-H448 AromaticContact ND1-CE1 3.45Å; H396-H448 PolarHBondContact ND1-CE1 2.52Å; H396-H448 AromaticContact ND1-CG 3.51Å; H396-H448 AromaticContact ND1-ND1 3.55Å; H396-H448 AromaticContact ND1-NE2 3.35Å; H396-H448 PolarHBondContact ND1-NE2 2.9Å
397	E	89.2	Confident	90.8	Very high	137 Å²	137	55.3 Å²	55.3	64%	0.64	27%	0.269	S	S	*	.	H	α-helix	trans	-66.8	-39.3	173.6	-75.2	-178.4	-178.4	0	0	112.6	A393 T394 Y395	A393-E397 WeakPolarHBondContact O-CG 3.36Å; A393-E397 PolarHBondContact O-N 3.21Å; T394-E397 PolarHBondContact O-N 2.97Å; Y395-E397 VanDerWaalsContact C-N 3.3Å; Y395-E397 PolarHBondContact O-N 3.24Å
398	Q	88.8	Confident	90.7	Very high	135 Å²	135	54.2 Å²	54.2	63%	0.631	27%	0.266	S	S	*	.	H	α-helix	trans	-72.5	-33.9	177.8	-72.1	173.7	9	0	0	112.7	T394 Y395	T394-Q398 VanDerWaalsContact O-CG 3.3Å; T394-Q398 WeakPolarHBondContact O-CG 3.21Å; T394-Q398 PolarHBondContact O-N 3.29Å; T394-Q398 VanDerWaalsContact O-N 3.08Å; Y395-Q398 PolarHBondContact O-N 3.39Å
399	H	85.8	Confident	90.5	Very high	68 Å²	68	59 Å²	59	32%	0.315	28%	0.283	S	S	.	.			trans	-127.6	65.1	-175.9	-62.9	-67.4	0	0	0	110.6	Y395 H396 D401 E402	Y395-H399 HydrophobicContact CE1-CB 4.3Å; Y395-H399 AromaticContact CE2-CD2 3.81Å; Y395-H399 AromaticContact CZ-CD2 3.98Å; Y395-H399 PolarHBondContact O-N 2.98Å; H396-H399 CarbonylContact O-C 3.57Å; H399-D401 PolarHBondContact O-N 2.97Å; H399-E402 HydrophobicContact CB-CB 4.04Å; H399-E402 HydrophobicContact CB-CG 3.99Å; H399-E402 PolarHBondContact O-N 3.07Å
400	R	83.3	Confident	90.5	Very high	164 Å²	164	56.9 Å²	56.9	62%	0.619	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-25.7	-178.4	-66.9	-174.9	-178.6	-175.4	-2.2	113.4	H396	H396-R400 WeakPolarHBondContact O-CA 3.23Å; H396-R400 WeakPolarHBondContact O-CG 3.48Å; H396-R400 PolarHBondContact O-N 3.49Å
401	D	78.5	Confident	90.4	Very high	39 Å²	39	54.2 Å²	54.2	21%	0.209	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-11.2	178.2	65.1	-38.4	0	0	0	113.1	H399 Q456 Q494	H399-D401 PolarHBondContact O-N 2.97Å; D401-Q456 VanDerWaalsContact CB-OE1 3.29Å; D401-Q456 PolarHBondContact OD2-NE2 3.39Å; D401-Q494 HydrophobicContact CB-CG 4.49Å; D401-Q494 PolarHBondContact O-NE2 2.91Å; D401-Q494 PolarHBondContact O-OE1 2.9Å
402	E	83.2	Confident	90.3	Very high	54 Å²	54	60.8 Å²	60.8	25%	0.252	28%	0.276	S	S	.	.	S	Bend	trans	-89.1	144	176.6	-69.3	-163.9	171.5	0	0	112	Y395 H399 G404 H448	Y395-E402 PolarHBondContact OH-OE2 3.38Å; H399-E402 HydrophobicContact CB-CB 4.04Å; H399-E402 HydrophobicContact CB-CG 3.99Å; H399-E402 PolarHBondContact O-N 3.07Å; E402-G404 PolarHBondContact O-N 3.3Å; E402-G404 VanDerWaalsContact O-N 3.13Å; E402-H448 PolarHBondContact O-NE2 3.1Å
403	P	84.7	Confident	90.3	Very high	23 Å²	23	63.9 Å²	63.9	15%	0.149	29%	0.292	C	S	.	.			trans	-65.4	-15.8	176.2	28	-35.9	0	0	0	113.2	W442 H444 A450	P403-W442 HydrophobicContact CB-CB 4.23Å; P403-W442 HydrophobicContact CB-CG 4.19Å; P403-W442 HydrophobicContact CG-CB 4.34Å; P403-W442 HydrophobicContact CG-CD2 3.8Å; P403-W442 HydrophobicContact CG-CE3 4.28Å; P403-W442 HydrophobicContact CG-CG 3.83Å; P403-H444 VanDerWaalsContact O-CB 3.31Å; P403-H444 WeakPolarHBondContact O-CB 3.42Å; P403-A450 HydrophobicContact CB-CB 4.42Å
404	G	89.3	Confident	90.2	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	28%	0.281	C	S	.	.			trans	139.2	175.2	178.2	0	0	0	0	0	111.7	H396 E402 W442 L443	H396-G404 VanDerWaalsContact CE1-CA 3.48Å; H396-G404 WeakPolarHBondContact CE1-CA 3.38Å; E402-G404 PolarHBondContact O-N 3.3Å; E402-G404 VanDerWaalsContact O-N 3.13Å; G404-W442 VanDerWaalsContact O-CZ3 3.24Å; G404-W442 WeakPolarHBondContact O-CZ3 3.29Å; G404-L443 WeakPolarHBondContact CA-O 3.3Å
405	P	92.5	Very high	90.2	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	26%	0.263	C	S	.	.			trans	-78.7	154.7	173.2	31.5	-34.1	0	0	0	111.6	L392 Y395 R409 L410 M413 L443	L392-P405 VanDerWaalsContact CD1-CD 3.41Å; L392-P405 HydrophobicContact CD1-CG 3.38Å; Y395-P405 HydrophobicContact CD1-CB 4.26Å; Y395-P405 HydrophobicContact CD1-CG 4.08Å; Y395-P405 HydrophobicContact CE1-CB 4Å; Y395-P405 HydrophobicContact CE1-CG 4.25Å; Y395-P405 HydrophobicContact CE2-CB 4.39Å; Y395-P405 HydrophobicContact CG-CG 4.42Å; P405-R409 HydrophobicContact CB-CB 4.29Å; P405-R409 HydrophobicContact CB-CG 4.27Å; P405-L410 HydrophobicContact CG-CB 4.34Å; P405-L410 HydrophobicContact CG-CD1 4.29Å; P405-M413 HydrophobicContact CB-CE 3.67Å; P405-M413 HydrophobicContact CG-CE 3.93Å; P405-L443 VanDerWaalsContact CD-O 3.3Å; P405-L443 WeakPolarHBondContact CD-O 3.44Å; P405-L443 PolarHBondContact O-N 2.81Å
406	G	91.9	Very high	90.1	Very high	20 Å²	20	62.6 Å²	62.6	21%	0.206	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-74.1	162.8	165.6	0	0	0	0	0	112	E408 R409 L410	G406-E408 PolarHBondContact O-N 2.88Å; G406-R409 WeakPolarHBondContact O-CB 3.46Å; G406-R409 PolarHBondContact O-N 3.5Å; G406-R409 VanDerWaalsContact O-N 3.08Å; G406-L410 PolarHBondContact O-N 3.11Å
407	R	92.9	Very high	90.1	Very high	121 Å²	121	70.8 Å²	70.8	46%	0.457	32%	0.324	S	S	.	.	H	α-helix	trans	-52.2	-51.8	-174.6	-171.3	176.4	69.5	173	-0.7	113.7	R409 L410 R411 L424 E428 L443	R407-R409 VanDerWaalsContact C-N 3.33Å; R407-R409 PolarHBondContact O-N 3.31Å; R407-L410 PolarHBondContact O-N 2.81Å; R407-R411 PolarHBondContact O-N 3.16Å; R407-L424 HydrophobicContact CG-CD2 3.63Å; R407-E428 IonicContact NH1-OE1 3.17Å; R407-E428 PolarHBondContact NH1-OE1 2.93Å; R407-L443 HydrophobicContact CB-CD1 3.94Å
408	E	91.9	Very high	90.2	Very high	82 Å²	82	67 Å²	67	38%	0.383	31%	0.307	S	S	.	.	H	α-helix	trans	-70.8	-30.6	-178.9	-170.9	53.4	-146.8	0	0	112.7	G406 L410 R411 R412	G406-E408 PolarHBondContact O-N 2.88Å; E408-L410 VanDerWaalsContact C-N 3.34Å; E408-R411 PolarHBondContact O-N 3.38Å; E408-R411 IonicContact OE1-CZ 2.79Å; E408-R411 IonicContact OE1-NH1 3.07Å; E408-R411 PolarHBondContact OE1-NH1 2.83Å; E408-R412 PolarHBondContact O-N 3.37Å
409	R	93.3	Very high	90.2	Very high	101 Å²	101	62.8 Å²	62.8	38%	0.381	29%	0.288	S	S	.	.	H	α-helix	trans	-64.9	-42.9	174.8	-173.1	178.8	-65	167.3	0.3	110.2	Y395 P405 G406 R407 R412 M413	Y395-R409 PolarHBondContact OH-NH1 3.31Å; Y395-R409 VanDerWaalsContact OH-NH1 3.1Å; P405-R409 HydrophobicContact CB-CB 4.29Å; P405-R409 HydrophobicContact CB-CG 4.27Å; G406-R409 WeakPolarHBondContact O-CB 3.46Å; G406-R409 PolarHBondContact O-N 3.5Å; G406-R409 VanDerWaalsContact O-N 3.08Å; R407-R409 VanDerWaalsContact C-N 3.33Å; R407-R409 PolarHBondContact O-N 3.31Å; R409-R412 PolarHBondContact O-N 2.9Å; R409-M413 HydrophobicContact CG-CE 4.15Å; R409-M413 HydrophobicContact CG-SD 4.17Å; R409-M413 VanDerWaalsContact O-CG 3.28Å; R409-M413 WeakPolarHBondContact O-CG 3.43Å; R409-M413 PolarHBondContact O-N 2.94Å
410	L	94.4	Very high	90.6	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-61.5	-45.3	177.6	-175.1	58.1	0	0	0	111.8	I388 L392 P405 G406 R407 E408 R412 M413 A414 I427 I436 L443	I388-L410 HydrophobicContact CG2-CD1 4.18Å; I388-L410 HydrophobicContact CG2-CD2 3.8Å; I388-L410 HydrophobicContact CG2-CG 4.02Å; L392-L410 HydrophobicContact CB-CD1 4.11Å; L392-L410 HydrophobicContact CD1-CD1 4.13Å; P405-L410 HydrophobicContact CG-CB 4.34Å; P405-L410 HydrophobicContact CG-CD1 4.29Å; G406-L410 PolarHBondContact O-N 3.11Å; R407-L410 PolarHBondContact O-N 2.81Å; E408-L410 VanDerWaalsContact C-N 3.34Å; L410-R412 PolarHBondContact O-N 3.38Å; L410-M413 HydrophobicContact CD1-CE 4.18Å; L410-M413 PolarHBondContact O-N 2.92Å; L410-A414 WeakPolarHBondContact O-CB 3.27Å; L410-A414 PolarHBondContact O-N 3.43Å; L410-I427 HydrophobicContact CD2-CD1 4.24Å; L410-I427 HydrophobicContact CG-CD1 4.38Å; L410-I436 HydrophobicContact CD2-CD1 4.29Å; L410-L443 HydrophobicContact CD2-CD2 4.23Å
411	R	94.6	Very high	91.1	Very high	37 Å²	37	58.3 Å²	58.3	14%	0.14	28%	0.281	C	S	.	.	H	α-helix	trans	-53	-53.3	173	171	177.1	174.1	-96.9	-2.4	111.5	R407 E408 M413 A414 L415 E418 E420 V423 L424	R407-R411 PolarHBondContact O-N 3.16Å; E408-R411 PolarHBondContact O-N 3.38Å; E408-R411 IonicContact OE1-CZ 2.79Å; E408-R411 IonicContact OE1-NH1 3.07Å; E408-R411 PolarHBondContact OE1-NH1 2.83Å; R411-M413 VanDerWaalsContact C-N 3.26Å; R411-M413 PolarHBondContact O-N 3.43Å; R411-A414 PolarHBondContact O-N 3.43Å; R411-L415 CarbonylContact O-C 3.45Å; R411-L415 PolarHBondContact O-N 3.17Å; R411-E418 PolarHBondContact NH2-O 2.98Å; R411-E420 VanDerWaalsContact NE-CA 3.31Å; R411-V423 HydrophobicContact CB-CG1 4.07Å; R411-V423 HydrophobicContact CG-CB 4.25Å; R411-V423 HydrophobicContact CG-CG1 3.87Å; R411-L424 HydrophobicContact CB-CD2 4.45Å
412	R	94.3	Very high	91.8	Very high	170 Å²	170	56.5 Å²	56.5	64%	0.642	27%	0.272	S	S	*	.	H	α-helix	trans	-61.8	-33.1	-177.7	-172	175.5	64.4	134.8	3.8	113	E408 R409 L410 P416	E408-R412 PolarHBondContact O-N 3.37Å; R409-R412 PolarHBondContact O-N 2.9Å; L410-R412 PolarHBondContact O-N 3.38Å; R412-P416 WeakPolarHBondContact O-CB 3.48Å
413	M	93.5	Very high	92.2	Very high	66 Å²	66	53.9 Å²	53.9	33%	0.325	26%	0.26	S	S	.	.	H	α-helix	trans	-75.8	-40.7	177.8	-68.3	-176	-51.7	0	0	112.3	T391 Y395 P405 R409 L410 R411	T391-M413 HydrophobicContact CG2-CB 3.83Å; Y395-M413 HydrophobicContact CD2-CE 3.61Å; Y395-M413 HydrophobicContact CD2-SD 3.42Å; Y395-M413 WeakPolarHBondContact CD2-SD 3.48Å; Y395-M413 HydrophobicContact CE2-CE 4.05Å; Y395-M413 HydrophobicContact CE2-SD 3.78Å; Y395-M413 HydrophobicContact CG-CE 4.05Å; Y395-M413 HydrophobicContact CG-SD 4.37Å; P405-M413 HydrophobicContact CB-CE 3.67Å; P405-M413 HydrophobicContact CG-CE 3.93Å; R409-M413 HydrophobicContact CG-CE 4.15Å; R409-M413 HydrophobicContact CG-SD 4.17Å; R409-M413 VanDerWaalsContact O-CG 3.28Å; R409-M413 WeakPolarHBondContact O-CG 3.43Å; R409-M413 PolarHBondContact O-N 2.94Å; L410-M413 HydrophobicContact CD1-CE 4.18Å; L410-M413 PolarHBondContact O-N 2.92Å; R411-M413 VanDerWaalsContact C-N 3.26Å; R411-M413 PolarHBondContact O-N 3.43Å
414	A	93.4	Very high	92.7	Very high	3 Å²	3	53.5 Å²	53.5	3%	0.025	26%	0.256	C	S	.	.	H	α-helix	trans	-84.3	-50.8	-174.1	0	0	0	0	0	113	K387 I388 T391 L410 R411	K387-A414 WeakPolarHBondContact CE-O 3.38Å; K387-A414 PolarHBondContact NZ-O 2.86Å; I388-A414 HydrophobicContact CB-CB 4.44Å; I388-A414 HydrophobicContact CG1-CB 3.68Å; T391-A414 HydrophobicContact CG2-CB 4.33Å; L410-A414 WeakPolarHBondContact O-CB 3.27Å; L410-A414 PolarHBondContact O-N 3.43Å; R411-A414 PolarHBondContact O-N 3.43Å
415	L	93.6	Very high	92.9	Very high	8 Å²	8	55.9 Å²	55.9	4%	0.042	27%	0.269	C	S	.	.			trans	-146.5	66.3	-166.3	-65.8	173.8	0	0	0	111.4	W384 K387 I388 R411 M417 E418 V423	W384-L415 HydrophobicContact CB-CD1 3.96Å; W384-L415 HydrophobicContact CD2-CD1 3.59Å; W384-L415 HydrophobicContact CE3-CD1 3.44Å; W384-L415 VanDerWaalsContact CE3-CD1 3.44Å; W384-L415 HydrophobicContact CG-CD1 3.85Å; W384-L415 HydrophobicContact CZ3-CD1 4.14Å; K387-L415 HydrophobicContact CD-CD2 4.13Å; I388-L415 HydrophobicContact CD1-CD1 4.44Å; R411-L415 CarbonylContact O-C 3.45Å; R411-L415 PolarHBondContact O-N 3.17Å; L415-M417 VanDerWaalsContact C-N 3.28Å; L415-M417 PolarHBondContact O-N 3.34Å; L415-E418 HydrophobicContact CB-CB 4.17Å; L415-E418 HydrophobicContact CB-CG 3.86Å; L415-E418 HydrophobicContact CD1-CG 4.49Å; L415-E418 HydrophobicContact CD2-CG 4.13Å; L415-E418 HydrophobicContact CG-CG 4.38Å; L415-E418 PolarHBondContact O-N 3.22Å; L415-V423 HydrophobicContact CB-CG2 4Å; L415-V423 HydrophobicContact CD1-CG2 4.08Å
416	P	92.1	Very high	92.9	Very high	77 Å²	77	56 Å²	56	50%	0.5	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-22	-175.9	27	-34.8	0	0	0	114.4	R412	R412-P416 WeakPolarHBondContact O-CB 3.48Å
417	M	89.8	Confident	93	Very high	181 Å²	181	55.3 Å²	55.3	89%	0.892	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.5	-177.6	-65	-175.9	66.3	0	0	113.3	L415	L415-M417 VanDerWaalsContact C-N 3.28Å; L415-M417 PolarHBondContact O-N 3.34Å
418	E	91.5	Very high	93	Very high	59 Å²	59	52.4 Å²	52.4	28%	0.276	25%	0.252	S	S	.	.	S	Bend	trans	-92.4	160.2	-175	-55	-59.7	157.4	0	0	111.4	W384 R411 L415 E420 V423	W384-E418 HydrophobicContact CH2-CB 3.86Å; W384-E418 HydrophobicContact CH2-CG 3.44Å; W384-E418 VanDerWaalsContact CH2-CG 3.44Å; W384-E418 WeakPolarHBondContact CH2-OE2 3.39Å; W384-E418 HydrophobicContact CZ2-CG 3.92Å; W384-E418 HydrophobicContact CZ3-CB 3.94Å; W384-E418 HydrophobicContact CZ3-CG 3.85Å; R411-E418 PolarHBondContact NH2-O 2.98Å; L415-E418 HydrophobicContact CB-CB 4.17Å; L415-E418 HydrophobicContact CB-CG 3.86Å; L415-E418 HydrophobicContact CD1-CG 4.49Å; L415-E418 HydrophobicContact CD2-CG 4.13Å; L415-E418 HydrophobicContact CG-CG 4.38Å; L415-E418 PolarHBondContact O-N 3.22Å; E418-E420 PolarHBondContact O-N 2.96Å; E418-V423 HydrophobicContact CB-CG2 3.74Å
419	D	90.1	Very high	93.1	Very high	45 Å²	45	52.9 Å²	52.9	24%	0.241	25%	0.253	C	S	.	.			trans	-55.6	129.4	178.5	-168.8	-40.4	0	0	0	111.2	S374 A421 L422 V423	S374-D419 PolarHBondContact OG-OD2 2.79Å; D419-A421 PolarHBondContact O-N 3.28Å; D419-A421 WeakPolarHBondContact OD1-CB 3.43Å; D419-A421 PolarHBondContact OD1-N 2.97Å; D419-L422 HydrophobicContact CB-CB 4.07Å; D419-L422 PolarHBondContact O-N 3.3Å; D419-V423 WeakPolarHBondContact O-CG2 3.47Å; D419-V423 PolarHBondContact O-N 3.03Å
420	E	93.1	Very high	93.1	Very high	98 Å²	98	48 Å²	48	46%	0.458	24%	0.235	S	C	.	.	H	α-helix	trans	-59.5	-46.3	179.4	-175.9	-179.3	156.1	0	0	112.2	R411 E418 L422 V423 L424	R411-E420 VanDerWaalsContact NE-CA 3.31Å; E418-E420 PolarHBondContact O-N 2.96Å; E420-L422 VanDerWaalsContact C-N 3.25Å; E420-L422 PolarHBondContact O-N 3.24Å; E420-V423 PolarHBondContact O-N 3.43Å; E420-L424 HydrophobicContact CG-CD1 3.67Å; E420-L424 HydrophobicContact CG-CG 4.03Å; E420-L424 VanDerWaalsContact O-CB 3.29Å; E420-L424 WeakPolarHBondContact O-CB 3.26Å; E420-L424 WeakPolarHBondContact O-CG 3.49Å; E420-L424 PolarHBondContact O-N 3.31Å
421	A	93.4	Very high	93.1	Very high	40 Å²	40	54.6 Å²	54.6	33%	0.331	26%	0.259	S	S	.	.	H	α-helix	trans	-60.8	-40.5	-177.4	0	0	0	0	0	111	A371 D419 L425	A371-A421 HydrophobicContact CB-CB 4.1Å; D419-A421 PolarHBondContact O-N 3.28Å; D419-A421 WeakPolarHBondContact OD1-CB 3.43Å; D419-A421 PolarHBondContact OD1-N 2.97Å; A421-L425 VanDerWaalsContact O-CB 3.23Å; A421-L425 WeakPolarHBondContact O-CB 3.48Å; A421-L425 PolarHBondContact O-N 3.07Å
422	L	93	Very high	93.1	Very high	1 Å²	1	59.2 Å²	59.2	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-70.5	-46.8	-178.4	-170.8	67	0	0	0	112.3	A342 I369 A371 L376 W384 D419 E420 L426	A342-L422 HydrophobicContact CB-CD2 3.6Å; I369-L422 HydrophobicContact CG2-CD1 4.14Å; A371-L422 HydrophobicContact CB-CB 4.1Å; A371-L422 HydrophobicContact CB-CD1 3.88Å; L376-L422 HydrophobicContact CB-CD1 3.88Å; L376-L422 HydrophobicContact CB-CD2 3.89Å; L376-L422 HydrophobicContact CB-CG 4.33Å; L376-L422 HydrophobicContact CD1-CD2 4.43Å; L376-L422 HydrophobicContact CD2-CD2 4.12Å; L376-L422 HydrophobicContact CD2-CG 4.34Å; L376-L422 HydrophobicContact CG-CD2 4.38Å; W384-L422 HydrophobicContact CH2-CD2 4.23Å; W384-L422 HydrophobicContact CZ3-CD2 3.85Å; W384-L422 HydrophobicContact CZ3-CG 4.44Å; D419-L422 HydrophobicContact CB-CB 4.07Å; D419-L422 PolarHBondContact O-N 3.3Å; E420-L422 VanDerWaalsContact C-N 3.25Å; E420-L422 PolarHBondContact O-N 3.24Å; L422-L426 WeakPolarHBondContact O-CB 3.43Å; L422-L426 PolarHBondContact O-N 3.23Å
