A0A077ZIV0_TRITR Loading...

EGF-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZIV0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 606 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.7	Very low	67.5	Low	214 Å²	214	99.8 Å²	99.8	100%	1.054	56%	0.561	S	S	*	*				0	128.3	0	-65.6	-178.3	85.8	0	0	107.7
2	S	68.2	Low	66.4	Low	74 Å²	74	97.8 Å²	97.8	52%	0.517	56%	0.557	S	S	.	*			trans	-64.7	136	-175.3	168	0	0	0	0	111	G4 L5	S2-G4 PolarHBondContact O-N 3.11Å; S2-G4 VanDerWaalsContact O-N 3.08Å; S2-L5 PolarHBondContact O-N 3.44Å; S2-L5 VanDerWaalsContact O-N 3.09Å
3	P	66.4	Low	65.4	Low	107 Å²	107	98.8 Å²	98.8	70%	0.695	56%	0.558	S	S	*	*	H	α-helix	trans	-57.8	-23.8	-178.9	20	-30.2	0	0	0	113.6	L5 I6 L7	P3-L5 VanDerWaalsContact C-N 3.34Å; P3-L5 PolarHBondContact O-N 3.09Å; P3-I6 PolarHBondContact O-N 3.17Å; P3-L7 PolarHBondContact O-N 3.36Å
4	G	71.5	Confident	63.8	Low	36 Å²	36	98.7 Å²	98.7	37%	0.371	56%	0.555	S	S	.	*	H	α-helix	trans	-65.4	-31.2	176.7	0	0	0	0	0	114.4	S2 I8	S2-G4 PolarHBondContact O-N 3.11Å; S2-G4 VanDerWaalsContact O-N 3.08Å; G4-I8 WeakPolarHBondContact O-CG1 3.47Å; G4-I8 PolarHBondContact O-N 2.8Å; G4-I8 VanDerWaalsContact O-N 3.14Å
5	L	67.4	Low	62.6	Low	113 Å²	113	102.1 Å²	102.1	59%	0.592	56%	0.562	S	S	*	*	H	α-helix	trans	-74	-31.4	179.1	-100.3	148.1	0	0	0	112.4	S2 P3 T9	S2-L5 PolarHBondContact O-N 3.44Å; S2-L5 VanDerWaalsContact O-N 3.09Å; P3-L5 VanDerWaalsContact C-N 3.34Å; P3-L5 PolarHBondContact O-N 3.09Å; L5-T9 PolarHBondContact O-N 3.4Å; L5-T9 VanDerWaalsContact O-N 3.11Å; L5-T9 PolarHBondContact O-OG1 2.94Å
6	I	74.5	Confident	61.4	Low	93 Å²	93	100.4 Å²	100.4	48%	0.477	57%	0.565	S	S	.	*	H	α-helix	trans	-71.1	-40	175.4	-59.7	175	0	0	0	109.9	P3 T9 L10	P3-I6 PolarHBondContact O-N 3.17Å; I6-T9 WeakPolarHBondContact CA-OG1 3.4Å; I6-T9 PolarHBondContact O-N 2.9Å; I6-T9 PolarHBondContact O-OG1 2.94Å; I6-T9 VanDerWaalsContact O-OG1 3.05Å; I6-L10 HydrophobicContact CG2-CD1 3.94Å; I6-L10 HydrophobicContact CG2-CG 4.46Å; I6-L10 WeakPolarHBondContact O-CB 3.34Å; I6-L10 VanDerWaalsContact O-CG 3.28Å; I6-L10 WeakPolarHBondContact O-CG 3.44Å; I6-L10 PolarHBondContact O-N 2.82Å
7	L	76.1	Confident	60.1	Low	107 Å²	107	98.5 Å²	98.5	56%	0.56	56%	0.56	S	S	*	*	H	α-helix	trans	-66.1	-43.5	177.7	-169.1	70.3	0	0	0	112	P3 L10 I11	P3-L7 PolarHBondContact O-N 3.36Å; L7-L10 PolarHBondContact O-N 2.85Å; L7-I11 HydrophobicContact CD2-CD1 4.46Å; L7-I11 HydrophobicContact CG-CD1 3.93Å; L7-I11 WeakPolarHBondContact O-CB 3.49Å; L7-I11 WeakPolarHBondContact O-CG1 3.21Å; L7-I11 PolarHBondContact O-N 2.86Å
8	I	73.1	Confident	58.8	Low	107 Å²	107	101.4 Å²	101.4	55%	0.549	57%	0.568	S	S	.	*	H	α-helix	trans	-66.1	-40.6	178.4	-66.4	167.7	0	0	0	110.9	G4 I11 C12	G4-I8 WeakPolarHBondContact O-CG1 3.47Å; G4-I8 PolarHBondContact O-N 2.8Å; G4-I8 VanDerWaalsContact O-N 3.14Å; I8-I11 PolarHBondContact O-N 3.19Å; I8-C12 WeakPolarHBondContact O-CB 3.13Å; I8-C12 PolarHBondContact O-N 2.74Å; I8-C12 PolarHBondContact O-SG 2.75Å
9	T	69	Low	58.1	Low	74 Å²	74	102 Å²	102	45%	0.454	57%	0.573	S	S	.	*	H	α-helix	trans	-66.3	-39.5	175.8	40.7	0	0	0	0	112.2	L5 I6 C12 I13	L5-T9 PolarHBondContact O-N 3.4Å; L5-T9 VanDerWaalsContact O-N 3.11Å; L5-T9 PolarHBondContact O-OG1 2.94Å; I6-T9 WeakPolarHBondContact CA-OG1 3.4Å; I6-T9 PolarHBondContact O-N 2.9Å; I6-T9 PolarHBondContact O-OG1 2.94Å; I6-T9 VanDerWaalsContact O-OG1 3.05Å; T9-C12 PolarHBondContact O-N 2.9Å; T9-I13 WeakPolarHBondContact O-CB 3.44Å; T9-I13 WeakPolarHBondContact O-CD1 3.27Å; T9-I13 WeakPolarHBondContact O-CG1 3.23Å; T9-I13 PolarHBondContact O-N 3.45Å
10	L	63.7	Low	57.3	Low	95 Å²	95	101.4 Å²	101.4	50%	0.497	58%	0.576	S	S	.	*	H	α-helix	trans	-63.7	-40.4	173.3	-74.6	168.6	0	0	0	112.5	I6 L7 N14	I6-L10 HydrophobicContact CG2-CD1 3.94Å; I6-L10 HydrophobicContact CG2-CG 4.46Å; I6-L10 WeakPolarHBondContact O-CB 3.34Å; I6-L10 VanDerWaalsContact O-CG 3.28Å; I6-L10 WeakPolarHBondContact O-CG 3.44Å; I6-L10 PolarHBondContact O-N 2.82Å; L7-L10 PolarHBondContact O-N 2.85Å; L10-N14 WeakPolarHBondContact O-CB 3.24Å; L10-N14 PolarHBondContact O-N 2.77Å; L10-N14 PolarHBondContact O-ND2 2.77Å
11	I	66.1	Low	56.8	Low	78 Å²	78	99.6 Å²	99.6	40%	0.4	57%	0.567	S	S	.	*	H	α-helix	trans	-65.7	-44.9	175.1	-68.4	167.1	0	0	0	110.2	L7 I8 I13 N14 F15	L7-I11 HydrophobicContact CD2-CD1 4.46Å; L7-I11 HydrophobicContact CG-CD1 3.93Å; L7-I11 WeakPolarHBondContact O-CB 3.49Å; L7-I11 WeakPolarHBondContact O-CG1 3.21Å; L7-I11 PolarHBondContact O-N 2.86Å; I8-I11 PolarHBondContact O-N 3.19Å; I11-I13 PolarHBondContact O-N 2.82Å; I11-N14 PolarHBondContact O-N 2.99Å; I11-F15 HydrophobicContact CG2-CD2 3.59Å; I11-F15 HydrophobicContact CG2-CE2 3.8Å; I11-F15 WeakPolarHBondContact O-CD2 3.46Å; I11-F15 PolarHBondContact O-N 2.67Å
12	C	53.6	Low	57	Low	76 Å²	76	92 Å²	92	51%	0.514	54%	0.543	S	S	.	.	H	α-helix	trans	-66.1	-35.9	178.5	-72.5	0	0	0	0	112.8	I8 T9 A16	I8-C12 WeakPolarHBondContact O-CB 3.13Å; I8-C12 PolarHBondContact O-N 2.74Å; I8-C12 PolarHBondContact O-SG 2.75Å; T9-C12 PolarHBondContact O-N 2.9Å; C12-A16 VanDerWaalsContact O-CB 3.26Å; C12-A16 WeakPolarHBondContact O-CB 3.1Å; C12-A16 PolarHBondContact O-N 3.23Å
13	I	53.7	Low	56.6	Low	111 Å²	111	93.6 Å²	93.6	57%	0.569	55%	0.546	S	S	*	.	H	α-helix	trans	-65.9	-44	173.4	-67.9	164.6	0	0	0	109.8	T9 I11 F15 A16 S17	T9-I13 WeakPolarHBondContact O-CB 3.44Å; T9-I13 WeakPolarHBondContact O-CD1 3.27Å; T9-I13 WeakPolarHBondContact O-CG1 3.23Å; T9-I13 PolarHBondContact O-N 3.45Å; I11-I13 PolarHBondContact O-N 2.82Å; I13-F15 PolarHBondContact O-N 2.98Å; I13-A16 PolarHBondContact O-N 2.85Å; I13-S17 WeakPolarHBondContact O-CB 3.36Å; I13-S17 PolarHBondContact O-N 2.05Å; I13-S17 PolarHBondContact O-OG 3.05Å
14	N	43.8	Very low	57.4	Low	97 Å²	97	92.9 Å²	92.9	52%	0.519	54%	0.54	S	S	.	.	H	α-helix	trans	-65.7	-36.4	176.7	-83	-31.3	0	0	0	113.7	L10 I11 S17 H18	L10-N14 WeakPolarHBondContact O-CB 3.24Å; L10-N14 PolarHBondContact O-N 2.77Å; L10-N14 PolarHBondContact O-ND2 2.77Å; I11-N14 PolarHBondContact O-N 2.99Å; N14-S17 WeakPolarHBondContact CA-OG 3.43Å; N14-S17 PolarHBondContact O-OG 3.32Å; N14-H18 PolarHBondContact O-CD2 2.9Å; N14-H18 VanDerWaalsContact O-CD2 3.29Å; N14-H18 PolarHBondContact O-N 2.87Å
15	F	45.8	Very low	58.4	Low	150 Å²	150	96 Å²	96	66%	0.658	54%	0.542	S	S	*	.	H	α-helix	trans	-77.4	-34	177.6	-89.5	-80.6	0	0	0	112.8	I11 I13 H18	I11-F15 HydrophobicContact CG2-CD2 3.59Å; I11-F15 HydrophobicContact CG2-CE2 3.8Å; I11-F15 WeakPolarHBondContact O-CD2 3.46Å; I11-F15 PolarHBondContact O-N 2.67Å; I13-F15 PolarHBondContact O-N 2.98Å; F15-H18 PolarHBondContact O-N 3.37Å
16	A	43	Very low	59.6	Low	74 Å²	74	92.5 Å²	92.5	61%	0.612	52%	0.52	S	S	*	.	H	α-helix	trans	-69.8	-33.9	174.3	0	0	0	0	0	112	C12 I13 H18	C12-A16 VanDerWaalsContact O-CB 3.26Å; C12-A16 WeakPolarHBondContact O-CB 3.1Å; C12-A16 PolarHBondContact O-N 3.23Å; I13-A16 PolarHBondContact O-N 2.85Å; A16-H18 VanDerWaalsContact C-N 3.35Å
17	S	38.9	Very low	60.5	Low	68 Å²	68	88.1 Å²	88.1	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-71.6	-26.2	175.1	54.8	0	0	0	0	113.3	I13 N14 V19	I13-S17 WeakPolarHBondContact O-CB 3.36Å; I13-S17 PolarHBondContact O-N 2.05Å; I13-S17 PolarHBondContact O-OG 3.05Å; N14-S17 WeakPolarHBondContact CA-OG 3.43Å; N14-S17 PolarHBondContact O-OG 3.32Å; S17-V19 PolarHBondContact O-N 3.11Å
18	H	37.6	Very low	61.3	Low	152 Å²	152	83 Å²	83	70%	0.704	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-5.5	-177	-94.9	-68.7	0	0	0	115.9	N14 F15 A16	N14-H18 PolarHBondContact O-CD2 2.9Å; N14-H18 VanDerWaalsContact O-CD2 3.29Å; N14-H18 PolarHBondContact O-N 2.87Å; F15-H18 PolarHBondContact O-N 3.37Å; A16-H18 VanDerWaalsContact C-N 3.35Å
19	V	44.9	Very low	62.2	Low	112 Å²	112	78.3 Å²	78.3	68%	0.679	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115.1	9.6	174	-168.6	0	0	0	0	112.5	S17	S17-V19 PolarHBondContact O-N 3.11Å
20	S	41.9	Very low	63.3	Low	90 Å²	90	79 Å²	79	63%	0.629	45%	0.446	S	S	*	.	S	Bend	trans	-95.4	99.3	149.7	-170.3	0	0	0	0	106.2	G22	S20-G22 PolarHBondContact O-N 2.75Å
21	T	47.9	Very low	64.5	Low	64 Å²	64	75.5 Å²	75.5	39%	0.393	43%	0.432	S	S	.	.			trans	-65.2	96.2	179.7	45.2	0	0	0	0	110.4	Y227	T21-Y227 HydrophobicContact CG2-CE1 4.46Å
22	G	50.1	Low	65.5	Low	53 Å²	53	78.7 Å²	78.7	55%	0.546	44%	0.444	S	S	.	.	S	Bend	trans	73.2	156.9	152.1	0	0	0	0	0	115.3	S20 T24	S20-G22 PolarHBondContact O-N 2.75Å; G22-T24 PolarHBondContact O-N 2.92Å
23	D	60	Low	67	Low	108 Å²	108	78.3 Å²	78.3	58%	0.578	44%	0.435	S	S	*	.			trans	-38.5	131.1	164.1	-68.4	-39.9	0	0	0	109.7	Y25 N224	D23-Y25 WeakPolarHBondContact CB-O 3.49Å; D23-Y25 PolarHBondContact O-N 3.25Å; D23-N224 PolarHBondContact O-ND2 3.18Å
24	T	83.2	Confident	68.7	Low	93 Å²	93	74.1 Å²	74.1	57%	0.571	41%	0.413	S	S	*	.	S	Bend	trans	-56.8	-16.5	-178.1	37.3	0	0	0	0	112.6	G22 R223 N224	G22-T24 PolarHBondContact O-N 2.92Å; T24-R223 WeakPolarHBondContact O-CA 3.09Å; T24-N224 PolarHBondContact O-N 2.92Å
25	Y	92.1	Very high	70.9	Confident	102 Å²	102	69.6 Å²	69.6	40%	0.4	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	155.9	-179.6	-57.3	-98	0	0	0	111.1	D23 P221 Y222 R223	D23-Y25 WeakPolarHBondContact CB-O 3.49Å; D23-Y25 PolarHBondContact O-N 3.25Å; Y25-P221 HydrophobicContact CD1-CG 4.26Å; Y25-P221 HydrophobicContact CG-CG 4.13Å; Y25-Y222 CarbonylContact C-O 3.52Å; Y25-Y222 VanDerWaalsContact CA-O 3.24Å; Y25-Y222 WeakPolarHBondContact CA-O 3.42Å; Y25-R223 HydrophobicContact CD1-CB 3.95Å; Y25-R223 HydrophobicContact CE1-CB 3.79Å; Y25-R223 HydrophobicContact CE1-CG 4.27Å
26	R	92.3	Very high	73.2	Confident	39 Å²	39	62.5 Å²	62.5	15%	0.147	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	155	170.9	72.7	176.9	178.1	166.5	7	113.3	E30 Y222 N224 Y257 G258	R26-E30 VanDerWaalsContact CA-OE2 3.22Å; R26-E30 WeakPolarHBondContact CA-OE2 3.19Å; R26-E30 WeakPolarHBondContact CB-OE2 3.31Å; R26-Y222 PolarHBondContact N-O 3.12Å; R26-Y222 PolarHBondContact O-N 3.45Å; R26-N224 WeakPolarHBondContact CD-OD1 3.42Å; R26-N224 WeakPolarHBondContact CG-OD1 3.44Å; R26-Y257 PolarHBondContact NE-O 2.96Å; R26-Y257 PolarHBondContact NH2-O 2.99Å; R26-G258 PolarHBondContact NH2-O 2.65Å
27	C	94.6	Very high	75.6	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.329	C	S	.	.			trans	-85.4	153	169.7	-64.5	0	0	0	0	112	S29 E30 G31 C43	C27-S29 PolarHBondContact O-N 3.01Å; C27-E30 HydrophobicContact CB-CG 4.28Å; C27-E30 PolarHBondContact N-OE2 3.4Å; C27-E30 PolarHBondContact O-N 2.8Å; C27-E30 VanDerWaalsContact O-N 3.15Å; C27-G31 PolarHBondContact O-N 2.97Å; C27-C43 WeakPolarHBondContact CA-SG 3.39Å; C27-C43 HydrophobicContact CB-CB 3.76Å; C27-C43 WeakPolarHBondContact CB-SG 3.2Å; C27-C43 VanDerWaalsContact SG-CA 3.52Å; C27-C43 WeakPolarHBondContact SG-CB 3.16Å; C27-C43 CovalentContact SG-SG 2.03Å; C27-C43 PolarHBondContact SG-SG 3.08Å
28	P	92.9	Very high	78.3	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-35.5	174.4	-28.1	35.5	0	0	0	114.1	G31 K32 M33 E34 T45 F70 Y257	P28-G31 CarbonylContact O-C 3.54Å; P28-G31 PolarHBondContact O-N 3.35Å; P28-K32 PolarHBondContact O-N 2.92Å; P28-M33 PolarHBondContact O-N 3.31Å; P28-E34 HydrophobicContact CB-CB 3.92Å; P28-E34 HydrophobicContact CB-CG 4.17Å; P28-T45 HydrophobicContact CB-CG2 4.47Å; P28-F70 HydrophobicContact CG-CE1 4.45Å; P28-Y257 HydrophobicContact CB-CD1 3.61Å; P28-Y257 HydrophobicContact CB-CD2 4.4Å; P28-Y257 HydrophobicContact CB-CE1 3.78Å; P28-Y257 HydrophobicContact CB-CG 3.95Å; P28-Y257 HydrophobicContact CG-CD1 3.84Å; P28-Y257 HydrophobicContact CG-CD2 3.72Å; P28-Y257 HydrophobicContact CG-CE1 4.08Å; P28-Y257 HydrophobicContact CG-CE2 3.94Å; P28-Y257 HydrophobicContact CG-CG 3.66Å
29	S	91.9	Very high	80.8	Confident	8 Å²	8	54.1 Å²	54.1	6%	0.056	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-39.7	178.6	48.3	0	0	0	0	113.3	C27 G31 K32 E34 G36	C27-S29 PolarHBondContact O-N 3.01Å; S29-G31 VanDerWaalsContact C-N 3.25Å; S29-G31 PolarHBondContact O-N 3.26Å; S29-K32 WeakPolarHBondContact O-CA 3.37Å; S29-K32 PolarHBondContact O-N 2.9Å; S29-E34 WeakPolarHBondContact CA-O 3.2Å; S29-G36 WeakPolarHBondContact CB-O 3.49Å
30	E	91.4	Very high	83	Confident	89 Å²	89	51.7 Å²	51.7	42%	0.416	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-34.9	174.8	-63.8	175.3	129.3	0	0	111.1	R26 C27 K32 K38	R26-E30 VanDerWaalsContact CA-OE2 3.22Å; R26-E30 WeakPolarHBondContact CA-OE2 3.19Å; R26-E30 WeakPolarHBondContact CB-OE2 3.31Å; C27-E30 HydrophobicContact CB-CG 4.28Å; C27-E30 PolarHBondContact N-OE2 3.4Å; C27-E30 PolarHBondContact O-N 2.8Å; C27-E30 VanDerWaalsContact O-N 3.15Å; E30-K32 PolarHBondContact O-N 3.39Å; E30-K38 IonicContact OE1-NZ 3.95Å
31	G	88.1	Confident	85.4	Confident	21 Å²	21	55.8 Å²	55.8	22%	0.216	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	0.3	171.4	0	0	0	0	0	114.7	C27 P28 S29 M33	C27-G31 PolarHBondContact O-N 2.97Å; P28-G31 CarbonylContact O-C 3.54Å; P28-G31 PolarHBondContact O-N 3.35Å; S29-G31 VanDerWaalsContact C-N 3.25Å; S29-G31 PolarHBondContact O-N 3.26Å; G31-M33 WeakPolarHBondContact O-CG 3.25Å; G31-M33 PolarHBondContact O-N 3.29Å
32	K	88.7	Confident	87.6	Confident	146 Å²	146	55.3 Å²	55.3	64%	0.635	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	58	23.8	-173.8	-63.9	-171.9	-178.6	179.4	0	114.3	P28 S29 E30 Y90	P28-K32 PolarHBondContact O-N 2.92Å; S29-K32 WeakPolarHBondContact O-CA 3.37Å; S29-K32 PolarHBondContact O-N 2.9Å; E30-K32 PolarHBondContact O-N 3.39Å; K32-Y90 VanDerWaalsContact CA-CZ 3.46Å; K32-Y90 HydrophobicContact CB-CE1 3.98Å; K32-Y90 HydrophobicContact CB-CE2 3.88Å; K32-Y90 VanDerWaalsContact CB-CZ 3.49Å; K32-Y90 WeakPolarHBondContact CB-OH 3.43Å; K32-Y90 HydrophobicContact CD-CE2 4.05Å; K32-Y90 HydrophobicContact CG-CD2 4.12Å; K32-Y90 HydrophobicContact CG-CE1 4.46Å; K32-Y90 HydrophobicContact CG-CE2 3.63Å; K32-Y90 WeakPolarHBondContact O-CE1 3.29Å; K32-Y90 PolarHBondContact O-OH 3.33Å