423	V	93.6	Very high	93.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.7	-40.5	178.9	178.3	0	0	0	0	111	W384 I388 R411 L415 E418 D419 E420 L426 I427	W384-V423 HydrophobicContact CZ3-CG2 4.29Å; I388-V423 HydrophobicContact CD1-CG1 4.46Å; R411-V423 HydrophobicContact CB-CG1 4.07Å; R411-V423 HydrophobicContact CG-CB 4.25Å; R411-V423 HydrophobicContact CG-CG1 3.87Å; L415-V423 HydrophobicContact CB-CG2 4Å; L415-V423 HydrophobicContact CD1-CG2 4.08Å; E418-V423 HydrophobicContact CB-CG2 3.74Å; D419-V423 WeakPolarHBondContact O-CG2 3.47Å; D419-V423 PolarHBondContact O-N 3.03Å; E420-V423 PolarHBondContact O-N 3.43Å; V423-L426 WeakPolarHBondContact O-CB 3.47Å; V423-L426 PolarHBondContact O-N 3.48Å; V423-I427 HydrophobicContact CG1-CD1 4.13Å; V423-I427 WeakPolarHBondContact O-CG1 3.45Å; V423-I427 PolarHBondContact O-N 2.91Å
424	L	93.3	Very high	93.1	Very high	15 Å²	15	52.9 Å²	52.9	8%	0.079	28%	0.276	C	S	.	.	H	α-helix	trans	-67.8	-41.8	178.3	-67.8	-172.1	0	0	0	112.2	R407 R411 E420 L426 I427 E428	R407-L424 HydrophobicContact CG-CD2 3.63Å; R411-L424 HydrophobicContact CB-CD2 4.45Å; E420-L424 HydrophobicContact CG-CD1 3.67Å; E420-L424 HydrophobicContact CG-CG 4.03Å; E420-L424 VanDerWaalsContact O-CB 3.29Å; E420-L424 WeakPolarHBondContact O-CB 3.26Å; E420-L424 WeakPolarHBondContact O-CG 3.49Å; E420-L424 PolarHBondContact O-N 3.31Å; L424-L426 VanDerWaalsContact C-N 3.25Å; L424-L426 PolarHBondContact O-N 3.45Å; L424-I427 HydrophobicContact CD2-CD1 4.3Å; L424-I427 PolarHBondContact O-N 3.1Å; L424-E428 WeakPolarHBondContact O-CG 3.38Å; L424-E428 PolarHBondContact O-N 2.97Å
425	L	93.7	Very high	93.1	Very high	50 Å²	50	56.2 Å²	56.2	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-59.9	-39.4	172.5	179.5	64.8	0	0	0	111.1	I369 A371 A421 E428 K429	I369-L425 HydrophobicContact CG2-CD2 3.65Å; I369-L425 HydrophobicContact CG2-CG 4.49Å; A371-L425 HydrophobicContact CB-CB 4.25Å; A371-L425 HydrophobicContact CB-CD2 3.76Å; A421-L425 VanDerWaalsContact O-CB 3.23Å; A421-L425 WeakPolarHBondContact O-CB 3.48Å; A421-L425 PolarHBondContact O-N 3.07Å; L425-E428 WeakPolarHBondContact O-CB 3.3Å; L425-E428 PolarHBondContact O-N 3.08Å; L425-K429 WeakPolarHBondContact O-CG 3.49Å; L425-K429 PolarHBondContact O-N 3.13Å
426	L	93.8	Very high	93.1	Very high	3 Å²	3	55.8 Å²	55.8	2%	0.016	29%	0.291	C	S	.	.	H	α-helix	trans	-64.3	-42.1	177.4	-167.2	66	0	0	0	112.1	I369 A381 W384 Q385 I388 L422 V423 L424 E428 K429 M430	I369-L426 HydrophobicContact CD1-CD1 4.38Å; A381-L426 HydrophobicContact CB-CD1 3.85Å; W384-L426 HydrophobicContact CB-CD2 3.55Å; W384-L426 HydrophobicContact CE3-CD2 4.36Å; Q385-L426 HydrophobicContact CG-CD1 3.51Å; Q385-L426 HydrophobicContact CG-CD2 3.85Å; Q385-L426 HydrophobicContact CG-CG 3.55Å; Q385-L426 VanDerWaalsContact NE2-CD1 3.33Å; I388-L426 HydrophobicContact CD1-CD2 3.98Å; L422-L426 WeakPolarHBondContact O-CB 3.43Å; L422-L426 PolarHBondContact O-N 3.23Å; V423-L426 WeakPolarHBondContact O-CB 3.47Å; V423-L426 PolarHBondContact O-N 3.48Å; L424-L426 VanDerWaalsContact C-N 3.25Å; L424-L426 PolarHBondContact O-N 3.45Å; L426-E428 VanDerWaalsContact C-N 3.29Å; L426-E428 PolarHBondContact O-N 3.37Å; L426-K429 WeakPolarHBondContact O-CB 3.39Å; L426-K429 PolarHBondContact O-N 2.93Å; L426-M430 VanDerWaalsContact O-CG 3.29Å; L426-M430 WeakPolarHBondContact O-CG 3.42Å; L426-M430 PolarHBondContact O-N 3.45Å
427	I	94	Very high	93.1	Very high	4 Å²	4	55.3 Å²	55.3	2%	0.021	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-38.6	173.5	-68.7	167.6	0	0	0	110.5	I388 L410 V423 L424 M430 R431 L443	I388-I427 HydrophobicContact CD1-CG1 4.23Å; L410-I427 HydrophobicContact CD2-CD1 4.24Å; L410-I427 HydrophobicContact CG-CD1 4.38Å; V423-I427 HydrophobicContact CG1-CD1 4.13Å; V423-I427 WeakPolarHBondContact O-CG1 3.45Å; V423-I427 PolarHBondContact O-N 2.91Å; L424-I427 HydrophobicContact CD2-CD1 4.3Å; L424-I427 PolarHBondContact O-N 3.1Å; I427-M430 PolarHBondContact O-N 3.16Å; I427-R431 PolarHBondContact O-N 3.3Å; I427-L443 HydrophobicContact CG2-CD2 3.52Å
428	E	93	Very high	93.1	Very high	60 Å²	60	48.6 Å²	48.6	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-64.7	-40.5	175.3	-74.1	173.9	-179.5	0	0	111.8	R407 L424 L425 L426 M430 R431 E432	R407-E428 IonicContact NH1-OE1 3.17Å; R407-E428 PolarHBondContact NH1-OE1 2.93Å; L424-E428 WeakPolarHBondContact O-CG 3.38Å; L424-E428 PolarHBondContact O-N 2.97Å; L425-E428 WeakPolarHBondContact O-CB 3.3Å; L425-E428 PolarHBondContact O-N 3.08Å; L426-E428 VanDerWaalsContact C-N 3.29Å; L426-E428 PolarHBondContact O-N 3.37Å; E428-M430 VanDerWaalsContact C-N 3.32Å; E428-M430 PolarHBondContact O-N 3.2Å; E428-R431 WeakPolarHBondContact O-CB 3.48Å; E428-R431 PolarHBondContact O-N 3.45Å; E428-R431 VanDerWaalsContact O-N 3.1Å; E428-E432 WeakPolarHBondContact O-CG 3.42Å; E428-E432 PolarHBondContact O-N 3.35Å
429	K	92.9	Very high	92.8	Very high	92 Å²	92	51.2 Å²	51.2	40%	0.4	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-39.2	172.2	-70.9	-75.8	161.1	-148.4	0	112.6	L425 L426 R431 E432 S433	L425-K429 WeakPolarHBondContact O-CG 3.49Å; L425-K429 PolarHBondContact O-N 3.13Å; L426-K429 WeakPolarHBondContact O-CB 3.39Å; L426-K429 PolarHBondContact O-N 2.93Å; K429-R431 VanDerWaalsContact C-N 3.29Å; K429-R431 PolarHBondContact O-N 2.93Å; K429-E432 IonicContact NZ-OE2 3.82Å; K429-E432 PolarHBondContact NZ-OE2 3.43Å; K429-E432 PolarHBondContact O-N 3.16Å; K429-S433 PolarHBondContact O-N 2.87Å; K429-S433 PolarHBondContact O-OG 2.88Å
430	M	94.6	Very high	92.4	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-69.5	-27.5	175.4	-64.5	168.5	75	0	0	112.8	Q385 I388 L389 L426 I427 E428 S433 G434 D435 I436	Q385-M430 HydrophobicContact CB-CE 4.1Å; Q385-M430 HydrophobicContact CB-CG 4.1Å; Q385-M430 HydrophobicContact CB-SD 3.82Å; Q385-M430 HydrophobicContact CG-CG 3.63Å; Q385-M430 HydrophobicContact CG-SD 3.67Å; Q385-M430 WeakPolarHBondContact O-CE 3.24Å; I388-M430 HydrophobicContact CB-CE 4.16Å; I388-M430 HydrophobicContact CB-SD 4.21Å; I388-M430 HydrophobicContact CD1-SD 4.2Å; I388-M430 HydrophobicContact CG2-CE 3.96Å; I388-M430 HydrophobicContact CG2-SD 4.04Å; L389-M430 HydrophobicContact CD1-CE 4.14Å; L389-M430 HydrophobicContact CD2-CE 3.39Å; L389-M430 HydrophobicContact CG-CE 3.39Å; L426-M430 VanDerWaalsContact O-CG 3.29Å; L426-M430 WeakPolarHBondContact O-CG 3.42Å; L426-M430 PolarHBondContact O-N 3.45Å; I427-M430 PolarHBondContact O-N 3.16Å; E428-M430 VanDerWaalsContact C-N 3.32Å; E428-M430 PolarHBondContact O-N 3.2Å; M430-S433 WeakPolarHBondContact CA-OG 3.33Å; M430-S433 PolarHBondContact O-OG 3.18Å; M430-G434 PolarHBondContact O-N 3.45Å; M430-D435 PolarHBondContact O-N 2.84Å; M430-D435 VanDerWaalsContact O-N 3.12Å; M430-I436 HydrophobicContact CB-CD1 4.18Å; M430-I436 HydrophobicContact CB-CG1 4.41Å; M430-I436 HydrophobicContact CE-CD1 3.57Å; M430-I436 HydrophobicContact CE-CG1 4.17Å; M430-I436 PolarHBondContact O-N 3.46Å; M430-I436 HydrophobicContact SD-CD1 4.21Å
431	R	94.1	Very high	92.1	Very high	137 Å²	137	55.8 Å²	55.8	52%	0.517	30%	0.299	S	S	.	.	H	α-helix	trans	-74.9	-36.9	172.4	-172.2	178.1	62.3	161.4	-1.4	111.6	I427 E428 K429 G434 I436	I427-R431 PolarHBondContact O-N 3.3Å; E428-R431 WeakPolarHBondContact O-CB 3.48Å; E428-R431 PolarHBondContact O-N 3.45Å; E428-R431 VanDerWaalsContact O-N 3.1Å; K429-R431 VanDerWaalsContact C-N 3.29Å; K429-R431 PolarHBondContact O-N 2.93Å; R431-G434 PolarHBondContact O-N 3.1Å; R431-I436 WeakPolarHBondContact CA-O 3.39Å
432	E	93.9	Very high	91.8	Very high	134 Å²	134	58.3 Å²	58.3	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-66.4	-37	174	-71.6	172.4	-179.9	0	0	112.2	E428 K429 G434	E428-E432 WeakPolarHBondContact O-CG 3.42Å; E428-E432 PolarHBondContact O-N 3.35Å; K429-E432 IonicContact NZ-OE2 3.82Å; K429-E432 PolarHBondContact NZ-OE2 3.43Å; K429-E432 PolarHBondContact O-N 3.16Å; E432-G434 VanDerWaalsContact C-N 3.28Å; E432-G434 PolarHBondContact O-N 3.17Å
433	S	94.3	Very high	91.8	Very high	72 Å²	72	58.8 Å²	58.8	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-72.6	-19.1	175.6	61	0	0	0	0	113.6	K429 M430 D435	K429-S433 PolarHBondContact O-N 2.87Å; K429-S433 PolarHBondContact O-OG 2.88Å; M430-S433 WeakPolarHBondContact CA-OG 3.33Å; M430-S433 PolarHBondContact O-OG 3.18Å; S433-D435 WeakPolarHBondContact CB-OD2 3.42Å; S433-D435 VanDerWaalsContact OG-CG 3.3Å; S433-D435 PolarHBondContact OG-OD2 2.7Å
434	G	93.7	Very high	91.7	Very high	31 Å²	31	59.8 Å²	59.8	32%	0.32	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.7	6.8	-176.7	0	0	0	0	0	114.8	M430 R431 E432 I436	M430-G434 PolarHBondContact O-N 3.45Å; R431-G434 PolarHBondContact O-N 3.1Å; E432-G434 VanDerWaalsContact C-N 3.28Å; E432-G434 PolarHBondContact O-N 3.17Å; G434-I436 VanDerWaalsContact C-N 3.26Å; G434-I436 PolarHBondContact O-N 2.94Å
435	D	93.5	Very high	91.7	Very high	73 Å²	73	61 Å²	61	39%	0.39	31%	0.314	S	S	.	.	S	Bend	trans	-68.4	-28.6	175.8	-62.3	-48.6	0	0	0	112	L389 M430 S433 P446	L389-D435 HydrophobicContact CD1-CB 4.48Å; L389-D435 HydrophobicContact CD2-CB 4.22Å; M430-D435 PolarHBondContact O-N 2.84Å; M430-D435 VanDerWaalsContact O-N 3.12Å; S433-D435 WeakPolarHBondContact CB-OD2 3.42Å; S433-D435 VanDerWaalsContact OG-CG 3.3Å; S433-D435 PolarHBondContact OG-OD2 2.7Å; D435-P446 WeakPolarHBondContact O-CD 3.28Å
436	I	93.2	Very high	91.5	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-127.1	127.8	174	-60	176.2	0	0	0	108.9	I388 L389 L392 L410 M430 R431 G434 L443	I388-I436 HydrophobicContact CG2-CD1 4.33Å; L389-I436 HydrophobicContact CD2-CD1 4.15Å; L389-I436 HydrophobicContact CD2-CG1 3.83Å; L392-I436 HydrophobicContact CD2-CD1 3.89Å; L392-I436 HydrophobicContact CD2-CG1 3.91Å; L392-I436 HydrophobicContact CD2-CG2 4.35Å; L410-I436 HydrophobicContact CD2-CD1 4.29Å; M430-I436 HydrophobicContact CB-CD1 4.18Å; M430-I436 HydrophobicContact CB-CG1 4.41Å; M430-I436 HydrophobicContact CE-CD1 3.57Å; M430-I436 HydrophobicContact CE-CG1 4.17Å; M430-I436 PolarHBondContact O-N 3.46Å; M430-I436 HydrophobicContact SD-CD1 4.21Å; R431-I436 WeakPolarHBondContact CA-O 3.39Å; G434-I436 VanDerWaalsContact C-N 3.26Å; G434-I436 PolarHBondContact O-N 2.94Å; I436-L443 HydrophobicContact CG2-CB 3.81Å; I436-L443 HydrophobicContact CG2-CD2 4Å; I436-L443 HydrophobicContact CG2-CG 4.21Å
437	L	92.5	Very high	91.3	Very high	66 Å²	66	68.8 Å²	68.8	35%	0.346	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	158.2	170.6	-59.2	-177.6	0	0	0	110.1	L443 H444 P446	L437-L443 WeakPolarHBondContact O-CA 3.12Å; L437-H444 PolarHBondContact N-O 3.13Å; L437-H444 PolarHBondContact O-N 3.41Å; L437-P446 HydrophobicContact CD1-CB 4.09Å; L437-P446 HydrophobicContact CD1-CG 4.31Å; L437-P446 HydrophobicContact CG-CB 4.48Å; L437-P446 HydrophobicContact CG-CG 4.17Å
438	S	90.2	Very high	90.8	Very high	41 Å²	41	70.1 Å²	70.1	29%	0.287	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	129.3	173.7	-174	0	0	0	0	112.7	W442	S438-W442 WeakPolarHBondContact CA-O 3.42Å; S438-W442 WeakPolarHBondContact CB-O 3.31Å; S438-W442 PolarHBondContact OG-O 2.99Å
439	H	84.5	Confident	90	Very high	114 Å²	114	75.8 Å²	75.8	53%	0.528	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	125.4	172.5	-63.5	-50.5	0	0	0	109.3	G441 W442 H444	H439-G441 PolarHBondContact O-N 3.33Å; H439-G441 VanDerWaalsContact O-N 3.1Å; H439-W442 PolarHBondContact N-O 2.98Å; H439-W442 VanDerWaalsContact N-O 3.11Å; H439-W442 WeakPolarHBondContact O-CB 3.38Å; H439-W442 PolarHBondContact O-N 3.08Å; H439-H444 AromaticContact CD2-CE1 3.82Å; H439-H444 AromaticContact CD2-NE2 3.1Å; H439-H444 PolarHBondContact CD2-NE2 2.79Å; H439-H444 AromaticContact CG-NE2 3.97Å; H439-H444 AromaticContact NE2-NE2 3.83Å
440	H	81.7	Confident	88.9	Confident	191 Å²	191	72.7 Å²	72.7	88%	0.884	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	29	-178.4	-56	-68.1	0	0	0	115.3	W442	H440-W442 VanDerWaalsContact C-N 3.32Å
441	G	86.4	Confident	87.9	Confident	48 Å²	48	74 Å²	74	50%	0.495	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	0.7	-179.5	0	0	0	0	0	115	H439	H439-G441 PolarHBondContact O-N 3.33Å; H439-G441 VanDerWaalsContact O-N 3.1Å
442	W	88.3	Confident	87	Confident	93 Å²	93	69.3 Å²	69.3	35%	0.352	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	131	167.5	-58.8	105.2	0	0	0	109.1	P403 G404 S438 H439 H440	P403-W442 HydrophobicContact CB-CB 4.23Å; P403-W442 HydrophobicContact CB-CG 4.19Å; P403-W442 HydrophobicContact CG-CB 4.34Å; P403-W442 HydrophobicContact CG-CD2 3.8Å; P403-W442 HydrophobicContact CG-CE3 4.28Å; P403-W442 HydrophobicContact CG-CG 3.83Å; G404-W442 VanDerWaalsContact O-CZ3 3.24Å; G404-W442 WeakPolarHBondContact O-CZ3 3.29Å; S438-W442 WeakPolarHBondContact CA-O 3.42Å; S438-W442 WeakPolarHBondContact CB-O 3.31Å; S438-W442 PolarHBondContact OG-O 2.99Å; H439-W442 PolarHBondContact N-O 2.98Å; H439-W442 VanDerWaalsContact N-O 3.11Å; H439-W442 WeakPolarHBondContact O-CB 3.38Å; H439-W442 PolarHBondContact O-N 3.08Å; H440-W442 VanDerWaalsContact C-N 3.32Å
443	L	92.4	Very high	86.3	Confident	10 Å²	10	64.5 Å²	64.5	5%	0.052	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	132.8	177.9	-71.7	84.3	0	0	0	108.6	G404 P405 R407 L410 I427 I436 L437	G404-L443 WeakPolarHBondContact CA-O 3.3Å; P405-L443 VanDerWaalsContact CD-O 3.3Å; P405-L443 WeakPolarHBondContact CD-O 3.44Å; P405-L443 PolarHBondContact O-N 2.81Å; R407-L443 HydrophobicContact CB-CD1 3.94Å; L410-L443 HydrophobicContact CD2-CD2 4.23Å; I427-L443 HydrophobicContact CG2-CD2 3.52Å; I436-L443 HydrophobicContact CG2-CB 3.81Å; I436-L443 HydrophobicContact CG2-CD2 4Å; I436-L443 HydrophobicContact CG2-CG 4.21Å; L437-L443 WeakPolarHBondContact O-CA 3.12Å
444	H	91.8	Very high	85.8	Confident	21 Å²	21	69 Å²	69	10%	0.097	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	159.9	178.8	65.1	87.7	0	0	0	112.4	H396 P403 L437 H439 H448	H396-H444 WeakPolarHBondContact NE2-CA 3.43Å; P403-H444 VanDerWaalsContact O-CB 3.31Å; P403-H444 WeakPolarHBondContact O-CB 3.42Å; L437-H444 PolarHBondContact N-O 3.13Å; L437-H444 PolarHBondContact O-N 3.41Å; H439-H444 AromaticContact CD2-CE1 3.82Å; H439-H444 AromaticContact CD2-NE2 3.1Å; H439-H444 PolarHBondContact CD2-NE2 2.79Å; H439-H444 AromaticContact CG-NE2 3.97Å; H439-H444 AromaticContact NE2-NE2 3.83Å; H444-H448 HydrophobicContact CB-CB 4.13Å
445	L	92.7	Very high	85.3	Confident	41 Å²	41	75 Å²	75	22%	0.215	39%	0.392	C	S	.	.			trans	-66.1	147.4	170.5	-64.9	172.5	0	0	0	110	L389 L392 A393 H396 D447 H448	L389-L445 HydrophobicContact CD2-CD2 3.98Å; L392-L445 HydrophobicContact CD2-CD2 3.98Å; L392-L445 HydrophobicContact CD2-CG 4.09Å; L392-L445 HydrophobicContact CG-CG 4.33Å; A393-L445 HydrophobicContact CB-CD1 4.08Å; H396-L445 PolarHBondContact NE2-N 3.09Å; L445-D447 PolarHBondContact O-N 3.01Å; L445-D447 VanDerWaalsContact O-N 3.13Å; L445-H448 HydrophobicContact CB-CB 4.31Å; L445-H448 WeakPolarHBondContact O-CB 3.24Å; L445-H448 PolarHBondContact O-N 3.2Å
446	P	90.3	Very high	85	Confident	62 Å²	62	72.2 Å²	72.2	40%	0.403	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-34.5	177.6	-26.7	32.5	0	0	0	114	D435 L437	D435-P446 WeakPolarHBondContact O-CD 3.28Å; L437-P446 HydrophobicContact CD1-CB 4.09Å; L437-P446 HydrophobicContact CD1-CG 4.31Å; L437-P446 HydrophobicContact CG-CB 4.48Å; L437-P446 HydrophobicContact CG-CG 4.17Å
447	D	88.5	Confident	84.7	Confident	154 Å²	154	76.7 Å²	76.7	82%	0.824	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-11.8	-179.7	-60.4	-35.8	0	0	0	113.5	L445 K449	L445-D447 PolarHBondContact O-N 3.01Å; L445-D447 VanDerWaalsContact O-N 3.13Å; D447-K449 PolarHBondContact O-N 2.93Å; D447-K449 VanDerWaalsContact O-N 3.16Å
448	H	83.8	Confident	84.5	Confident	32 Å²	32	75.7 Å²	75.7	15%	0.148	40%	0.398	C	S	.	.			trans	-76.3	106.7	179.3	-171.8	69	0	0	0	110	H396 E402 H444 L445	H396-H448 AromaticContact CE1-CD2 3.45Å; H396-H448 PolarHBondContact CE1-CD2 3.48Å; H396-H448 VanDerWaalsContact CE1-CD2 3.45Å; H396-H448 AromaticContact CE1-CG 3.67Å; H396-H448 AromaticContact CE1-NE2 3.84Å; H396-H448 AromaticContact CG-CE1 3.93Å; H396-H448 AromaticContact CG-CG 3.87Å; H396-H448 AromaticContact CG-ND1 3.69Å; H396-H448 AromaticContact ND1-CD2 3.41Å; H396-H448 PolarHBondContact ND1-CD2 3.18Å; H396-H448 AromaticContact ND1-CE1 3.45Å; H396-H448 PolarHBondContact ND1-CE1 2.52Å; H396-H448 AromaticContact ND1-CG 3.51Å; H396-H448 AromaticContact ND1-ND1 3.55Å; H396-H448 AromaticContact ND1-NE2 3.35Å; H396-H448 PolarHBondContact ND1-NE2 2.9Å; E402-H448 PolarHBondContact O-NE2 3.1Å; H444-H448 HydrophobicContact CB-CB 4.13Å; L445-H448 HydrophobicContact CB-CB 4.31Å; L445-H448 WeakPolarHBondContact O-CB 3.24Å; L445-H448 PolarHBondContact O-N 3.2Å
449	K	75.9	Confident	84.5	Confident	179 Å²	179	75 Å²	75	78%	0.778	39%	0.391	S	S	*	.			trans	-101.5	123.5	166.2	-63.9	-177.9	-177.5	178.5	0	107	D447 G451	D447-K449 PolarHBondContact O-N 2.93Å; D447-K449 VanDerWaalsContact O-N 3.16Å; K449-G451 PolarHBondContact O-N 2.96Å
450	A	71.3	Confident	84.8	Confident	27 Å²	27	70.3 Å²	70.3	22%	0.223	37%	0.369	C	S	.	.			trans	-64.6	79.3	173.2	0	0	0	0	0	109.7	P403 Q498	P403-A450 HydrophobicContact CB-CB 4.42Å; A450-Q498 PolarHBondContact O-NE2 3.19Å
451	G	73.2	Confident	85.1	Confident	29 Å²	29	66.9 Å²	66.9	30%	0.299	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-81.8	169.7	175.1	0	0	0	0	0	110.6	K449	K449-G451 PolarHBondContact O-N 2.96Å
452	F	74.9	Confident	85.2	Confident	38 Å²	38	70.5 Å²	70.5	17%	0.167	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-69.9	143.8	164.3	-65.4	-54.6	0	0	0	109.7	Q456 Q457 W460 T491 Q494 A495 Q498 I500	F452-Q456 HydrophobicContact CB-CB 3.88Å; F452-Q456 HydrophobicContact CD1-CB 3.89Å; F452-Q456 HydrophobicContact CG-CB 4.24Å; F452-Q457 HydrophobicContact CB-CB 3.92Å; F452-W460 HydrophobicContact CD2-CB 4.41Å; F452-W460 HydrophobicContact CD2-CG 4.36Å; F452-W460 HydrophobicContact CE2-CB 4.09Å; F452-W460 AromaticContact CE2-CD1 3.63Å; F452-W460 HydrophobicContact CE2-CD2 4.17Å; F452-W460 AromaticContact CE2-CG 3.64Å; F452-W460 HydrophobicContact CE2-CG 3.64Å; F452-W460 HydrophobicContact CZ-CB 4.26Å; F452-W460 AromaticContact CZ-CD2 3.98Å; F452-W460 HydrophobicContact CZ-CD2 3.98Å; F452-W460 HydrophobicContact CZ-CE3 4.43Å; F452-W460 AromaticContact CZ-CG 3.84Å; F452-W460 HydrophobicContact CZ-CG 3.84Å; F452-T491 HydrophobicContact CE1-CG2 4.38Å; F452-Q494 HydrophobicContact CD1-CB 4.09Å; F452-Q494 HydrophobicContact CE1-CB 3.84Å; F452-A495 HydrophobicContact CE1-CB 4Å; F452-A495 HydrophobicContact CZ-CB 3.64Å; F452-Q498 VanDerWaalsContact CE2-OE1 3.26Å; F452-I500 HydrophobicContact CE2-CD1 4.07Å; F452-I500 HydrophobicContact CZ-CD1 4.16Å
453	S	79.9	Confident	85.2	Confident	32 Å²	32	66.1 Å²	66.1	22%	0.224	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-64.1	161.4	156.8	69.3	0	0	0	0	109.8	E455 Q456 Q457	S453-E455 PolarHBondContact O-N 3.19Å; S453-Q456 PolarHBondContact O-N 3.11Å; S453-Q456 VanDerWaalsContact O-N 3.09Å; S453-Q456 WeakPolarHBondContact OG-CG 3.46Å; S453-Q456 PolarHBondContact OG-N 3.01Å; S453-Q457 WeakPolarHBondContact O-CB 3.4Å; S453-Q457 PolarHBondContact O-N 3.1Å
454	E	82.6	Confident	84.9	Confident	166 Å²	166	70.5 Å²	70.5	78%	0.776	36%	0.359	S	S	*	.	H	α-helix	trans	-56.2	-36.6	176.9	-67.5	-179.6	-177.9	0	0	111.9	Q457 A458	E454-Q457 PolarHBondContact O-N 2.74Å; E454-A458 WeakPolarHBondContact O-CB 3.35Å; E454-A458 PolarHBondContact O-N 2.86Å
455	E	83.6	Confident	84.6	Confident	159 Å²	159	74.2 Å²	74.2	74%	0.743	39%	0.385	S	S	*	.	H	α-helix	trans	-64.4	-47.5	175	-63.4	-177.8	172.9	0	0	112.1	S453 Q457 A458 I459	S453-E455 PolarHBondContact O-N 3.19Å; E455-Q457 VanDerWaalsContact C-N 3.31Å; E455-Q457 PolarHBondContact O-N 2.83Å; E455-A458 PolarHBondContact O-N 3.43Å; E455-I459 WeakPolarHBondContact O-CG1 3.39Å; E455-I459 PolarHBondContact O-N 3.31Å
456	Q	86.7	Confident	84.3	Confident	14 Å²	14	74.9 Å²	74.9	7%	0.065	39%	0.389	C	S	.	.	H	α-helix	trans	-65.4	-37	177	-74.4	177.7	-7.7	0	0	111.4	D401 F452 S453 A458 I459 W460 T491	D401-Q456 VanDerWaalsContact CB-OE1 3.29Å; D401-Q456 PolarHBondContact OD2-NE2 3.39Å; F452-Q456 HydrophobicContact CB-CB 3.88Å; F452-Q456 HydrophobicContact CD1-CB 3.89Å; F452-Q456 HydrophobicContact CG-CB 4.24Å; S453-Q456 PolarHBondContact O-N 3.11Å; S453-Q456 VanDerWaalsContact O-N 3.09Å; S453-Q456 WeakPolarHBondContact OG-CG 3.46Å; S453-Q456 PolarHBondContact OG-N 3.01Å; Q456-A458 VanDerWaalsContact C-N 3.34Å; Q456-I459 PolarHBondContact O-N 3.07Å; Q456-W460 VanDerWaalsContact O-CB 3.25Å; Q456-W460 WeakPolarHBondContact O-CB 3.37Å; Q456-W460 PolarHBondContact O-N 2.99Å; Q456-T491 HydrophobicContact CB-CG2 4.05Å; Q456-T491 HydrophobicContact CG-CG2 4.39Å; Q456-T491 WeakPolarHBondContact O-CG2 3.26Å
457	Q	87.2	Confident	83.9	Confident	93 Å²	93	72.4 Å²	72.4	44%	0.435	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-38.8	177.4	-166.3	174.3	11	0	0	110.8	F452 S453 E454 E455 W460 Q461	F452-Q457 HydrophobicContact CB-CB 3.92Å; S453-Q457 WeakPolarHBondContact O-CB 3.4Å; S453-Q457 PolarHBondContact O-N 3.1Å; E454-Q457 PolarHBondContact O-N 2.74Å; E455-Q457 VanDerWaalsContact C-N 3.31Å; E455-Q457 PolarHBondContact O-N 2.83Å; Q457-W460 PolarHBondContact O-N 3.32Å; Q457-Q461 WeakPolarHBondContact O-CB 3.42Å; Q457-Q461 VanDerWaalsContact O-CG 3.26Å; Q457-Q461 WeakPolarHBondContact O-CG 3.5Å; Q457-Q461 PolarHBondContact O-N 3.47Å
458	A	89.5	Confident	83.2	Confident	45 Å²	45	66.9 Å²	66.9	37%	0.372	35%	0.351	S	S	.	.	H	α-helix	trans	-66.1	-37.1	174.7	0	0	0	0	0	112.7	E454 E455 Q456 K462	E454-A458 WeakPolarHBondContact O-CB 3.35Å; E454-A458 PolarHBondContact O-N 2.86Å; E455-A458 PolarHBondContact O-N 3.43Å; Q456-A458 VanDerWaalsContact C-N 3.34Å; A458-K462 WeakPolarHBondContact O-CG 3.5Å
459	I	90.3	Very high	82.4	Confident	27 Å²	27	69.9 Å²	69.9	14%	0.138	37%	0.368	C	S	.	.	H	α-helix	trans	-67.3	-45.7	172.2	-64.9	171.4	0	0	0	110	E455 Q456 Q461 K462 A463 T483 A487 M488 T491	E455-I459 WeakPolarHBondContact O-CG1 3.39Å; E455-I459 PolarHBondContact O-N 3.31Å; Q456-I459 PolarHBondContact O-N 3.07Å; I459-Q461 PolarHBondContact O-N 3.12Å; I459-K462 PolarHBondContact O-N 3.34Å; I459-K462 VanDerWaalsContact O-N 3.16Å; I459-A463 WeakPolarHBondContact O-CB 3.47Å; I459-A463 PolarHBondContact O-N 3.31Å; I459-T483 HydrophobicContact CD1-CG2 4.3Å; I459-T483 HydrophobicContact CG1-CG2 3.98Å; I459-T483 HydrophobicContact CG2-CG2 4.22Å; I459-A487 HydrophobicContact CD1-CB 4.45Å; I459-M488 HydrophobicContact CG2-CE 3.91Å; I459-M488 HydrophobicContact CG2-SD 3.85Å; I459-T491 HydrophobicContact CB-CG2 4.17Å; I459-T491 HydrophobicContact CG2-CG2 4.03Å
460	W	89.7	Confident	82.2	Confident	15 Å²	15	67.8 Å²	67.8	6%	0.057	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-43.9	-179.7	-177.5	-107	0	0	0	111.9	F452 Q456 Q457 K462 A463 E464 F467 T491 L492 A495 I500 I501	F452-W460 HydrophobicContact CD2-CB 4.41Å; F452-W460 HydrophobicContact CD2-CG 4.36Å; F452-W460 HydrophobicContact CE2-CB 4.09Å; F452-W460 AromaticContact CE2-CD1 3.63Å; F452-W460 HydrophobicContact CE2-CD2 4.17Å; F452-W460 AromaticContact CE2-CG 3.64Å; F452-W460 HydrophobicContact CE2-CG 3.64Å; F452-W460 HydrophobicContact CZ-CB 4.26Å; F452-W460 AromaticContact CZ-CD2 3.98Å; F452-W460 HydrophobicContact CZ-CD2 3.98Å; F452-W460 HydrophobicContact CZ-CE3 4.43Å; F452-W460 AromaticContact CZ-CG 3.84Å; F452-W460 HydrophobicContact CZ-CG 3.84Å; Q456-W460 VanDerWaalsContact O-CB 3.25Å; Q456-W460 WeakPolarHBondContact O-CB 3.37Å; Q456-W460 PolarHBondContact O-N 2.99Å; Q457-W460 PolarHBondContact O-N 3.32Å; W460-K462 PolarHBondContact O-N 2.77Å; W460-A463 CarbonylContact O-C 3.52Å; W460-A463 PolarHBondContact O-N 2.91Å; W460-E464 HydrophobicContact CZ2-CB 4.12Å; W460-E464 HydrophobicContact CZ2-CG 4.26Å; W460-E464 VanDerWaalsContact O-CB 3.26Å; W460-E464 WeakPolarHBondContact O-CB 3.36Å; W460-E464 PolarHBondContact O-N 3.35Å; W460-F467 AromaticContact CH2-CD2 3.92Å; W460-F467 HydrophobicContact CH2-CD2 3.92Å; W460-F467 AromaticContact CH2-CE2 3.99Å; W460-F467 HydrophobicContact CH2-CE2 3.99Å; W460-F467 HydrophobicContact CZ3-CD2 4.1Å; W460-F467 AromaticContact CZ3-CE2 3.74Å; W460-F467 HydrophobicContact CZ3-CE2 3.74Å; W460-T491 HydrophobicContact CB-CG2 4.28Å; W460-L492 HydrophobicContact CE3-CD2 4.28Å; W460-L492 HydrophobicContact CZ3-CD2 3.83Å; W460-A495 HydrophobicContact CD2-CB 4.31Å; W460-A495 HydrophobicContact CE3-CB 3.74Å; W460-A495 HydrophobicContact CH2-CB 4.09Å; W460-A495 HydrophobicContact CZ3-CB 3.6Å; W460-I500 HydrophobicContact CH2-CG2 3.93Å; W460-I500 HydrophobicContact CZ2-CB 4.24Å; W460-I500 HydrophobicContact CZ2-CD1 4.37Å; W460-I500 HydrophobicContact CZ2-CG2 3.38Å; W460-I501 HydrophobicContact CH2-CD1 4.38Å; W460-I501 HydrophobicContact CH2-CG2 3.68Å; W460-I501 HydrophobicContact CZ3-CD1 4.04Å; W460-I501 HydrophobicContact CZ3-CG2 4.36Å
461	Q	88.8	Confident	82.5	Confident	119 Å²	119	67.7 Å²	67.7	56%	0.556	36%	0.358	S	S	*	.	H	α-helix	trans	-60	-29.4	176.5	-76.8	172.8	0.5	0	0	113.4	Q457 I459 P465	Q457-Q461 WeakPolarHBondContact O-CB 3.42Å; Q457-Q461 VanDerWaalsContact O-CG 3.26Å; Q457-Q461 WeakPolarHBondContact O-CG 3.5Å; Q457-Q461 PolarHBondContact O-N 3.47Å; I459-Q461 PolarHBondContact O-N 3.12Å; Q461-P465 VanDerWaalsContact O-CD 3.27Å; Q461-P465 WeakPolarHBondContact O-CD 3.49Å
462	K	88	Confident	83.1	Confident	125 Å²	125	69.1 Å²	69.1	54%	0.543	35%	0.354	S	S	.	.	H	α-helix	trans	-80.1	-35.5	173.6	-65.5	175.7	-175.4	178.3	0	112.2	A458 I459 W460 T481	A458-K462 WeakPolarHBondContact O-CG 3.5Å; I459-K462 PolarHBondContact O-N 3.34Å; I459-K462 VanDerWaalsContact O-N 3.16Å; W460-K462 PolarHBondContact O-N 2.77Å; K462-T481 HydrophobicContact CB-CG2 4.1Å
463	A	87.7	Confident	83.9	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-82.6	-33	-176.7	0	0	0	0	0	113.5	I459 W460 L466 F467 T481 M488	I459-A463 WeakPolarHBondContact O-CB 3.47Å; I459-A463 PolarHBondContact O-N 3.31Å; W460-A463 CarbonylContact O-C 3.52Å; W460-A463 PolarHBondContact O-N 2.91Å; A463-L466 WeakPolarHBondContact O-CB 3.48Å; A463-L466 PolarHBondContact O-N 2.93Å; A463-F467 HydrophobicContact CB-CE2 4.44Å; A463-F467 WeakPolarHBondContact O-CD2 3.26Å; A463-F467 PolarHBondContact O-N 2.94Å; A463-T481 HydrophobicContact CB-CG2 4.45Å; A463-M488 HydrophobicContact CB-CE 4.27Å
464	E	86.6	Confident	84.4	Confident	103 Å²	103	70 Å²	70	48%	0.481	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-52.1	-49.4	-179.3	-179.8	174.5	-147	0	0	113.5	W460 L466 F467	W460-E464 HydrophobicContact CZ2-CB 4.12Å; W460-E464 HydrophobicContact CZ2-CG 4.26Å; W460-E464 VanDerWaalsContact O-CB 3.26Å; W460-E464 WeakPolarHBondContact O-CB 3.36Å; W460-E464 PolarHBondContact O-N 3.35Å; E464-L466 PolarHBondContact O-N 3.24Å; E464-F467 PolarHBondContact O-N 2.93Å
465	P	85.8	Confident	84.9	Confident	99 Å²	99	69.3 Å²	69.3	64%	0.643	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-70.5	-19.2	177.8	28.1	-36.1	0	0	0	113.7	Q461	Q461-P465 VanDerWaalsContact O-CD 3.27Å; Q461-P465 WeakPolarHBondContact O-CD 3.49Å
466	L	86.3	Confident	85.2	Confident	55 Å²	55	64.7 Å²	64.7	29%	0.288	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-74.8	-29.3	175.2	-61.7	173	0	0	0	111.2	A463 E464 G468 W472 L477 E480 T481	A463-L466 WeakPolarHBondContact O-CB 3.48Å; A463-L466 PolarHBondContact O-N 2.93Å; E464-L466 PolarHBondContact O-N 3.24Å; L466-G468 PolarHBondContact O-N 3.49Å; L466-W472 PolarHBondContact O-NE1 3.27Å; L466-L477 HydrophobicContact CB-CD2 4.14Å; L466-L477 HydrophobicContact CD1-CD2 4.18Å; L466-E480 HydrophobicContact CD1-CB 4.07Å; L466-T481 HydrophobicContact CD1-CG2 3.7Å
467	F	82.4	Confident	85.4	Confident	10 Å²	10	64 Å²	64	4%	0.044	32%	0.319	C	S	.	.			trans	-70.8	74.9	170.4	-74.6	-71	0	0	0	111	W460 A463 E464 W472 L477 L492 I501	W460-F467 AromaticContact CH2-CD2 3.92Å; W460-F467 HydrophobicContact CH2-CD2 3.92Å; W460-F467 AromaticContact CH2-CE2 3.99Å; W460-F467 HydrophobicContact CH2-CE2 3.99Å; W460-F467 HydrophobicContact CZ3-CD2 4.1Å; W460-F467 AromaticContact CZ3-CE2 3.74Å; W460-F467 HydrophobicContact CZ3-CE2 3.74Å; A463-F467 HydrophobicContact CB-CE2 4.44Å; A463-F467 WeakPolarHBondContact O-CD2 3.26Å; A463-F467 PolarHBondContact O-N 2.94Å; E464-F467 PolarHBondContact O-N 2.93Å; F467-W472 HydrophobicContact CE1-CB 4.11Å; F467-L477 HydrophobicContact CE1-CD1 4.06Å; F467-L477 HydrophobicContact CE2-CD1 3.95Å; F467-L477 HydrophobicContact CZ-CD1 3.4Å; F467-L477 VanDerWaalsContact CZ-CD1 3.4Å; F467-L492 HydrophobicContact CE2-CD2 3.65Å; F467-L492 HydrophobicContact CZ-CD2 3.75Å; F467-I501 HydrophobicContact CD2-CG2 4.44Å; F467-I501 HydrophobicContact CE1-CG2 4.46Å; F467-I501 HydrophobicContact CE2-CD1 4.33Å; F467-I501 HydrophobicContact CE2-CG2 4.38Å; F467-I501 HydrophobicContact CZ-CD1 4.03Å; F467-I501 HydrophobicContact CZ-CG2 4.38Å
468	G	73	Confident	85.7	Confident	37 Å²	37	60 Å²	60	38%	0.381	30%	0.301	S	S	.	.	S	Bend	trans	-81	-134.2	164	0	0	0	0	0	111.4	L466	L466-G468 PolarHBondContact O-N 3.49Å
469	D	66.9	Low	85.8	Confident	96 Å²	96	65.6 Å²	65.6	51%	0.513	32%	0.318	S	S	.	.	S	Bend	trans	-81.8	-21.4	-176.1	-72.2	-23.1	0	0	0	114.5	R514	D469-R514 IonicContact OD1-CZ 3.05Å; D469-R514 VanDerWaalsContact OD1-CZ 3.29Å; D469-R514 IonicContact OD1-NE 3.02Å; D469-R514 PolarHBondContact OD1-NE 2.9Å; D469-R514 VanDerWaalsContact OD1-NE 3.15Å; D469-R514 IonicContact OD1-NH2 3.09Å; D469-R514 PolarHBondContact OD1-NH2 3.04Å; D469-R514 IonicContact OD2-CZ 3.37Å; D469-R514 IonicContact OD2-NH2 3.38Å; D469-R514 PolarHBondContact OD2-NH2 2.96Å
470	E	72.2	Confident	85.8	Confident	135 Å²	135	69.1 Å²	69.1	63%	0.631	33%	0.333	S	S	*	.	S	Bend	trans	-95.5	148.2	-173.9	-69.5	-66.6	155.6	0	0	112.2