33	M	85.1	Confident	89.8	Confident	67 Å²	67	52.8 Å²	52.8	33%	0.33	27%	0.273	S	S	.	.	S	Bend	trans	-89.8	-37.7	-171.9	-61.4	-173.2	177.6	0	0	112.9	P28 G31 K92 Y257	P28-M33 PolarHBondContact O-N 3.31Å; G31-M33 WeakPolarHBondContact O-CG 3.25Å; G31-M33 PolarHBondContact O-N 3.29Å; M33-K92 VanDerWaalsContact O-CD 3.26Å; M33-K92 WeakPolarHBondContact O-CD 3.47Å; M33-K92 PolarHBondContact O-NZ 2.75Å; M33-Y257 HydrophobicContact CB-CD1 4.02Å; M33-Y257 HydrophobicContact CB-CE1 4.15Å; M33-Y257 HydrophobicContact CG-CD1 4.46Å; M33-Y257 HydrophobicContact SD-CD1 3.69Å; M33-Y257 HydrophobicContact SD-CE1 4.49Å
34	E	88.5	Confident	91.5	Very high	23 Å²	23	47.6 Å²	47.6	11%	0.107	25%	0.245	C	C	.	.	S	Bend	trans	-138.8	153.8	-177.6	-65.7	-70.1	175.6	0	0	110.5	P28 S29 G36 T45 K47 Y90 R94 Y257	P28-E34 HydrophobicContact CB-CB 3.92Å; P28-E34 HydrophobicContact CB-CG 4.17Å; S29-E34 WeakPolarHBondContact CA-O 3.2Å; E34-G36 PolarHBondContact O-N 3.13Å; E34-T45 HydrophobicContact CB-CG2 3.57Å; E34-T45 HydrophobicContact CG-CG2 4.21Å; E34-K47 IonicContact OE1-NZ 2.74Å; E34-K47 PolarHBondContact OE1-NZ 3.2Å; E34-Y90 VanDerWaalsContact O-CD1 3.27Å; E34-Y90 WeakPolarHBondContact O-CD1 3.39Å; E34-R94 IonicContact OE2-CZ 2.84Å; E34-R94 IonicContact OE2-NH1 3.03Å; E34-R94 IonicContact OE2-NH2 3.97Å; E34-R94 PolarHBondContact OE2-NH2 3.27Å; E34-Y257 HydrophobicContact CG-CE1 3.8Å
35	T	90	Very high	92	Very high	3 Å²	3	43.2 Å²	43.2	2%	0.018	22%	0.218	C	C	.	.	S	Bend	trans	-65.1	129	173.7	-65.8	0	0	0	0	110.1	T45 W46 L89 Y90 Y91 K92	T35-T45 WeakPolarHBondContact O-CA 3.35Å; T35-W46 HydrophobicContact CG2-CB 4.07Å; T35-W46 HydrophobicContact CG2-CD2 4.46Å; T35-W46 HydrophobicContact CG2-CE3 4.42Å; T35-W46 HydrophobicContact CG2-CG 4.32Å; T35-W46 PolarHBondContact O-N 2.98Å; T35-L89 HydrophobicContact CG2-CD1 3.99Å; T35-Y90 CarbonylContact C-O 3.4Å; T35-Y90 VanDerWaalsContact CA-O 3.23Å; T35-Y90 WeakPolarHBondContact CA-O 3.31Å; T35-Y91 HydrophobicContact CG2-CD2 3.85Å; T35-K92 PolarHBondContact OG1-N 3.3Å; T35-K92 PolarHBondContact OG1-O 2.82Å
36	G	93.9	Very high	91.9	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.6	-173.9	-177.4	0	0	0	0	0	114.5	S29 E34 V44 Y90	S29-G36 WeakPolarHBondContact CB-O 3.49Å; E34-G36 PolarHBondContact O-N 3.13Å; G36-V44 CarbonylContact C-O 3.58Å; G36-V44 WeakPolarHBondContact CA-O 3.12Å; G36-Y90 PolarHBondContact N-O 2.85Å; G36-Y90 PolarHBondContact O-N 3.02Å
37	Y	94.6	Very high	91.7	Very high	2 Å²	2	38.7 Å²	38.7	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	170.6	177.8	59	-87.9	0	0	0	111	L39 V44 W46 I84 K85 E88 L89	Y37-L39 HydrophobicContact CD2-CB 4.44Å; Y37-L39 HydrophobicContact CE2-CB 4.09Å; Y37-L39 HydrophobicContact CE2-CD1 4.37Å; Y37-V44 HydrophobicContact CD1-CB 4.41Å; Y37-V44 HydrophobicContact CD2-CB 4.42Å; Y37-V44 HydrophobicContact CE1-CB 4.01Å; Y37-V44 HydrophobicContact CE1-CG1 4.02Å; Y37-V44 HydrophobicContact CE2-CB 4.02Å; Y37-V44 HydrophobicContact CE2-CG2 3.89Å; Y37-V44 PolarHBondContact N-O 2.79Å; Y37-V44 PolarHBondContact O-N 3.23Å; Y37-W46 HydrophobicContact CD1-CH2 4.44Å; Y37-W46 AromaticContact CD1-CZ3 3.97Å; Y37-W46 HydrophobicContact CD1-CZ3 3.97Å; Y37-W46 AromaticContact CE1-CH2 3.64Å; Y37-W46 HydrophobicContact CE1-CH2 3.64Å; Y37-W46 AromaticContact CE1-CZ3 3.57Å; Y37-W46 HydrophobicContact CE1-CZ3 3.57Å; Y37-I84 HydrophobicContact CE1-CG2 3.78Å; Y37-K85 HydrophobicContact CD2-CB 3.91Å; Y37-K85 HydrophobicContact CD2-CD 4.21Å; Y37-K85 HydrophobicContact CD2-CG 4.35Å; Y37-K85 HydrophobicContact CE2-CB 3.8Å; Y37-K85 HydrophobicContact CE2-CD 4.2Å; Y37-K85 HydrophobicContact CE2-CG 3.99Å; Y37-K85 HydrophobicContact CG-CB 4.36Å; Y37-E88 WeakPolarHBondContact CB-O 3.06Å; Y37-L89 HydrophobicContact CD1-CD1 3.93Å
38	K	93.9	Very high	91	Very high	67 Å²	67	42.9 Å²	42.9	29%	0.291	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.6	176.3	-172.1	172.5	-177	175.1	0	109.8	E30	E30-K38 IonicContact OE1-NZ 3.95Å
39	L	92.1	Very high	90.2	Very high	50 Å²	50	44 Å²	44	26%	0.262	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	92.9	179.5	-176.7	64.1	0	0	0	109.2	Y37 E41 E42 V44 Y76 K85 I218	Y37-L39 HydrophobicContact CD2-CB 4.44Å; Y37-L39 HydrophobicContact CE2-CB 4.09Å; Y37-L39 HydrophobicContact CE2-CD1 4.37Å; L39-E41 PolarHBondContact O-N 3.14Å; L39-E42 PolarHBondContact N-O 3.19Å; L39-E42 PolarHBondContact O-N 3.17Å; L39-V44 HydrophobicContact CB-CG2 3.83Å; L39-V44 HydrophobicContact CD2-CG2 3.9Å; L39-Y76 HydrophobicContact CD2-CE2 3.71Å; L39-K85 HydrophobicContact CD1-CD 4.37Å; L39-I218 HydrophobicContact CD2-CD1 4.17Å
40	G	90.5	Very high	88.8	Confident	60 Å²	60	49.2 Å²	49.2	62%	0.619	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	-120.1	-173.1	0	0	0	0	0	110.9
41	E	91.1	Very high	87.1	Confident	177 Å²	177	46 Å²	46	83%	0.827	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	-8	175.4	-61.6	-169.1	145.7	0	0	113.4	L39 P221	L39-E41 PolarHBondContact O-N 3.14Å; E41-P221 VanDerWaalsContact O-CD 3.23Å; E41-P221 WeakPolarHBondContact O-CD 3.12Å; E41-P221 WeakPolarHBondContact O-CG 3.03Å
42	E	95	Very high	85.2	Confident	53 Å²	53	48.6 Å²	48.6	25%	0.248	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	168.9	-179.7	-64.2	-170.3	110.8	0	0	111.9	L39 R74 I218	L39-E42 PolarHBondContact N-O 3.19Å; L39-E42 PolarHBondContact O-N 3.17Å; E42-R74 VanDerWaalsContact CD-NH2 3.28Å; E42-R74 IonicContact OE1-CZ 2.78Å; E42-R74 VanDerWaalsContact OE1-CZ 3.23Å; E42-R74 IonicContact OE1-NH1 2.9Å; E42-R74 PolarHBondContact OE1-NH1 2.97Å; E42-R74 IonicContact OE1-NH2 3.99Å; E42-R74 PolarHBondContact OE1-NH2 3.11Å; E42-R74 IonicContact OE2-NH2 3.44Å; E42-R74 PolarHBondContact OE2-NH2 3.32Å; E42-I218 HydrophobicContact CB-CD1 4.06Å; E42-I218 HydrophobicContact CB-CG1 3.87Å; E42-I218 HydrophobicContact CG-CG1 4.47Å; E42-I218 WeakPolarHBondContact OE2-CD1 3.32Å
43	C	95.8	Very high	83.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	135.7	175.8	-56.3	0	0	0	0	110.1	C27 I218 H219 P221	C27-C43 WeakPolarHBondContact CA-SG 3.39Å; C27-C43 HydrophobicContact CB-CB 3.76Å; C27-C43 WeakPolarHBondContact CB-SG 3.2Å; C27-C43 VanDerWaalsContact SG-CA 3.52Å; C27-C43 WeakPolarHBondContact SG-CB 3.16Å; C27-C43 CovalentContact SG-SG 2.03Å; C27-C43 PolarHBondContact SG-SG 3.08Å; C43-I218 CarbonylContact O-C 3.27Å; C43-I218 VanDerWaalsContact O-CA 3.27Å; C43-I218 WeakPolarHBondContact O-CA 3.27Å; C43-H219 WeakPolarHBondContact CB-CE1 3.26Å; C43-H219 PolarHBondContact N-O 2.8Å; C43-H219 PolarHBondContact O-N 2.94Å; C43-P221 VanDerWaalsContact SG-CA 3.55Å; C43-P221 VanDerWaalsContact SG-CB 3.59Å
44	V	95.3	Very high	81.6	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	119.8	169.4	-175.5	0	0	0	0	108.2	G36 Y37 L39 W46 Y76 T216 C217 I218	G36-V44 CarbonylContact C-O 3.58Å; G36-V44 WeakPolarHBondContact CA-O 3.12Å; Y37-V44 HydrophobicContact CD1-CB 4.41Å; Y37-V44 HydrophobicContact CD2-CB 4.42Å; Y37-V44 HydrophobicContact CE1-CB 4.01Å; Y37-V44 HydrophobicContact CE1-CG1 4.02Å; Y37-V44 HydrophobicContact CE2-CB 4.02Å; Y37-V44 HydrophobicContact CE2-CG2 3.89Å; Y37-V44 PolarHBondContact N-O 2.79Å; Y37-V44 PolarHBondContact O-N 3.23Å; L39-V44 HydrophobicContact CB-CG2 3.83Å; L39-V44 HydrophobicContact CD2-CG2 3.9Å; V44-W46 HydrophobicContact CB-CZ3 4.37Å; V44-W46 HydrophobicContact CG1-CE3 4.34Å; V44-W46 HydrophobicContact CG1-CH2 3.76Å; V44-W46 HydrophobicContact CG1-CZ3 3.5Å; V44-Y76 HydrophobicContact CG1-CD1 3.75Å; V44-Y76 HydrophobicContact CG1-CE1 4.14Å; V44-Y76 HydrophobicContact CG1-CG 4.06Å; V44-Y76 HydrophobicContact CG2-CD1 4.47Å; V44-Y76 HydrophobicContact CG2-CD2 4.26Å; V44-Y76 HydrophobicContact CG2-CE1 4.41Å; V44-Y76 HydrophobicContact CG2-CE2 4.19Å; V44-Y76 HydrophobicContact CG2-CG 4.4Å; V44-T216 HydrophobicContact CG1-CG2 3.42Å; V44-T216 VanDerWaalsContact CG1-CG2 3.42Å; V44-C217 CarbonylContact C-O 3.12Å; V44-C217 WeakPolarHBondContact CA-O 3.39Å; V44-I218 HydrophobicContact CG2-CD1 4.45Å; V44-I218 HydrophobicContact CG2-CG1 4.38Å
45	T	93.5	Very high	79.8	Confident	0 Å²	0	50 Å²	50	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	133.2	-174.3	-57	0	0	0	0	111.2	P28 E34 T35 F70 C217 H219	P28-T45 HydrophobicContact CB-CG2 4.47Å; E34-T45 HydrophobicContact CB-CG2 3.57Å; E34-T45 HydrophobicContact CG-CG2 4.21Å; T35-T45 WeakPolarHBondContact O-CA 3.35Å; T45-F70 HydrophobicContact CG2-CE1 3.84Å; T45-F70 HydrophobicContact CG2-CE2 4.46Å; T45-F70 HydrophobicContact CG2-CZ 3.52Å; T45-C217 PolarHBondContact N-O 2.82Å; T45-C217 PolarHBondContact O-N 3.39Å; T45-H219 WeakPolarHBondContact CB-NE2 3.5Å; T45-H219 PolarHBondContact OG1-NE2 2.88Å
46	W	91.1	Very high	78.4	Confident	1 Å²	1	54.5 Å²	54.5	0%	0.004	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	123	171.9	-81.6	-106.6	0	0	0	109.9	T35 Y37 V44 I84 L89 R94 Y188 D214 V215 T216	T35-W46 HydrophobicContact CG2-CB 4.07Å; T35-W46 HydrophobicContact CG2-CD2 4.46Å; T35-W46 HydrophobicContact CG2-CE3 4.42Å; T35-W46 HydrophobicContact CG2-CG 4.32Å; T35-W46 PolarHBondContact O-N 2.98Å; Y37-W46 HydrophobicContact CD1-CH2 4.44Å; Y37-W46 AromaticContact CD1-CZ3 3.97Å; Y37-W46 HydrophobicContact CD1-CZ3 3.97Å; Y37-W46 AromaticContact CE1-CH2 3.64Å; Y37-W46 HydrophobicContact CE1-CH2 3.64Å; Y37-W46 AromaticContact CE1-CZ3 3.57Å; Y37-W46 HydrophobicContact CE1-CZ3 3.57Å; V44-W46 HydrophobicContact CB-CZ3 4.37Å; V44-W46 HydrophobicContact CG1-CE3 4.34Å; V44-W46 HydrophobicContact CG1-CH2 3.76Å; V44-W46 HydrophobicContact CG1-CZ3 3.5Å; W46-I84 HydrophobicContact CH2-CD1 4.28Å; W46-I84 HydrophobicContact CH2-CG1 4.26Å; W46-I84 HydrophobicContact CH2-CG2 3.99Å; W46-I84 HydrophobicContact CZ2-CD1 3.86Å; W46-I84 HydrophobicContact CZ2-CG1 4.33Å; W46-I84 HydrophobicContact CZ2-CG2 4.46Å; W46-L89 HydrophobicContact CE3-CD1 4.27Å; W46-L89 HydrophobicContact CZ3-CD1 4.06Å; W46-R94 PolarHBondContact O-NH2 3.28Å; W46-Y188 AromaticContact NE1-CE2 3.85Å; W46-Y188 AromaticContact NE1-CZ 3.69Å; W46-Y188 PolarHBondContact NE1-OH 3.43Å; W46-D214 HydrophobicContact CB-CB 4.36Å; W46-V215 WeakPolarHBondContact CA-O 3.23Å; W46-T216 HydrophobicContact CD2-CG2 3.92Å; W46-T216 VanDerWaalsContact CE2-OG1 3.24Å; W46-T216 HydrophobicContact CE3-CG2 4.04Å; W46-T216 HydrophobicContact CH2-CG2 3.58Å; W46-T216 HydrophobicContact CZ2-CG2 3.49Å; W46-T216 VanDerWaalsContact CZ2-CG2 3.49Å; W46-T216 HydrophobicContact CZ3-CG2 3.88Å; W46-T216 PolarHBondContact NE1-OG1 2.8Å; W46-T216 VanDerWaalsContact NE1-OG1 3.09Å
47	K	87.2	Confident	77.1	Confident	45 Å²	45	55.1 Å²	55.1	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.4	177.9	-165.3	74.2	167.5	-174.1	0	110.5	E34 Y49 F65 T69 F70 D214 V215	E34-K47 IonicContact OE1-NZ 2.74Å; E34-K47 PolarHBondContact OE1-NZ 3.2Å; K47-Y49 PolarHBondContact O-N 3.11Å; K47-F65 HydrophobicContact CB-CE1 3.99Å; K47-F65 HydrophobicContact CB-CZ 4.02Å; K47-F65 HydrophobicContact CG-CE1 4.14Å; K47-F65 HydrophobicContact CG-CZ 3.66Å; K47-T69 HydrophobicContact CD-CG2 4.35Å; K47-T69 HydrophobicContact CG-CG2 4.11Å; K47-F70 HydrophobicContact CB-CE2 4.01Å; K47-F70 HydrophobicContact CB-CZ 4.04Å; K47-F70 HydrophobicContact CD-CZ 4.2Å; K47-F70 HydrophobicContact CG-CE2 4.5Å; K47-F70 HydrophobicContact CG-CZ 4.36Å; K47-D214 WeakPolarHBondContact O-CA 3.4Å; K47-V215 PolarHBondContact N-O 2.67Å; K47-V215 PolarHBondContact O-N 3.43Å
48	R	81.3	Confident	76.1	Confident	88 Å²	88	55.9 Å²	55.9	33%	0.332	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	125.8	173.3	-175.7	168.1	173	169	-13.9	110.7	V50 D212 D214	R48-V50 HydrophobicContact CG-CG2 3.95Å; R48-D212 HydrophobicContact CG-CB 4.44Å; R48-D212 IonicContact CZ-OD1 2.97Å; R48-D212 IonicContact CZ-OD2 3.96Å; R48-D212 IonicContact NE-OD1 3.66Å; R48-D212 PolarHBondContact NE-OD1 3.11Å; R48-D212 IonicContact NE-OD2 3.95Å; R48-D212 IonicContact NH1-OD2 3.55Å; R48-D212 PolarHBondContact NH1-OD2 3.14Å; R48-D212 IonicContact NH2-OD1 3.78Å; R48-D212 PolarHBondContact NH2-OD1 3.33Å; R48-D212 IonicContact NH2-OD2 3.13Å; R48-D212 PolarHBondContact NH2-OD2 3.22Å; R48-D214 WeakPolarHBondContact CA-OD1 3.38Å; R48-D214 WeakPolarHBondContact CB-OD1 3.39Å; R48-D214 PolarHBondContact N-OD1 2.97Å
49	Y	74.5	Confident	75.2	Confident	23 Å²	23	52.8 Å²	52.8	9%	0.09	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	114.2	176.9	-175.9	-108.9	0	0	0	109	K47 G51 T61 F65 H213 V215	K47-Y49 PolarHBondContact O-N 3.11Å; Y49-G51 WeakPolarHBondContact CE1-O 3.19Å; Y49-T61 WeakPolarHBondContact OH-CG2 3.31Å; Y49-F65 HydrophobicContact CD2-CB 4.13Å; Y49-F65 AromaticContact CD2-CD1 3.86Å; Y49-F65 HydrophobicContact CD2-CD1 3.86Å; Y49-F65 AromaticContact CD2-CD2 3.64Å; Y49-F65 HydrophobicContact CD2-CD2 3.64Å; Y49-F65 HydrophobicContact CD2-CE1 4.12Å; Y49-F65 AromaticContact CD2-CE2 3.92Å; Y49-F65 HydrophobicContact CD2-CE2 3.92Å; Y49-F65 AromaticContact CD2-CG 3.59Å; Y49-F65 HydrophobicContact CD2-CG 3.59Å; Y49-F65 HydrophobicContact CD2-CZ 4.14Å; Y49-F65 HydrophobicContact CE2-CB 3.88Å; Y49-F65 HydrophobicContact CE2-CD1 4.47Å; Y49-F65 AromaticContact CE2-CD2 3.91Å; Y49-F65 HydrophobicContact CE2-CD2 3.91Å; Y49-F65 AromaticContact CE2-CG 3.83Å; Y49-F65 HydrophobicContact CE2-CG 3.83Å; Y49-H213 WeakPolarHBondContact CB-O 3.48Å; Y49-H213 PolarHBondContact N-O 2.64Å; Y49-V215 HydrophobicContact CD2-CG2 4.35Å; Y49-V215 HydrophobicContact CG-CG2 3.9Å
50	V	63.5	Low	74.4	Confident	118 Å²	118	51.7 Å²	51.7	72%	0.715	30%	0.296	S	S	*	.			trans	-113.1	81.5	178.1	-168.9	0	0	0	0	106.7	R48	R48-V50 HydrophobicContact CG-CG2 3.95Å
51	G	55.9	Low	73.8	Confident	22 Å²	22	50.7 Å²	50.7	23%	0.227	28%	0.278	C	S	.	.			trans	-164.3	119.2	-179.5	0	0	0	0	0	111.4	Y49	Y49-G51 WeakPolarHBondContact CE1-O 3.19Å