471	P	77.6	Confident	85.8	Confident	25 Å²	25	69.3 Å²	69.3	16%	0.162	34%	0.336	C	S	.	.			trans	-71.3	142.9	174	28.7	-29.4	0	0	0	110.3	R508 Y510	P471-R508 HydrophobicContact CB-CG 4.18Å; P471-Y510 HydrophobicContact CB-CD1 3.85Å; P471-Y510 HydrophobicContact CB-CD2 4.15Å; P471-Y510 HydrophobicContact CB-CE1 3.4Å; P471-Y510 VanDerWaalsContact CB-CE1 3.4Å; P471-Y510 HydrophobicContact CB-CE2 3.74Å; P471-Y510 HydrophobicContact CB-CG 4.21Å; P471-Y510 WeakPolarHBondContact CD-OH 3.49Å; P471-Y510 HydrophobicContact CG-CE1 3.68Å; P471-Y510 HydrophobicContact CG-CE2 4.17Å; P471-Y510 VanDerWaalsContact CG-CZ 3.43Å; P471-Y510 WeakPolarHBondContact CG-OH 3.25Å
472	W	85.9	Confident	85.9	Confident	59 Å²	59	67 Å²	67	22%	0.223	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	141.2	172.8	-71.9	91.8	0	0	0	112	L466 F467 D476 L477 E480 Y509	L466-W472 PolarHBondContact O-NE1 3.27Å; F467-W472 HydrophobicContact CE1-CB 4.11Å; W472-D476 HydrophobicContact CE3-CB 3.98Å; W472-D476 HydrophobicContact CZ3-CB 4.21Å; W472-L477 HydrophobicContact CB-CD1 3.62Å; W472-L477 HydrophobicContact CB-CD2 3.81Å; W472-L477 HydrophobicContact CB-CG 3.58Å; W472-L477 HydrophobicContact CD2-CD2 4.01Å; W472-L477 HydrophobicContact CD2-CG 4.46Å; W472-L477 HydrophobicContact CE3-CD2 4.28Å; W472-L477 HydrophobicContact CE3-CG 4.49Å; W472-L477 HydrophobicContact CG-CD1 4.48Å; W472-L477 HydrophobicContact CG-CD2 3.8Å; W472-L477 HydrophobicContact CG-CG 4.11Å; W472-E480 WeakPolarHBondContact CH2-OE1 3.27Å; W472-E480 WeakPolarHBondContact CH2-OE2 3.3Å; W472-E480 HydrophobicContact CZ3-CG 4.45Å; W472-E480 WeakPolarHBondContact CZ3-OE1 3.37Å; W472-E480 VanDerWaalsContact CZ3-OE2 3.29Å; W472-E480 WeakPolarHBondContact CZ3-OE2 3.18Å; W472-Y509 PolarHBondContact N-O 3.07Å; W472-Y509 PolarHBondContact O-N 3.07Å; W472-Y509 VanDerWaalsContact O-N 3.07Å
473	W	90.8	Very high	86.1	Confident	87 Å²	87	62.4 Å²	62.4	33%	0.33	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	144.7	165.6	-67.4	98.9	0	0	0	109.9	R475 D476 L477 D507 R508	W473-R475 PolarHBondContact O-N 3.48Å; W473-R475 VanDerWaalsContact O-N 3.13Å; W473-D476 PolarHBondContact O-N 2.74Å; W473-L477 PolarHBondContact O-N 3.04Å; W473-D507 VanDerWaalsContact CA-O 3.32Å; W473-D507 WeakPolarHBondContact CA-O 3.48Å; W473-D507 HydrophobicContact CE3-CB 4.35Å; W473-R508 HydrophobicContact CD2-CB 4.37Å; W473-R508 VanDerWaalsContact CE2-NE 3.34Å; W473-R508 HydrophobicContact CE3-CB 4Å; W473-R508 HydrophobicContact CZ3-CB 4.07Å
474	V	91.3	Very high	86.3	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-50.3	-41.5	175.5	173.8	0	0	0	0	111.9	D476 A478 E485 M488 R489 L492 D507 Y509	V474-D476 VanDerWaalsContact C-N 3.34Å; V474-D476 PolarHBondContact O-N 3.2Å; V474-A478 VanDerWaalsContact O-CB 3.25Å; V474-A478 WeakPolarHBondContact O-CB 3.49Å; V474-A478 PolarHBondContact O-N 3.19Å; V474-E485 HydrophobicContact CG1-CG 4.22Å; V474-M488 HydrophobicContact CG1-CG 4.32Å; V474-R489 HydrophobicContact CG1-CB 3.84Å; V474-R489 HydrophobicContact CG1-CG 4.43Å; V474-L492 HydrophobicContact CG2-CD1 4.02Å; V474-D507 HydrophobicContact CB-CB 4.13Å; V474-D507 HydrophobicContact CG2-CB 3.77Å; V474-D507 WeakPolarHBondContact CG2-O 3.49Å; V474-D507 PolarHBondContact N-O 3.35Å; V474-Y509 HydrophobicContact CG2-CD2 3.94Å; V474-Y509 HydrophobicContact CG2-CE2 3.56Å
475	R	92	Very high	86.6	Confident	153 Å²	153	65.4 Å²	65.4	58%	0.577	34%	0.344	S	S	*	.	H	α-helix	trans	-65.7	-35.5	-179	-73.7	-176.1	174.5	176.3	0.5	113.4	W473 K479 E485	W473-R475 PolarHBondContact O-N 3.48Å; W473-R475 VanDerWaalsContact O-N 3.13Å; R475-K479 VanDerWaalsContact O-CG 3.31Å; R475-K479 WeakPolarHBondContact O-CG 3.26Å; R475-K479 PolarHBondContact O-N 3.02Å; R475-E485 HydrophobicContact CG-CG 4.18Å; R475-E485 IonicContact NE-OE1 3.93Å; R475-E485 PolarHBondContact NE-OE1 2.93Å; R475-E485 IonicContact NE-OE2 2.69Å; R475-E485 PolarHBondContact NE-OE2 2.93Å
476	D	91.5	Very high	86.8	Confident	62 Å²	62	66.8 Å²	66.8	33%	0.332	34%	0.342	S	S	.	.	H	α-helix	trans	-77.7	-42.6	-178.3	-60.8	-33.5	0	0	0	109.3	W472 W473 V474 A478 K479 E480	W472-D476 HydrophobicContact CE3-CB 3.98Å; W472-D476 HydrophobicContact CZ3-CB 4.21Å; W473-D476 PolarHBondContact O-N 2.74Å; V474-D476 VanDerWaalsContact C-N 3.34Å; V474-D476 PolarHBondContact O-N 3.2Å; D476-A478 VanDerWaalsContact C-N 3.32Å; D476-A478 PolarHBondContact O-N 3.45Å; D476-K479 WeakPolarHBondContact O-CB 3.32Å; D476-K479 PolarHBondContact O-N 3.16Å; D476-K479 VanDerWaalsContact O-N 3.11Å; D476-E480 WeakPolarHBondContact O-CG 3.23Å; D476-E480 PolarHBondContact O-N 2.99Å
477	L	90.9	Very high	87	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-58.9	-42.4	171.6	-71.2	169.4	0	0	0	112.7	L466 F467 W472 W473 K479 E480 T481 M488 L492	L466-L477 HydrophobicContact CB-CD2 4.14Å; L466-L477 HydrophobicContact CD1-CD2 4.18Å; F467-L477 HydrophobicContact CE1-CD1 4.06Å; F467-L477 HydrophobicContact CE2-CD1 3.95Å; F467-L477 HydrophobicContact CZ-CD1 3.4Å; F467-L477 VanDerWaalsContact CZ-CD1 3.4Å; W472-L477 HydrophobicContact CB-CD1 3.62Å; W472-L477 HydrophobicContact CB-CD2 3.81Å; W472-L477 HydrophobicContact CB-CG 3.58Å; W472-L477 HydrophobicContact CD2-CD2 4.01Å; W472-L477 HydrophobicContact CD2-CG 4.46Å; W472-L477 HydrophobicContact CE3-CD2 4.28Å; W472-L477 HydrophobicContact CE3-CG 4.49Å; W472-L477 HydrophobicContact CG-CD1 4.48Å; W472-L477 HydrophobicContact CG-CD2 3.8Å; W472-L477 HydrophobicContact CG-CG 4.11Å; W473-L477 PolarHBondContact O-N 3.04Å; L477-K479 VanDerWaalsContact C-N 3.29Å; L477-K479 PolarHBondContact O-N 3.4Å; L477-E480 PolarHBondContact O-N 3.28Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 WeakPolarHBondContact O-CG2 3.3Å; L477-T481 PolarHBondContact O-N 3.03Å; L477-T481 PolarHBondContact O-OG1 3.33Å; L477-M488 HydrophobicContact CB-CE 3.81Å; L477-M488 HydrophobicContact CB-CG 4.12Å; L477-M488 HydrophobicContact CB-SD 4.19Å; L477-M488 WeakPolarHBondContact O-CE 2.95Å; L477-L492 HydrophobicContact CD1-CD1 3.58Å; L477-L492 HydrophobicContact CD1-CD2 4.29Å
478	A	91.6	Very high	87.4	Confident	7 Å²	7	65.4 Å²	65.4	6%	0.058	34%	0.34	C	S	.	.	H	α-helix	trans	-60.6	-40.8	177.1	0	0	0	0	0	111.5	V474 D476 G482 T483 E485 M488	V474-A478 VanDerWaalsContact O-CB 3.25Å; V474-A478 WeakPolarHBondContact O-CB 3.49Å; V474-A478 PolarHBondContact O-N 3.19Å; D476-A478 VanDerWaalsContact C-N 3.32Å; D476-A478 PolarHBondContact O-N 3.45Å; A478-G482 PolarHBondContact O-N 3.01Å; A478-G482 VanDerWaalsContact O-N 3.11Å; A478-T483 PolarHBondContact O-N 3.17Å; A478-E485 HydrophobicContact CB-CB 4.45Å; A478-M488 HydrophobicContact CB-CB 4.05Å; A478-M488 HydrophobicContact CB-CG 4.26Å
479	K	92.2	Very high	88.3	Confident	164 Å²	164	65.9 Å²	65.9	71%	0.713	33%	0.331	S	S	*	.	H	α-helix	trans	-68.8	-44.1	176.4	-73.4	171.6	-177.3	175.4	0	112.6	R475 D476 L477 G482	R475-K479 VanDerWaalsContact O-CG 3.31Å; R475-K479 WeakPolarHBondContact O-CG 3.26Å; R475-K479 PolarHBondContact O-N 3.02Å; D476-K479 WeakPolarHBondContact O-CB 3.32Å; D476-K479 PolarHBondContact O-N 3.16Å; D476-K479 VanDerWaalsContact O-N 3.11Å; L477-K479 VanDerWaalsContact C-N 3.29Å; L477-K479 PolarHBondContact O-N 3.4Å; K479-G482 PolarHBondContact O-N 3.35Å
480	E	90.7	Very high	89.3	Confident	100 Å²	100	64.9 Å²	64.9	47%	0.467	33%	0.325	S	S	.	.	H	α-helix	trans	-68.8	-37.6	-176.8	-72.7	-169.2	164.8	0	0	113	L466 W472 D476 L477	L466-E480 HydrophobicContact CD1-CB 4.07Å; W472-E480 WeakPolarHBondContact CH2-OE1 3.27Å; W472-E480 WeakPolarHBondContact CH2-OE2 3.3Å; W472-E480 HydrophobicContact CZ3-CG 4.45Å; W472-E480 WeakPolarHBondContact CZ3-OE1 3.37Å; W472-E480 VanDerWaalsContact CZ3-OE2 3.29Å; W472-E480 WeakPolarHBondContact CZ3-OE2 3.18Å; D476-E480 WeakPolarHBondContact O-CG 3.23Å; D476-E480 PolarHBondContact O-N 2.99Å; L477-E480 PolarHBondContact O-N 3.28Å
481	T	90.3	Very high	90.1	Very high	20 Å²	20	58.5 Å²	58.5	12%	0.123	30%	0.295	C	S	.	.	H	α-helix	trans	-88.6	-7.2	179.3	60.5	0	0	0	0	113.4	K462 A463 L466 L477 T483 M488	K462-T481 HydrophobicContact CB-CG2 4.1Å; A463-T481 HydrophobicContact CB-CG2 4.45Å; L466-T481 HydrophobicContact CD1-CG2 3.7Å; L477-T481 WeakPolarHBondContact O-CB 3.37Å; L477-T481 WeakPolarHBondContact O-CG2 3.3Å; L477-T481 PolarHBondContact O-N 3.03Å; L477-T481 PolarHBondContact O-OG1 3.33Å; T481-T483 PolarHBondContact OG1-OG1 2.99Å; T481-T483 VanDerWaalsContact OG1-OG1 3.1Å; T481-M488 HydrophobicContact CG2-CE 3.75Å; T481-M488 WeakPolarHBondContact OG1-CE 3.41Å
482	G	90.5	Very high	90.8	Very high	70 Å²	70	57.3 Å²	57.3	72%	0.722	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.6	31.4	-178.5	0	0	0	0	0	113.8	A478 K479	A478-G482 PolarHBondContact O-N 3.01Å; A478-G482 VanDerWaalsContact O-N 3.11Å; K479-G482 PolarHBondContact O-N 3.35Å
483	T	91.2	Very high	90.8	Very high	29 Å²	29	59.8 Å²	59.8	18%	0.178	30%	0.297	C	S	.	.			trans	-106.4	156	-178.7	61.2	0	0	0	0	111.8	I459 A478 T481	I459-T483 HydrophobicContact CD1-CG2 4.3Å; I459-T483 HydrophobicContact CG1-CG2 3.98Å; I459-T483 HydrophobicContact CG2-CG2 4.22Å; A478-T483 PolarHBondContact O-N 3.17Å; T481-T483 PolarHBondContact OG1-OG1 2.99Å; T481-T483 VanDerWaalsContact OG1-OG1 3.1Å
484	D	92.3	Very high	90.5	Very high	105 Å²	105	56.4 Å²	56.4	56%	0.561	29%	0.285	S	S	*	.			trans	-59.5	141.5	170.7	172.6	68.5	0	0	0	112.2	Q486 A487 M488	D484-Q486 VanDerWaalsContact C-N 3.3Å; D484-Q486 PolarHBondContact O-N 3.3Å; D484-Q486 WeakPolarHBondContact OD2-CA 3.2Å; D484-Q486 VanDerWaalsContact OD2-CB 3.23Å; D484-Q486 WeakPolarHBondContact OD2-CB 3.38Å; D484-Q486 PolarHBondContact OD2-N 3.33Å; D484-A487 HydrophobicContact CB-CB 4.12Å; D484-A487 PolarHBondContact O-N 3.02Å; D484-A487 PolarHBondContact OD2-N 3.1Å; D484-M488 WeakPolarHBondContact O-CB 3.27Å; D484-M488 PolarHBondContact O-N 2.88Å
485	E	92.3	Very high	90.3	Very high	61 Å²	61	56.4 Å²	56.4	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-61.7	-36.9	-176.4	-174.4	-174.9	147.3	0	0	111.8	V474 R475 A478 R489	V474-E485 HydrophobicContact CG1-CG 4.22Å; R475-E485 HydrophobicContact CG-CG 4.18Å; R475-E485 IonicContact NE-OE1 3.93Å; R475-E485 PolarHBondContact NE-OE1 2.93Å; R475-E485 IonicContact NE-OE2 2.69Å; R475-E485 PolarHBondContact NE-OE2 2.93Å; A478-E485 HydrophobicContact CB-CB 4.45Å; E485-R489 WeakPolarHBondContact O-CB 3.34Å; E485-R489 PolarHBondContact O-N 3.24Å; E485-R489 IonicContact OE1-CZ 2.89Å; E485-R489 IonicContact OE1-NH1 2.68Å; E485-R489 IonicContact OE1-NH2 3.29Å; E485-R489 PolarHBondContact OE1-NH2 3.3Å
486	Q	91.3	Very high	90.1	Very high	127 Å²	127	50.6 Å²	50.6	59%	0.593	27%	0.27	S	S	*	.	H	α-helix	trans	-73.4	-42.3	179.2	-177.4	176.8	-19.3	0	0	111.1	D484 R489 L490	D484-Q486 VanDerWaalsContact C-N 3.3Å; D484-Q486 PolarHBondContact O-N 3.3Å; D484-Q486 WeakPolarHBondContact OD2-CA 3.2Å; D484-Q486 VanDerWaalsContact OD2-CB 3.23Å; D484-Q486 WeakPolarHBondContact OD2-CB 3.38Å; D484-Q486 PolarHBondContact OD2-N 3.33Å; Q486-R489 PolarHBondContact O-N 3.33Å; Q486-L490 HydrophobicContact CG-CD1 4.36Å; Q486-L490 WeakPolarHBondContact O-CG 3.49Å; Q486-L490 PolarHBondContact O-N 3.01Å
487	A	89.4	Confident	89.6	Confident	36 Å²	36	52.8 Å²	52.8	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-60.8	-44.9	175	0	0	0	0	0	112.3	I459 D484 L490 T491	I459-A487 HydrophobicContact CD1-CB 4.45Å; D484-A487 HydrophobicContact CB-CB 4.12Å; D484-A487 PolarHBondContact O-N 3.02Å; D484-A487 PolarHBondContact OD2-N 3.1Å; A487-L490 PolarHBondContact O-N 3.05Å; A487-T491 PolarHBondContact O-N 3.08Å; A487-T491 PolarHBondContact O-OG1 3.37Å
488	M	91.6	Very high	89.1	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.1	-46.6	174.9	-178.2	57.2	90.5	0	0	110.9	I459 A463 V474 L477 A478 T481 D484 L490 T491 L492	I459-M488 HydrophobicContact CG2-CE 3.91Å; I459-M488 HydrophobicContact CG2-SD 3.85Å; A463-M488 HydrophobicContact CB-CE 4.27Å; V474-M488 HydrophobicContact CG1-CG 4.32Å; L477-M488 HydrophobicContact CB-CE 3.81Å; L477-M488 HydrophobicContact CB-CG 4.12Å; L477-M488 HydrophobicContact CB-SD 4.19Å; L477-M488 WeakPolarHBondContact O-CE 2.95Å; A478-M488 HydrophobicContact CB-CB 4.05Å; A478-M488 HydrophobicContact CB-CG 4.26Å; T481-M488 HydrophobicContact CG2-CE 3.75Å; T481-M488 WeakPolarHBondContact OG1-CE 3.41Å; D484-M488 WeakPolarHBondContact O-CB 3.27Å; D484-M488 PolarHBondContact O-N 2.88Å; M488-L490 VanDerWaalsContact C-N 3.31Å; M488-L490 PolarHBondContact O-N 2.67Å; M488-T491 PolarHBondContact O-N 2.87Å; M488-L492 HydrophobicContact CG-CD1 3.8Å; M488-L492 HydrophobicContact CG-CG 4.26Å; M488-L492 VanDerWaalsContact O-CG 3.26Å; M488-L492 WeakPolarHBondContact O-CG 3.34Å; M488-L492 PolarHBondContact O-N 2.9Å; M488-L492 HydrophobicContact SD-CD1 3.88Å; M488-L492 HydrophobicContact SD-CD2 4.17Å; M488-L492 HydrophobicContact SD-CG 3.85Å
489	R	92	Very high	88.7	Confident	47 Å²	47	58 Å²	58	18%	0.177	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-43.5	178	-170.4	-178.4	-77	113.1	-0.2	112.3	V474 E485 Q486 R493 D507	V474-R489 HydrophobicContact CG1-CB 3.84Å; V474-R489 HydrophobicContact CG1-CG 4.43Å; E485-R489 WeakPolarHBondContact O-CB 3.34Å; E485-R489 PolarHBondContact O-N 3.24Å; E485-R489 IonicContact OE1-CZ 2.89Å; E485-R489 IonicContact OE1-NH1 2.68Å; E485-R489 IonicContact OE1-NH2 3.29Å; E485-R489 PolarHBondContact OE1-NH2 3.3Å; Q486-R489 PolarHBondContact O-N 3.33Å; R489-R493 VanDerWaalsContact O-CG 3.3Å; R489-R493 WeakPolarHBondContact O-CG 3.47Å; R489-R493 PolarHBondContact O-N 3.21Å; R489-D507 IonicContact CZ-OD1 2.87Å; R489-D507 IonicContact CZ-OD2 2.92Å; R489-D507 IonicContact NE-OD1 3.99Å; R489-D507 PolarHBondContact NE-OD1 2.89Å; R489-D507 IonicContact NE-OD2 2.67Å; R489-D507 IonicContact NH2-OD1 3.41Å; R489-D507 IonicContact NH2-OD2 3.85Å; R489-D507 PolarHBondContact NH2-OD2 2.8Å; R489-D507 VanDerWaalsContact NH2-OD2 3.08Å
490	L	87.5	Confident	88.3	Confident	75 Å²	75	53 Å²	53	39%	0.393	29%	0.293	S	S	.	.	H	α-helix	trans	-65.8	-46.8	179.5	-70.5	172.2	0	0	0	111.1	Q486 A487 M488 L492 R493 Q494	Q486-L490 HydrophobicContact CG-CD1 4.36Å; Q486-L490 WeakPolarHBondContact O-CG 3.49Å; Q486-L490 PolarHBondContact O-N 3.01Å; A487-L490 PolarHBondContact O-N 3.05Å; M488-L490 VanDerWaalsContact C-N 3.31Å; M488-L490 PolarHBondContact O-N 2.67Å; L490-L492 PolarHBondContact O-N 3.42Å; L490-R493 WeakPolarHBondContact O-CB 3.46Å; L490-R493 PolarHBondContact O-N 3.11Å; L490-R493 VanDerWaalsContact O-N 3.17Å; L490-Q494 WeakPolarHBondContact O-CG 3.22Å; L490-Q494 PolarHBondContact O-N 3.11Å
491	T	89.5	Confident	88.3	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.012	27%	0.271	C	S	.	.	H	α-helix	trans	-57.3	-46.7	176.6	-54	0	0	0	0	111.6	F452 Q456 I459 W460 A487 M488 R493 Q494 A495	F452-T491 HydrophobicContact CE1-CG2 4.38Å; Q456-T491 HydrophobicContact CB-CG2 4.05Å; Q456-T491 HydrophobicContact CG-CG2 4.39Å; Q456-T491 WeakPolarHBondContact O-CG2 3.26Å; I459-T491 HydrophobicContact CB-CG2 4.17Å; I459-T491 HydrophobicContact CG2-CG2 4.03Å; W460-T491 HydrophobicContact CB-CG2 4.28Å; A487-T491 PolarHBondContact O-N 3.08Å; A487-T491 PolarHBondContact O-OG1 3.37Å; M488-T491 PolarHBondContact O-N 2.87Å; T491-R493 VanDerWaalsContact C-N 3.34Å; T491-R493 PolarHBondContact O-N 2.7Å; T491-Q494 PolarHBondContact O-N 3Å; T491-A495 PolarHBondContact O-N 3.37Å
492	L	91	Very high	88.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.5	-31.8	179.2	-64.1	175.8	0	0	0	112.8	W460 F467 V474 L477 M488 L490 Q494 A495 A496 I501 Y509	W460-L492 HydrophobicContact CE3-CD2 4.28Å; W460-L492 HydrophobicContact CZ3-CD2 3.83Å; F467-L492 HydrophobicContact CE2-CD2 3.65Å; F467-L492 HydrophobicContact CZ-CD2 3.75Å; V474-L492 HydrophobicContact CG2-CD1 4.02Å; L477-L492 HydrophobicContact CD1-CD1 3.58Å; L477-L492 HydrophobicContact CD1-CD2 4.29Å; M488-L492 HydrophobicContact CG-CD1 3.8Å; M488-L492 HydrophobicContact CG-CG 4.26Å; M488-L492 VanDerWaalsContact O-CG 3.26Å; M488-L492 WeakPolarHBondContact O-CG 3.34Å; M488-L492 PolarHBondContact O-N 2.9Å; M488-L492 HydrophobicContact SD-CD1 3.88Å; M488-L492 HydrophobicContact SD-CD2 4.17Å; M488-L492 HydrophobicContact SD-CG 3.85Å; L490-L492 PolarHBondContact O-N 3.42Å; L492-Q494 VanDerWaalsContact C-N 3.35Å; L492-A495 PolarHBondContact O-N 3.47Å; L492-A496 WeakPolarHBondContact O-CB 3.47Å; L492-A496 PolarHBondContact O-N 2.77Å; L492-I501 HydrophobicContact CB-CD1 3.93Å; L492-I501 HydrophobicContact CD2-CD1 3.64Å; L492-I501 HydrophobicContact CG-CD1 4.35Å; L492-I501 WeakPolarHBondContact O-CD1 3.47Å; L492-Y509 HydrophobicContact CB-CD2 4.2Å; L492-Y509 HydrophobicContact CB-CE1 4.36Å; L492-Y509 HydrophobicContact CB-CE2 3.91Å; L492-Y509 HydrophobicContact CD1-CD2 4.03Å; L492-Y509 HydrophobicContact CD1-CE2 4.22Å
493	R	87.3	Confident	88.3	Confident	111 Å²	111	46.1 Å²	46.1	42%	0.419	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-40.1	171.4	-77.7	178.4	-179.4	-176.6	1.1	111.6	R489 L490 T491 A496 Q497 Y509	R489-R493 VanDerWaalsContact O-CG 3.3Å; R489-R493 WeakPolarHBondContact O-CG 3.47Å; R489-R493 PolarHBondContact O-N 3.21Å; L490-R493 WeakPolarHBondContact O-CB 3.46Å; L490-R493 PolarHBondContact O-N 3.11Å; L490-R493 VanDerWaalsContact O-N 3.17Å; T491-R493 VanDerWaalsContact C-N 3.34Å; T491-R493 PolarHBondContact O-N 2.7Å; R493-A496 WeakPolarHBondContact O-CB 3.25Å; R493-A496 PolarHBondContact O-N 3.43Å; R493-Q497 WeakPolarHBondContact O-CG 3.46Å; R493-Q497 PolarHBondContact O-N 3.46Å; R493-Y509 VanDerWaalsContact CG-OH 3.27Å; R493-Y509 WeakPolarHBondContact CG-OH 3.5Å
494	Q	83.9	Confident	88.2	Confident	16 Å²	16	45 Å²	45	8%	0.075	24%	0.24	C	C	.	.	H	α-helix	trans	-66.4	-43.4	175	-66.5	-55	-20.7	0	0	111.8	D401 F452 L490 T491 L492 A496 Q497 Q498	D401-Q494 HydrophobicContact CB-CG 4.49Å; D401-Q494 PolarHBondContact O-NE2 2.91Å; D401-Q494 PolarHBondContact O-OE1 2.9Å; F452-Q494 HydrophobicContact CD1-CB 4.09Å; F452-Q494 HydrophobicContact CE1-CB 3.84Å; L490-Q494 WeakPolarHBondContact O-CG 3.22Å; L490-Q494 PolarHBondContact O-N 3.11Å; T491-Q494 PolarHBondContact O-N 3Å; L492-Q494 VanDerWaalsContact C-N 3.35Å; Q494-A496 PolarHBondContact O-N 3.41Å; Q494-Q497 PolarHBondContact O-N 2.97Å; Q494-Q498 PolarHBondContact O-N 3.08Å
495	A	87.2	Confident	88	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.2	-35.8	173.3	0	0	0	0	0	111.9	F452 W460 T491 L492 G499 I500 I501	F452-A495 HydrophobicContact CE1-CB 4Å; F452-A495 HydrophobicContact CZ-CB 3.64Å; W460-A495 HydrophobicContact CD2-CB 4.31Å; W460-A495 HydrophobicContact CE3-CB 3.74Å; W460-A495 HydrophobicContact CH2-CB 4.09Å; W460-A495 HydrophobicContact CZ3-CB 3.6Å; T491-A495 PolarHBondContact O-N 3.37Å; L492-A495 PolarHBondContact O-N 3.47Å; A495-G499 PolarHBondContact O-N 2.68Å; A495-I500 WeakPolarHBondContact O-CB 2.97Å; A495-I500 PolarHBondContact O-N 3.29Å; A495-I501 HydrophobicContact CB-CD1 3.84Å; A495-I501 HydrophobicContact CB-CG1 3.84Å
496	A	87.2	Confident	87.8	Confident	31 Å²	31	46.4 Å²	46.4	26%	0.256	24%	0.243	S	C	.	.	H	α-helix	trans	-71.4	-36.6	174.6	0	0	0	0	0	113.4	L492 R493 Q494 Q498 G499 I501 Y509	L492-A496 WeakPolarHBondContact O-CB 3.47Å; L492-A496 PolarHBondContact O-N 2.77Å; R493-A496 WeakPolarHBondContact O-CB 3.25Å; R493-A496 PolarHBondContact O-N 3.43Å; Q494-A496 PolarHBondContact O-N 3.41Å; A496-Q498 VanDerWaalsContact C-N 3.33Å; A496-G499 PolarHBondContact O-N 3.04Å; A496-G499 VanDerWaalsContact O-N 3.12Å; A496-I501 WeakPolarHBondContact CA-O 3.37Å; A496-I501 HydrophobicContact CB-CG1 4.11Å; A496-I501 WeakPolarHBondContact CB-O 3.39Å; A496-Y509 HydrophobicContact CB-CD1 4.49Å; A496-Y509 HydrophobicContact CB-CE1 3.98Å
497	Q	81.2	Confident	87.7	Confident	107 Å²	107	41.6 Å²	41.6	50%	0.5	22%	0.222	S	C	.	.	H	α-helix	trans	-67.5	-33.3	174	-73.8	-172.7	-5.1	0	0	112.5	R493 Q494 G499	R493-Q497 WeakPolarHBondContact O-CG 3.46Å; R493-Q497 PolarHBondContact O-N 3.46Å; Q494-Q497 PolarHBondContact O-N 2.97Å; Q497-G499 PolarHBondContact O-N 2.67Å
498	Q	80.1	Confident	87.7	Confident	74 Å²	74	41.3 Å²	41.3	35%	0.346	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73	-7	171.8	-71.1	178.7	3.4	0	0	113.5	A450 F452 Q494 A496 I500	A450-Q498 PolarHBondContact O-NE2 3.19Å; F452-Q498 VanDerWaalsContact CE2-OE1 3.26Å; Q494-Q498 PolarHBondContact O-N 3.08Å; A496-Q498 VanDerWaalsContact C-N 3.33Å; Q498-I500 HydrophobicContact CB-CD1 4.2Å; Q498-I500 HydrophobicContact CB-CG1 4.12Å
499	G	83.2	Confident	87.7	Confident	44 Å²	44	41.7 Å²	41.7	45%	0.454	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.6	36.6	-178.7	0	0	0	0	0	113.1	A495 A496 Q497 N512	A495-G499 PolarHBondContact O-N 2.68Å; A496-G499 PolarHBondContact O-N 3.04Å; A496-G499 VanDerWaalsContact O-N 3.12Å; Q497-G499 PolarHBondContact O-N 2.67Å; G499-N512 PolarHBondContact O-ND2 3.13Å
500	I	85.3	Confident	87.6	Confident	57 Å²	57	39.8 Å²	39.8	29%	0.292	21%	0.207	S	C	.	.	S	Bend	trans	-94.7	-42.3	172.9	-52.6	172.4	0	0	0	110.7	F452 W460 A495 Q498	F452-I500 HydrophobicContact CE2-CD1 4.07Å; F452-I500 HydrophobicContact CZ-CD1 4.16Å; W460-I500 HydrophobicContact CH2-CG2 3.93Å; W460-I500 HydrophobicContact CZ2-CB 4.24Å; W460-I500 HydrophobicContact CZ2-CD1 4.37Å; W460-I500 HydrophobicContact CZ2-CG2 3.38Å; A495-I500 WeakPolarHBondContact O-CB 2.97Å; A495-I500 PolarHBondContact O-N 3.29Å; Q498-I500 HydrophobicContact CB-CD1 4.2Å; Q498-I500 HydrophobicContact CB-CG1 4.12Å
501	I	90.4	Very high	87.6	Confident	2 Å²	2	42 Å²	42	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	163.7	178.5	60	177.5	0	0	0	111.5	W460 F467 L492 A495 A496 Y509 Y510	W460-I501 HydrophobicContact CH2-CD1 4.38Å; W460-I501 HydrophobicContact CH2-CG2 3.68Å; W460-I501 HydrophobicContact CZ3-CD1 4.04Å; W460-I501 HydrophobicContact CZ3-CG2 4.36Å; F467-I501 HydrophobicContact CD2-CG2 4.44Å; F467-I501 HydrophobicContact CE1-CG2 4.46Å; F467-I501 HydrophobicContact CE2-CD1 4.33Å; F467-I501 HydrophobicContact CE2-CG2 4.38Å; F467-I501 HydrophobicContact CZ-CD1 4.03Å; F467-I501 HydrophobicContact CZ-CG2 4.38Å; L492-I501 HydrophobicContact CB-CD1 3.93Å; L492-I501 HydrophobicContact CD2-CD1 3.64Å; L492-I501 HydrophobicContact CG-CD1 4.35Å; L492-I501 WeakPolarHBondContact O-CD1 3.47Å; A495-I501 HydrophobicContact CB-CD1 3.84Å; A495-I501 HydrophobicContact CB-CG1 3.84Å; A496-I501 WeakPolarHBondContact CA-O 3.37Å; A496-I501 HydrophobicContact CB-CG1 4.11Å; A496-I501 WeakPolarHBondContact CB-O 3.39Å; I501-Y509 HydrophobicContact CB-CD1 4.47Å; I501-Y509 HydrophobicContact CD1-CD1 3.58Å; I501-Y509 HydrophobicContact CD1-CE1 4.21Å; I501-Y509 HydrophobicContact CD1-CG 3.88Å; I501-Y509 HydrophobicContact CG1-CD1 3.9Å; I501-Y510 CarbonylContact C-O 3.59Å; I501-Y510 WeakPolarHBondContact CA-O 3.16Å; I501-Y510 VanDerWaalsContact CB-O 3.3Å; I501-Y510 WeakPolarHBondContact CB-O 3.14Å
502	T	90.2	Very high	87.4	Confident	18 Å²	18	44.2 Å²	44.2	11%	0.11	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.9	-174.7	-78.4	0	0	0	0	110.9	I504 Y509 Y510 N512 I515 Y554	T502-I504 PolarHBondContact O-N 2.77Å; T502-Y509 WeakPolarHBondContact O-CA 3.32Å; T502-Y510 PolarHBondContact N-O 3.39Å; T502-Y510 PolarHBondContact O-N 2.92Å; T502-N512 WeakPolarHBondContact CB-OD1 3.44Å; T502-N512 PolarHBondContact OG1-OD1 2.96Å; T502-I515 HydrophobicContact CG2-CD1 3.82Å; T502-I515 HydrophobicContact CG2-CG1 3.95Å; T502-Y554 HydrophobicContact CG2-CE1 3.59Å; T502-Y554 HydrophobicContact CG2-CE2 3.73Å; T502-Y554 WeakPolarHBondContact CG2-OH 3.37Å
503	A	90.9	Very high	87.2	Confident	27 Å²	27	47.1 Å²	47.1	22%	0.223	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	100.5	173.8	0	0	0	0	0	111.4	V505 R508 Y509 R557	A503-V505 VanDerWaalsContact C-N 3.34Å; A503-R508 WeakPolarHBondContact CA-O 3.29Å; A503-Y509 HydrophobicContact CB-CD1 3.85Å; A503-Y509 HydrophobicContact CB-CE1 3.58Å; A503-R557 PolarHBondContact O-NH2 2.87Å
504	I	88.5	Confident	87.1	Confident	5 Å²	5	44.4 Å²	44.4	3%	0.026	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-40.4	173.7	52.9	156.9	0	0	0	111.4	T502 R508 Y510 I515 L547 Q550 I551 Y554	T502-I504 PolarHBondContact O-N 2.77Å; I504-R508 HydrophobicContact CD1-CG 4.21Å; I504-R508 HydrophobicContact CG1-CB 4.49Å; I504-R508 HydrophobicContact CG1-CG 4.12Å; I504-R508 PolarHBondContact N-O 3.4Å; I504-Y510 HydrophobicContact CD1-CD2 3.84Å; I504-Y510 HydrophobicContact CD1-CE2 3.58Å; I504-Y510 HydrophobicContact CG1-CD2 3.97Å; I504-Y510 HydrophobicContact CG1-CE2 4.24Å; I504-Y510 HydrophobicContact CG2-CD2 3.94Å; I504-I515 HydrophobicContact CG2-CD1 3.8Å; I504-L547 HydrophobicContact CD1-CD1 3.74Å; I504-Q550 HydrophobicContact CD1-CB 4.28Å; I504-I551 HydrophobicContact CD1-CG1 4.13Å; I504-Y554 HydrophobicContact CB-CG 4.27Å; I504-Y554 HydrophobicContact CG2-CD1 4.01Å; I504-Y554 HydrophobicContact CG2-CG 4.01Å
505	V	88.8	Confident	87.2	Confident	40 Å²	40	44.5 Å²	44.5	24%	0.242	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	161.8	172.7	67.1	0	0	0	0	108.6	A503 D507 R508	A503-V505 VanDerWaalsContact C-N 3.34Å; V505-D507 PolarHBondContact O-N 3.35Å; V505-R508 HydrophobicContact CG1-CB 3.57Å; V505-R508 HydrophobicContact CG1-CG 4.33Å; V505-R508 PolarHBondContact O-N 3.23Å
506	K	86.4	Confident	87.1	Confident	155 Å²	155	48.6 Å²	48.6	67%	0.674	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	128	178.2	-174.7	178.7	175.8	-177.7	0	110.6	R508	K506-R508 VanDerWaalsContact C-N 3.29Å; K506-R508 PolarHBondContact O-N 3.25Å
507	D	89.7	Confident	87.1	Confident	27 Å²	27	50.7 Å²	50.7	14%	0.144	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	12.5	179.5	-59.7	-23.9	0	0	0	116.4	W473 V474 R489 V505	W473-D507 VanDerWaalsContact CA-O 3.32Å; W473-D507 WeakPolarHBondContact CA-O 3.48Å; W473-D507 HydrophobicContact CE3-CB 4.35Å; V474-D507 HydrophobicContact CB-CB 4.13Å; V474-D507 HydrophobicContact CG2-CB 3.77Å; V474-D507 WeakPolarHBondContact CG2-O 3.49Å; V474-D507 PolarHBondContact N-O 3.35Å; R489-D507 IonicContact CZ-OD1 2.87Å; R489-D507 IonicContact CZ-OD2 2.92Å; R489-D507 IonicContact NE-OD1 3.99Å; R489-D507 PolarHBondContact NE-OD1 2.89Å; R489-D507 IonicContact NE-OD2 2.67Å; R489-D507 IonicContact NH2-OD1 3.41Å; R489-D507 IonicContact NH2-OD2 3.85Å; R489-D507 PolarHBondContact NH2-OD2 2.8Å; R489-D507 VanDerWaalsContact NH2-OD2 3.08Å; V505-D507 PolarHBondContact O-N 3.35Å
508	R	90	Very high	87.3	Confident	30 Å²	30	46 Å²	46	11%	0.113	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	116.3	174.9	-177.7	178.6	-74.4	-154.7	-31.4	110.7	P471 W473 A503 I504 V505 K506	P471-R508 HydrophobicContact CB-CG 4.18Å; W473-R508 HydrophobicContact CD2-CB 4.37Å; W473-R508 VanDerWaalsContact CE2-NE 3.34Å; W473-R508 HydrophobicContact CE3-CB 4Å; W473-R508 HydrophobicContact CZ3-CB 4.07Å; A503-R508 WeakPolarHBondContact CA-O 3.29Å; I504-R508 HydrophobicContact CD1-CG 4.21Å; I504-R508 HydrophobicContact CG1-CB 4.49Å; I504-R508 HydrophobicContact CG1-CG 4.12Å; I504-R508 PolarHBondContact N-O 3.4Å; V505-R508 HydrophobicContact CG1-CB 3.57Å; V505-R508 HydrophobicContact CG1-CG 4.33Å; V505-R508 PolarHBondContact O-N 3.23Å; K506-R508 VanDerWaalsContact C-N 3.29Å; K506-R508 PolarHBondContact O-N 3.25Å
509	Y	91.1	Very high	87.6	Confident	8 Å²	8	43 Å²	43	3%	0.031	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.9	-172.8	-69	-88.7	0	0	0	112.1	W472 V474 L492 R493 A496 I501 T502 A503	W472-Y509 PolarHBondContact N-O 3.07Å; W472-Y509 PolarHBondContact O-N 3.07Å; W472-Y509 VanDerWaalsContact O-N 3.07Å; V474-Y509 HydrophobicContact CG2-CD2 3.94Å; V474-Y509 HydrophobicContact CG2-CE2 3.56Å; L492-Y509 HydrophobicContact CB-CD2 4.2Å; L492-Y509 HydrophobicContact CB-CE1 4.36Å; L492-Y509 HydrophobicContact CB-CE2 3.91Å; L492-Y509 HydrophobicContact CD1-CD2 4.03Å; L492-Y509 HydrophobicContact CD1-CE2 4.22Å; R493-Y509 VanDerWaalsContact CG-OH 3.27Å; R493-Y509 WeakPolarHBondContact CG-OH 3.5Å; A496-Y509 HydrophobicContact CB-CD1 4.49Å; A496-Y509 HydrophobicContact CB-CE1 3.98Å; I501-Y509 HydrophobicContact CB-CD1 4.47Å; I501-Y509 HydrophobicContact CD1-CD1 3.58Å; I501-Y509 HydrophobicContact CD1-CE1 4.21Å; I501-Y509 HydrophobicContact CD1-CG 3.88Å; I501-Y509 HydrophobicContact CG1-CD1 3.9Å; T502-Y509 WeakPolarHBondContact O-CA 3.32Å; A503-Y509 HydrophobicContact CB-CD1 3.85Å; A503-Y509 HydrophobicContact CB-CE1 3.58Å
510	Y	89.3	Confident	87.7	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	157.1	173	-90.8	-64.3	0	0	0	111.1	P471 I501 T502 I504 R514 I515 F518 L547	P471-Y510 HydrophobicContact CB-CD1 3.85Å; P471-Y510 HydrophobicContact CB-CD2 4.15Å; P471-Y510 HydrophobicContact CB-CE1 3.4Å; P471-Y510 VanDerWaalsContact CB-CE1 3.4Å; P471-Y510 HydrophobicContact CB-CE2 3.74Å; P471-Y510 HydrophobicContact CB-CG 4.21Å; P471-Y510 WeakPolarHBondContact CD-OH 3.49Å; P471-Y510 HydrophobicContact CG-CE1 3.68Å; P471-Y510 HydrophobicContact CG-CE2 4.17Å; P471-Y510 VanDerWaalsContact CG-CZ 3.43Å; P471-Y510 WeakPolarHBondContact CG-OH 3.25Å; I501-Y510 CarbonylContact C-O 3.59Å; I501-Y510 WeakPolarHBondContact CA-O 3.16Å; I501-Y510 VanDerWaalsContact CB-O 3.3Å; I501-Y510 WeakPolarHBondContact CB-O 3.14Å; T502-Y510 PolarHBondContact N-O 3.39Å; T502-Y510 PolarHBondContact O-N 2.92Å; I504-Y510 HydrophobicContact CD1-CD2 3.84Å; I504-Y510 HydrophobicContact CD1-CE2 3.58Å; I504-Y510 HydrophobicContact CG1-CD2 3.97Å; I504-Y510 HydrophobicContact CG1-CE2 4.24Å; I504-Y510 HydrophobicContact CG2-CD2 3.94Å; Y510-R514 HydrophobicContact CD1-CB 4.36Å; Y510-I515 HydrophobicContact CD2-CD1 4.5Å; Y510-F518 HydrophobicContact CD1-CE2 4.47Å; Y510-F518 HydrophobicContact CD2-CE2 4.07Å; Y510-F518 HydrophobicContact CE1-CE2 4.24Å; Y510-F518 HydrophobicContact CE1-CZ 4.08Å; Y510-F518 AromaticContact CE2-CE2 3.81Å; Y510-F518 HydrophobicContact CE2-CE2 3.81Å; Y510-F518 HydrophobicContact CE2-CZ 4.26Å; Y510-F518 HydrophobicContact CG-CE2 4.38Å; Y510-F518 AromaticContact CZ-CE2 3.9Å; Y510-F518 AromaticContact CZ-CZ 3.86Å; Y510-L547 HydrophobicContact CE2-CD1 3.99Å; Y510-L547 WeakPolarHBondContact OH-CD2 3.24Å