52	F	48.7	Very low	73.3	Confident	75 Å²	75	42.3 Å²	42.3	33%	0.329	24%	0.239	S	C	.	.			trans	-142.9	105.1	170.3	-64.2	-66.5	0	0	0	108.2	L207 T209	F52-L207 HydrophobicContact CD1-CB 3.8Å; F52-L207 WeakPolarHBondContact CD1-O 3.36Å; F52-L207 HydrophobicContact CE1-CB 3.17Å; F52-L207 HydrophobicContact CE1-CD1 3.94Å; F52-L207 HydrophobicContact CE1-CG 4.19Å; F52-L207 WeakPolarHBondContact CG-O 3.5Å; F52-L207 HydrophobicContact CZ-CB 3.65Å; F52-T209 HydrophobicContact CD2-CG2 4.16Å
53	G	46.4	Very low	72.7	Confident	62 Å²	62	41.2 Å²	41.2	64%	0.639	24%	0.235	S	C	*	.			trans	162.7	95.9	175.1	0	0	0	0	0	112.3	R395	G53-R395 PolarHBondContact O-NE 3.21Å; G53-R395 VanDerWaalsContact O-NE 3.09Å; G53-R395 PolarHBondContact O-NH2 3.11Å
54	G	50.8	Low	72	Confident	45 Å²	45	44.9 Å²	44.9	46%	0.464	25%	0.254	S	S	.	.			trans	-177.9	133.6	-173	0	0	0	0	0	112.1	R56	G54-R56 PolarHBondContact O-N 2.64Å
55	D	51.6	Low	71.4	Confident	160 Å²	160	47 Å²	47	86%	0.856	26%	0.263	S	S	*	.	S	Bend	trans	-77.2	5.6	161.3	-55.4	-40.4	0	0	0	111.3
56	R	58.8	Low	71.2	Confident	97 Å²	97	47 Å²	47	37%	0.366	26%	0.263	S	S	.	.	S	Bend	trans	-88.9	138.8	-179.1	-168.2	175.4	180	-169.7	-10.5	109.7	G54 L58 D60 D64	G54-R56 PolarHBondContact O-N 2.64Å; R56-L58 PolarHBondContact O-N 3.46Å; R56-D60 HydrophobicContact CG-CB 4.26Å; R56-D60 IonicContact NE-OD2 2.64Å; R56-D60 IonicContact NH2-OD2 2.77Å; R56-D64 IonicContact CZ-OD2 2.67Å; R56-D64 IonicContact NH1-OD2 2.78Å; R56-D64 PolarHBondContact NH1-OD2 3.11Å; R56-D64 VanDerWaalsContact NH2-CG 3.34Å; R56-D64 IonicContact NH2-OD1 3.9Å; R56-D64 PolarHBondContact NH2-OD1 2.81Å; R56-D64 IonicContact NH2-OD2 2.85Å; R56-D64 PolarHBondContact NH2-OD2 2.95Å
57	F	68.4	Low	71	Confident	13 Å²	13	48.9 Å²	48.9	6%	0.057	28%	0.284	C	S	.	.			trans	-51.8	137	176.4	176.6	-113.7	0	0	0	112.9	G59 D60 T61 F108 Q133 W183	F57-G59 PolarHBondContact O-N 3.31Å; F57-D60 HydrophobicContact CD1-CB 4.43Å; F57-D60 WeakPolarHBondContact O-CB 3.38Å; F57-D60 PolarHBondContact O-N 3.16Å; F57-T61 PolarHBondContact O-N 2.92Å; F57-T61 VanDerWaalsContact O-N 3.14Å; F57-T61 PolarHBondContact O-OG1 2.82Å; F57-F108 HydrophobicContact CE1-CD2 4.08Å; F57-F108 HydrophobicContact CE1-CE2 4.42Å; F57-F108 HydrophobicContact CE2-CB 4.39Å; F57-F108 HydrophobicContact CE2-CG 4.43Å; F57-F108 HydrophobicContact CZ-CB 3.89Å; F57-F108 AromaticContact CZ-CD2 3.55Å; F57-F108 HydrophobicContact CZ-CD2 3.55Å; F57-F108 HydrophobicContact CZ-CE2 4.2Å; F57-F108 AromaticContact CZ-CG 3.75Å; F57-F108 HydrophobicContact CZ-CG 3.75Å; F57-Q133 HydrophobicContact CE1-CG 4.3Å; F57-Q133 HydrophobicContact CZ-CB 4.44Å; F57-W183 AromaticContact CD2-CD1 3.69Å; F57-W183 AromaticContact CD2-CD2 3.86Å; F57-W183 HydrophobicContact CD2-CD2 3.86Å; F57-W183 AromaticContact CD2-CE2 3.43Å; F57-W183 VanDerWaalsContact CD2-CE2 3.43Å; F57-W183 AromaticContact CD2-CG 3.98Å; F57-W183 HydrophobicContact CD2-CG 3.98Å; F57-W183 AromaticContact CD2-CZ2 3.86Å; F57-W183 HydrophobicContact CD2-CZ2 3.86Å; F57-W183 AromaticContact CD2-NE1 3.35Å; F57-W183 VanDerWaalsContact CD2-NE1 3.35Å; F57-W183 HydrophobicContact CE2-CB 4.36Å; F57-W183 AromaticContact CE2-CD1 3.76Å; F57-W183 AromaticContact CE2-CD2 3.19Å; F57-W183 HydrophobicContact CE2-CD2 3.19Å; F57-W183 AromaticContact CE2-CE2 3.18Å; F57-W183 AromaticContact CE2-CE3 3.61Å; F57-W183 HydrophobicContact CE2-CE3 3.61Å; F57-W183 AromaticContact CE2-CG 3.55Å; F57-W183 HydrophobicContact CE2-CG 3.55Å; F57-W183 AromaticContact CE2-CH2 3.94Å; F57-W183 HydrophobicContact CE2-CH2 3.94Å; F57-W183 AromaticContact CE2-CZ2 3.58Å; F57-W183 HydrophobicContact CE2-CZ2 3.58Å; F57-W183 AromaticContact CE2-CZ3 3.96Å; F57-W183 HydrophobicContact CE2-CZ3 3.96Å; F57-W183 AromaticContact CE2-NE1 3.56Å; F57-W183 HydrophobicContact CZ-CD2 4.08Å; F57-W183 HydrophobicContact CZ-CE3 4.04Å; F57-W183 HydrophobicContact CZ-CH2 4.06Å; F57-W183 HydrophobicContact CZ-CZ2 4.1Å; F57-W183 HydrophobicContact CZ-CZ3 4.04Å
58	L	72.6	Confident	70.8	Confident	18 Å²	18	50 Å²	50	9%	0.094	30%	0.301	C	S	.	.	H	α-helix	trans	-62.5	-39.7	-173.8	-177.6	63.1	0	0	0	112.7	R56 D60 T61 I62 F108 C185 C204 L207	R56-L58 PolarHBondContact O-N 3.46Å; L58-D60 PolarHBondContact O-N 2.91Å; L58-T61 WeakPolarHBondContact O-CB 3.19Å; L58-T61 PolarHBondContact O-N 3.49Å; L58-T61 VanDerWaalsContact O-N 3.16Å; L58-I62 HydrophobicContact CD1-CD1 4.06Å; L58-I62 HydrophobicContact CD1-CG1 4.19Å; L58-I62 HydrophobicContact CD2-CD1 4.21Å; L58-I62 HydrophobicContact CG-CD1 3.75Å; L58-I62 HydrophobicContact CG-CG1 4.3Å; L58-I62 WeakPolarHBondContact O-CB 3.24Å; L58-I62 WeakPolarHBondContact O-CG1 3.22Å; L58-I62 PolarHBondContact O-N 2.98Å; L58-F108 HydrophobicContact CD2-CE1 4.05Å; L58-F108 HydrophobicContact CG-CE1 4.35Å; L58-C185 VanDerWaalsContact CD2-SG 3.57Å; L58-C204 HydrophobicContact CB-CB 4.46Å; L58-C204 HydrophobicContact CD2-CB 3.57Å; L58-L207 HydrophobicContact CD2-CD1 4.03Å
59	G	75.1	Confident	70.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-65.9	-36.3	180	0	0	0	0	0	113.9	F57 T61 N63	F57-G59 PolarHBondContact O-N 3.31Å; G59-T61 VanDerWaalsContact C-N 3.33Å; G59-N63 WeakPolarHBondContact O-CB 3.11Å; G59-N63 PolarHBondContact O-N 3.18Å
60	D	76.2	Confident	71.6	Confident	28 Å²	28	46.7 Å²	46.7	15%	0.15	29%	0.293	C	S	.	.	H	α-helix	trans	-62.4	-45.2	170.7	-86.6	6.4	0	0	0	110.6	R56 F57 L58 I62 N63 D64 R504	R56-D60 HydrophobicContact CG-CB 4.26Å; R56-D60 IonicContact NE-OD2 2.64Å; R56-D60 IonicContact NH2-OD2 2.77Å; F57-D60 HydrophobicContact CD1-CB 4.43Å; F57-D60 WeakPolarHBondContact O-CB 3.38Å; F57-D60 PolarHBondContact O-N 3.16Å; L58-D60 PolarHBondContact O-N 2.91Å; D60-I62 VanDerWaalsContact C-N 3.34Å; D60-I62 PolarHBondContact O-N 3.13Å; D60-N63 PolarHBondContact O-N 3.44Å; D60-D64 PolarHBondContact O-N 2.87Å; D60-R504 IonicContact OD2-NH1 3.25Å; D60-R504 PolarHBondContact OD2-NH1 2.93Å
61	T	77	Confident	72.6	Confident	38 Å²	38	43.2 Å²	43.2	23%	0.233	27%	0.27	C	S	.	.	H	α-helix	trans	-64.7	-41.2	-177.4	-52.9	0	0	0	0	111	Y49 F57 L58 G59 F65	Y49-T61 WeakPolarHBondContact OH-CG2 3.31Å; F57-T61 PolarHBondContact O-N 2.92Å; F57-T61 VanDerWaalsContact O-N 3.14Å; F57-T61 PolarHBondContact O-OG1 2.82Å; L58-T61 WeakPolarHBondContact O-CB 3.19Å; L58-T61 PolarHBondContact O-N 3.49Å; L58-T61 VanDerWaalsContact O-N 3.16Å; G59-T61 VanDerWaalsContact C-N 3.33Å; T61-F65 WeakPolarHBondContact O-CB 3.06Å; T61-F65 PolarHBondContact O-N 3.06Å
62	I	80.4	Confident	74.3	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-64.8	-40.8	173.7	-77.5	172	0	0	0	111.3	L58 D60 F65 C66 R75 F104 F108 V215	L58-I62 HydrophobicContact CD1-CD1 4.06Å; L58-I62 HydrophobicContact CD1-CG1 4.19Å; L58-I62 HydrophobicContact CD2-CD1 4.21Å; L58-I62 HydrophobicContact CG-CD1 3.75Å; L58-I62 HydrophobicContact CG-CG1 4.3Å; L58-I62 WeakPolarHBondContact O-CB 3.24Å; L58-I62 WeakPolarHBondContact O-CG1 3.22Å; L58-I62 PolarHBondContact O-N 2.98Å; D60-I62 VanDerWaalsContact C-N 3.34Å; D60-I62 PolarHBondContact O-N 3.13Å; I62-F65 WeakPolarHBondContact O-CB 3.28Å; I62-F65 PolarHBondContact O-N 2.77Å; I62-C66 PolarHBondContact O-N 2.97Å; I62-C66 PolarHBondContact O-SG 3.47Å; I62-C66 VanDerWaalsContact O-SG 3.42Å; I62-R75 HydrophobicContact CG2-CB 3.93Å; I62-R75 HydrophobicContact CG2-CG 3.62Å; I62-F104 HydrophobicContact CD1-CD2 4.24Å; I62-F108 HydrophobicContact CD1-CE1 4.38Å; I62-F108 HydrophobicContact CD1-CZ 3.88Å; I62-V215 HydrophobicContact CD1-CG2 4.11Å; I62-V215 HydrophobicContact CG1-CG2 3.91Å; I62-V215 HydrophobicContact CG2-CG1 3.46Å; I62-V215 VanDerWaalsContact CG2-CG1 3.46Å; I62-V215 HydrophobicContact CG2-CG2 4.33Å
63	N	83.1	Confident	76.3	Confident	31 Å²	31	44.7 Å²	44.7	17%	0.166	28%	0.278	C	S	.	.	H	α-helix	trans	-65.7	-44.7	178.6	-169.9	66.9	0	0	0	112.1	G59 D60 F65 C66 G67 R74 R75 P136	G59-N63 WeakPolarHBondContact O-CB 3.11Å; G59-N63 PolarHBondContact O-N 3.18Å; D60-N63 PolarHBondContact O-N 3.44Å; N63-F65 VanDerWaalsContact C-N 3.28Å; N63-F65 PolarHBondContact O-N 2.97Å; N63-C66 PolarHBondContact O-N 2.85Å; N63-G67 PolarHBondContact O-N 2.95Å; N63-R74 WeakPolarHBondContact OD1-CA 2.95Å; N63-R74 WeakPolarHBondContact OD1-CB 3.33Å; N63-R75 PolarHBondContact OD1-N 3.39Å; N63-P136 HydrophobicContact CB-CB 3.98Å; N63-P136 HydrophobicContact CB-CG 3.68Å; N63-P136 WeakPolarHBondContact OD1-CG 3.44Å
64	D	81.3	Confident	78.3	Confident	77 Å²	77	45.4 Å²	45.4	41%	0.412	26%	0.261	S	S	.	.	H	α-helix	trans	-62.1	-39.1	174.8	-76.3	13.3	0	0	0	111.3	R56 D60 G67 A68	R56-D64 IonicContact CZ-OD2 2.67Å; R56-D64 IonicContact NH1-OD2 2.78Å; R56-D64 PolarHBondContact NH1-OD2 3.11Å; R56-D64 VanDerWaalsContact NH2-CG 3.34Å; R56-D64 IonicContact NH2-OD1 3.9Å; R56-D64 PolarHBondContact NH2-OD1 2.81Å; R56-D64 IonicContact NH2-OD2 2.85Å; R56-D64 PolarHBondContact NH2-OD2 2.95Å; D60-D64 PolarHBondContact O-N 2.87Å; D64-G67 PolarHBondContact O-N 2.77Å; D64-A68 VanDerWaalsContact O-CB 3.25Å; D64-A68 WeakPolarHBondContact O-CB 3.47Å; D64-A68 PolarHBondContact O-N 2.91Å
65	F	82.7	Confident	80	Confident	43 Å²	43	44 Å²	44	19%	0.189	24%	0.242	C	C	.	.	H	α-helix	trans	-59.7	-48.7	172.8	169.5	-100	0	0	0	111.9	K47 Y49 T61 I62 N63 G67 A68 T69 V215	K47-F65 HydrophobicContact CB-CE1 3.99Å; K47-F65 HydrophobicContact CB-CZ 4.02Å; K47-F65 HydrophobicContact CG-CE1 4.14Å; K47-F65 HydrophobicContact CG-CZ 3.66Å; Y49-F65 HydrophobicContact CD2-CB 4.13Å; Y49-F65 AromaticContact CD2-CD1 3.86Å; Y49-F65 HydrophobicContact CD2-CD1 3.86Å; Y49-F65 AromaticContact CD2-CD2 3.64Å; Y49-F65 HydrophobicContact CD2-CD2 3.64Å; Y49-F65 HydrophobicContact CD2-CE1 4.12Å; Y49-F65 AromaticContact CD2-CE2 3.92Å; Y49-F65 HydrophobicContact CD2-CE2 3.92Å; Y49-F65 AromaticContact CD2-CG 3.59Å; Y49-F65 HydrophobicContact CD2-CG 3.59Å; Y49-F65 HydrophobicContact CD2-CZ 4.14Å; Y49-F65 HydrophobicContact CE2-CB 3.88Å; Y49-F65 HydrophobicContact CE2-CD1 4.47Å; Y49-F65 AromaticContact CE2-CD2 3.91Å; Y49-F65 HydrophobicContact CE2-CD2 3.91Å; Y49-F65 AromaticContact CE2-CG 3.83Å; Y49-F65 HydrophobicContact CE2-CG 3.83Å; T61-F65 WeakPolarHBondContact O-CB 3.06Å; T61-F65 PolarHBondContact O-N 3.06Å; I62-F65 WeakPolarHBondContact O-CB 3.28Å; I62-F65 PolarHBondContact O-N 2.77Å; N63-F65 VanDerWaalsContact C-N 3.28Å; N63-F65 PolarHBondContact O-N 2.97Å; F65-G67 VanDerWaalsContact C-N 3.35Å; F65-G67 PolarHBondContact O-N 3.33Å; F65-A68 PolarHBondContact O-N 2.97Å; F65-T69 WeakPolarHBondContact O-CB 3.28Å; F65-T69 PolarHBondContact O-N 3.08Å; F65-T69 PolarHBondContact O-OG1 3.42Å; F65-V215 HydrophobicContact CD1-CB 4.32Å; F65-V215 HydrophobicContact CD1-CG1 4.18Å; F65-V215 HydrophobicContact CE1-CB 4.13Å; F65-V215 HydrophobicContact CE1-CG1 4.36Å
66	C	88.3	Confident	81.8	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.4	-43.1	176.8	-70.3	0	0	0	0	111.6	I62 N63 T69 F70 C217	I62-C66 PolarHBondContact O-N 2.97Å; I62-C66 PolarHBondContact O-SG 3.47Å; I62-C66 VanDerWaalsContact O-SG 3.42Å; N63-C66 PolarHBondContact O-N 2.85Å; C66-T69 PolarHBondContact O-N 2.81Å; C66-F70 PolarHBondContact O-N 3.13Å; C66-C217 WeakPolarHBondContact CA-SG 3.48Å; C66-C217 HydrophobicContact CB-CB 3.73Å; C66-C217 WeakPolarHBondContact CB-SG 3.14Å; C66-C217 VanDerWaalsContact SG-CA 3.6Å; C66-C217 WeakPolarHBondContact SG-CB 3.44Å; C66-C217 CovalentContact SG-SG 2.04Å; C66-C217 PolarHBondContact SG-SG 2.61Å
67	G	86.9	Confident	82.6	Confident	42 Å²	42	35 Å²	35	43%	0.433	21%	0.208	S	C	.	.	H	α-helix	trans	-68.8	-31.4	179.3	0	0	0	0	0	114	N63 D64 F65 G73	N63-G67 PolarHBondContact O-N 2.95Å; D64-G67 PolarHBondContact O-N 2.77Å; F65-G67 VanDerWaalsContact C-N 3.35Å; F65-G67 PolarHBondContact O-N 3.33Å; G67-G73 WeakPolarHBondContact CA-O 3.42Å; G67-G73 PolarHBondContact N-O 2.76Å
68	A	82.5	Confident	82.9	Confident	67 Å²	67	34.4 Å²	34.4	55%	0.554	21%	0.205	S	C	*	.	H	α-helix	trans	-76.8	-27.5	172.6	0	0	0	0	0	112.5	D64 F65 S359	D64-A68 VanDerWaalsContact O-CB 3.25Å; D64-A68 WeakPolarHBondContact O-CB 3.47Å; D64-A68 PolarHBondContact O-N 2.91Å; F65-A68 PolarHBondContact O-N 2.97Å; A68-S359 VanDerWaalsContact O-CB 3.3Å; A68-S359 WeakPolarHBondContact O-CB 3.46Å
69	T	83.7	Confident	82.7	Confident	35 Å²	35	34.2 Å²	34.2	22%	0.215	20%	0.204	C	C	.	.	H	α-helix	trans	-89.6	-38.3	-174.6	-57.7	0	0	0	0	112.8	K47 F65 C66	K47-T69 HydrophobicContact CD-CG2 4.35Å; K47-T69 HydrophobicContact CG-CG2 4.11Å; F65-T69 WeakPolarHBondContact O-CB 3.28Å; F65-T69 PolarHBondContact O-N 3.08Å; F65-T69 PolarHBondContact O-OG1 3.42Å; C66-T69 PolarHBondContact O-N 2.81Å
70	F	88.9	Confident	82.5	Confident	7 Å²	7	37.4 Å²	37.4	3%	0.031	22%	0.217	C	C	.	.	S	Bend	trans	-128.7	154.4	-171.5	-57.4	-75.1	0	0	0	112.9	P28 T45 K47 C66 D72 G73 C217 H219 Y222 Y257	P28-F70 HydrophobicContact CG-CE1 4.45Å; T45-F70 HydrophobicContact CG2-CE1 3.84Å; T45-F70 HydrophobicContact CG2-CE2 4.46Å; T45-F70 HydrophobicContact CG2-CZ 3.52Å; K47-F70 HydrophobicContact CB-CE2 4.01Å; K47-F70 HydrophobicContact CB-CZ 4.04Å; K47-F70 HydrophobicContact CD-CZ 4.2Å; K47-F70 HydrophobicContact CG-CE2 4.5Å; K47-F70 HydrophobicContact CG-CZ 4.36Å; C66-F70 PolarHBondContact O-N 3.13Å; F70-D72 PolarHBondContact O-N 3.41Å; F70-G73 PolarHBondContact O-N 2.8Å; F70-C217 HydrophobicContact CD2-CB 3.64Å; F70-C217 HydrophobicContact CE2-CB 3.73Å; F70-H219 HydrophobicContact CB-CB 3.44Å; F70-H219 VanDerWaalsContact CB-CB 3.44Å; F70-H219 VanDerWaalsContact CB-CG 3.47Å; F70-H219 AromaticContact CD1-CD2 3.68Å; F70-H219 AromaticContact CD1-CE1 3.85Å; F70-H219 AromaticContact CD1-NE2 3.53Å; F70-H219 AromaticContact CD2-CD2 3.99Å; F70-H219 AromaticContact CE1-NE2 3.83Å; F70-H219 HydrophobicContact CG-CB 4.22Å; F70-H219 AromaticContact CG-CD2 3.54Å; F70-H219 AromaticContact CG-CG 3.81Å; F70-H219 AromaticContact CG-NE2 3.93Å; F70-Y222 WeakPolarHBondContact CA-OH 3.28Å; F70-Y257 HydrophobicContact CD1-CE2 4.03Å; F70-Y257 AromaticContact CE1-CE2 3.89Å; F70-Y257 HydrophobicContact CE1-CE2 3.89Å