511	R	89.1	Confident	87.6	Confident	121 Å²	121	43.4 Å²	43.4	46%	0.457	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	149.6	166.6	-161.7	174.1	96.8	148.1	5.8	110.4	D513 R514 I515	R511-D513 VanDerWaalsContact C-N 3.34Å; R511-D513 WeakPolarHBondContact CB-OD1 3.48Å; R511-D513 WeakPolarHBondContact CG-OD1 3.31Å; R511-D513 IonicContact CZ-OD1 3.99Å; R511-D513 IonicContact CZ-OD2 3.15Å; R511-D513 IonicContact NE-OD1 3.16Å; R511-D513 PolarHBondContact NE-OD1 3.22Å; R511-D513 IonicContact NE-OD2 3.66Å; R511-D513 PolarHBondContact NE-OD2 3.49Å; R511-D513 IonicContact NH2-OD1 2.63Å; R511-D513 IonicContact NH2-OD2 2.62Å; R511-D513 PolarHBondContact NH2-OD2 3.18Å; R511-D513 PolarHBondContact O-N 3.41Å; R511-R514 PolarHBondContact O-N 3.48Å; R511-I515 PolarHBondContact O-N 2.93Å
512	N	85.3	Confident	87.3	Confident	49 Å²	49	43.3 Å²	43.3	26%	0.262	21%	0.214	S	C	.	.	H	α-helix	trans	-69.1	-27.6	-171.8	-76.5	-14.6	0	0	0	114.6	G499 T502 R514 I515 V516	G499-N512 PolarHBondContact O-ND2 3.13Å; T502-N512 WeakPolarHBondContact CB-OD1 3.44Å; T502-N512 PolarHBondContact OG1-OD1 2.96Å; N512-R514 VanDerWaalsContact C-N 3.32Å; N512-R514 PolarHBondContact O-N 2.77Å; N512-I515 WeakPolarHBondContact O-CB 3.09Å; N512-I515 PolarHBondContact O-N 3.07Å; N512-V516 PolarHBondContact O-N 3.01Å; N512-V516 VanDerWaalsContact O-N 3.08Å
513	D	85.4	Confident	87	Confident	60 Å²	60	44.7 Å²	44.7	32%	0.321	22%	0.217	S	C	.	.	H	α-helix	trans	-59.4	-41.8	173.1	61.3	-31.5	0	0	0	112.3	R511 I515 V516 E517	R511-D513 VanDerWaalsContact C-N 3.34Å; R511-D513 WeakPolarHBondContact CB-OD1 3.48Å; R511-D513 WeakPolarHBondContact CG-OD1 3.31Å; R511-D513 IonicContact CZ-OD1 3.99Å; R511-D513 IonicContact CZ-OD2 3.15Å; R511-D513 IonicContact NE-OD1 3.16Å; R511-D513 PolarHBondContact NE-OD1 3.22Å; R511-D513 IonicContact NE-OD2 3.66Å; R511-D513 PolarHBondContact NE-OD2 3.49Å; R511-D513 IonicContact NH2-OD1 2.63Å; R511-D513 IonicContact NH2-OD2 2.62Å; R511-D513 PolarHBondContact NH2-OD2 3.18Å; R511-D513 PolarHBondContact O-N 3.41Å; D513-I515 VanDerWaalsContact C-N 3.32Å; D513-I515 PolarHBondContact O-N 2.85Å; D513-V516 PolarHBondContact O-N 3.48Å; D513-E517 PolarHBondContact O-N 3.21Å
514	R	85.8	Confident	86.7	Confident	54 Å²	54	46.4 Å²	46.4	20%	0.204	22%	0.223	C	C	.	.	H	α-helix	trans	-66.7	-34.1	175.5	-67.7	-64	177.4	176.8	-6.9	112.3	D469 Y510 R511 N512 V516 E517 F518	D469-R514 IonicContact OD1-CZ 3.05Å; D469-R514 VanDerWaalsContact OD1-CZ 3.29Å; D469-R514 IonicContact OD1-NE 3.02Å; D469-R514 PolarHBondContact OD1-NE 2.9Å; D469-R514 VanDerWaalsContact OD1-NE 3.15Å; D469-R514 IonicContact OD1-NH2 3.09Å; D469-R514 PolarHBondContact OD1-NH2 3.04Å; D469-R514 IonicContact OD2-CZ 3.37Å; D469-R514 IonicContact OD2-NH2 3.38Å; D469-R514 PolarHBondContact OD2-NH2 2.96Å; Y510-R514 HydrophobicContact CD1-CB 4.36Å; R511-R514 PolarHBondContact O-N 3.48Å; N512-R514 VanDerWaalsContact C-N 3.32Å; N512-R514 PolarHBondContact O-N 2.77Å; R514-V516 VanDerWaalsContact C-N 3.34Å; R514-V516 PolarHBondContact O-N 3.49Å; R514-E517 VanDerWaalsContact CD-OE2 3.24Å; R514-E517 WeakPolarHBondContact CD-OE2 3.3Å; R514-E517 IonicContact CZ-OE2 3.09Å; R514-E517 IonicContact NE-OE2 3.52Å; R514-E517 IonicContact NH1-OE1 3.99Å; R514-E517 PolarHBondContact NH1-OE1 3.48Å; R514-E517 IonicContact NH1-OE2 3.9Å; R514-E517 PolarHBondContact NH1-OE2 3.02Å; R514-E517 WeakPolarHBondContact O-CB 3.29Å; R514-E517 PolarHBondContact O-N 3.43Å; R514-F518 HydrophobicContact CB-CE2 4.35Å; R514-F518 HydrophobicContact CB-CZ 4.21Å; R514-F518 WeakPolarHBondContact O-CD1 3.39Å; R514-F518 VanDerWaalsContact O-CD2 3.3Å; R514-F518 WeakPolarHBondContact O-CD2 3.38Å; R514-F518 WeakPolarHBondContact O-CG 3.44Å; R514-F518 PolarHBondContact O-N 2.71Å
515	I	86.5	Confident	86.4	Confident	18 Å²	18	46.3 Å²	46.3	9%	0.092	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-39.2	174.4	-59.9	-68.8	0	0	0	111.1	T502 I504 Y510 R511 N512 D513 F518 A519 Y554 F555	T502-I515 HydrophobicContact CG2-CD1 3.82Å; T502-I515 HydrophobicContact CG2-CG1 3.95Å; I504-I515 HydrophobicContact CG2-CD1 3.8Å; Y510-I515 HydrophobicContact CD2-CD1 4.5Å; R511-I515 PolarHBondContact O-N 2.93Å; N512-I515 WeakPolarHBondContact O-CB 3.09Å; N512-I515 PolarHBondContact O-N 3.07Å; D513-I515 VanDerWaalsContact C-N 3.32Å; D513-I515 PolarHBondContact O-N 2.85Å; I515-F518 HydrophobicContact CD1-CD2 4.2Å; I515-F518 HydrophobicContact CD1-CE2 4.48Å; I515-F518 PolarHBondContact O-N 3.19Å; I515-A519 PolarHBondContact O-N 3.3Å; I515-Y554 HydrophobicContact CD1-CE1 4.32Å; I515-Y554 HydrophobicContact CG2-CE1 4.27Å; I515-F555 HydrophobicContact CG2-CE1 3.93Å; I515-F555 HydrophobicContact CG2-CZ 3.99Å
516	V	85.4	Confident	86.1	Confident	86 Å²	86	46.5 Å²	46.5	52%	0.521	22%	0.222	S	C	.	.	H	α-helix	trans	-65	-42.1	174.5	175.3	0	0	0	0	110.9	N512 D513 R514 F518 A519 N520	N512-V516 PolarHBondContact O-N 3.01Å; N512-V516 VanDerWaalsContact O-N 3.08Å; D513-V516 PolarHBondContact O-N 3.48Å; R514-V516 VanDerWaalsContact C-N 3.34Å; R514-V516 PolarHBondContact O-N 3.49Å; V516-F518 PolarHBondContact O-N 3.46Å; V516-A519 WeakPolarHBondContact O-CB 3.49Å; V516-A519 PolarHBondContact O-N 3.31Å; V516-N520 PolarHBondContact O-N 2.87Å; V516-N520 PolarHBondContact O-OD1 2.95Å
517	E	85.8	Confident	85.9	Confident	75 Å²	75	45.5 Å²	45.5	35%	0.35	22%	0.219	S	C	.	.	H	α-helix	trans	-61.9	-43.2	176	-158.8	-172.4	170.2	0	0	111.9	D513 R514 A519 N520 M521	D513-E517 PolarHBondContact O-N 3.21Å; R514-E517 VanDerWaalsContact CD-OE2 3.24Å; R514-E517 WeakPolarHBondContact CD-OE2 3.3Å; R514-E517 IonicContact CZ-OE2 3.09Å; R514-E517 IonicContact NE-OE2 3.52Å; R514-E517 IonicContact NH1-OE1 3.99Å; R514-E517 PolarHBondContact NH1-OE1 3.48Å; R514-E517 IonicContact NH1-OE2 3.9Å; R514-E517 PolarHBondContact NH1-OE2 3.02Å; R514-E517 WeakPolarHBondContact O-CB 3.29Å; R514-E517 PolarHBondContact O-N 3.43Å; E517-A519 VanDerWaalsContact C-N 3.3Å; E517-A519 PolarHBondContact O-N 3.31Å; E517-N520 WeakPolarHBondContact O-CB 3.29Å; E517-N520 PolarHBondContact O-N 3.23Å; E517-M521 HydrophobicContact CB-CE 4.44Å; E517-M521 HydrophobicContact CG-CE 3.62Å; E517-M521 WeakPolarHBondContact O-CG 3.09Å; E517-M521 PolarHBondContact O-N 3.46Å
518	F	85.6	Confident	85.5	Confident	10 Å²	10	50.3 Å²	50.3	4%	0.044	24%	0.241	C	C	.	.	H	α-helix	trans	-61.9	-39	174.2	-59.9	-22.5	0	0	0	112	Y510 R514 I515 V516 M521 I522 F537 L541 I551 F555	Y510-F518 HydrophobicContact CD1-CE2 4.47Å; Y510-F518 HydrophobicContact CD2-CE2 4.07Å; Y510-F518 HydrophobicContact CE1-CE2 4.24Å; Y510-F518 HydrophobicContact CE1-CZ 4.08Å; Y510-F518 AromaticContact CE2-CE2 3.81Å; Y510-F518 HydrophobicContact CE2-CE2 3.81Å; Y510-F518 HydrophobicContact CE2-CZ 4.26Å; Y510-F518 HydrophobicContact CG-CE2 4.38Å; Y510-F518 AromaticContact CZ-CE2 3.9Å; Y510-F518 AromaticContact CZ-CZ 3.86Å; R514-F518 HydrophobicContact CB-CE2 4.35Å; R514-F518 HydrophobicContact CB-CZ 4.21Å; R514-F518 WeakPolarHBondContact O-CD1 3.39Å; R514-F518 VanDerWaalsContact O-CD2 3.3Å; R514-F518 WeakPolarHBondContact O-CD2 3.38Å; R514-F518 WeakPolarHBondContact O-CG 3.44Å; R514-F518 PolarHBondContact O-N 2.71Å; I515-F518 HydrophobicContact CD1-CD2 4.2Å; I515-F518 HydrophobicContact CD1-CE2 4.48Å; I515-F518 PolarHBondContact O-N 3.19Å; V516-F518 PolarHBondContact O-N 3.46Å; F518-M521 HydrophobicContact CD1-CE 4.41Å; F518-M521 PolarHBondContact O-N 3.5Å; F518-I522 WeakPolarHBondContact O-CG1 3.41Å; F518-I522 PolarHBondContact O-N 3.42Å; F518-I522 VanDerWaalsContact O-N 3.11Å; F518-F537 HydrophobicContact CB-CZ 4.47Å; F518-L541 HydrophobicContact CD1-CD1 4.5Å; F518-L541 HydrophobicContact CD1-CD2 3.58Å; F518-L541 HydrophobicContact CE1-CD2 3.61Å; F518-I551 HydrophobicContact CB-CG2 4.2Å; F518-I551 HydrophobicContact CD2-CD1 3.78Å; F518-I551 HydrophobicContact CD2-CG1 4.21Å; F518-I551 HydrophobicContact CD2-CG2 4.08Å; F518-I551 HydrophobicContact CE1-CD1 4.49Å; F518-I551 HydrophobicContact CE2-CD1 3.65Å; F518-I551 HydrophobicContact CE2-CG1 4.27Å; F518-I551 HydrophobicContact CG-CD1 4.29Å; F518-I551 HydrophobicContact CG-CG2 4.36Å; F518-I551 HydrophobicContact CZ-CD1 4.03Å; F518-F555 HydrophobicContact CB-CE2 3.96Å; F518-F555 HydrophobicContact CB-CZ 4.1Å
519	A	85.9	Confident	84.9	Confident	9 Å²	9	52.2 Å²	52.2	7%	0.074	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-40.1	175.2	0	0	0	0	0	111.7	I515 V516 E517 I522 R523 F555 F560	I515-A519 PolarHBondContact O-N 3.3Å; V516-A519 WeakPolarHBondContact O-CB 3.49Å; V516-A519 PolarHBondContact O-N 3.31Å; E517-A519 VanDerWaalsContact C-N 3.3Å; E517-A519 PolarHBondContact O-N 3.31Å; A519-I522 PolarHBondContact O-N 3.45Å; A519-R523 WeakPolarHBondContact O-CG 3.38Å; A519-R523 PolarHBondContact O-N 3.5Å; A519-R523 VanDerWaalsContact O-N 3.07Å; A519-R523 PolarHBondContact O-NH1 3.28Å; A519-F555 HydrophobicContact CB-CZ 4.23Å; A519-F560 HydrophobicContact CB-CE1 4.02Å; A519-F560 HydrophobicContact CB-CE2 4.41Å; A519-F560 HydrophobicContact CB-CZ 3.77Å
520	N	85.4	Confident	84.1	Confident	77 Å²	77	54.4 Å²	54.4	41%	0.412	28%	0.283	S	S	.	.	H	α-helix	trans	-62.1	-45.3	175.5	-68.4	-10	0	0	0	111.4	V516 E517 I522 R523 D524	V516-N520 PolarHBondContact O-N 2.87Å; V516-N520 PolarHBondContact O-OD1 2.95Å; E517-N520 WeakPolarHBondContact O-CB 3.29Å; E517-N520 PolarHBondContact O-N 3.23Å; N520-I522 VanDerWaalsContact C-N 3.29Å; N520-I522 PolarHBondContact O-N 2.9Å; N520-R523 WeakPolarHBondContact O-CB 3.49Å; N520-R523 PolarHBondContact O-N 3.22Å; N520-R523 PolarHBondContact OD1-NH1 3.16Å; N520-D524 PolarHBondContact O-N 3.04Å
521	M	84.6	Confident	83.4	Confident	33 Å²	33	55.1 Å²	55.1	16%	0.163	29%	0.289	C	S	.	.	H	α-helix	trans	-62.2	-35	177.1	-65.4	-175.5	-140.3	0	0	113.1	E517 F518 D524 L525 F537 L541	E517-M521 HydrophobicContact CB-CE 4.44Å; E517-M521 HydrophobicContact CG-CE 3.62Å; E517-M521 WeakPolarHBondContact O-CG 3.09Å; E517-M521 PolarHBondContact O-N 3.46Å; F518-M521 HydrophobicContact CD1-CE 4.41Å; F518-M521 PolarHBondContact O-N 3.5Å; M521-D524 PolarHBondContact O-N 2.89Å; M521-L525 WeakPolarHBondContact O-CG 3.38Å; M521-L525 PolarHBondContact O-N 3.15Å; M521-L525 VanDerWaalsContact O-N 3.09Å; M521-F537 HydrophobicContact CB-CE2 4.3Å; M521-L541 HydrophobicContact CE-CD2 3.53Å; M521-L541 HydrophobicContact SD-CD2 3.26Å; M521-L541 WeakPolarHBondContact SD-CD2 3.41Å; M521-L541 HydrophobicContact SD-CG 3.64Å
522	I	84.2	Confident	82.9	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-39	174	-68.1	169.4	0	0	0	110.7	F518 A519 N520 L525 D526 F537 L552 F555 F560 T561	F518-I522 WeakPolarHBondContact O-CG1 3.41Å; F518-I522 PolarHBondContact O-N 3.42Å; F518-I522 VanDerWaalsContact O-N 3.11Å; A519-I522 PolarHBondContact O-N 3.45Å; N520-I522 VanDerWaalsContact C-N 3.29Å; N520-I522 PolarHBondContact O-N 2.9Å; I522-L525 PolarHBondContact O-N 3Å; I522-D526 PolarHBondContact O-N 3.42Å; I522-F537 HydrophobicContact CD1-CE2 4.1Å; I522-F537 HydrophobicContact CD1-CZ 4.15Å; I522-F537 HydrophobicContact CG1-CD2 3.97Å; I522-F537 HydrophobicContact CG1-CE2 3.49Å; I522-F537 VanDerWaalsContact CG1-CE2 3.49Å; I522-F537 HydrophobicContact CG1-CZ 4.05Å; I522-L552 HydrophobicContact CD1-CD2 4.06Å; I522-L552 HydrophobicContact CG1-CD2 4.47Å; I522-F555 HydrophobicContact CD1-CD2 3.27Å; I522-F555 HydrophobicContact CD1-CE2 3.43Å; I522-F555 VanDerWaalsContact CD1-CE2 3.43Å; I522-F555 HydrophobicContact CD1-CG 4.24Å; I522-F560 HydrophobicContact CB-CE1 4.22Å; I522-F560 HydrophobicContact CD1-CE1 4.28Å; I522-F560 HydrophobicContact CG2-CE1 4.02Å; I522-T561 HydrophobicContact CG2-CG2 3.93Å
523	R	83.1	Confident	82.7	Confident	47 Å²	47	48.4 Å²	48.4	18%	0.177	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-42.1	175.6	-67.9	-178.9	-168	98.3	-4.5	111.5	A519 N520 L525 D526 Q527 F560 L570	A519-R523 WeakPolarHBondContact O-CG 3.38Å; A519-R523 PolarHBondContact O-N 3.5Å; A519-R523 VanDerWaalsContact O-N 3.07Å; A519-R523 PolarHBondContact O-NH1 3.28Å; N520-R523 WeakPolarHBondContact O-CB 3.49Å; N520-R523 PolarHBondContact O-N 3.22Å; N520-R523 PolarHBondContact OD1-NH1 3.16Å; R523-L525 VanDerWaalsContact C-N 3.35Å; R523-L525 PolarHBondContact O-N 2.99Å; R523-D526 PolarHBondContact O-N 3.48Å; R523-Q527 WeakPolarHBondContact O-CG 3.2Å; R523-Q527 PolarHBondContact O-N 2.83Å; R523-Q527 VanDerWaalsContact O-N 3.1Å; R523-F560 HydrophobicContact CG-CZ 4.48Å; R523-L570 HydrophobicContact CG-CD2 4.42Å
524	D	84.6	Confident	82.5	Confident	63 Å²	63	46.8 Å²	46.8	34%	0.337	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-41.9	177.5	-64	-15.9	0	0	0	111.4	N520 M521 Q527 E528	N520-D524 PolarHBondContact O-N 3.04Å; M521-D524 PolarHBondContact O-N 2.89Å; D524-Q527 PolarHBondContact O-N 3.06Å; D524-E528 WeakPolarHBondContact O-CB 2.99Å; D524-E528 WeakPolarHBondContact O-CG 3.41Å; D524-E528 PolarHBondContact O-N 2.68Å
525	L	83.2	Confident	82.2	Confident	3 Å²	3	46.3 Å²	46.3	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-66	-37.7	177.1	-75.2	170.3	0	0	0	113	M521 I522 R523 Q527 E528 C529 T532 D536 F537 R540	M521-L525 WeakPolarHBondContact O-CG 3.38Å; M521-L525 PolarHBondContact O-N 3.15Å; M521-L525 VanDerWaalsContact O-N 3.09Å; I522-L525 PolarHBondContact O-N 3Å; R523-L525 VanDerWaalsContact C-N 3.35Å; R523-L525 PolarHBondContact O-N 2.99Å; L525-Q527 VanDerWaalsContact C-N 3.28Å; L525-Q527 PolarHBondContact O-N 3.04Å; L525-E528 PolarHBondContact O-N 3.07Å; L525-C529 WeakPolarHBondContact O-CB 3.39Å; L525-C529 PolarHBondContact O-N 3.31Å; L525-T532 HydrophobicContact CD1-CG2 3.98Å; L525-D536 HydrophobicContact CD2-CB 3.79Å; L525-F537 HydrophobicContact CD1-CB 3.9Å; L525-F537 HydrophobicContact CD1-CD2 3.76Å; L525-F537 HydrophobicContact CD1-CG 4.34Å; L525-R540 HydrophobicContact CD2-CG 3.94Å; L525-R540 HydrophobicContact CG-CG 4.46Å
526	D	82.7	Confident	81.9	Confident	43 Å²	43	48.2 Å²	48.2	23%	0.23	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-34.8	174.5	-160.8	54	0	0	0	111.4	I522 R523 G530	I522-D526 PolarHBondContact O-N 3.42Å; R523-D526 PolarHBondContact O-N 3.48Å; D526-G530 WeakPolarHBondContact O-CA 3.22Å; D526-G530 PolarHBondContact O-N 3.32Å
527	Q	80.7	Confident	81.7	Confident	134 Å²	134	44.1 Å²	44.1	63%	0.626	25%	0.252	S	S	*	.	H	α-helix	trans	-74.4	-40.4	176.1	-67.7	164.7	27.3	0	0	113.1	R523 D524 L525	R523-Q527 WeakPolarHBondContact O-CG 3.2Å; R523-Q527 PolarHBondContact O-N 2.83Å; R523-Q527 VanDerWaalsContact O-N 3.1Å; D524-Q527 PolarHBondContact O-N 3.06Å; L525-Q527 VanDerWaalsContact C-N 3.28Å; L525-Q527 PolarHBondContact O-N 3.04Å
528	E	81.4	Confident	81.6	Confident	128 Å²	128	44.8 Å²	44.8	60%	0.598	25%	0.252	S	S	*	.	H	α-helix	trans	-77.6	-41.8	-178.2	-72.9	179.1	174.8	0	0	112.7	D524 L525 R540	D524-E528 WeakPolarHBondContact O-CB 2.99Å; D524-E528 WeakPolarHBondContact O-CG 3.41Å; D524-E528 PolarHBondContact O-N 2.68Å; L525-E528 PolarHBondContact O-N 3.07Å; E528-R540 IonicContact OE1-NH2 3.25Å; E528-R540 PolarHBondContact OE1-NH2 3.38Å; E528-R540 VanDerWaalsContact OE1-NH2 3.09Å; E528-R540 IonicContact OE2-NE 3.59Å; E528-R540 IonicContact OE2-NH2 3.48Å
529	C	77.8	Confident	81.5	Confident	71 Å²	71	49.1 Å²	49.1	48%	0.48	28%	0.275	S	S	.	.	H	α-helix	trans	-111.1	-12.9	-171.6	-64.6	0	0	0	0	113.9	L525 S531	L525-C529 WeakPolarHBondContact O-CB 3.39Å; L525-C529 PolarHBondContact O-N 3.31Å; C529-S531 WeakPolarHBondContact CB-O 3.5Å; C529-S531 PolarHBondContact O-N 3.11Å
530	G	74.9	Confident	81.2	Confident	54 Å²	54	55 Å²	55	56%	0.557	30%	0.295	S	S	*	.	S	Bend	trans	73.4	-1.2	-173	0	0	0	0	0	114.3	D526	D526-G530 WeakPolarHBondContact O-CA 3.22Å; D526-G530 PolarHBondContact O-N 3.32Å
531	S	73.6	Confident	80.9	Confident	21 Å²	21	52.6 Å²	52.6	15%	0.147	28%	0.283	C	S	.	.	S	Bend	trans	-162.3	158.8	173.4	79.1	0	0	0	0	110.3	C529	C529-S531 WeakPolarHBondContact CB-O 3.5Å; C529-S531 PolarHBondContact O-N 3.11Å
532	T	78.9	Confident	80.6	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.006	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.8	172.6	-60.3	0	0	0	0	110.3	L525 F537 L552 H568	L525-T532 HydrophobicContact CD1-CG2 3.98Å; T532-F537 HydrophobicContact CG2-CB 4.05Å; T532-F537 HydrophobicContact CG2-CG 4.47Å; T532-L552 HydrophobicContact CG2-CD2 4.01Å; T532-H568 PolarHBondContact N-O 3.09Å; T532-H568 PolarHBondContact O-N 3.25Å
533	C	81.8	Confident	80.2	Confident	28 Å²	28	56.1 Å²	56.1	19%	0.189	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	154.1	167.7	91.8	0	0	0	0	111	A535 D536 F537	C533-A535 PolarHBondContact O-N 3.42Å; C533-A535 VanDerWaalsContact O-N 3.17Å; C533-D536 PolarHBondContact O-N 3.02Å; C533-D536 PolarHBondContact SG-N 3.19Å; C533-D536 VanDerWaalsContact SG-N 3.38Å; C533-D536 PolarHBondContact SG-OD2 2.78Å; C533-F537 PolarHBondContact O-N 3.23Å; C533-F537 VanDerWaalsContact O-N 3.12Å
534	A	79.7	Confident	80	Confident	27 Å²	27	56.4 Å²	56.4	22%	0.223	34%	0.337	C	S	.	.	H	α-helix	trans	-65	-20.1	-178.1	0	0	0	0	0	113.8	R538 I549 L552	A534-R538 VanDerWaalsContact O-CB 3.27Å; A534-R538 WeakPolarHBondContact O-CB 3.34Å; A534-R538 PolarHBondContact O-N 3.29Å; A534-I549 HydrophobicContact CB-CG1 4.25Å; A534-L552 HydrophobicContact CB-CD1 4.2Å
535	A	80.3	Confident	79.9	Confident	43 Å²	43	61.6 Å²	61.6	36%	0.355	35%	0.352	S	S	.	.	H	α-helix	trans	-76.7	-48.2	176.9	0	0	0	0	0	111.1	C533 F537 R538 D539	C533-A535 PolarHBondContact O-N 3.42Å; C533-A535 VanDerWaalsContact O-N 3.17Å; A535-F537 VanDerWaalsContact C-N 3.35Å; A535-F537 PolarHBondContact O-N 2.64Å; A535-R538 WeakPolarHBondContact O-CB 3.28Å; A535-R538 PolarHBondContact O-N 3.35Å; A535-D539 PolarHBondContact O-N 2.93Å
536	D	79.8	Confident	80.1	Confident	58 Å²	58	68.2 Å²	68.2	31%	0.31	38%	0.381	S	S	.	.	H	α-helix	trans	-66.2	-40.1	-179.8	-55.8	-27.4	0	0	0	111.3	L525 C533 R538 D539 R540	L525-D536 HydrophobicContact CD2-CB 3.79Å; C533-D536 PolarHBondContact O-N 3.02Å; C533-D536 PolarHBondContact SG-N 3.19Å; C533-D536 VanDerWaalsContact SG-N 3.38Å; C533-D536 PolarHBondContact SG-OD2 2.78Å; D536-R538 VanDerWaalsContact C-N 3.31Å; D536-R538 PolarHBondContact O-N 3.42Å; D536-D539 PolarHBondContact O-N 2.98Å; D536-R540 PolarHBondContact O-N 3.44Å
537	F	82.1	Confident	80.1	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-62.9	-39	175.4	-171.2	-120.1	0	0	0	112.4	F518 M521 I522 L525 T532 C533 A535 L541 A548 I551 L552	F518-F537 HydrophobicContact CB-CZ 4.47Å; M521-F537 HydrophobicContact CB-CE2 4.3Å; I522-F537 HydrophobicContact CD1-CE2 4.1Å; I522-F537 HydrophobicContact CD1-CZ 4.15Å; I522-F537 HydrophobicContact CG1-CD2 3.97Å; I522-F537 HydrophobicContact CG1-CE2 3.49Å; I522-F537 VanDerWaalsContact CG1-CE2 3.49Å; I522-F537 HydrophobicContact CG1-CZ 4.05Å; L525-F537 HydrophobicContact CD1-CB 3.9Å; L525-F537 HydrophobicContact CD1-CD2 3.76Å; L525-F537 HydrophobicContact CD1-CG 4.34Å; T532-F537 HydrophobicContact CG2-CB 4.05Å; T532-F537 HydrophobicContact CG2-CG 4.47Å; C533-F537 PolarHBondContact O-N 3.23Å; C533-F537 VanDerWaalsContact O-N 3.12Å; A535-F537 VanDerWaalsContact C-N 3.35Å; A535-F537 PolarHBondContact O-N 2.64Å; F537-L541 HydrophobicContact CD1-CD1 3.79Å; F537-L541 HydrophobicContact CD2-CD1 4.02Å; F537-L541 HydrophobicContact CE1-CD1 3.28Å; F537-L541 HydrophobicContact CE2-CD1 3.54Å; F537-L541 HydrophobicContact CE2-CG 4.18Å; F537-L541 HydrophobicContact CG-CD1 4.14Å; F537-L541 HydrophobicContact CZ-CD1 3.17Å; F537-L541 HydrophobicContact CZ-CG 4.24Å; F537-L541 WeakPolarHBondContact O-CB 3.31Å; F537-L541 PolarHBondContact O-N 3.05Å; F537-L541 VanDerWaalsContact O-N 3.1Å; F537-A548 HydrophobicContact CD1-CB 3.8Å; F537-A548 HydrophobicContact CE1-CB 4.38Å; F537-I551 HydrophobicContact CE1-CB 4Å; F537-I551 HydrophobicContact CE1-CD1 4.4Å; F537-I551 HydrophobicContact CE1-CG2 3.82Å; F537-I551 HydrophobicContact CZ-CB 4.44Å; F537-I551 HydrophobicContact CZ-CG2 3.78Å; F537-L552 HydrophobicContact CD1-CD1 4.11Å; F537-L552 HydrophobicContact CD1-CD2 4.25Å; F537-L552 HydrophobicContact CD1-CG 3.96Å; F537-L552 HydrophobicContact CE1-CD2 4.43Å; F537-L552 HydrophobicContact CE1-CG 4.21Å
538	R	83.8	Confident	80.3	Confident	90 Å²	90	60.8 Å²	60.8	34%	0.34	35%	0.346	S	S	.	.	H	α-helix	trans	-63.2	-46	173.6	-180	-156.8	65.5	-168.7	-9.2	111	A534 A535 D536 L541 G542 V543 A548	A534-R538 VanDerWaalsContact O-CB 3.27Å; A534-R538 WeakPolarHBondContact O-CB 3.34Å; A534-R538 PolarHBondContact O-N 3.29Å; A535-R538 WeakPolarHBondContact O-CB 3.28Å; A535-R538 PolarHBondContact O-N 3.35Å; D536-R538 VanDerWaalsContact C-N 3.31Å; D536-R538 PolarHBondContact O-N 3.42Å; R538-L541 PolarHBondContact O-N 3.09Å; R538-G542 PolarHBondContact O-N 3.02Å; R538-V543 WeakPolarHBondContact CG-O 3.42Å; R538-A548 HydrophobicContact CB-CB 4.18Å
539	D	82.7	Confident	80.7	Confident	101 Å²	101	57.2 Å²	57.2	54%	0.54	33%	0.33	S	S	.	.	H	α-helix	trans	-71	-32.3	-173.9	-66.6	-13.6	0	0	0	111.9	A535 D536	A535-D539 PolarHBondContact O-N 2.93Å; D536-D539 PolarHBondContact O-N 2.98Å
540	R	80.8	Confident	81.2	Confident	131 Å²	131	54.9 Å²	54.9	49%	0.494	31%	0.312	S	S	.	.	H	α-helix	trans	-72.6	-44.8	172.3	-75	-72.5	-108	170.8	-11.1	113.4	L525 E528 D536 G542	L525-R540 HydrophobicContact CD2-CG 3.94Å; L525-R540 HydrophobicContact CG-CG 4.46Å; E528-R540 IonicContact OE1-NH2 3.25Å; E528-R540 PolarHBondContact OE1-NH2 3.38Å; E528-R540 VanDerWaalsContact OE1-NH2 3.09Å; E528-R540 IonicContact OE2-NE 3.59Å; E528-R540 IonicContact OE2-NH2 3.48Å; D536-R540 PolarHBondContact O-N 3.44Å; R540-G542 VanDerWaalsContact C-N 3.31Å; R540-G542 PolarHBondContact O-N 2.62Å
541	L	78	Confident	81.8	Confident	28 Å²	28	52.3 Å²	52.3	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-73.3	-22.7	-179.1	-87.5	169	0	0	0	113.6	F518 M521 F537 R538 V543 I551	F518-L541 HydrophobicContact CD1-CD1 4.5Å; F518-L541 HydrophobicContact CD1-CD2 3.58Å; F518-L541 HydrophobicContact CE1-CD2 3.61Å; M521-L541 HydrophobicContact CE-CD2 3.53Å; M521-L541 HydrophobicContact SD-CD2 3.26Å; M521-L541 WeakPolarHBondContact SD-CD2 3.41Å; M521-L541 HydrophobicContact SD-CG 3.64Å; F537-L541 HydrophobicContact CD1-CD1 3.79Å; F537-L541 HydrophobicContact CD2-CD1 4.02Å; F537-L541 HydrophobicContact CE1-CD1 3.28Å; F537-L541 HydrophobicContact CE2-CD1 3.54Å; F537-L541 HydrophobicContact CE2-CG 4.18Å; F537-L541 HydrophobicContact CG-CD1 4.14Å; F537-L541 HydrophobicContact CZ-CD1 3.17Å; F537-L541 HydrophobicContact CZ-CG 4.24Å; F537-L541 WeakPolarHBondContact O-CB 3.31Å; F537-L541 PolarHBondContact O-N 3.05Å; F537-L541 VanDerWaalsContact O-N 3.1Å; R538-L541 PolarHBondContact O-N 3.09Å; L541-V543 HydrophobicContact CB-CB 4.27Å; L541-V543 HydrophobicContact CB-CG1 4.06Å; L541-V543 HydrophobicContact CB-CG2 3.61Å; L541-V543 HydrophobicContact CD1-CG2 3.87Å; L541-V543 HydrophobicContact CG-CG2 4.36Å; L541-V543 PolarHBondContact O-N 3.41Å; L541-I551 HydrophobicContact CD1-CD1 4.41Å
542	G	79.4	Confident	82.5	Confident	71 Å²	71	51.3 Å²	51.3	73%	0.732	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	13.3	-170.4	0	0	0	0	0	113.7	R538 R540	R538-G542 PolarHBondContact O-N 3.02Å; R540-G542 VanDerWaalsContact C-N 3.31Å; R540-G542 PolarHBondContact O-N 2.62Å
543	V	74.2	Confident	83	Confident	37 Å²	37	56 Å²	56	22%	0.224	30%	0.3	C	S	.	.			trans	-96.4	159.4	-178.1	-61	0	0	0	0	112.2	R538 L541 L547 A548	R538-V543 WeakPolarHBondContact CG-O 3.42Å; L541-V543 HydrophobicContact CB-CB 4.27Å; L541-V543 HydrophobicContact CB-CG1 4.06Å; L541-V543 HydrophobicContact CB-CG2 3.61Å; L541-V543 HydrophobicContact CD1-CG2 3.87Å; L541-V543 HydrophobicContact CG-CG2 4.36Å; L541-V543 PolarHBondContact O-N 3.41Å; V543-L547 HydrophobicContact CB-CB 4.38Å; V543-L547 HydrophobicContact CB-CD2 3.82Å; V543-L547 HydrophobicContact CB-CG 4.36Å; V543-L547 HydrophobicContact CG1-CD2 3.83Å; V543-L547 HydrophobicContact CG2-CB 4.22Å; V543-L547 HydrophobicContact CG2-CD2 4.19Å; V543-L547 HydrophobicContact CG2-CG 4.23Å; V543-A548 HydrophobicContact CG2-CB 4.32Å
544	G	80.2	Confident	83.4	Confident	52 Å²	52	56.2 Å²	56.2	54%	0.536	30%	0.298	S	S	.	.			trans	-61.4	145.3	175.2	0	0	0	0	0	113	K546 L547 A548	G544-K546 PolarHBondContact O-N 3.39Å; G544-L547 WeakPolarHBondContact O-CB 3.46Å; G544-L547 PolarHBondContact O-N 3.03Å; G544-A548 PolarHBondContact O-N 3.26Å
545	R	83	Confident	83.8	Confident	172 Å²	172	55.3 Å²	55.3	65%	0.649	29%	0.288	S	S	*	.	H	α-helix	trans	-47.2	-37.9	179.5	-178.3	-179.9	179.6	-172.6	1.9	113.9	L547 I549	R545-L547 VanDerWaalsContact C-N 3.32Å; R545-L547 PolarHBondContact O-N 3.44Å; R545-I549 HydrophobicContact CG-CD1 3.85Å; R545-I549 HydrophobicContact CG-CG1 4.48Å; R545-I549 VanDerWaalsContact O-CG1 3.32Å; R545-I549 WeakPolarHBondContact O-CG1 3.39Å; R545-I549 PolarHBondContact O-N 2.86Å; R545-I549 VanDerWaalsContact O-N 3.09Å
546	K	85.4	Confident	84.2	Confident	142 Å²	142	55.1 Å²	55.1	62%	0.617	28%	0.281	S	S	*	.	H	α-helix	trans	-62.3	-39.6	179.4	-175.6	176.5	-179.2	178.6	0	112.2	G544 Q550	G544-K546 PolarHBondContact O-N 3.39Å; K546-Q550 VanDerWaalsContact O-CG 3.3Å; K546-Q550 WeakPolarHBondContact O-CG 3.4Å; K546-Q550 PolarHBondContact O-N 3.27Å
547	L	83.5	Confident	84.5	Confident	22 Å²	22	60.3 Å²	60.3	12%	0.115	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-45.1	-179.7	179.5	56.6	0	0	0	110.8	I504 Y510 V543 G544 R545 I549 Q550 I551	I504-L547 HydrophobicContact CD1-CD1 3.74Å; Y510-L547 HydrophobicContact CE2-CD1 3.99Å; Y510-L547 WeakPolarHBondContact OH-CD2 3.24Å; V543-L547 HydrophobicContact CB-CB 4.38Å; V543-L547 HydrophobicContact CB-CD2 3.82Å; V543-L547 HydrophobicContact CB-CG 4.36Å; V543-L547 HydrophobicContact CG1-CD2 3.83Å; V543-L547 HydrophobicContact CG2-CB 4.22Å; V543-L547 HydrophobicContact CG2-CD2 4.19Å; V543-L547 HydrophobicContact CG2-CG 4.23Å; G544-L547 WeakPolarHBondContact O-CB 3.46Å; G544-L547 PolarHBondContact O-N 3.03Å; R545-L547 VanDerWaalsContact C-N 3.32Å; R545-L547 PolarHBondContact O-N 3.44Å; L547-I549 VanDerWaalsContact C-N 3.32Å; L547-I549 PolarHBondContact O-N 3.09Å; L547-Q550 PolarHBondContact O-N 3.46Å; L547-Q550 VanDerWaalsContact O-N 3.16Å; L547-I551 HydrophobicContact CD1-CD1 4.01Å; L547-I551 HydrophobicContact CD1-CG1 4.23Å; L547-I551 HydrophobicContact CG-CD1 3.91Å; L547-I551 WeakPolarHBondContact O-CG1 3.16Å; L547-I551 PolarHBondContact O-N 3.28Å
548	A	86.1	Confident	84.7	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-52.7	-48.3	174.8	0	0	0	0	0	112.1	F537 R538 V543 G544 Q550 I551 L552	F537-A548 HydrophobicContact CD1-CB 3.8Å; F537-A548 HydrophobicContact CE1-CB 4.38Å; R538-A548 HydrophobicContact CB-CB 4.18Å; V543-A548 HydrophobicContact CG2-CB 4.32Å; G544-A548 PolarHBondContact O-N 3.26Å; A548-Q550 PolarHBondContact O-N 3.16Å; A548-I551 PolarHBondContact O-N 3.09Å; A548-L552 WeakPolarHBondContact O-CG 3.47Å; A548-L552 PolarHBondContact O-N 3.35Å; A548-L552 VanDerWaalsContact O-N 3.09Å
549	I	88.3	Confident	84.7	Confident	52 Å²	52	62 Å²	62	27%	0.267	32%	0.318	S	S	.	.	H	α-helix	trans	-62.4	-43.6	178.6	-68.4	168.9	0	0	0	111.7	A534 R545 L547 I551 L552 E553	A534-I549 HydrophobicContact CB-CG1 4.25Å; R545-I549 HydrophobicContact CG-CD1 3.85Å; R545-I549 HydrophobicContact CG-CG1 4.48Å; R545-I549 VanDerWaalsContact O-CG1 3.32Å; R545-I549 WeakPolarHBondContact O-CG1 3.39Å; R545-I549 PolarHBondContact O-N 2.86Å; R545-I549 VanDerWaalsContact O-N 3.09Å; L547-I549 VanDerWaalsContact C-N 3.32Å; L547-I549 PolarHBondContact O-N 3.09Å; I549-I551 VanDerWaalsContact C-N 3.33Å; I549-I551 PolarHBondContact O-N 2.88Å; I549-L552 PolarHBondContact O-N 3.49Å; I549-E553 HydrophobicContact CG2-CG 4.25Å; I549-E553 WeakPolarHBondContact O-CB 3.3Å; I549-E553 WeakPolarHBondContact O-CG 3.43Å; I549-E553 PolarHBondContact O-N 3.33Å
550	Q	88.9	Confident	84.9	Confident	22 Å²	22	58.4 Å²	58.4	10%	0.103	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-35.2	-178.7	-73.9	177.6	-17.7	0	0	113	I504 K546 L547 A548 Y554	I504-Q550 HydrophobicContact CD1-CB 4.28Å; K546-Q550 VanDerWaalsContact O-CG 3.3Å; K546-Q550 WeakPolarHBondContact O-CG 3.4Å; K546-Q550 PolarHBondContact O-N 3.27Å; L547-Q550 PolarHBondContact O-N 3.46Å; L547-Q550 VanDerWaalsContact O-N 3.16Å; A548-Q550 PolarHBondContact O-N 3.16Å; Q550-Y554 WeakPolarHBondContact O-CB 3.32Å; Q550-Y554 PolarHBondContact O-N 3.22Å
551	I	88	Confident	85.2	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-44.8	174.6	-67.7	165.4	0	0	0	109.9	I504 F518 F537 L541 L547 A548 I549 E553 Y554 F555	I504-I551 HydrophobicContact CD1-CG1 4.13Å; F518-I551 HydrophobicContact CB-CG2 4.2Å; F518-I551 HydrophobicContact CD2-CD1 3.78Å; F518-I551 HydrophobicContact CD2-CG1 4.21Å; F518-I551 HydrophobicContact CD2-CG2 4.08Å; F518-I551 HydrophobicContact CE1-CD1 4.49Å; F518-I551 HydrophobicContact CE2-CD1 3.65Å; F518-I551 HydrophobicContact CE2-CG1 4.27Å; F518-I551 HydrophobicContact CG-CD1 4.29Å; F518-I551 HydrophobicContact CG-CG2 4.36Å; F518-I551 HydrophobicContact CZ-CD1 4.03Å; F537-I551 HydrophobicContact CE1-CB 4Å; F537-I551 HydrophobicContact CE1-CD1 4.4Å; F537-I551 HydrophobicContact CE1-CG2 3.82Å; F537-I551 HydrophobicContact CZ-CB 4.44Å; F537-I551 HydrophobicContact CZ-CG2 3.78Å; L541-I551 HydrophobicContact CD1-CD1 4.41Å; L547-I551 HydrophobicContact CD1-CD1 4.01Å; L547-I551 HydrophobicContact CD1-CG1 4.23Å; L547-I551 HydrophobicContact CG-CD1 3.91Å; L547-I551 WeakPolarHBondContact O-CG1 3.16Å; L547-I551 PolarHBondContact O-N 3.28Å; A548-I551 PolarHBondContact O-N 3.09Å; I549-I551 VanDerWaalsContact C-N 3.33Å; I549-I551 PolarHBondContact O-N 2.88Å; I551-E553 PolarHBondContact O-N 3.46Å; I551-Y554 WeakPolarHBondContact O-CB 3.35Å; I551-Y554 PolarHBondContact O-N 3.46Å; I551-F555 HydrophobicContact CG2-CD2 3.67Å; I551-F555 HydrophobicContact CG2-CE2 3.38Å; I551-F555 HydrophobicContact CG2-CZ 4.4Å; I551-F555 VanDerWaalsContact O-CD2 3.29Å; I551-F555 WeakPolarHBondContact O-CD2 3.26Å; I551-F555 PolarHBondContact O-N 2.98Å
552	L	88	Confident	85.6	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-63	-42.1	176.3	-68.7	171.8	0	0	0	112	I522 T532 A534 F537 A548 I549 Y554 F555 D556	I522-L552 HydrophobicContact CD1-CD2 4.06Å; I522-L552 HydrophobicContact CG1-CD2 4.47Å; T532-L552 HydrophobicContact CG2-CD2 4.01Å; A534-L552 HydrophobicContact CB-CD1 4.2Å; F537-L552 HydrophobicContact CD1-CD1 4.11Å; F537-L552 HydrophobicContact CD1-CD2 4.25Å; F537-L552 HydrophobicContact CD1-CG 3.96Å; F537-L552 HydrophobicContact CE1-CD2 4.43Å; F537-L552 HydrophobicContact CE1-CG 4.21Å; A548-L552 WeakPolarHBondContact O-CG 3.47Å; A548-L552 PolarHBondContact O-N 3.35Å; A548-L552 VanDerWaalsContact O-N 3.09Å; I549-L552 PolarHBondContact O-N 3.49Å; L552-Y554 VanDerWaalsContact C-N 3.3Å; L552-Y554 PolarHBondContact O-N 3.1Å; L552-F555 PolarHBondContact O-N 3.09Å; L552-D556 WeakPolarHBondContact O-CB 3.33Å; L552-D556 PolarHBondContact O-N 2.87Å