71	L	86.5	Confident	82.8	Confident	45 Å²	45	37 Å²	37	24%	0.236	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	123.3	177.2	-61.6	170.5	0	0	0	111	G73 H219 S220 Y222 Q254	L71-G73 PolarHBondContact O-N 3.18Å; L71-H219 WeakPolarHBondContact O-CB 3.19Å; L71-S220 PolarHBondContact O-N 2.97Å; L71-Y222 HydrophobicContact CD1-CD1 3.54Å; L71-Y222 HydrophobicContact CD1-CD2 4.15Å; L71-Y222 HydrophobicContact CD1-CE1 3.49Å; L71-Y222 VanDerWaalsContact CD1-CE1 3.49Å; L71-Y222 HydrophobicContact CD1-CE2 4.1Å; L71-Y222 HydrophobicContact CD1-CG 3.87Å; L71-Y222 HydrophobicContact CD2-CE1 4.39Å; L71-Y222 HydrophobicContact CG-CD1 4.21Å; L71-Y222 HydrophobicContact CG-CE1 3.62Å; L71-Y222 HydrophobicContact CG-CE2 4.28Å; L71-Y222 PolarHBondContact N-OH 3.12Å; L71-Q254 HydrophobicContact CD1-CG 4.05Å
72	D	89.7	Confident	83	Confident	120 Å²	120	41.9 Å²	41.9	64%	0.642	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	29.1	-174.7	-47	-52.4	0	0	0	112.2	F70 S220	F70-D72 PolarHBondContact O-N 3.41Å; D72-S220 WeakPolarHBondContact OD2-CB 3.36Å; D72-S220 PolarHBondContact OD2-OG 2.02Å
73	G	91.3	Very high	83	Confident	8 Å²	8	44.8 Å²	44.8	8%	0.082	25%	0.248	C	C	.	.			trans	-68.1	136.9	-172.1	0	0	0	0	0	111.9	G67 F70 L71	G67-G73 WeakPolarHBondContact CA-O 3.42Å; G67-G73 PolarHBondContact N-O 2.76Å; F70-G73 PolarHBondContact O-N 2.8Å; L71-G73 PolarHBondContact O-N 3.18Å
74	R	88.8	Confident	83.2	Confident	77 Å²	77	43.6 Å²	43.6	29%	0.291	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	165.7	173.5	63.3	-171	-176.6	-83	-2	109.8	E42 N63 Y76 C217 I218	E42-R74 VanDerWaalsContact CD-NH2 3.28Å; E42-R74 IonicContact OE1-CZ 2.78Å; E42-R74 VanDerWaalsContact OE1-CZ 3.23Å; E42-R74 IonicContact OE1-NH1 2.9Å; E42-R74 PolarHBondContact OE1-NH1 2.97Å; E42-R74 IonicContact OE1-NH2 3.99Å; E42-R74 PolarHBondContact OE1-NH2 3.11Å; E42-R74 IonicContact OE2-NH2 3.44Å; E42-R74 PolarHBondContact OE2-NH2 3.32Å; N63-R74 WeakPolarHBondContact OD1-CA 2.95Å; N63-R74 WeakPolarHBondContact OD1-CB 3.33Å; R74-Y76 PolarHBondContact O-N 2.95Å; R74-C217 CarbonylContact O-C 3.57Å; R74-C217 VanDerWaalsContact O-CA 3.29Å; R74-C217 WeakPolarHBondContact O-CA 3.42Å; R74-I218 HydrophobicContact CG-CG2 3.44Å; R74-I218 VanDerWaalsContact CG-CG2 3.44Å; R74-I218 PolarHBondContact N-O 2.65Å; R74-I218 PolarHBondContact O-N 3.28Å
75	R	87.1	Confident	83.7	Confident	17 Å²	17	43.5 Å²	43.5	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	134.7	174.8	-168.5	179	71.2	134.5	-9.7	110.6	I62 N63 G77 G105 G106 F108 Q133 T134	I62-R75 HydrophobicContact CG2-CB 3.93Å; I62-R75 HydrophobicContact CG2-CG 3.62Å; N63-R75 PolarHBondContact OD1-N 3.39Å; R75-G77 PolarHBondContact O-N 3.08Å; R75-G105 PolarHBondContact NH1-O 2.92Å; R75-G106 VanDerWaalsContact CZ-C 3.46Å; R75-G106 PolarHBondContact NH1-O 2.94Å; R75-G106 PolarHBondContact NH2-O 3.46Å; R75-F108 VanDerWaalsContact NH1-CZ 3.29Å; R75-Q133 PolarHBondContact NH2-O 2.73Å; R75-T134 PolarHBondContact NH2-O 3.01Å
76	Y	88	Confident	84	Confident	30 Å²	30	43.8 Å²	43.8	12%	0.118	24%	0.237	C	C	.	.			trans	-84.7	106.4	169.2	-173	-121.6	0	0	0	109.5	L39 V44 R74 F78 T216 I218	L39-Y76 HydrophobicContact CD2-CE2 3.71Å; V44-Y76 HydrophobicContact CG1-CD1 3.75Å; V44-Y76 HydrophobicContact CG1-CE1 4.14Å; V44-Y76 HydrophobicContact CG1-CG 4.06Å; V44-Y76 HydrophobicContact CG2-CD1 4.47Å; V44-Y76 HydrophobicContact CG2-CD2 4.26Å; V44-Y76 HydrophobicContact CG2-CE1 4.41Å; V44-Y76 HydrophobicContact CG2-CE2 4.19Å; V44-Y76 HydrophobicContact CG2-CG 4.4Å; R74-Y76 PolarHBondContact O-N 2.95Å; Y76-F78 AromaticContact CD1-CD1 3.5Å; Y76-F78 HydrophobicContact CD1-CD1 3.5Å; Y76-F78 VanDerWaalsContact CD1-CD1 3.5Å; Y76-F78 HydrophobicContact CD1-CE1 4.16Å; Y76-F78 HydrophobicContact CD1-CG 4.42Å; Y76-F78 HydrophobicContact CE1-CB 4.15Å; Y76-F78 AromaticContact CE1-CD1 3.79Å; Y76-F78 HydrophobicContact CE1-CD1 3.79Å; Y76-F78 HydrophobicContact CE1-CG 4.32Å; Y76-F78 HydrophobicContact CG-CD1 4.47Å; Y76-F78 PolarHBondContact O-N 2.93Å; Y76-T216 HydrophobicContact CD1-CG2 3.79Å; Y76-T216 HydrophobicContact CG-CG2 4.24Å; Y76-T216 PolarHBondContact N-O 3.34Å; Y76-I218 HydrophobicContact CD2-CB 3.8Å; Y76-I218 HydrophobicContact CD2-CD1 3.85Å; Y76-I218 HydrophobicContact CD2-CG1 4.36Å; Y76-I218 HydrophobicContact CD2-CG2 4.13Å; Y76-I218 HydrophobicContact CE2-CD1 4.04Å; Y76-I218 HydrophobicContact CG-CB 4.31Å
77	G	76.4	Confident	84	Confident	37 Å²	37	52 Å²	52	38%	0.381	28%	0.281	S	S	.	.			trans	-85.1	105.4	176.9	0	0	0	0	0	110.9	R75	R75-G77 PolarHBondContact O-N 3.08Å
78	F	75.6	Confident	84.2	Confident	1 Å²	1	55 Å²	55	0%	0.004	28%	0.284	C	S	.	.			trans	-122.5	152.9	164.7	62	-83.6	0	0	0	109.9	Y76 E83 I84 G106 Y188 T216	Y76-F78 AromaticContact CD1-CD1 3.5Å; Y76-F78 HydrophobicContact CD1-CD1 3.5Å; Y76-F78 VanDerWaalsContact CD1-CD1 3.5Å; Y76-F78 HydrophobicContact CD1-CE1 4.16Å; Y76-F78 HydrophobicContact CD1-CG 4.42Å; Y76-F78 HydrophobicContact CE1-CB 4.15Å; Y76-F78 AromaticContact CE1-CD1 3.79Å; Y76-F78 HydrophobicContact CE1-CD1 3.79Å; Y76-F78 HydrophobicContact CE1-CG 4.32Å; Y76-F78 HydrophobicContact CG-CD1 4.47Å; Y76-F78 PolarHBondContact O-N 2.93Å; F78-E83 WeakPolarHBondContact CA-OE2 3.46Å; F78-E83 HydrophobicContact CB-CB 3.94Å; F78-E83 WeakPolarHBondContact CB-OE2 3.48Å; F78-I84 HydrophobicContact CD1-CD1 4.39Å; F78-I84 HydrophobicContact CD1-CG1 4.43Å; F78-I84 HydrophobicContact CD2-CD1 3.95Å; F78-I84 HydrophobicContact CD2-CG1 4.28Å; F78-I84 HydrophobicContact CE1-CD1 4.08Å; F78-I84 HydrophobicContact CE2-CD1 3.61Å; F78-I84 HydrophobicContact CE2-CG1 4.41Å; F78-I84 HydrophobicContact CG-CD1 4.32Å; F78-I84 HydrophobicContact CG-CG1 4.29Å; F78-I84 HydrophobicContact CZ-CD1 3.68Å; F78-G106 WeakPolarHBondContact O-CA 3.37Å; F78-G106 PolarHBondContact O-N 2.76Å; F78-Y188 HydrophobicContact CE1-CE1 4.42Å; F78-Y188 HydrophobicContact CE2-CD1 4.29Å; F78-Y188 AromaticContact CE2-CE1 3.95Å; F78-Y188 HydrophobicContact CE2-CE1 3.95Å; F78-Y188 HydrophobicContact CZ-CD1 4.13Å; F78-Y188 AromaticContact CZ-CE1 3.35Å; F78-Y188 HydrophobicContact CZ-CE1 3.35Å; F78-Y188 HydrophobicContact CZ-CE2 4.46Å; F78-Y188 AromaticContact CZ-CZ 3.52Å; F78-Y188 WeakPolarHBondContact CZ-OH 3.37Å; F78-T216 HydrophobicContact CE1-CG2 4.4Å
79	V	67.1	Low	84.6	Confident	13 Å²	13	52.1 Å²	52.1	8%	0.079	26%	0.259	C	S	.	.	S	Bend	trans	-105.1	-39.3	-178.9	-177.7	0	0	0	0	111.2	E83 F107 R166 Y167 Q186	V79-E83 PolarHBondContact N-OE1 3.11Å; V79-E83 VanDerWaalsContact N-OE1 3.11Å; V79-E83 PolarHBondContact N-OE2 3.02Å; V79-F107 HydrophobicContact CB-CD1 4.43Å; V79-F107 HydrophobicContact CG1-CD1 4.18Å; V79-F107 HydrophobicContact CG1-CE1 4.05Å; V79-F107 HydrophobicContact CG2-CD1 4.31Å; V79-R166 VanDerWaalsContact CB-CZ 3.45Å; V79-R166 HydrophobicContact CG1-CG 3.69Å; V79-R166 VanDerWaalsContact CG1-CZ 3.47Å; V79-Y167 HydrophobicContact CG1-CE1 3.55Å; V79-Y167 VanDerWaalsContact CG1-OH 3.29Å; V79-Y167 WeakPolarHBondContact CG1-OH 3.25Å; V79-Q186 PolarHBondContact O-NE2 3.5Å; V79-Q186 PolarHBondContact O-OE1 3.33Å
80	Y	72.1	Confident	84.9	Confident	68 Å²	68	53.3 Å²	53.3	27%	0.267	26%	0.26	S	S	.	.	S	Bend	trans	-113	151.4	177.2	-59.8	-58.2	0	0	0	113	H82 E83 R166	Y80-H82 WeakPolarHBondContact CB-CE1 3.46Å; Y80-H82 WeakPolarHBondContact CB-ND1 3.03Å; Y80-H82 AromaticContact CD2-CE1 3.06Å; Y80-H82 WeakPolarHBondContact CD2-CE1 3.34Å; Y80-H82 AromaticContact CD2-ND1 4Å; Y80-H82 AromaticContact CD2-NE2 3.47Å; Y80-H82 WeakPolarHBondContact CD2-NE2 3.14Å; Y80-H82 AromaticContact CE2-CE1 3.83Å; Y80-H82 AromaticContact CG-CE1 3.39Å; Y80-H82 AromaticContact CG-ND1 3.88Å; Y80-H82 PolarHBondContact O-N 2.87Å; Y80-E83 PolarHBondContact N-OE1 3.44Å; Y80-E83 WeakPolarHBondContact O-CB 3.14Å; Y80-E83 PolarHBondContact O-N 3.02Å; Y80-E83 VanDerWaalsContact O-N 3.11Å; Y80-R166 HydrophobicContact CE1-CG 3.72Å; Y80-R166 HydrophobicContact CE2-CG 4.26Å; Y80-R166 VanDerWaalsContact CZ-CG 3.46Å; Y80-R166 VanDerWaalsContact OH-CD 3.22Å; Y80-R166 WeakPolarHBondContact OH-CD 3.26Å; Y80-R166 WeakPolarHBondContact OH-CG 3.4Å; Y80-R166 PolarHBondContact OH-NE 3.15Å
81	L	81.1	Confident	84.9	Confident	20 Å²	20	53.5 Å²	53.5	11%	0.105	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-59.7	-28.1	174.2	-65.1	177.5	0	0	0	113	E83 I84 W86 Y188 P196 E198	L81-E83 PolarHBondContact O-N 2.87Å; L81-I84 HydrophobicContact CD2-CD1 4.42Å; L81-I84 WeakPolarHBondContact O-CB 3.27Å; L81-I84 PolarHBondContact O-N 2.83Å; L81-I84 VanDerWaalsContact O-N 3.11Å; L81-W86 HydrophobicContact CD2-CZ2 4.06Å; L81-W86 PolarHBondContact O-NE1 3.37Å; L81-Y188 HydrophobicContact CD2-CD2 3.84Å; L81-Y188 HydrophobicContact CD2-CG 3.78Å; L81-P196 HydrophobicContact CD1-CB 4.15Å; L81-E198 HydrophobicContact CD1-CB 4.42Å; L81-E198 HydrophobicContact CD1-CG 3.46Å; L81-E198 VanDerWaalsContact CD1-CG 3.46Å; L81-E198 HydrophobicContact CG-CG 3.92Å
82	H	80.8	Confident	84.7	Confident	141 Å²	141	55.7 Å²	55.7	65%	0.653	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-72.7	-13.5	179.6	65.4	-110.9	0	0	0	113.9	Y80 I84	Y80-H82 WeakPolarHBondContact CB-CE1 3.46Å; Y80-H82 WeakPolarHBondContact CB-ND1 3.03Å; Y80-H82 AromaticContact CD2-CE1 3.06Å; Y80-H82 WeakPolarHBondContact CD2-CE1 3.34Å; Y80-H82 AromaticContact CD2-ND1 4Å; Y80-H82 AromaticContact CD2-NE2 3.47Å; Y80-H82 WeakPolarHBondContact CD2-NE2 3.14Å; Y80-H82 AromaticContact CE2-CE1 3.83Å; Y80-H82 AromaticContact CG-CE1 3.39Å; Y80-H82 AromaticContact CG-ND1 3.88Å; Y80-H82 PolarHBondContact O-N 2.87Å; H82-I84 PolarHBondContact O-N 2.04Å
83	E	82.3	Confident	83.8	Confident	62 Å²	62	53.9 Å²	53.9	29%	0.29	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-70.9	-19.1	170.9	-63.2	174.5	-136.4	0	0	111.2	F78 V79 Y80 L81 R166	F78-E83 WeakPolarHBondContact CA-OE2 3.46Å; F78-E83 HydrophobicContact CB-CB 3.94Å; F78-E83 WeakPolarHBondContact CB-OE2 3.48Å; V79-E83 PolarHBondContact N-OE1 3.11Å; V79-E83 VanDerWaalsContact N-OE1 3.11Å; V79-E83 PolarHBondContact N-OE2 3.02Å; Y80-E83 PolarHBondContact N-OE1 3.44Å; Y80-E83 WeakPolarHBondContact O-CB 3.14Å; Y80-E83 PolarHBondContact O-N 3.02Å; Y80-E83 VanDerWaalsContact O-N 3.11Å; L81-E83 PolarHBondContact O-N 2.87Å; E83-R166 IonicContact OE1-NH2 3.51Å; E83-R166 PolarHBondContact OE1-NH2 3.25Å
84	I	87.4	Confident	82.6	Confident	5 Å²	5	57.3 Å²	57.3	3%	0.026	27%	0.274	C	S	.	.	S	Bend	trans	-83.6	131.6	174.1	-64.9	163.8	0	0	0	109.9	Y37 W46 F78 L81 H82 W86	Y37-I84 HydrophobicContact CE1-CG2 3.78Å; W46-I84 HydrophobicContact CH2-CD1 4.28Å; W46-I84 HydrophobicContact CH2-CG1 4.26Å; W46-I84 HydrophobicContact CH2-CG2 3.99Å; W46-I84 HydrophobicContact CZ2-CD1 3.86Å; W46-I84 HydrophobicContact CZ2-CG1 4.33Å; W46-I84 HydrophobicContact CZ2-CG2 4.46Å; F78-I84 HydrophobicContact CD1-CD1 4.39Å; F78-I84 HydrophobicContact CD1-CG1 4.43Å; F78-I84 HydrophobicContact CD2-CD1 3.95Å; F78-I84 HydrophobicContact CD2-CG1 4.28Å; F78-I84 HydrophobicContact CE1-CD1 4.08Å; F78-I84 HydrophobicContact CE2-CD1 3.61Å; F78-I84 HydrophobicContact CE2-CG1 4.41Å; F78-I84 HydrophobicContact CG-CD1 4.32Å; F78-I84 HydrophobicContact CG-CG1 4.29Å; F78-I84 HydrophobicContact CZ-CD1 3.68Å; L81-I84 HydrophobicContact CD2-CD1 4.42Å; L81-I84 WeakPolarHBondContact O-CB 3.27Å; L81-I84 PolarHBondContact O-N 2.83Å; L81-I84 VanDerWaalsContact O-N 3.11Å; H82-I84 PolarHBondContact O-N 2.04Å; I84-W86 VanDerWaalsContact C-N 3.32Å; I84-W86 HydrophobicContact CB-CD2 4.45Å; I84-W86 HydrophobicContact CB-CZ2 3.83Å; I84-W86 HydrophobicContact CD1-CH2 4.13Å; I84-W86 HydrophobicContact CD1-CZ2 3.52Å; I84-W86 HydrophobicContact CG1-CZ2 4.29Å; I84-W86 HydrophobicContact CG2-CD2 3.78Å; I84-W86 VanDerWaalsContact CG2-CE2 3.44Å; I84-W86 HydrophobicContact CG2-CE3 4.27Å; I84-W86 HydrophobicContact CG2-CG 4.22Å; I84-W86 HydrophobicContact CG2-CH2 4.08Å; I84-W86 HydrophobicContact CG2-CZ2 3.61Å; I84-W86 HydrophobicContact CG2-CZ3 4.4Å; I84-W86 PolarHBondContact O-N 3.39Å
85	K	90.9	Very high	81.2	Confident	75 Å²	75	56 Å²	56	33%	0.326	27%	0.274	S	S	.	.			trans	-80	73.8	176.2	-65.3	-168	172.5	-167.8	0	112.5	Y37 L39 N87 E88 L89	Y37-K85 HydrophobicContact CD2-CB 3.91Å; Y37-K85 HydrophobicContact CD2-CD 4.21Å; Y37-K85 HydrophobicContact CD2-CG 4.35Å; Y37-K85 HydrophobicContact CE2-CB 3.8Å; Y37-K85 HydrophobicContact CE2-CD 4.2Å; Y37-K85 HydrophobicContact CE2-CG 3.99Å; Y37-K85 HydrophobicContact CG-CB 4.36Å; L39-K85 HydrophobicContact CD1-CD 4.37Å; K85-N87 PolarHBondContact O-N 2.93Å; K85-E88 HydrophobicContact CB-CB 4.2Å; K85-E88 VanDerWaalsContact CD-CD 3.44Å; K85-E88 HydrophobicContact CD-CG 4.38Å; K85-E88 WeakPolarHBondContact CD-OE1 3.45Å; K85-E88 VanDerWaalsContact CD-OE2 3.25Å; K85-E88 WeakPolarHBondContact CD-OE2 3.46Å; K85-E88 VanDerWaalsContact NZ-CD 3.33Å; K85-E88 IonicContact NZ-OE1 3.65Å; K85-E88 PolarHBondContact NZ-OE1 2.03Å; K85-E88 IonicContact NZ-OE2 3.94Å; K85-E88 PolarHBondContact NZ-OE2 3.1Å; K85-E88 PolarHBondContact O-N 3Å; K85-L89 PolarHBondContact O-N 3.11Å
86	W	88.2	Confident	79.6	Confident	50 Å²	50	62.6 Å²	62.6	19%	0.189	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-56.9	-33.3	-177.9	-63.4	100.8	0	0	0	114.3	L81 I84 E88 L89 I190 P196	L81-W86 HydrophobicContact CD2-CZ2 4.06Å; L81-W86 PolarHBondContact O-NE1 3.37Å; I84-W86 VanDerWaalsContact C-N 3.32Å; I84-W86 HydrophobicContact CB-CD2 4.45Å; I84-W86 HydrophobicContact CB-CZ2 3.83Å; I84-W86 HydrophobicContact CD1-CH2 4.13Å; I84-W86 HydrophobicContact CD1-CZ2 3.52Å; I84-W86 HydrophobicContact CG1-CZ2 4.29Å; I84-W86 HydrophobicContact CG2-CD2 3.78Å; I84-W86 VanDerWaalsContact CG2-CE2 3.44Å; I84-W86 HydrophobicContact CG2-CE3 4.27Å; I84-W86 HydrophobicContact CG2-CG 4.22Å; I84-W86 HydrophobicContact CG2-CH2 4.08Å; I84-W86 HydrophobicContact CG2-CZ2 3.61Å; I84-W86 HydrophobicContact CG2-CZ3 4.4Å; I84-W86 PolarHBondContact O-N 3.39Å; W86-E88 VanDerWaalsContact C-N 3.26Å; W86-E88 PolarHBondContact O-N 3.02Å; W86-L89 HydrophobicContact CE3-CD2 3.54Å; W86-L89 HydrophobicContact CZ3-CD2 3.51Å; W86-L89 WeakPolarHBondContact O-CB 3.47Å; W86-L89 PolarHBondContact O-N 3.17Å; W86-I190 HydrophobicContact CH2-CD1 3.92Å; W86-I190 HydrophobicContact CH2-CG1 3.81Å; W86-I190 HydrophobicContact CZ3-CD1 3.86Å; W86-I190 HydrophobicContact CZ3-CG1 3.86Å; W86-I190 HydrophobicContact CZ3-CG2 4.22Å; W86-P196 HydrophobicContact CD2-CB 3.97Å; W86-P196 HydrophobicContact CD2-CG 3.66Å; W86-P196 VanDerWaalsContact CE2-CG 3.5Å; W86-P196 HydrophobicContact CE3-CB 4.04Å; W86-P196 HydrophobicContact CE3-CG 4.05Å; W86-P196 HydrophobicContact CG-CG 4.15Å; W86-P196 HydrophobicContact CH2-CB 3.46Å; W86-P196 VanDerWaalsContact CH2-CB 3.46Å; W86-P196 HydrophobicContact CH2-CG 4.26Å; W86-P196 HydrophobicContact CZ2-CB 3.31Å; W86-P196 HydrophobicContact CZ2-CG 3.83Å; W86-P196 HydrophobicContact CZ3-CB 3.79Å; W86-P196 HydrophobicContact CZ3-CG 4.33Å
87	N	88.8	Confident	77.9	Confident	173 Å²	173	70.9 Å²	70.9	93%	0.925	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-68.2	-24.6	178.1	-66.8	-17.6	0	0	0	113.4	K85	K85-N87 PolarHBondContact O-N 2.93Å
88	E	90.6	Very high	77.1	Confident	103 Å²	103	78.3 Å²	78.3	48%	0.481	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-98	-4	178.8	-65.5	177.3	-152.9	0	0	112	Y37 K85 W86 Y90	Y37-E88 WeakPolarHBondContact CB-O 3.06Å; K85-E88 HydrophobicContact CB-CB 4.2Å; K85-E88 VanDerWaalsContact CD-CD 3.44Å; K85-E88 HydrophobicContact CD-CG 4.38Å; K85-E88 WeakPolarHBondContact CD-OE1 3.45Å; K85-E88 VanDerWaalsContact CD-OE2 3.25Å; K85-E88 WeakPolarHBondContact CD-OE2 3.46Å; K85-E88 VanDerWaalsContact NZ-CD 3.33Å; K85-E88 IonicContact NZ-OE1 3.65Å; K85-E88 PolarHBondContact NZ-OE1 2.03Å; K85-E88 IonicContact NZ-OE2 3.94Å; K85-E88 PolarHBondContact NZ-OE2 3.1Å; K85-E88 PolarHBondContact O-N 3Å; W86-E88 VanDerWaalsContact C-N 3.26Å; W86-E88 PolarHBondContact O-N 3.02Å; E88-Y90 PolarHBondContact O-N 2.77Å
89	L	91	Very high	77.1	Confident	8 Å²	8	83.9 Å²	83.9	4%	0.042	39%	0.385	C	S	.	.			trans	-69.6	116.2	-175.4	-176.1	70.4	0	0	0	111.3	T35 Y37 W46 K85 W86	T35-L89 HydrophobicContact CG2-CD1 3.99Å; Y37-L89 HydrophobicContact CD1-CD1 3.93Å; W46-L89 HydrophobicContact CE3-CD1 4.27Å; W46-L89 HydrophobicContact CZ3-CD1 4.06Å; K85-L89 PolarHBondContact O-N 3.11Å; W86-L89 HydrophobicContact CE3-CD2 3.54Å; W86-L89 HydrophobicContact CZ3-CD2 3.51Å; W86-L89 WeakPolarHBondContact O-CB 3.47Å; W86-L89 PolarHBondContact O-N 3.17Å
90	Y	91.5	Very high	77.8	Confident	59 Å²	59	85.9 Å²	85.9	23%	0.231	40%	0.395	C	S	.	.	B	Isolated β-bridge	trans	-78.6	121	157.6	173.9	-103.4	0	0	0	108.7	K32 E34 T35 G36 E88 K92	K32-Y90 VanDerWaalsContact CA-CZ 3.46Å; K32-Y90 HydrophobicContact CB-CE1 3.98Å; K32-Y90 HydrophobicContact CB-CE2 3.88Å; K32-Y90 VanDerWaalsContact CB-CZ 3.49Å; K32-Y90 WeakPolarHBondContact CB-OH 3.43Å; K32-Y90 HydrophobicContact CD-CE2 4.05Å; K32-Y90 HydrophobicContact CG-CD2 4.12Å; K32-Y90 HydrophobicContact CG-CE1 4.46Å; K32-Y90 HydrophobicContact CG-CE2 3.63Å; K32-Y90 WeakPolarHBondContact O-CE1 3.29Å; K32-Y90 PolarHBondContact O-OH 3.33Å; E34-Y90 VanDerWaalsContact O-CD1 3.27Å; E34-Y90 WeakPolarHBondContact O-CD1 3.39Å; T35-Y90 CarbonylContact C-O 3.4Å; T35-Y90 VanDerWaalsContact CA-O 3.23Å; T35-Y90 WeakPolarHBondContact CA-O 3.31Å; G36-Y90 PolarHBondContact N-O 2.85Å; G36-Y90 PolarHBondContact O-N 3.02Å; E88-Y90 PolarHBondContact O-N 2.77Å; Y90-K92 HydrophobicContact CE1-CB 3.82Å
91	Y	87.5	Confident	78.2	Confident	11 Å²	11	83.4 Å²	83.4	4%	0.043	39%	0.387	C	S	.	.			trans	-110.1	120.3	179.7	-178.5	-110	0	0	0	110.8	T35 P93 T101 I190 R194	T35-Y91 HydrophobicContact CG2-CD2 3.85Å; Y91-P93 HydrophobicContact CE1-CB 3.95Å; Y91-P93 HydrophobicContact CE1-CG 4.43Å; Y91-T101 PolarHBondContact OH-OG1 3.35Å; Y91-I190 HydrophobicContact CD2-CG2 3.95Å; Y91-I190 HydrophobicContact CE2-CB 4.19Å; Y91-I190 HydrophobicContact CE2-CG2 3.67Å; Y91-R194 HydrophobicContact CD1-CG 3.98Å; Y91-R194 HydrophobicContact CG-CG 4.1Å
92	K	82.4	Confident	78.3	Confident	91 Å²	91	87 Å²	87	40%	0.396	40%	0.4	S	S	.	.			trans	-111.1	103.8	173.9	-178.5	178.3	172.6	-179.2	0	108.9	M33 T35 Y90	M33-K92 VanDerWaalsContact O-CD 3.26Å; M33-K92 WeakPolarHBondContact O-CD 3.47Å; M33-K92 PolarHBondContact O-NZ 2.75Å; T35-K92 PolarHBondContact OG1-N 3.3Å; T35-K92 PolarHBondContact OG1-O 2.82Å; Y90-K92 HydrophobicContact CE1-CB 3.82Å
93	P	71.9	Confident	78.5	Confident	82 Å²	82	80.3 Å²	80.3	53%	0.532	37%	0.369	S	S	.	.			trans	-64.3	137.7	177.3	24.3	-31	0	0	0	110.8	Y91	Y91-P93 HydrophobicContact CE1-CB 3.95Å; Y91-P93 HydrophobicContact CE1-CG 4.43Å
94	R	64.9	Low	78.5	Confident	80 Å²	80	77.6 Å²	77.6	30%	0.302	36%	0.356	S	S	.	.			trans	-100.7	-18.2	-174.6	-65.3	179.5	-175.1	-101.5	-11.5	114	E34 W46 D214	E34-R94 IonicContact OE2-CZ 2.84Å; E34-R94 IonicContact OE2-NH1 3.03Å; E34-R94 IonicContact OE2-NH2 3.97Å; E34-R94 PolarHBondContact OE2-NH2 3.27Å; W46-R94 PolarHBondContact O-NH2 3.28Å; R94-D214 IonicContact CZ-OD2 2.8Å; R94-D214 IonicContact NE-OD1 3.64Å; R94-D214 IonicContact NE-OD2 2.64Å; R94-D214 PolarHBondContact NE-OD2 3.15Å; R94-D214 IonicContact NH2-OD2 3.18Å
95	T	59	Low	77.8	Confident	50 Å²	50	77.5 Å²	77.5	31%	0.307	36%	0.356	S	S	.	.	S	Bend	trans	-110.3	169.4	-170	42.8	0	0	0	0	113.2	Y97 E99	T95-Y97 PolarHBondContact O-N 2.95Å; T95-E99 WeakPolarHBondContact CG2-OE2 3.42Å
96	L	53.5	Low	76.9	Confident	156 Å²	156	74 Å²	74	82%	0.817	34%	0.341	S	S	*	.	S	Bend	trans	-48.2	137.3	164.3	-76.1	156.5	0	0	0	108.7	R98	L96-R98 PolarHBondContact O-N 3.28Å; L96-R98 VanDerWaalsContact O-N 3.15Å
97	Y	54	Low	76.2	Confident	204 Å²	204	71.7 Å²	71.7	80%	0.8	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.9	117.9	-174.3	-170.8	-106.1	0	0	0	112.6	T95	T95-Y97 PolarHBondContact O-N 2.95Å
98	R	57.9	Low	75.8	Confident	193 Å²	193	63.5 Å²	63.5	73%	0.728	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	13.4	170.3	-59.6	173.7	170.5	-170.5	-2.1	119.9	L96	L96-R98 PolarHBondContact O-N 3.28Å; L96-R98 VanDerWaalsContact O-N 3.15Å
99	E	75.6	Confident	75.1	Confident	118 Å²	118	58.8 Å²	58.8	55%	0.551	27%	0.266	S	S	*	.			trans	-95.2	143.8	170.9	-67	178.5	170	0	0	112.8	T95	T95-E99 WeakPolarHBondContact CG2-OE2 3.42Å
100	D	81.6	Confident	74.5	Confident	55 Å²	55	61.6 Å²	61.6	29%	0.294	28%	0.277	S	S	.	.			trans	-70.5	143	176.4	-64	-19.7	0	0	0	110.6	R191 P192 Y197	D100-R191 WeakPolarHBondContact OD1-CA 3.37Å; D100-P192 VanDerWaalsContact OD1-CD 3.26Å; D100-P192 WeakPolarHBondContact OD1-CD 3.38Å; D100-Y197 HydrophobicContact CB-CE1 4.44Å; D100-Y197 PolarHBondContact OD2-OH 3.01Å
101	T	82.1	Confident	73.7	Confident	15 Å²	15	59.1 Å²	59.1	9%	0.092	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	113.1	169.8	-53.7	0	0	0	0	109.1	Y91 G189 I190 D214	Y91-T101 PolarHBondContact OH-OG1 3.35Å; T101-G189 CarbonylContact O-C 3.55Å; T101-G189 WeakPolarHBondContact O-CA 3.32Å; T101-I190 PolarHBondContact N-O 2.97Å; T101-I190 PolarHBondContact O-N 3.21Å; T101-D214 HydrophobicContact CG2-CB 4.23Å
102	W	83.6	Confident	73.1	Confident	97 Å²	97	61 Å²	61	37%	0.367	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	140.3	174.7	-67.5	91.6	0	0	0	110.5	Y197 H213 D214	W102-Y197 AromaticContact CH2-CE2 3.84Å; W102-Y197 HydrophobicContact CH2-CE2 3.84Å; W102-Y197 VanDerWaalsContact CH2-OH 3.31Å; W102-Y197 WeakPolarHBondContact CH2-OH 3.48Å; W102-Y197 WeakPolarHBondContact CZ2-OH 3.27Å; W102-Y197 HydrophobicContact CZ3-CE2 4.1Å; W102-H213 CarbonylContact O-C 3.54Å; W102-H213 WeakPolarHBondContact O-CA 3.13Å; W102-D214 PolarHBondContact O-N 3.35Å
103	A	84.7	Confident	72.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	156	-179.5	0	0	0	0	0	113	T187 Y188 D214	A103-T187 WeakPolarHBondContact O-CA 3.24Å; A103-Y188 HydrophobicContact CB-CD1 4.45Å; A103-Y188 HydrophobicContact CB-CD2 4.39Å; A103-Y188 HydrophobicContact CB-CE1 3.7Å; A103-Y188 HydrophobicContact CB-CE2 3.69Å; A103-Y188 WeakPolarHBondContact CB-OH 3.43Å; A103-Y188 PolarHBondContact N-O 2.84Å; A103-Y188 WeakPolarHBondContact O-CD1 3.22Å; A103-Y188 PolarHBondContact O-N 2.81Å; A103-Y188 VanDerWaalsContact O-N 3.08Å; A103-D214 CarbonylContact C-O 3.58Å; A103-D214 WeakPolarHBondContact CA-O 3.45Å; A103-D214 HydrophobicContact CB-CB 4.04Å; A103-D214 VanDerWaalsContact CB-O 3.27Å; A103-D214 WeakPolarHBondContact CB-O 3.14Å
104	F	80.6	Confident	72.5	Confident	5 Å²	5	62 Å²	62	2%	0.022	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	135.8	175.1	-62.3	-61.9	0	0	0	111.8	I62 C185 T187 Y188 L207 H213 D214 V215	I62-F104 HydrophobicContact CD1-CD2 4.24Å; F104-C185 HydrophobicContact CD1-CB 4.3Å; F104-T187 HydrophobicContact CD1-CG2 4.48Å; F104-Y188 VanDerWaalsContact C-CE1 3.49Å; F104-Y188 WeakPolarHBondContact O-CE1 3.25Å; F104-L207 HydrophobicContact CD1-CD1 4.45Å; F104-L207 HydrophobicContact CE1-CD1 3.31Å; F104-L207 HydrophobicContact CE1-CD2 3.72Å; F104-L207 HydrophobicContact CE1-CG 4.16Å; F104-L207 HydrophobicContact CE2-CD1 4.3Å; F104-L207 HydrophobicContact CZ-CD1 3.23Å; F104-L207 HydrophobicContact CZ-CD2 3.89Å; F104-L207 HydrophobicContact CZ-CG 4.15Å; F104-H213 HydrophobicContact CD2-CB 3.88Å; F104-H213 HydrophobicContact CE1-CB 4.1Å; F104-H213 AromaticContact CE1-CD2 3.52Å; F104-H213 AromaticContact CE1-CG 3.83Å; F104-H213 HydrophobicContact CE2-CB 3.16Å; F104-H213 AromaticContact CE2-CG 3.78Å; F104-H213 HydrophobicContact CZ-CB 3.24Å; F104-H213 AromaticContact CZ-CD2 3.48Å; F104-H213 VanDerWaalsContact CZ-CD2 3.48Å; F104-H213 WeakPolarHBondContact CZ-CD2 3.49Å; F104-H213 AromaticContact CZ-CG 3.26Å; F104-H213 AromaticContact CZ-ND1 3.88Å; F104-D214 PolarHBondContact N-O 3.4Å; F104-V215 HydrophobicContact CD2-CG2 3.93Å
105	G	74.5	Confident	72.9	Confident	3 Å²	3	61.2 Å²	61.2	3%	0.031	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	-179.9	171.6	0	0	0	0	0	113.4	R75 Q186	R75-G105 PolarHBondContact NH1-O 2.92Å; G105-Q186 PolarHBondContact N-O 2.63Å
106	G	72	Confident	73.6	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.01	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	6.6	-171.7	0	0	0	0	0	116.3	R75 F78	R75-G106 VanDerWaalsContact CZ-C 3.46Å; R75-G106 PolarHBondContact NH1-O 2.94Å; R75-G106 PolarHBondContact NH2-O 3.46Å; F78-G106 WeakPolarHBondContact O-CA 3.37Å; F78-G106 PolarHBondContact O-N 2.76Å
107	F	73.5	Confident	75	Confident	1 Å²	1	57.4 Å²	57.4	0%	0.004	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	158.6	177.8	69.4	-86.5	0	0	0	111.9	V79 L109 Q133 T134 Y167 Q186	V79-F107 HydrophobicContact CB-CD1 4.43Å; V79-F107 HydrophobicContact CG1-CD1 4.18Å; V79-F107 HydrophobicContact CG1-CE1 4.05Å; V79-F107 HydrophobicContact CG2-CD1 4.31Å; F107-L109 HydrophobicContact CD2-CD1 4.21Å; F107-L109 HydrophobicContact CD2-CD2 4.15Å; F107-L109 HydrophobicContact CD2-CG 3.81Å; F107-L109 HydrophobicContact CE2-CD1 3.71Å; F107-L109 HydrophobicContact CE2-CD2 4.46Å; F107-L109 HydrophobicContact CE2-CG 3.81Å; F107-Q133 WeakPolarHBondContact CA-O 3.47Å; F107-T134 HydrophobicContact CB-CG2 4.06Å; F107-Y167 HydrophobicContact CD1-CE1 4.06Å; F107-Y167 WeakPolarHBondContact CD1-OH 3.26Å; F107-Y167 HydrophobicContact CD2-CE1 4.23Å; F107-Y167 HydrophobicContact CD2-CE2 4.49Å; F107-Y167 AromaticContact CD2-CZ 3.83Å; F107-Y167 WeakPolarHBondContact CD2-OH 3.41Å; F107-Y167 HydrophobicContact CE1-CD1 4.17Å; F107-Y167 AromaticContact CE1-CE1 3.23Å; F107-Y167 HydrophobicContact CE1-CE1 3.23Å; F107-Y167 AromaticContact CE1-CZ 3.7Å; F107-Y167 HydrophobicContact CE2-CD1 4.06Å; F107-Y167 AromaticContact CE2-CE1 3.47Å; F107-Y167 HydrophobicContact CE2-CE1 3.47Å; F107-Y167 VanDerWaalsContact CE2-CE1 3.47Å; F107-Y167 HydrophobicContact CE2-CE2 4.09Å; F107-Y167 AromaticContact CE2-CZ 3.44Å; F107-Y167 VanDerWaalsContact CE2-CZ 3.44Å; F107-Y167 HydrophobicContact CG-CE1 4.5Å; F107-Y167 WeakPolarHBondContact CG-OH 3.32Å; F107-Y167 AromaticContact CZ-CD1 3.51Å; F107-Y167 HydrophobicContact CZ-CD1 3.51Å; F107-Y167 AromaticContact CZ-CE1 2.9Å; F107-Y167 HydrophobicContact CZ-CE1 2.9Å; F107-Y167 HydrophobicContact CZ-CE2 4.35Å; F107-Y167 HydrophobicContact CZ-CG 4.45Å; F107-Y167 AromaticContact CZ-CZ 3.38Å; F107-Q186 HydrophobicContact CD1-CB 4.46Å; F107-Q186 HydrophobicContact CE1-CB 3.66Å; F107-Q186 VanDerWaalsContact CE1-CD 3.43Å; F107-Q186 HydrophobicContact CE1-CG 4.06Å; F107-Q186 HydrophobicContact CE2-CB 4.31Å; F107-Q186 HydrophobicContact CZ-CB 3.54Å; F107-Q186 HydrophobicContact CZ-CG 4.12Å
108	F	78.8	Confident	76.5	Confident	1 Å²	1	50.9 Å²	50.9	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140.3	175.6	-51.9	-77	0	0	0	108.5	F57 L58 I62 R75 E132 Q133 W183 I184 C185	F57-F108 HydrophobicContact CE1-CD2 4.08Å; F57-F108 HydrophobicContact CE1-CE2 4.42Å; F57-F108 HydrophobicContact CE2-CB 4.39Å; F57-F108 HydrophobicContact CE2-CG 4.43Å; F57-F108 HydrophobicContact CZ-CB 3.89Å; F57-F108 AromaticContact CZ-CD2 3.55Å; F57-F108 HydrophobicContact CZ-CD2 3.55Å; F57-F108 HydrophobicContact CZ-CE2 4.2Å; F57-F108 AromaticContact CZ-CG 3.75Å; F57-F108 HydrophobicContact CZ-CG 3.75Å; L58-F108 HydrophobicContact CD2-CE1 4.05Å; L58-F108 HydrophobicContact CG-CE1 4.35Å; I62-F108 HydrophobicContact CD1-CE1 4.38Å; I62-F108 HydrophobicContact CD1-CZ 3.88Å; R75-F108 VanDerWaalsContact NH1-CZ 3.29Å; F108-E132 WeakPolarHBondContact O-CA 3.45Å; F108-Q133 HydrophobicContact CD2-CB 4.43Å; F108-Q133 PolarHBondContact N-O 3.19Å; F108-Q133 VanDerWaalsContact N-O 3.17Å; F108-Q133 PolarHBondContact O-N 3.12Å; F108-W183 HydrophobicContact CB-CE3 3.55Å; F108-W183 HydrophobicContact CB-CZ3 3.75Å; F108-I184 WeakPolarHBondContact CA-O 3.21Å; F108-C185 HydrophobicContact CD1-CB 4.49Å; F108-C185 WeakPolarHBondContact CD1-SG 3.39Å; F108-C185 WeakPolarHBondContact CE1-SG 3.3Å