553	E	89.7	Confident	85.9	Confident	98 Å²	98	61.5 Å²	61.5	46%	0.458	29%	0.285	S	S	.	.	H	α-helix	trans	-62.6	-36.1	174.7	-74.8	175.7	174.4	0	0	112.4	I549 I551 R557	I549-E553 HydrophobicContact CG2-CG 4.25Å; I549-E553 WeakPolarHBondContact O-CB 3.3Å; I549-E553 WeakPolarHBondContact O-CG 3.43Å; I549-E553 PolarHBondContact O-N 3.33Å; I551-E553 PolarHBondContact O-N 3.46Å; E553-R557 WeakPolarHBondContact O-CB 3.32Å; E553-R557 PolarHBondContact O-N 3.46Å
554	Y	89.8	Confident	86.4	Confident	34 Å²	34	68.8 Å²	68.8	13%	0.133	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-48.2	174.1	171.7	-107.6	0	0	0	111.5	T502 I504 I515 Q550 I551 L552 D556 R557 I558	T502-Y554 HydrophobicContact CG2-CE1 3.59Å; T502-Y554 HydrophobicContact CG2-CE2 3.73Å; T502-Y554 WeakPolarHBondContact CG2-OH 3.37Å; I504-Y554 HydrophobicContact CB-CG 4.27Å; I504-Y554 HydrophobicContact CG2-CD1 4.01Å; I504-Y554 HydrophobicContact CG2-CG 4.01Å; I515-Y554 HydrophobicContact CD1-CE1 4.32Å; I515-Y554 HydrophobicContact CG2-CE1 4.27Å; Q550-Y554 WeakPolarHBondContact O-CB 3.32Å; Q550-Y554 PolarHBondContact O-N 3.22Å; I551-Y554 WeakPolarHBondContact O-CB 3.35Å; I551-Y554 PolarHBondContact O-N 3.46Å; L552-Y554 VanDerWaalsContact C-N 3.3Å; L552-Y554 PolarHBondContact O-N 3.1Å; Y554-D556 VanDerWaalsContact C-N 3.33Å; Y554-D556 PolarHBondContact O-N 2.79Å; Y554-R557 WeakPolarHBondContact O-CB 3.44Å; Y554-R557 PolarHBondContact O-N 3.01Å; Y554-R557 VanDerWaalsContact O-N 3.16Å; Y554-I558 HydrophobicContact CD1-CD1 3.79Å; Y554-I558 HydrophobicContact CD2-CD1 4.23Å; Y554-I558 HydrophobicContact CE1-CD1 3.19Å; Y554-I558 HydrophobicContact CE1-CG1 4.44Å; Y554-I558 HydrophobicContact CE2-CD1 3.67Å; Y554-I558 HydrophobicContact CE2-CG1 4.2Å; Y554-I558 HydrophobicContact CG-CD1 4.27Å; Y554-I558 PolarHBondContact O-N 3.34Å; Y554-I558 VanDerWaalsContact OH-CD1 3.22Å; Y554-I558 WeakPolarHBondContact OH-CD1 3.49Å
555	F	88.7	Confident	86.6	Confident	7 Å²	7	69 Å²	69	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-66.2	-34.4	177.3	-74.4	-48	0	0	0	112.8	I515 F518 A519 I522 I551 L552 R557 I558 G559 F560 T561	I515-F555 HydrophobicContact CG2-CE1 3.93Å; I515-F555 HydrophobicContact CG2-CZ 3.99Å; F518-F555 HydrophobicContact CB-CE2 3.96Å; F518-F555 HydrophobicContact CB-CZ 4.1Å; A519-F555 HydrophobicContact CB-CZ 4.23Å; I522-F555 HydrophobicContact CD1-CD2 3.27Å; I522-F555 HydrophobicContact CD1-CE2 3.43Å; I522-F555 VanDerWaalsContact CD1-CE2 3.43Å; I522-F555 HydrophobicContact CD1-CG 4.24Å; I551-F555 HydrophobicContact CG2-CD2 3.67Å; I551-F555 HydrophobicContact CG2-CE2 3.38Å; I551-F555 HydrophobicContact CG2-CZ 4.4Å; I551-F555 VanDerWaalsContact O-CD2 3.29Å; I551-F555 WeakPolarHBondContact O-CD2 3.26Å; I551-F555 PolarHBondContact O-N 2.98Å; L552-F555 PolarHBondContact O-N 3.09Å; F555-R557 VanDerWaalsContact C-N 3.31Å; F555-R557 PolarHBondContact O-N 3.38Å; F555-I558 HydrophobicContact CD1-CD1 4.37Å; F555-I558 PolarHBondContact O-N 3.23Å; F555-G559 CarbonylContact O-C 3.41Å; F555-G559 PolarHBondContact O-N 3.32Å; F555-F560 HydrophobicContact CB-CB 4.03Å; F555-F560 HydrophobicContact CB-CD1 4.05Å; F555-F560 HydrophobicContact CD1-CB 3.89Å; F555-F560 AromaticContact CD1-CD1 3.77Å; F555-F560 HydrophobicContact CD1-CD1 3.77Å; F555-F560 HydrophobicContact CD1-CG 4.03Å; F555-F560 HydrophobicContact CD2-CD1 4.38Å; F555-F560 HydrophobicContact CE1-CD1 4.3Å; F555-F560 HydrophobicContact CG-CB 4.29Å; F555-F560 AromaticContact CG-CD1 3.83Å; F555-F560 HydrophobicContact CG-CD1 3.83Å; F555-F560 HydrophobicContact CG-CG 4.42Å; F555-F560 PolarHBondContact O-N 3.45Å; F555-T561 HydrophobicContact CB-CG2 4.39Å; F555-T561 WeakPolarHBondContact CB-OG1 3.43Å; F555-T561 PolarHBondContact O-N 3.24Å
556	D	88.2	Confident	86.5	Confident	39 Å²	39	67.5 Å²	67.5	21%	0.209	32%	0.316	C	S	.	.	H	α-helix	trans	-62.2	-40.2	171.6	-72.8	-23.2	0	0	0	111.4	L552 Y554 G559 T561 R562 R563 H568	L552-D556 WeakPolarHBondContact O-CB 3.33Å; L552-D556 PolarHBondContact O-N 2.87Å; Y554-D556 VanDerWaalsContact C-N 3.33Å; Y554-D556 PolarHBondContact O-N 2.79Å; D556-G559 PolarHBondContact O-N 3.48Å; D556-T561 WeakPolarHBondContact CA-O 3.38Å; D556-T561 PolarHBondContact N-OG1 2.99Å; D556-T561 VanDerWaalsContact OD1-C 3.29Å; D556-T561 VanDerWaalsContact OD1-CB 3.31Å; D556-T561 WeakPolarHBondContact OD1-CB 3.11Å; D556-T561 PolarHBondContact OD1-OG1 3.1Å; D556-R562 PolarHBondContact OD1-N 3.48Å; D556-R563 PolarHBondContact OD1-N 3.01Å; D556-H568 IonicContact OD1-CE1 3.76Å; D556-H568 IonicContact OD1-ND1 3.75Å; D556-H568 PolarHBondContact OD1-ND1 2.93Å; D556-H568 VanDerWaalsContact OD1-ND1 3.09Å; D556-H568 IonicContact OD2-CE1 2.78Å; D556-H568 PolarHBondContact OD2-CE1 3.12Å; D556-H568 IonicContact OD2-ND1 3.62Å; D556-H568 PolarHBondContact OD2-ND1 3.46Å
557	R	86.5	Confident	86.4	Confident	168 Å²	168	63.7 Å²	63.7	63%	0.634	30%	0.302	S	S	*	.	H	α-helix	trans	-69.2	-37.2	179.1	-176	175.5	67.2	-155	0.7	112.8	A503 E553 Y554 F555	A503-R557 PolarHBondContact O-NH2 2.87Å; E553-R557 WeakPolarHBondContact O-CB 3.32Å; E553-R557 PolarHBondContact O-N 3.46Å; Y554-R557 WeakPolarHBondContact O-CB 3.44Å; Y554-R557 PolarHBondContact O-N 3.01Å; Y554-R557 VanDerWaalsContact O-N 3.16Å; F555-R557 VanDerWaalsContact C-N 3.31Å; F555-R557 PolarHBondContact O-N 3.38Å
558	I	85.7	Confident	86.5	Confident	96 Å²	96	63.2 Å²	63.2	49%	0.492	30%	0.3	S	S	.	.	H	α-helix	trans	-70.6	-27.4	172.8	-66.8	162.3	0	0	0	111	Y554 F555	Y554-I558 HydrophobicContact CD1-CD1 3.79Å; Y554-I558 HydrophobicContact CD2-CD1 4.23Å; Y554-I558 HydrophobicContact CE1-CD1 3.19Å; Y554-I558 HydrophobicContact CE1-CG1 4.44Å; Y554-I558 HydrophobicContact CE2-CD1 3.67Å; Y554-I558 HydrophobicContact CE2-CG1 4.2Å; Y554-I558 HydrophobicContact CG-CD1 4.27Å; Y554-I558 PolarHBondContact O-N 3.34Å; Y554-I558 VanDerWaalsContact OH-CD1 3.22Å; Y554-I558 WeakPolarHBondContact OH-CD1 3.49Å; F555-I558 HydrophobicContact CD1-CD1 4.37Å; F555-I558 PolarHBondContact O-N 3.23Å
559	G	84.5	Confident	86.3	Confident	28 Å²	28	66.2 Å²	66.2	29%	0.289	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.9	14.7	-172.9	0	0	0	0	0	113.7	F555 D556 R571	F555-G559 CarbonylContact O-C 3.41Å; F555-G559 PolarHBondContact O-N 3.32Å; D556-G559 PolarHBondContact O-N 3.48Å; G559-R571 VanDerWaalsContact O-CB 3.29Å; G559-R571 WeakPolarHBondContact O-CB 3.27Å
560	F	85.8	Confident	86.1	Confident	26 Å²	26	65.3 Å²	65.3	11%	0.114	31%	0.311	C	S	.	.	S	Bend	trans	-66.7	-46.8	171.2	-177.8	-105.4	0	0	0	110.4	A519 I522 R523 F555 L570 R571 F576	A519-F560 HydrophobicContact CB-CE1 4.02Å; A519-F560 HydrophobicContact CB-CE2 4.41Å; A519-F560 HydrophobicContact CB-CZ 3.77Å; I522-F560 HydrophobicContact CB-CE1 4.22Å; I522-F560 HydrophobicContact CD1-CE1 4.28Å; I522-F560 HydrophobicContact CG2-CE1 4.02Å; R523-F560 HydrophobicContact CG-CZ 4.48Å; F555-F560 HydrophobicContact CB-CB 4.03Å; F555-F560 HydrophobicContact CB-CD1 4.05Å; F555-F560 HydrophobicContact CD1-CB 3.89Å; F555-F560 AromaticContact CD1-CD1 3.77Å; F555-F560 HydrophobicContact CD1-CD1 3.77Å; F555-F560 HydrophobicContact CD1-CG 4.03Å; F555-F560 HydrophobicContact CD2-CD1 4.38Å; F555-F560 HydrophobicContact CE1-CD1 4.3Å; F555-F560 HydrophobicContact CG-CB 4.29Å; F555-F560 AromaticContact CG-CD1 3.83Å; F555-F560 HydrophobicContact CG-CD1 3.83Å; F555-F560 HydrophobicContact CG-CG 4.42Å; F555-F560 PolarHBondContact O-N 3.45Å; F560-L570 HydrophobicContact CD1-CD1 4.19Å; F560-L570 HydrophobicContact CD2-CD1 4.43Å; F560-L570 HydrophobicContact CE1-CD1 3.74Å; F560-L570 HydrophobicContact CE2-CD1 4.02Å; F560-L570 HydrophobicContact CZ-CD1 3.64Å; F560-R571 PolarHBondContact O-N 3.42Å; F560-F576 HydrophobicContact CD2-CE2 4.32Å; F560-F576 HydrophobicContact CE2-CD2 4.3Å; F560-F576 HydrophobicContact CE2-CE2 4.36Å
561	T	87.5	Confident	85.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	165.8	168.5	53.4	0	0	0	0	111	I522 F555 D556 H568 L569	I522-T561 HydrophobicContact CG2-CG2 3.93Å; F555-T561 HydrophobicContact CB-CG2 4.39Å; F555-T561 WeakPolarHBondContact CB-OG1 3.43Å; F555-T561 PolarHBondContact O-N 3.24Å; D556-T561 WeakPolarHBondContact CA-O 3.38Å; D556-T561 PolarHBondContact N-OG1 2.99Å; D556-T561 VanDerWaalsContact OD1-C 3.29Å; D556-T561 VanDerWaalsContact OD1-CB 3.31Å; D556-T561 WeakPolarHBondContact OD1-CB 3.11Å; D556-T561 PolarHBondContact OD1-OG1 3.1Å; T561-H568 HydrophobicContact CG2-CB 4.38Å; T561-L569 CarbonylContact C-O 3.55Å; T561-L569 VanDerWaalsContact CA-O 3.28Å; T561-L569 WeakPolarHBondContact CA-O 3.35Å
562	R	85.8	Confident	84.2	Confident	147 Å²	147	74.4 Å²	74.4	56%	0.555	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.6	118.6	165.6	-171.2	-172.2	-161.7	150.4	-1.8	109.4	D556 R564 L569 R571	D556-R562 PolarHBondContact OD1-N 3.48Å; R562-R564 PolarHBondContact O-N 3.2Å; R562-L569 PolarHBondContact N-O 3.06Å; R562-L569 PolarHBondContact O-N 3.32Å; R562-R571 HydrophobicContact CB-CG 3.66Å; R562-R571 VanDerWaalsContact CD-NH1 3.34Å
563	R	87.2	Confident	82.7	Confident	148 Å²	148	78.3 Å²	78.3	56%	0.558	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	124.6	172.2	-168	172.7	176.9	179.8	0.9	112.2	D556 G565 D567	D556-R563 PolarHBondContact OD1-N 3.01Å; R563-G565 PolarHBondContact NE-O 2.9Å; R563-D567 CarbonylContact C-O 3.59Å; R563-D567 WeakPolarHBondContact CA-O 3.05Å
564	R	84.4	Confident	80.9	Confident	190 Å²	190	81.7 Å²	81.7	72%	0.717	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	99.8	170.4	-175.8	-177.7	177.2	177.2	-3	108.8	R562 N566 D567 L569	R562-R564 PolarHBondContact O-N 3.2Å; R564-N566 PolarHBondContact O-N 2.98Å; R564-D567 PolarHBondContact N-O 3.48Å; R564-D567 PolarHBondContact O-N 2.88Å; R564-L569 HydrophobicContact CB-CD1 4.02Å; R564-L569 HydrophobicContact CB-CG 4.41Å
565	G	84.8	Confident	79	Confident	58 Å²	58	85.2 Å²	85.2	60%	0.598	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-119.9	-175.3	0	0	0	0	0	111.5	R563	R563-G565 PolarHBondContact NE-O 2.9Å
566	N	79.8	Confident	77.1	Confident	139 Å²	139	90.1 Å²	90.1	74%	0.743	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.8	178.8	-67.9	-25.5	0	0	0	113.5	R564	R564-N566 PolarHBondContact O-N 2.98Å
567	D	83.8	Confident	74.9	Confident	62 Å²	62	93.8 Å²	93.8	33%	0.332	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	147.8	-171.2	-62.4	-21.6	0	0	0	111	R563 R564	R563-D567 CarbonylContact C-O 3.59Å; R563-D567 WeakPolarHBondContact CA-O 3.05Å; R564-D567 PolarHBondContact N-O 3.48Å; R564-D567 PolarHBondContact O-N 2.88Å
568	H	84.6	Confident	72.7	Confident	12 Å²	12	94.2 Å²	94.2	6%	0.056	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	118.1	170.3	-66.4	-102.7	0	0	0	108.4	T532 D556 T561	T532-H568 PolarHBondContact N-O 3.09Å; T532-H568 PolarHBondContact O-N 3.25Å; D556-H568 IonicContact OD1-CE1 3.76Å; D556-H568 IonicContact OD1-ND1 3.75Å; D556-H568 PolarHBondContact OD1-ND1 2.93Å; D556-H568 VanDerWaalsContact OD1-ND1 3.09Å; D556-H568 IonicContact OD2-CE1 2.78Å; D556-H568 PolarHBondContact OD2-CE1 3.12Å; D556-H568 IonicContact OD2-ND1 3.62Å; D556-H568 PolarHBondContact OD2-ND1 3.46Å; T561-H568 HydrophobicContact CG2-CB 4.38Å
569	L	82.2	Confident	70.3	Confident	63 Å²	63	102.7 Å²	102.7	33%	0.33	52%	0.515	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.8	179	-60	176.9	0	0	0	109.7	T561 R562 R564 R571	T561-L569 CarbonylContact C-O 3.55Å; T561-L569 VanDerWaalsContact CA-O 3.28Å; T561-L569 WeakPolarHBondContact CA-O 3.35Å; R562-L569 PolarHBondContact N-O 3.06Å; R562-L569 PolarHBondContact O-N 3.32Å; R564-L569 HydrophobicContact CB-CD1 4.02Å; R564-L569 HydrophobicContact CB-CG 4.41Å; L569-R571 PolarHBondContact O-N 3.21Å
570	L	83.9	Confident	69.6	Low	34 Å²	34	106.5 Å²	106.5	18%	0.178	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	122.4	172.4	-168.9	68.6	0	0	0	109.5	R523 F560 A573	R523-L570 HydrophobicContact CG-CD2 4.42Å; F560-L570 HydrophobicContact CD1-CD1 4.19Å; F560-L570 HydrophobicContact CD2-CD1 4.43Å; F560-L570 HydrophobicContact CE1-CD1 3.74Å; F560-L570 HydrophobicContact CE2-CD1 4.02Å; F560-L570 HydrophobicContact CZ-CD1 3.64Å; L570-A573 HydrophobicContact CD2-CB 4.45Å
571	R	74.7	Confident	68.8	Low	118 Å²	118	110.7 Å²	110.7	45%	0.445	55%	0.548	S	S	.	.	S	Bend	trans	-78.1	-29.7	-169.9	-80.2	-74.7	-72	-82.1	-0.3	114.2	G559 F560 R562 L569	G559-R571 VanDerWaalsContact O-CB 3.29Å; G559-R571 WeakPolarHBondContact O-CB 3.27Å; F560-R571 PolarHBondContact O-N 3.42Å; R562-R571 HydrophobicContact CB-CG 3.66Å; R562-R571 VanDerWaalsContact CD-NH1 3.34Å; L569-R571 PolarHBondContact O-N 3.21Å
572	D	63.7	Low	67.7	Low	94 Å²	94	116.8 Å²	116.8	50%	0.503	58%	0.578	S	S	.	*			trans	-146.4	96.7	177.7	-73.9	-49.7	0	0	0	111	L574 L575	D572-L574 PolarHBondContact O-N 3.38Å; D572-L575 HydrophobicContact CB-CB 3.7Å; D572-L575 HydrophobicContact CB-CD1 4.26Å; D572-L575 PolarHBondContact O-N 3.35Å
573	A	56.1	Low	66.7	Low	84 Å²	84	115.1 Å²	115.1	69%	0.694	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.3	-16	170.3	0	0	0	0	0	113	L570	L570-A573 HydrophobicContact CD2-CB 4.45Å
574	L	50.8	Low	65.4	Low	169 Å²	169	113 Å²	113	89%	0.885	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	-8.3	-175.4	-72.8	166.7	0	0	0	114.8	D572 F576	D572-L574 PolarHBondContact O-N 3.38Å; L574-F576 VanDerWaalsContact C-N 3.32Å; L574-F576 PolarHBondContact O-N 3.17Å
575	L	50.1	Low	64.1	Low	108 Å²	108	107.9 Å²	107.9	57%	0.565	57%	0.572	S	S	*	*	S	Bend	trans	-81.1	-12	-174.8	-150.8	136.4	0	0	0	113.1	D572	D572-L575 HydrophobicContact CB-CB 3.7Å; D572-L575 HydrophobicContact CB-CD1 4.26Å; D572-L575 PolarHBondContact O-N 3.35Å
576	F	49.1	Very low	62.7	Low	110 Å²	110	111.4 Å²	111.4	48%	0.482	57%	0.57	S	S	.	*	S	Bend	trans	-135.7	100.5	179.9	-68.1	-86	0	0	0	110.4	F560 L574	F560-F576 HydrophobicContact CD2-CE2 4.32Å; F560-F576 HydrophobicContact CE2-CD2 4.3Å; F560-F576 HydrophobicContact CE2-CE2 4.36Å; L574-F576 VanDerWaalsContact C-N 3.32Å; L574-F576 PolarHBondContact O-N 3.17Å
577	P	42.8	Very low	61.3	Low	116 Å²	116	109.3 Å²	109.3	75%	0.753	56%	0.557	S	S	*	*			trans	-65.1	149.2	173.8	-13.8	27.6	0	0	0	111	K579	P577-K579 VanDerWaalsContact C-N 3.28Å; P577-K579 PolarHBondContact O-N 2.93Å
578	E	40.4	Very low	59.5	Low	176 Å²	176	113.3 Å²	113.3	82%	0.822	58%	0.576	S	S	*	*			trans	-64.9	83.3	167.4	-74.4	-122.6	154.6	0	0	110.6
579	K	35.3	Very low	57.2	Low	275 Å²	275	122.5 Å²	122.5	100%	1.196	62%	0.623	S	S	*	*			trans	-152.5	0	150.8	-72.2	-156.8	178.6	176.3	0	111.3	P577	P577-K579 VanDerWaalsContact C-N 3.28Å; P577-K579 PolarHBondContact O-N 2.93Å

Retrieved 579 of 579 residues in 167.5 ms (Link to these results)

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