109	L	77.3	Confident	77.8	Confident	4 Å²	4	49.7 Å²	49.7	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	143.7	178.6	-62.4	174.4	0	0	0	109.9	F107 I130 E131 E132 Y167 F176 I184	F107-L109 HydrophobicContact CD2-CD1 4.21Å; F107-L109 HydrophobicContact CD2-CD2 4.15Å; F107-L109 HydrophobicContact CD2-CG 3.81Å; F107-L109 HydrophobicContact CE2-CD1 3.71Å; F107-L109 HydrophobicContact CE2-CD2 4.46Å; F107-L109 HydrophobicContact CE2-CG 3.81Å; L109-I130 HydrophobicContact CB-CG2 4.27Å; L109-I130 HydrophobicContact CD2-CG2 3.92Å; L109-E131 CarbonylContact C-O 3.5Å; L109-E131 WeakPolarHBondContact CA-O 3.43Å; L109-E132 HydrophobicContact CD2-CB 3.94Å; L109-E132 HydrophobicContact CD2-CG 3.9Å; L109-Y167 HydrophobicContact CD1-CD2 4.19Å; L109-Y167 HydrophobicContact CD1-CE2 4.25Å; L109-F176 HydrophobicContact CB-CE1 3.77Å; L109-F176 HydrophobicContact CD1-CE1 3.49Å; L109-F176 VanDerWaalsContact CD1-CE1 3.49Å; L109-F176 HydrophobicContact CD1-CZ 3.38Å; L109-F176 HydrophobicContact CG-CE1 4.28Å; L109-I184 PolarHBondContact N-O 3.46Å; L109-I184 PolarHBondContact O-N 3.39Å
110	R	77.7	Confident	78.1	Confident	67 Å²	67	48.3 Å²	48.3	25%	0.253	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	123.9	172.7	170.3	178.1	156.7	-155.2	-4.9	109.7	L112 E131 G181 W183	R110-L112 HydrophobicContact CG-CD2 4.46Å; R110-L112 PolarHBondContact O-N 2.93Å; R110-E131 HydrophobicContact CB-CB 4.42Å; R110-E131 PolarHBondContact N-O 3.25Å; R110-E131 PolarHBondContact O-N 3.27Å; R110-G181 WeakPolarHBondContact CD-O 3.41Å; R110-G181 WeakPolarHBondContact CG-O 3.25Å; R110-G181 PolarHBondContact NE-O 3.16Å; R110-G181 VanDerWaalsContact NE-O 3.15Å; R110-W183 HydrophobicContact CB-CD2 3.69Å; R110-W183 HydrophobicContact CB-CE3 3.59Å; R110-W183 HydrophobicContact CB-CG 4.34Å; R110-W183 HydrophobicContact CB-CH2 4.24Å; R110-W183 HydrophobicContact CB-CZ2 4.31Å; R110-W183 HydrophobicContact CB-CZ3 3.88Å; R110-W183 HydrophobicContact CG-CD2 4.46Å
111	P	75.2	Confident	78.2	Confident	7 Å²	7	52.7 Å²	52.7	5%	0.045	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	132.5	168.9	29.5	-32.6	0	0	0	109.7	I128 F176 S179 G181	P111-I128 HydrophobicContact CB-CD1 3.68Å; P111-I128 HydrophobicContact CB-CG1 4.32Å; P111-F176 WeakPolarHBondContact CG-O 3.23Å; P111-S179 VanDerWaalsContact CD-OG 3.27Å; P111-S179 WeakPolarHBondContact CD-OG 3.43Å; P111-S179 WeakPolarHBondContact CG-OG 3.07Å; P111-G181 WeakPolarHBondContact O-CA 3.44Å
112	L	73.5	Confident	78.1	Confident	52 Å²	52	58.9 Å²	58.9	27%	0.272	29%	0.289	S	S	.	.			trans	-94.4	-31	176.6	-63.5	-176.9	0	0	0	112.2	R110 E129 E131 R141	R110-L112 HydrophobicContact CG-CD2 4.46Å; R110-L112 PolarHBondContact O-N 2.93Å; L112-E129 HydrophobicContact CB-CB 4.23Å; L112-E129 HydrophobicContact CB-CG 4.48Å; L112-E129 HydrophobicContact CD1-CG 4Å; L112-E129 PolarHBondContact N-O 2.97Å; L112-E131 HydrophobicContact CD1-CB 4.09Å; L112-E131 HydrophobicContact CD2-CB 3.96Å; L112-E131 HydrophobicContact CG-CB 3.99Å; L112-R141 HydrophobicContact CD1-CG 4.23Å
113	T	72.3	Confident	78.2	Confident	61 Å²	61	54.3 Å²	54.3	37%	0.374	27%	0.271	S	S	.	.	S	Bend	trans	-124	160.6	-176.9	66.3	0	0	0	0	110.9	I128 E129	T113-I128 VanDerWaalsContact O-CD1 3.24Å; T113-I128 WeakPolarHBondContact O-CD1 3.43Å; T113-I128 VanDerWaalsContact O-CG1 3.28Å; T113-I128 WeakPolarHBondContact O-CG1 3.37Å; T113-E129 HydrophobicContact CG2-CB 4.07Å; T113-E129 PolarHBondContact OG1-N 3.36Å; T113-E129 VanDerWaalsContact OG1-N 3.08Å
114	D	70.4	Confident	78	Confident	133 Å²	133	56 Å²	56	71%	0.711	28%	0.279	S	S	*	.			trans	-70.7	170.3	163.4	-65.3	-40.5	0	0	0	110.8	D116	D114-D116 PolarHBondContact O-N 3Å
115	E	72.6	Confident	77.9	Confident	63 Å²	63	56.7 Å²	56.7	29%	0.294	28%	0.284	S	S	.	.			trans	-64.3	112	175.2	174.7	-179.4	177.5	0	0	110.7	C117 K124 C126 W146 L177	E115-C117 WeakPolarHBondContact CG-SG 3.33Å; E115-C117 PolarHBondContact OE1-SG 2.86Å; E115-K124 IonicContact OE1-NZ 2.82Å; E115-K124 PolarHBondContact OE1-NZ 3.16Å; E115-C126 HydrophobicContact CG-CB 3.81Å; E115-C126 PolarHBondContact OE1-SG 2.85Å; E115-W146 HydrophobicContact CB-CH2 4.02Å; E115-W146 HydrophobicContact CB-CZ2 4.3Å; E115-W146 VanDerWaalsContact CD-CZ2 3.41Å; E115-W146 HydrophobicContact CG-CH2 3.56Å; E115-W146 HydrophobicContact CG-CZ2 3.49Å; E115-W146 VanDerWaalsContact CG-CZ2 3.49Å; E115-L177 HydrophobicContact CB-CD2 3.84Å
116	D	75.2	Confident	78.1	Confident	101 Å²	101	56.7 Å²	56.7	54%	0.54	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117.1	171	179.8	22.1	0	0	0	110.1	D114 C126 S127	D114-D116 PolarHBondContact O-N 3Å; D116-C126 CarbonylContact O-C 3.42Å; D116-C126 WeakPolarHBondContact O-CA 3.49Å; D116-S127 PolarHBondContact N-O 3.17Å; D116-S127 PolarHBondContact O-N 2.78Å
117	C	81.6	Confident	78.2	Confident	25 Å²	25	57.3 Å²	57.3	17%	0.169	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	133.1	-176.4	-64.4	0	0	0	0	114.1	E115 K124 S125 C126	E115-C117 WeakPolarHBondContact CG-SG 3.33Å; E115-C117 PolarHBondContact OE1-SG 2.86Å; C117-K124 HydrophobicContact CB-CB 4.44Å; C117-K124 HydrophobicContact CB-CD 3.99Å; C117-K124 PolarHBondContact SG-NZ 3.04Å; C117-S125 CarbonylContact C-O 3.48Å; C117-S125 VanDerWaalsContact CA-O 3.27Å; C117-S125 WeakPolarHBondContact CA-O 3.43Å; C117-C126 HydrophobicContact CB-CB 4.18Å; C117-C126 WeakPolarHBondContact CB-SG 3.41Å; C117-C126 WeakPolarHBondContact SG-CB 3.35Å; C117-C126 CovalentContact SG-SG 2.05Å; C117-C126 PolarHBondContact SG-SG 2.79Å
118	S	85.7	Confident	78.3	Confident	66 Å²	66	57.4 Å²	57.4	46%	0.462	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	130.4	165.3	-63.9	0	0	0	0	110.6	H120 K124 S125	S118-H120 PolarHBondContact O-CD2 2.92Å; S118-K124 CarbonylContact O-C 3.45Å; S118-K124 VanDerWaalsContact O-CA 3.23Å; S118-K124 WeakPolarHBondContact O-CA 3.44Å; S118-K124 WeakPolarHBondContact O-CB 3.19Å; S118-S125 PolarHBondContact N-O 3.46Å; S118-S125 PolarHBondContact O-N 2.77Å; S118-S125 PolarHBondContact O-OG 3.33Å
119	Y	85.8	Confident	78.2	Confident	168 Å²	168	60.7 Å²	60.7	66%	0.659	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	133.9	-175.7	-65.9	-94	0	0	0	111.4	K124	Y119-K124 HydrophobicContact CD1-CB 3.98Å; Y119-K124 HydrophobicContact CD1-CD 4.43Å; Y119-K124 HydrophobicContact CE1-CB 4.31Å; Y119-K124 HydrophobicContact CE1-CD 3.9Å; Y119-K124 HydrophobicContact CG-CB 4.41Å
120	H	82.4	Confident	78.1	Confident	90 Å²	90	60.7 Å²	60.7	42%	0.417	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	169.6	-179.6	-55.2	-71.6	0	0	0	110.5	S118 F122 G123 S125 Y147	S118-H120 PolarHBondContact O-CD2 2.92Å; H120-F122 PolarHBondContact O-N 3.08Å; H120-F122 VanDerWaalsContact O-N 3.11Å; H120-G123 CarbonylContact C-O 3.43Å; H120-G123 WeakPolarHBondContact CA-O 3.3Å; H120-G123 PolarHBondContact N-O 2.93Å; H120-G123 PolarHBondContact O-N 3.35Å; H120-S125 PolarHBondContact NE2-OG 2.95Å; H120-Y147 AromaticContact CD2-CE2 3.99Å
121	L	83.3	Confident	77.9	Confident	147 Å²	147	58.6 Å²	58.6	77%	0.77	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.5	-173.9	-162.1	74.1	0	0	0	114.2
122	F	80.4	Confident	78	Confident	145 Å²	145	58.6 Å²	58.6	64%	0.636	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	4.9	-174.3	-60.5	-67.3	0	0	0	114.7	H120 Y147	H120-F122 PolarHBondContact O-N 3.08Å; H120-F122 VanDerWaalsContact O-N 3.11Å; F122-Y147 VanDerWaalsContact C-OH 3.32Å
123	G	83.9	Confident	78	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.5	-165.7	-174.6	0	0	0	0	0	112.2	H120 Y147 K148 Y150	H120-G123 CarbonylContact C-O 3.43Å; H120-G123 WeakPolarHBondContact CA-O 3.3Å; H120-G123 PolarHBondContact N-O 2.93Å; H120-G123 PolarHBondContact O-N 3.35Å; G123-Y147 WeakPolarHBondContact CA-OH 3.43Å; G123-Y147 PolarHBondContact N-OH 3Å; G123-Y147 VanDerWaalsContact N-OH 3.17Å; G123-K148 CarbonylContact C-O 3.55Å; G123-K148 WeakPolarHBondContact CA-O 3.48Å; G123-Y150 VanDerWaalsContact N-CE2 3.3Å
124	K	81.9	Confident	77.8	Confident	36 Å²	36	55.1 Å²	55.1	16%	0.157	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	136.8	173.7	58	174.8	-166.3	145.2	0	110.3	E115 C117 S118 Y119 K148	E115-K124 IonicContact OE1-NZ 2.82Å; E115-K124 PolarHBondContact OE1-NZ 3.16Å; C117-K124 HydrophobicContact CB-CB 4.44Å; C117-K124 HydrophobicContact CB-CD 3.99Å; C117-K124 PolarHBondContact SG-NZ 3.04Å; S118-K124 CarbonylContact O-C 3.45Å; S118-K124 VanDerWaalsContact O-CA 3.23Å; S118-K124 WeakPolarHBondContact O-CA 3.44Å; S118-K124 WeakPolarHBondContact O-CB 3.19Å; Y119-K124 HydrophobicContact CD1-CB 3.98Å; Y119-K124 HydrophobicContact CD1-CD 4.43Å; Y119-K124 HydrophobicContact CE1-CB 4.31Å; Y119-K124 HydrophobicContact CE1-CD 3.9Å; Y119-K124 HydrophobicContact CG-CB 4.41Å; K124-K148 HydrophobicContact CG-CB 4.19Å; K124-K148 PolarHBondContact N-O 3.01Å; K124-K148 PolarHBondContact O-N 3.41Å
125	S	78.2	Confident	77.7	Confident	20 Å²	20	51.4 Å²	51.4	14%	0.14	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.3	169.1	60.7	0	0	0	0	107.7	C117 S118 H120 W146	C117-S125 CarbonylContact C-O 3.48Å; C117-S125 VanDerWaalsContact CA-O 3.27Å; C117-S125 WeakPolarHBondContact CA-O 3.43Å; S118-S125 PolarHBondContact N-O 3.46Å; S118-S125 PolarHBondContact O-N 2.77Å; S118-S125 PolarHBondContact O-OG 3.33Å; H120-S125 PolarHBondContact NE2-OG 2.95Å; S125-W146 CarbonylContact C-O 3.57Å
126	C	77.5	Confident	77.3	Confident	3 Å²	3	49.3 Å²	49.3	2%	0.02	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	150.7	-175.2	-60	0	0	0	0	110.3	E115 D116 C117 M145 W146	E115-C126 HydrophobicContact CG-CB 3.81Å; E115-C126 PolarHBondContact OE1-SG 2.85Å; D116-C126 CarbonylContact O-C 3.42Å; D116-C126 WeakPolarHBondContact O-CA 3.49Å; C117-C126 HydrophobicContact CB-CB 4.18Å; C117-C126 WeakPolarHBondContact CB-SG 3.41Å; C117-C126 WeakPolarHBondContact SG-CB 3.35Å; C117-C126 CovalentContact SG-SG 2.05Å; C117-C126 PolarHBondContact SG-SG 2.79Å; C126-M145 WeakPolarHBondContact O-CA 3.42Å; C126-W146 HydrophobicContact CB-CD2 3.87Å; C126-W146 HydrophobicContact CB-CE3 4.21Å; C126-W146 HydrophobicContact CB-CH2 3.8Å; C126-W146 HydrophobicContact CB-CZ2 3.4Å; C126-W146 HydrophobicContact CB-CZ3 4.16Å; C126-W146 PolarHBondContact N-O 3.04Å; C126-W146 VanDerWaalsContact O-CE3 3.23Å; C126-W146 PolarHBondContact O-N 2.77Å
127	S	75.2	Confident	76.5	Confident	13 Å²	13	53.1 Å²	53.1	9%	0.091	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	150.1	179.9	71.9	0	0	0	0	113	D116 K143 Y144	D116-S127 PolarHBondContact N-O 3.17Å; D116-S127 PolarHBondContact O-N 2.78Å; S127-K143 VanDerWaalsContact CB-CE 3.46Å; S127-K143 WeakPolarHBondContact OG-CE 3.41Å; S127-Y144 CarbonylContact C-O 3.52Å; S127-Y144 WeakPolarHBondContact CA-O 3.14Å; S127-Y144 WeakPolarHBondContact CB-O 3.5Å
128	I	75.2	Confident	75.9	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.021	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	138.4	177.6	-172.9	161.9	0	0	0	109.7	P111 T113 I130 Y144 W146 L177	P111-I128 HydrophobicContact CB-CD1 3.68Å; P111-I128 HydrophobicContact CB-CG1 4.32Å; T113-I128 VanDerWaalsContact O-CD1 3.24Å; T113-I128 WeakPolarHBondContact O-CD1 3.43Å; T113-I128 VanDerWaalsContact O-CG1 3.28Å; T113-I128 WeakPolarHBondContact O-CG1 3.37Å; I128-I130 HydrophobicContact CG2-CD1 4.11Å; I128-I130 HydrophobicContact CG2-CG1 4.01Å; I128-Y144 HydrophobicContact CG2-CD1 4.04Å; I128-Y144 HydrophobicContact CG2-CG 4.42Å; I128-Y144 PolarHBondContact N-O 3.19Å; I128-Y144 PolarHBondContact O-N 3.27Å; I128-W146 HydrophobicContact CB-CH2 4.3Å; I128-W146 HydrophobicContact CB-CZ3 3.96Å; I128-W146 HydrophobicContact CG2-CH2 4.27Å; I128-W146 HydrophobicContact CG2-CZ3 3.64Å; I128-L177 HydrophobicContact CD1-CD2 3.62Å
129	E	76.3	Confident	75.3	Confident	69 Å²	69	58.1 Å²	58.1	32%	0.322	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125.8	171.2	-164.8	-179.7	-177	0	0	109.7	L112 T113 R141 H142	L112-E129 HydrophobicContact CB-CB 4.23Å; L112-E129 HydrophobicContact CB-CG 4.48Å; L112-E129 HydrophobicContact CD1-CG 4Å; L112-E129 PolarHBondContact N-O 2.97Å; T113-E129 HydrophobicContact CG2-CB 4.07Å; T113-E129 PolarHBondContact OG1-N 3.36Å; T113-E129 VanDerWaalsContact OG1-N 3.08Å; E129-R141 WeakPolarHBondContact OE1-CD 3.35Å; E129-H142 CarbonylContact C-O 3.51Å; E129-H142 WeakPolarHBondContact CA-O 3.5Å
130	I	75.2	Confident	74.7	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	129.8	-179.9	-56.1	178.6	0	0	0	108.8	L109 I128 R141 H142 Y144 V164	L109-I130 HydrophobicContact CB-CG2 4.27Å; L109-I130 HydrophobicContact CD2-CG2 3.92Å; I128-I130 HydrophobicContact CG2-CD1 4.11Å; I128-I130 HydrophobicContact CG2-CG1 4.01Å; I130-R141 WeakPolarHBondContact O-CA 3.4Å; I130-H142 PolarHBondContact N-O 3.43Å; I130-H142 PolarHBondContact O-N 3.34Å; I130-Y144 HydrophobicContact CD1-CG 4.37Å; I130-V164 HydrophobicContact CD1-CG1 3.94Å; I130-V164 HydrophobicContact CD1-CG2 4.37Å
131	E	75	Confident	74.4	Confident	22 Å²	22	57.1 Å²	57.1	10%	0.103	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	120.5	169.5	-167.5	166.6	111.8	0	0	109.6	L109 R110 L112 T139 Y140 R141 W183	L109-E131 CarbonylContact C-O 3.5Å; L109-E131 WeakPolarHBondContact CA-O 3.43Å; R110-E131 HydrophobicContact CB-CB 4.42Å; R110-E131 PolarHBondContact N-O 3.25Å; R110-E131 PolarHBondContact O-N 3.27Å; L112-E131 HydrophobicContact CD1-CB 4.09Å; L112-E131 HydrophobicContact CD2-CB 3.96Å; L112-E131 HydrophobicContact CG-CB 3.99Å; E131-T139 VanDerWaalsContact CD-CG2 3.47Å; E131-T139 HydrophobicContact CG-CG2 3.09Å; E131-Y140 WeakPolarHBondContact CA-O 3.03Å; E131-R141 HydrophobicContact CG-CG 4.45Å; E131-R141 IonicContact OE2-CZ 2.78Å; E131-R141 IonicContact OE2-NE 2.62Å; E131-R141 PolarHBondContact OE2-NE 3Å; E131-R141 IonicContact OE2-NH2 3.36Å; E131-W183 HydrophobicContact CG-CH2 4.15Å
132	E	75.8	Confident	74	Confident	8 Å²	8	51.9 Å²	51.9	4%	0.037	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	134.1	177.6	-176.3	-169.4	-162	0	0	110.8	F108 L109 T134 T139 Y140 H142 I163	F108-E132 WeakPolarHBondContact O-CA 3.45Å; L109-E132 HydrophobicContact CD2-CB 3.94Å; L109-E132 HydrophobicContact CD2-CG 3.9Å; E132-T134 HydrophobicContact CG-CG2 4.1Å; E132-T134 WeakPolarHBondContact OE1-CG2 3.2Å; E132-T139 CarbonylContact O-C 3.57Å; E132-T139 WeakPolarHBondContact O-CA 3.42Å; E132-T139 WeakPolarHBondContact O-CG2 3.02Å; E132-Y140 PolarHBondContact N-O 3.39Å; E132-Y140 PolarHBondContact O-N 2.83Å; E132-H142 IonicContact OE2-CD2 3.07Å; E132-H142 IonicContact OE2-NE2 2.98Å; E132-H142 PolarHBondContact OE2-NE2 3.36Å; E132-I163 WeakPolarHBondContact OE2-CG2 3.44Å
133	Q	73.4	Confident	73.6	Confident	9 Å²	9	50.4 Å²	50.4	4%	0.042	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	102.4	172.2	-167	168.1	-3.8	0	0	113	F57 R75 F107 F108 I135 P136 T139 W183	F57-Q133 HydrophobicContact CE1-CG 4.3Å; F57-Q133 HydrophobicContact CZ-CB 4.44Å; R75-Q133 PolarHBondContact NH2-O 2.73Å; F107-Q133 WeakPolarHBondContact CA-O 3.47Å; F108-Q133 HydrophobicContact CD2-CB 4.43Å; F108-Q133 PolarHBondContact N-O 3.19Å; F108-Q133 VanDerWaalsContact N-O 3.17Å; F108-Q133 PolarHBondContact O-N 3.12Å; Q133-I135 VanDerWaalsContact CG-O 3.24Å; Q133-I135 WeakPolarHBondContact CG-O 3.33Å; Q133-I135 PolarHBondContact NE2-O 2.01Å; Q133-P136 PolarHBondContact NE2-O 2.85Å; Q133-T139 HydrophobicContact CB-CG2 4.48Å; Q133-W183 HydrophobicContact CB-CH2 4.29Å; Q133-W183 HydrophobicContact CB-CZ3 4.27Å
134	T	68.8	Low	73.1	Confident	31 Å²	31	50.7 Å²	50.7	19%	0.19	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-27.4	175.2	51.2	0	0	0	0	112.7	R75 F107 E132	R75-T134 PolarHBondContact NH2-O 3.01Å; F107-T134 HydrophobicContact CB-CG2 4.06Å; E132-T134 HydrophobicContact CG-CG2 4.1Å; E132-T134 WeakPolarHBondContact OE1-CG2 3.2Å
135	I	67.3	Low	72.6	Confident	54 Å²	54	52.2 Å²	52.2	28%	0.277	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	153.6	178.4	60.5	-174	0	0	0	111.5	Q133 W137 R138	Q133-I135 VanDerWaalsContact CG-O 3.24Å; Q133-I135 WeakPolarHBondContact CG-O 3.33Å; Q133-I135 PolarHBondContact NE2-O 2.01Å; I135-W137 VanDerWaalsContact C-N 3.28Å; I135-W137 HydrophobicContact CB-CZ2 4.34Å; I135-W137 HydrophobicContact CD1-CZ2 4.22Å; I135-W137 VanDerWaalsContact CD1-NE1 3.35Å; I135-W137 PolarHBondContact O-N 2.8Å; I135-R138 HydrophobicContact CD1-CB 3.65Å; I135-R138 HydrophobicContact CG1-CB 3.56Å; I135-R138 PolarHBondContact O-N 2.92Å
136	P	64.4	Low	72.4	Confident	20 Å²	20	51.4 Å²	51.4	13%	0.13	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-35.3	-171.1	-21.2	29.2	0	0	0	114.2	N63 Q133	N63-P136 HydrophobicContact CB-CB 3.98Å; N63-P136 HydrophobicContact CB-CG 3.68Å; N63-P136 WeakPolarHBondContact OD1-CG 3.44Å; Q133-P136 PolarHBondContact NE2-O 2.85Å
137	W	60.2	Low	72.2	Confident	181 Å²	181	52.8 Å²	52.8	69%	0.686	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-1.1	-172.6	52.1	83.7	0	0	0	114.5	I135	I135-W137 VanDerWaalsContact C-N 3.28Å; I135-W137 HydrophobicContact CB-CZ2 4.34Å; I135-W137 HydrophobicContact CD1-CZ2 4.22Å; I135-W137 VanDerWaalsContact CD1-NE1 3.35Å; I135-W137 PolarHBondContact O-N 2.8Å
138	R	67.9	Low	72.2	Confident	137 Å²	137	56 Å²	56	52%	0.517	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138	124.6	-176.8	-163.5	171	180	-166.3	5.5	110.7	I135 Y140	I135-R138 HydrophobicContact CD1-CB 3.65Å; I135-R138 HydrophobicContact CG1-CB 3.56Å; I135-R138 PolarHBondContact O-N 2.92Å; R138-Y140 VanDerWaalsContact CD-OH 3.25Å; R138-Y140 WeakPolarHBondContact CD-OH 3.46Å; R138-Y140 HydrophobicContact CG-CE1 4.22Å; R138-Y140 HydrophobicContact CG-CE2 4.08Å; R138-Y140 VanDerWaalsContact CZ-OH 3.22Å; R138-Y140 VanDerWaalsContact NE-CE1 3.29Å; R138-Y140 PolarHBondContact NE-OH 3.48Å; R138-Y140 PolarHBondContact NH1-OH 2.04Å
139	T	73.5	Confident	72.2	Confident	59 Å²	59	60.1 Å²	60.1	36%	0.362	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.7	176.7	-50.4	0	0	0	0	107.9	E131 E132 Q133	E131-T139 VanDerWaalsContact CD-CG2 3.47Å; E131-T139 HydrophobicContact CG-CG2 3.09Å; E132-T139 CarbonylContact O-C 3.57Å; E132-T139 WeakPolarHBondContact O-CA 3.42Å; E132-T139 WeakPolarHBondContact O-CG2 3.02Å; Q133-T139 HydrophobicContact CB-CG2 4.48Å
140	Y	72.5	Confident	72.1	Confident	70 Å²	70	64.2 Å²	64.2	28%	0.275	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	145.5	178	-57.7	-88.1	0	0	0	109	E131 E132 R138 H142	E131-Y140 WeakPolarHBondContact CA-O 3.03Å; E132-Y140 PolarHBondContact N-O 3.39Å; E132-Y140 PolarHBondContact O-N 2.83Å; R138-Y140 VanDerWaalsContact CD-OH 3.25Å; R138-Y140 WeakPolarHBondContact CD-OH 3.46Å; R138-Y140 HydrophobicContact CG-CE1 4.22Å; R138-Y140 HydrophobicContact CG-CE2 4.08Å; R138-Y140 VanDerWaalsContact CZ-OH 3.22Å; R138-Y140 VanDerWaalsContact NE-CE1 3.29Å; R138-Y140 PolarHBondContact NE-OH 3.48Å; R138-Y140 PolarHBondContact NH1-OH 2.04Å; Y140-H142 WeakPolarHBondContact CB-NE2 3.39Å
141	R	77.3	Confident	71.9	Confident	166 Å²	166	72.1 Å²	72.1	63%	0.626	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.2	173.7	-67.5	-174.1	-173.7	167.1	-0.2	108.7	L112 E129 I130 E131	L112-R141 HydrophobicContact CD1-CG 4.23Å; E129-R141 WeakPolarHBondContact OE1-CD 3.35Å; I130-R141 WeakPolarHBondContact O-CA 3.4Å; E131-R141 HydrophobicContact CG-CG 4.45Å; E131-R141 IonicContact OE2-CZ 2.78Å; E131-R141 IonicContact OE2-NE 2.62Å; E131-R141 PolarHBondContact OE2-NE 3Å; E131-R141 IonicContact OE2-NH2 3.36Å
142	H	73.4	Confident	71.2	Confident	38 Å²	38	73.3 Å²	73.3	18%	0.176	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.5	-177	-60.9	-86	0	0	0	108.1	E129 I130 E132 Y140 V164	E129-H142 CarbonylContact C-O 3.51Å; E129-H142 WeakPolarHBondContact CA-O 3.5Å; I130-H142 PolarHBondContact N-O 3.43Å; I130-H142 PolarHBondContact O-N 3.34Å; E132-H142 IonicContact OE2-CD2 3.07Å; E132-H142 IonicContact OE2-NE2 2.98Å; E132-H142 PolarHBondContact OE2-NE2 3.36Å; Y140-H142 WeakPolarHBondContact CB-NE2 3.39Å; H142-V164 HydrophobicContact CB-CG2 4.33Å
143	K	73.5	Confident	70.3	Confident	114 Å²	114	75.5 Å²	75.5	50%	0.496	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	106.6	170	-175	170.7	-176.9	177.4	0	107.5	S127 M145	S127-K143 VanDerWaalsContact CB-CE 3.46Å; S127-K143 WeakPolarHBondContact OG-CE 3.41Å; K143-M145 HydrophobicContact CD-CE 3.69Å; K143-M145 HydrophobicContact CG-CE 4.19Å; K143-M145 HydrophobicContact CG-CG 4.47Å
144	Y	71.9	Confident	69.7	Low	5 Å²	5	78.1 Å²	78.1	2%	0.02	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.3	177.2	-177.6	-109.3	0	0	0	111.5	S127 I128 I130 W146 D161 V164 P169 L173	S127-Y144 CarbonylContact C-O 3.52Å; S127-Y144 WeakPolarHBondContact CA-O 3.14Å; S127-Y144 WeakPolarHBondContact CB-O 3.5Å; I128-Y144 HydrophobicContact CG2-CD1 4.04Å; I128-Y144 HydrophobicContact CG2-CG 4.42Å; I128-Y144 PolarHBondContact N-O 3.19Å; I128-Y144 PolarHBondContact O-N 3.27Å; I130-Y144 HydrophobicContact CD1-CG 4.37Å; Y144-W146 HydrophobicContact CD1-CD2 4.38Å; Y144-W146 AromaticContact CD1-CE3 3.52Å; Y144-W146 HydrophobicContact CD1-CE3 3.52Å; Y144-W146 HydrophobicContact CD1-CZ3 4.03Å; Y144-W146 HydrophobicContact CE1-CB 3.9Å; Y144-W146 HydrophobicContact CE1-CD2 4.08Å; Y144-W146 AromaticContact CE1-CE3 3.67Å; Y144-W146 HydrophobicContact CE1-CE3 3.67Å; Y144-W146 HydrophobicContact CE1-CG 4.22Å; Y144-D161 WeakPolarHBondContact CA-OD2 3.32Å; Y144-D161 WeakPolarHBondContact CD2-OD2 3.36Å; Y144-V164 HydrophobicContact CD1-CG1 4.36Å; Y144-V164 HydrophobicContact CD2-CB 3.41Å; Y144-V164 VanDerWaalsContact CD2-CB 3.41Å; Y144-V164 HydrophobicContact CD2-CG1 3.18Å; Y144-V164 HydrophobicContact CD2-CG2 4.11Å; Y144-V164 HydrophobicContact CE2-CB 3.93Å; Y144-V164 HydrophobicContact CE2-CG1 3.62Å; Y144-V164 HydrophobicContact CG-CB 4.2Å; Y144-V164 HydrophobicContact CG-CG1 3.63Å; Y144-P169 HydrophobicContact CE1-CB 4.15Å; Y144-P169 HydrophobicContact CE1-CG 4.07Å; Y144-P169 HydrophobicContact CE2-CB 4.37Å; Y144-P169 HydrophobicContact CE2-CG 3.66Å; Y144-P169 WeakPolarHBondContact OH-CG 3.33Å; Y144-L173 HydrophobicContact CE1-CD1 4.38Å
145	M	71.9	Confident	69.3	Low	69 Å²	69	81.8 Å²	81.8	34%	0.34	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.6	178.5	-63.3	-167.7	-177	0	0	111.9	C126 K143 D157 D161	C126-M145 WeakPolarHBondContact O-CA 3.42Å; K143-M145 HydrophobicContact CD-CE 3.69Å; K143-M145 HydrophobicContact CG-CE 4.19Å; K143-M145 HydrophobicContact CG-CG 4.47Å; M145-D157 HydrophobicContact CB-CB 4.1Å; M145-D157 PolarHBondContact O-N 2.96Å; M145-D161 PolarHBondContact N-OD2 3.39Å
146	W	74	Confident	68.8	Low	2 Å²	2	82 Å²	82	1%	0.008	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.2	176.2	75.4	94.7	0	0	0	112.4	E115 S125 C126 I128 Y144 H154 H155 L173	E115-W146 HydrophobicContact CB-CH2 4.02Å; E115-W146 HydrophobicContact CB-CZ2 4.3Å; E115-W146 VanDerWaalsContact CD-CZ2 3.41Å; E115-W146 HydrophobicContact CG-CH2 3.56Å; E115-W146 HydrophobicContact CG-CZ2 3.49Å; E115-W146 VanDerWaalsContact CG-CZ2 3.49Å; S125-W146 CarbonylContact C-O 3.57Å; C126-W146 HydrophobicContact CB-CD2 3.87Å; C126-W146 HydrophobicContact CB-CE3 4.21Å; C126-W146 HydrophobicContact CB-CH2 3.8Å; C126-W146 HydrophobicContact CB-CZ2 3.4Å; C126-W146 HydrophobicContact CB-CZ3 4.16Å; C126-W146 PolarHBondContact N-O 3.04Å; C126-W146 VanDerWaalsContact O-CE3 3.23Å; C126-W146 PolarHBondContact O-N 2.77Å; I128-W146 HydrophobicContact CB-CH2 4.3Å; I128-W146 HydrophobicContact CB-CZ3 3.96Å; I128-W146 HydrophobicContact CG2-CH2 4.27Å; I128-W146 HydrophobicContact CG2-CZ3 3.64Å; Y144-W146 HydrophobicContact CD1-CD2 4.38Å; Y144-W146 AromaticContact CD1-CE3 3.52Å; Y144-W146 HydrophobicContact CD1-CE3 3.52Å; Y144-W146 HydrophobicContact CD1-CZ3 4.03Å; Y144-W146 HydrophobicContact CE1-CB 3.9Å; Y144-W146 HydrophobicContact CE1-CD2 4.08Å; Y144-W146 AromaticContact CE1-CE3 3.67Å; Y144-W146 HydrophobicContact CE1-CE3 3.67Å; Y144-W146 HydrophobicContact CE1-CG 4.22Å; W146-H154 AromaticContact CD1-ND1 3.61Å; W146-H154 AromaticContact NE1-ND1 3.87Å; W146-H155 CarbonylContact C-O 3.5Å; W146-H155 WeakPolarHBondContact CA-O 3.48Å; W146-L173 HydrophobicContact CD2-CD1 4.48Å; W146-L173 HydrophobicContact CD2-CD2 4.08Å; W146-L173 HydrophobicContact CG-CD2 4.31Å; W146-L173 HydrophobicContact CH2-CD1 4.17Å; W146-L173 HydrophobicContact CZ2-CD1 4.13Å; W146-L173 HydrophobicContact CZ2-CD2 3.82Å; W146-L173 HydrophobicContact CZ2-CG 4.39Å; W146-L173 HydrophobicContact CZ3-CD1 4.38Å
147	Y	74.5	Confident	68.4	Low	33 Å²	33	85.1 Å²	85.1	13%	0.129	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.9	174.3	-164.6	-90.1	0	0	0	110.5	H120 F122 G123 Y149 H154 H155	H120-Y147 AromaticContact CD2-CE2 3.99Å; F122-Y147 VanDerWaalsContact C-OH 3.32Å; G123-Y147 WeakPolarHBondContact CA-OH 3.43Å; G123-Y147 PolarHBondContact N-OH 3Å; G123-Y147 VanDerWaalsContact N-OH 3.17Å; Y147-Y149 HydrophobicContact CD1-CD1 4.2Å; Y147-Y149 AromaticContact CD1-CD2 3.69Å; Y147-Y149 HydrophobicContact CD1-CD2 3.69Å; Y147-Y149 HydrophobicContact CD1-CE1 4.05Å; Y147-Y149 AromaticContact CD1-CE2 3.51Å; Y147-Y149 HydrophobicContact CD1-CE2 3.51Å; Y147-Y149 HydrophobicContact CD1-CG 4.03Å; Y147-Y149 AromaticContact CD1-CZ 3.71Å; Y147-Y149 AromaticContact CE1-CD1 3.61Å; Y147-Y149 HydrophobicContact CE1-CD1 3.61Å; Y147-Y149 AromaticContact CE1-CD2 3.98Å; Y147-Y149 HydrophobicContact CE1-CD2 3.98Å; Y147-Y149 AromaticContact CE1-CE1 3.53Å; Y147-Y149 HydrophobicContact CE1-CE1 3.53Å; Y147-Y149 AromaticContact CE1-CE2 3.89Å; Y147-Y149 HydrophobicContact CE1-CE2 3.89Å; Y147-Y149 AromaticContact CE1-CG 3.84Å; Y147-Y149 HydrophobicContact CE1-CG 3.84Å; Y147-Y149 AromaticContact CE1-CZ 3.67Å; Y147-H154 CarbonylContact O-C 3.54Å; Y147-H154 VanDerWaalsContact O-CA 3.24Å; Y147-H154 WeakPolarHBondContact O-CA 3.07Å; Y147-H155 PolarHBondContact N-O 3.34Å; Y147-H155 PolarHBondContact O-N 2.72Å
148	K	73.3	Confident	68	Low	79 Å²	79	80.2 Å²	80.2	34%	0.343	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	113.7	172.8	-174.5	179	-168.1	171.6	0	109.7	G123 K124 H154	G123-K148 CarbonylContact C-O 3.55Å; G123-K148 WeakPolarHBondContact CA-O 3.48Å; K124-K148 HydrophobicContact CG-CB 4.19Å; K124-K148 PolarHBondContact N-O 3.01Å; K124-K148 PolarHBondContact O-N 3.41Å; K148-H154 VanDerWaalsContact CG-CE1 3.49Å; K148-H154 WeakPolarHBondContact CG-CE1 3Å
149	Y	75.6	Confident	67.2	Low	91 Å²	91	80.6 Å²	80.6	36%	0.357	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	147.6	171.1	-70.2	-86.6	0	0	0	110.4	Y147 L151 G152 S153 H155	Y147-Y149 HydrophobicContact CD1-CD1 4.2Å; Y147-Y149 AromaticContact CD1-CD2 3.69Å; Y147-Y149 HydrophobicContact CD1-CD2 3.69Å; Y147-Y149 HydrophobicContact CD1-CE1 4.05Å; Y147-Y149 AromaticContact CD1-CE2 3.51Å; Y147-Y149 HydrophobicContact CD1-CE2 3.51Å; Y147-Y149 HydrophobicContact CD1-CG 4.03Å; Y147-Y149 AromaticContact CD1-CZ 3.71Å; Y147-Y149 AromaticContact CE1-CD1 3.61Å; Y147-Y149 HydrophobicContact CE1-CD1 3.61Å; Y147-Y149 AromaticContact CE1-CD2 3.98Å; Y147-Y149 HydrophobicContact CE1-CD2 3.98Å; Y147-Y149 AromaticContact CE1-CE1 3.53Å; Y147-Y149 HydrophobicContact CE1-CE1 3.53Å; Y147-Y149 AromaticContact CE1-CE2 3.89Å; Y147-Y149 HydrophobicContact CE1-CE2 3.89Å; Y147-Y149 AromaticContact CE1-CG 3.84Å; Y147-Y149 HydrophobicContact CE1-CG 3.84Å; Y147-Y149 AromaticContact CE1-CZ 3.67Å; Y149-L151 PolarHBondContact O-N 2.77Å; Y149-L151 VanDerWaalsContact O-N 3.09Å; Y149-G152 PolarHBondContact O-N 3.17Å; Y149-S153 WeakPolarHBondContact CB-OG 3.45Å; Y149-S153 WeakPolarHBondContact CD2-OG 2.98Å; Y149-S153 PolarHBondContact N-O 3.1Å; Y149-H155 HydrophobicContact CE2-CB 4.5Å; Y149-H155 AromaticContact CE2-CD2 3.66Å
150	Y	74.9	Confident	65.7	Low	156 Å²	156	83 Å²	83	61%	0.612	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.1	174.5	-67.7	-59.3	0	0	0	113.4	G123 G152	G123-Y150 VanDerWaalsContact N-CE2 3.3Å; Y150-G152 PolarHBondContact O-N 3.23Å
151	L	70.7	Confident	64.7	Low	170 Å²	170	80.2 Å²	80.2	89%	0.89	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	2.9	174.9	-69.5	161	0	0	0	113.8	Y149	Y149-L151 PolarHBondContact O-N 2.77Å; Y149-L151 VanDerWaalsContact O-N 3.09Å
152	G	59.9	Low	63.2	Low	47 Å²	47	79.9 Å²	79.9	49%	0.485	40%	0.4	S	S	.	.	S	Bend	trans	91.4	-2.5	173	0	0	0	0	0	115.9	Y149 Y150	Y149-G152 PolarHBondContact O-N 3.17Å; Y150-G152 PolarHBondContact O-N 3.23Å
153	S	57.6	Low	62	Low	54 Å²	54	79.6 Å²	79.6	38%	0.378	40%	0.399	S	S	.	.			trans	-79.5	143.2	173.2	50.5	0	0	0	0	111.8	Y149	Y149-S153 WeakPolarHBondContact CB-OG 3.45Å; Y149-S153 WeakPolarHBondContact CD2-OG 2.98Å; Y149-S153 PolarHBondContact N-O 3.1Å
154	H	60.4	Low	60.8	Low	65 Å²	65	74.4 Å²	74.4	30%	0.301	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	137.1	176.2	-67	-90.3	0	0	0	109.6	W146 Y147 K148 E170	W146-H154 AromaticContact CD1-ND1 3.61Å; W146-H154 AromaticContact NE1-ND1 3.87Å; Y147-H154 CarbonylContact O-C 3.54Å; Y147-H154 VanDerWaalsContact O-CA 3.24Å; Y147-H154 WeakPolarHBondContact O-CA 3.07Å; K148-H154 VanDerWaalsContact CG-CE1 3.49Å; K148-H154 WeakPolarHBondContact CG-CE1 3Å; H154-E170 HydrophobicContact CB-CB 4.39Å
155	H	60.1	Low	59.7	Low	108 Å²	108	77.2 Å²	77.2	50%	0.5	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	142	174.5	-84.8	-79	0	0	0	110.8	W146 Y147 Y149	W146-H155 CarbonylContact C-O 3.5Å; W146-H155 WeakPolarHBondContact CA-O 3.48Å; Y147-H155 PolarHBondContact N-O 3.34Å; Y147-H155 PolarHBondContact O-N 2.72Å; Y149-H155 HydrophobicContact CE2-CB 4.5Å; Y149-H155 AromaticContact CE2-CD2 3.66Å
156	P	57.2	Low	58.7	Low	59 Å²	59	76.6 Å²	76.6	38%	0.383	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	139.7	168.5	-17.9	30.3	0	0	0	110.5	Q165	P156-Q165 HydrophobicContact CB-CG 4.28Å; P156-Q165 HydrophobicContact CG-CG 4.25Å
157	D	56.3	Low	57.8	Low	84 Å²	84	77.6 Å²	77.6	45%	0.449	39%	0.388	S	S	.	.			trans	-92	-15.7	-176.3	-148.8	8.8	0	0	0	112.9	M145	M145-D157 HydrophobicContact CB-CB 4.1Å; M145-D157 PolarHBondContact O-N 2.96Å
158	D	51.8	Low	56.7	Low	78 Å²	78	80.9 Å²	80.9	42%	0.417	41%	0.405	S	S	.	.			trans	-151.8	156.6	-175.7	-161.6	8.3	0	0	0	114.4	T160 Q165	D158-T160 VanDerWaalsContact C-N 3.32Å; D158-T160 VanDerWaalsContact OD2-CG2 3.31Å; D158-T160 WeakPolarHBondContact OD2-CG2 3.43Å; D158-T160 PolarHBondContact OD2-OG1 3.45Å; D158-Q165 PolarHBondContact O-NE2 2.88Å; D158-Q165 VanDerWaalsContact O-NE2 3.11Å
159	D	50.1	Low	55.7	Low	145 Å²	145	77.2 Å²	77.2	78%	0.775	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-79.1	-10.1	175.3	-90.7	-19.3	0	0	0	112.8	D161	D159-D161 PolarHBondContact O-N 2.93Å; D159-D161 VanDerWaalsContact O-N 3.12Å
160	T	43.1	Very low	54.7	Low	111 Å²	111	76.6 Å²	76.6	68%	0.681	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-74.3	2	-176.3	56.4	0	0	0	0	114.4	D158	D158-T160 VanDerWaalsContact C-N 3.32Å; D158-T160 VanDerWaalsContact OD2-CG2 3.31Å; D158-T160 WeakPolarHBondContact OD2-CG2 3.43Å; D158-T160 PolarHBondContact OD2-OG1 3.45Å
161	D	51.8	Low	53.9	Low	10 Å²	10	75.2 Å²	75.2	5%	0.053	39%	0.388	C	S	.	.	G	3₁₀ helix	trans	-130.1	25.8	-161.3	-144.4	4.4	0	0	0	114.7	Y144 M145 D159 I163 V164 Q165	Y144-D161 WeakPolarHBondContact CA-OD2 3.32Å; Y144-D161 WeakPolarHBondContact CD2-OD2 3.36Å; M145-D161 PolarHBondContact N-OD2 3.39Å; D159-D161 PolarHBondContact O-N 2.93Å; D159-D161 VanDerWaalsContact O-N 3.12Å; D161-I163 PolarHBondContact O-N 2.86Å; D161-V164 PolarHBondContact O-N 3.07Å; D161-V164 WeakPolarHBondContact OD1-CG2 3.05Å; D161-Q165 PolarHBondContact O-N 2.81Å; D161-Q165 VanDerWaalsContact O-N 3.14Å
162	W	45.7	Very low	53.6	Low	160 Å²	160	70 Å²	70	61%	0.606	36%	0.357	S	S	*	.	H	α-helix	trans	-52.6	-24.5	-176.8	66.2	-88.2	0	0	0	114.4	R166	W162-R166 PolarHBondContact O-N 3.47Å
163	I	47.4	Very low	53.9	Low	31 Å²	31	68.4 Å²	68.4	16%	0.159	34%	0.337	C	S	.	.	H	α-helix	trans	-74	-36.5	177.6	-65.3	172.8	0	0	0	111.8	E132 D161 R166 Y167	E132-I163 WeakPolarHBondContact OE2-CG2 3.44Å; D161-I163 PolarHBondContact O-N 2.86Å; I163-R166 WeakPolarHBondContact O-CB 3.34Å; I163-Y167 HydrophobicContact CG2-CE2 4.43Å; I163-Y167 VanDerWaalsContact O-CD2 3.28Å; I163-Y167 WeakPolarHBondContact O-CD2 3.34Å; I163-Y167 WeakPolarHBondContact O-CE2 3.4Å
164	V	48.7	Very low	54.5	Low	5 Å²	5	69.3 Å²	69.3	3%	0.03	34%	0.344	C	S	.	.	H	α-helix	trans	-83	-36.1	178.2	-172.3	0	0	0	0	109.9	I130 H142 Y144 D161 R166 Y167 P169	I130-V164 HydrophobicContact CD1-CG1 3.94Å; I130-V164 HydrophobicContact CD1-CG2 4.37Å; H142-V164 HydrophobicContact CB-CG2 4.33Å; Y144-V164 HydrophobicContact CD1-CG1 4.36Å; Y144-V164 HydrophobicContact CD2-CB 3.41Å; Y144-V164 VanDerWaalsContact CD2-CB 3.41Å; Y144-V164 HydrophobicContact CD2-CG1 3.18Å; Y144-V164 HydrophobicContact CD2-CG2 4.11Å; Y144-V164 HydrophobicContact CE2-CB 3.93Å; Y144-V164 HydrophobicContact CE2-CG1 3.62Å; Y144-V164 HydrophobicContact CG-CB 4.2Å; Y144-V164 HydrophobicContact CG-CG1 3.63Å; D161-V164 PolarHBondContact O-N 3.07Å; D161-V164 WeakPolarHBondContact OD1-CG2 3.05Å; V164-R166 PolarHBondContact O-N 2.8Å; V164-R166 VanDerWaalsContact O-N 3.17Å; V164-Y167 PolarHBondContact O-N 3.33Å; V164-Y167 VanDerWaalsContact O-N 3.13Å; V164-P169 HydrophobicContact CG1-CB 3.94Å; V164-P169 HydrophobicContact CG1-CG 4.04Å; V164-P169 WeakPolarHBondContact O-CD 3.49Å; V164-P169 WeakPolarHBondContact O-CG 3.11Å
165	Q	48.9	Very low	55.1	Low	65 Å²	65	68.7 Å²	68.7	30%	0.304	34%	0.339	S	S	.	.	H	α-helix	trans	-55.2	-31	170.4	-67.3	-178.7	1.7	0	0	112.8	P156 D158 D161 Y167 H168	P156-Q165 HydrophobicContact CB-CG 4.28Å; P156-Q165 HydrophobicContact CG-CG 4.25Å; D158-Q165 PolarHBondContact O-NE2 2.88Å; D158-Q165 VanDerWaalsContact O-NE2 3.11Å; D161-Q165 PolarHBondContact O-N 2.81Å; D161-Q165 VanDerWaalsContact O-N 3.14Å; Q165-Y167 PolarHBondContact O-N 3.29Å; Q165-H168 PolarHBondContact O-N 3.02Å
166	R	51.5	Low	55.6	Low	56 Å²	56	63.8 Å²	63.8	21%	0.211	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-45.7	-28.9	173.4	-171.2	122.2	-169.3	-151.3	11.5	114.1	V79 Y80 E83 W162 I163 V164	V79-R166 VanDerWaalsContact CB-CZ 3.45Å; V79-R166 HydrophobicContact CG1-CG 3.69Å; V79-R166 VanDerWaalsContact CG1-CZ 3.47Å; Y80-R166 HydrophobicContact CE1-CG 3.72Å; Y80-R166 HydrophobicContact CE2-CG 4.26Å; Y80-R166 VanDerWaalsContact CZ-CG 3.46Å; Y80-R166 VanDerWaalsContact OH-CD 3.22Å; Y80-R166 WeakPolarHBondContact OH-CD 3.26Å; Y80-R166 WeakPolarHBondContact OH-CG 3.4Å; Y80-R166 PolarHBondContact OH-NE 3.15Å; E83-R166 IonicContact OE1-NH2 3.51Å; E83-R166 PolarHBondContact OE1-NH2 3.25Å; W162-R166 PolarHBondContact O-N 3.47Å; I163-R166 WeakPolarHBondContact O-CB 3.34Å; V164-R166 PolarHBondContact O-N 2.8Å; V164-R166 VanDerWaalsContact O-N 3.17Å
167	Y	54.3	Low	56.1	Low	22 Å²	22	63.1 Å²	63.1	9%	0.086	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	3.1	-169.3	-58.5	-59.1	0	0	0	114.7	V79 F107 L109 I163 V164 Q165 P169	V79-Y167 HydrophobicContact CG1-CE1 3.55Å; V79-Y167 VanDerWaalsContact CG1-OH 3.29Å; V79-Y167 WeakPolarHBondContact CG1-OH 3.25Å; F107-Y167 HydrophobicContact CD1-CE1 4.06Å; F107-Y167 WeakPolarHBondContact CD1-OH 3.26Å; F107-Y167 HydrophobicContact CD2-CE1 4.23Å; F107-Y167 HydrophobicContact CD2-CE2 4.49Å; F107-Y167 AromaticContact CD2-CZ 3.83Å; F107-Y167 WeakPolarHBondContact CD2-OH 3.41Å; F107-Y167 HydrophobicContact CE1-CD1 4.17Å; F107-Y167 AromaticContact CE1-CE1 3.23Å; F107-Y167 HydrophobicContact CE1-CE1 3.23Å; F107-Y167 AromaticContact CE1-CZ 3.7Å; F107-Y167 HydrophobicContact CE2-CD1 4.06Å; F107-Y167 AromaticContact CE2-CE1 3.47Å; F107-Y167 HydrophobicContact CE2-CE1 3.47Å; F107-Y167 VanDerWaalsContact CE2-CE1 3.47Å; F107-Y167 HydrophobicContact CE2-CE2 4.09Å; F107-Y167 AromaticContact CE2-CZ 3.44Å; F107-Y167 VanDerWaalsContact CE2-CZ 3.44Å; F107-Y167 HydrophobicContact CG-CE1 4.5Å; F107-Y167 WeakPolarHBondContact CG-OH 3.32Å; F107-Y167 AromaticContact CZ-CD1 3.51Å; F107-Y167 HydrophobicContact CZ-CD1 3.51Å; F107-Y167 AromaticContact CZ-CE1 2.9Å; F107-Y167 HydrophobicContact CZ-CE1 2.9Å; F107-Y167 HydrophobicContact CZ-CE2 4.35Å; F107-Y167 HydrophobicContact CZ-CG 4.45Å; F107-Y167 AromaticContact CZ-CZ 3.38Å; L109-Y167 HydrophobicContact CD1-CD2 4.19Å; L109-Y167 HydrophobicContact CD1-CE2 4.25Å; I163-Y167 HydrophobicContact CG2-CE2 4.43Å; I163-Y167 VanDerWaalsContact O-CD2 3.28Å; I163-Y167 WeakPolarHBondContact O-CD2 3.34Å; I163-Y167 WeakPolarHBondContact O-CE2 3.4Å; V164-Y167 PolarHBondContact O-N 3.33Å; V164-Y167 VanDerWaalsContact O-N 3.13Å; Q165-Y167 PolarHBondContact O-N 3.29Å; Y167-P169 VanDerWaalsContact C-N 3.31Å
168	H	52.1	Low	56.9	Low	103 Å²	103	65.7 Å²	65.7	48%	0.477	32%	0.318	S	S	.	.			trans	48.5	54.8	-167.3	-67.5	-70.4	0	0	0	111.1	Q165 E170 Q171	Q165-H168 PolarHBondContact O-N 3.02Å; H168-E170 VanDerWaalsContact C-CD 3.48Å; H168-E170 WeakPolarHBondContact CA-OE1 3.17Å; H168-E170 WeakPolarHBondContact CA-OE2 3.13Å; H168-E170 VanDerWaalsContact CB-OE1 3.25Å; H168-E170 WeakPolarHBondContact CB-OE1 3.31Å; H168-E170 IonicContact CG-OE1 3.7Å; H168-E170 IonicContact ND1-OE1 3.95Å; H168-E170 PolarHBondContact ND1-OE1 2.9Å; H168-E170 PolarHBondContact O-N 2.03Å; H168-Q171 HydrophobicContact CB-CG 4.1Å; H168-Q171 WeakPolarHBondContact O-CB 3.42Å; H168-Q171 PolarHBondContact O-N 2.78Å
169	P	51.9	Low	57.8	Low	1 Å²	1	62 Å²	62	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-56.4	-27	-171.9	27.3	-36.7	0	0	0	110.8	Y144 V164 Y167 Q171 Y172 L173	Y144-P169 HydrophobicContact CE1-CB 4.15Å; Y144-P169 HydrophobicContact CE1-CG 4.07Å; Y144-P169 HydrophobicContact CE2-CB 4.37Å; Y144-P169 HydrophobicContact CE2-CG 3.66Å; Y144-P169 WeakPolarHBondContact OH-CG 3.33Å; V164-P169 HydrophobicContact CG1-CB 3.94Å; V164-P169 HydrophobicContact CG1-CG 4.04Å; V164-P169 WeakPolarHBondContact O-CD 3.49Å; V164-P169 WeakPolarHBondContact O-CG 3.11Å; Y167-P169 VanDerWaalsContact C-N 3.31Å; P169-Q171 PolarHBondContact O-N 3.29Å; P169-Y172 CarbonylContact O-C 3.59Å; P169-Y172 VanDerWaalsContact O-C 3.31Å; P169-Y172 PolarHBondContact O-N 3.1Å; P169-L173 WeakPolarHBondContact O-CA 3.42Å; P169-L173 WeakPolarHBondContact O-CB 3.4Å; P169-L173 PolarHBondContact O-N 3.39Å
170	E	54.3	Low	58.8	Low	78 Å²	78	65.8 Å²	65.8	36%	0.364	30%	0.302	S	S	.	.	H	α-helix	trans	-52.4	-37.2	171.3	67.1	-76	177.3	0	0	113.8	H154 H168 Y172	H154-E170 HydrophobicContact CB-CB 4.39Å; H168-E170 VanDerWaalsContact C-CD 3.48Å; H168-E170 WeakPolarHBondContact CA-OE1 3.17Å; H168-E170 WeakPolarHBondContact CA-OE2 3.13Å; H168-E170 VanDerWaalsContact CB-OE1 3.25Å; H168-E170 WeakPolarHBondContact CB-OE1 3.31Å; H168-E170 IonicContact CG-OE1 3.7Å; H168-E170 IonicContact ND1-OE1 3.95Å; H168-E170 PolarHBondContact ND1-OE1 2.9Å; H168-E170 PolarHBondContact O-N 2.03Å; E170-Y172 VanDerWaalsContact C-N 3.31Å
171	Q	58.8	Low	60.3	Low	127 Å²	127	61.9 Å²	61.9	59%	0.593	28%	0.284	S	S	*	.	H	α-helix	trans	-72	-29.5	178.1	-62	-177.2	10.8	0	0	112	H168 P169	H168-Q171 HydrophobicContact CB-CG 4.1Å; H168-Q171 WeakPolarHBondContact O-CB 3.42Å; H168-Q171 PolarHBondContact O-N 2.78Å; P169-Q171 PolarHBondContact O-N 3.29Å
172	Y	64.2	Low	61.4	Low	61 Å²	61	66 Å²	66	24%	0.239	30%	0.302	C	S	.	.	H	α-helix	trans	-112	4.5	-174.4	-60.7	-75.8	0	0	0	113.1	P169 E170 S174 Y175 F176 L201	P169-Y172 CarbonylContact O-C 3.59Å; P169-Y172 VanDerWaalsContact O-C 3.31Å; P169-Y172 PolarHBondContact O-N 3.1Å; E170-Y172 VanDerWaalsContact C-N 3.31Å; Y172-S174 VanDerWaalsContact C-N 3.34Å; Y172-S174 PolarHBondContact O-N 3.45Å; Y172-Y175 CarbonylContact O-C 3.41Å; Y172-Y175 WeakPolarHBondContact O-CA 3.22Å; Y172-Y175 VanDerWaalsContact O-CB 3.31Å; Y172-Y175 WeakPolarHBondContact O-CB 3.36Å; Y172-Y175 PolarHBondContact O-N 3.14Å; Y172-F176 WeakPolarHBondContact O-CD2 3.34Å; Y172-F176 PolarHBondContact O-N 2.97Å; Y172-L201 HydrophobicContact CD1-CB 4.11Å; Y172-L201 HydrophobicContact CD1-CD1 3.99Å; Y172-L201 HydrophobicContact CD1-CG 4.05Å; Y172-L201 HydrophobicContact CD2-CD1 4.1Å; Y172-L201 HydrophobicContact CD2-CG 4.49Å; Y172-L201 HydrophobicContact CE1-CB 4.38Å; Y172-L201 HydrophobicContact CE1-CG 4.29Å; Y172-L201 HydrophobicContact CG-CD1 3.67Å; Y172-L201 HydrophobicContact CG-CG 4.16Å
173	L	66.4	Low	62.9	Low	13 Å²	13	59.2 Å²	59.2	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-63.7	-43.7	-168	-177.8	64	0	0	0	110.3	Y144 W146 P169 Y175 F176 L177	Y144-L173 HydrophobicContact CE1-CD1 4.38Å; W146-L173 HydrophobicContact CD2-CD1 4.48Å; W146-L173 HydrophobicContact CD2-CD2 4.08Å; W146-L173 HydrophobicContact CG-CD2 4.31Å; W146-L173 HydrophobicContact CH2-CD1 4.17Å; W146-L173 HydrophobicContact CZ2-CD1 4.13Å; W146-L173 HydrophobicContact CZ2-CD2 3.82Å; W146-L173 HydrophobicContact CZ2-CG 4.39Å; W146-L173 HydrophobicContact CZ3-CD1 4.38Å; P169-L173 WeakPolarHBondContact O-CA 3.42Å; P169-L173 WeakPolarHBondContact O-CB 3.4Å; P169-L173 PolarHBondContact O-N 3.39Å; L173-Y175 VanDerWaalsContact C-N 3.28Å; L173-Y175 PolarHBondContact O-N 3.22Å; L173-F176 WeakPolarHBondContact O-CB 3.45Å; L173-F176 PolarHBondContact O-N 2.98Å; L173-L177 HydrophobicContact CG-CD1 4.13Å; L173-L177 VanDerWaalsContact O-CG 3.23Å; L173-L177 WeakPolarHBondContact O-CG 3.28Å; L173-L177 PolarHBondContact O-N 3.43Å
174	S	68.9	Low	64.4	Low	73 Å²	73	57.8 Å²	57.8	51%	0.51	27%	0.268	S	S	.	.	H	α-helix	trans	-58.4	-43	173.6	55	0	0	0	0	111.5	Y172 L177 E178	Y172-S174 VanDerWaalsContact C-N 3.34Å; Y172-S174 PolarHBondContact O-N 3.45Å; S174-L177 PolarHBondContact O-N 2.82Å; S174-E178 WeakPolarHBondContact O-CB 3.35Å; S174-E178 VanDerWaalsContact O-CG 3.26Å; S174-E178 WeakPolarHBondContact O-CG 3.29Å; S174-E178 PolarHBondContact O-N 3.09Å
175	Y	73.3	Confident	65.8	Low	53 Å²	53	57.6 Å²	57.6	21%	0.208	27%	0.267	C	S	.	.	H	α-helix	trans	-65.9	-39.2	178.1	-172.5	-98.2	0	0	0	112.6	Y172 L173 S179 I184 L201 F202 H203	Y172-Y175 CarbonylContact O-C 3.41Å; Y172-Y175 WeakPolarHBondContact O-CA 3.22Å; Y172-Y175 VanDerWaalsContact O-CB 3.31Å; Y172-Y175 WeakPolarHBondContact O-CB 3.36Å; Y172-Y175 PolarHBondContact O-N 3.14Å; L173-Y175 VanDerWaalsContact C-N 3.28Å; L173-Y175 PolarHBondContact O-N 3.22Å; Y175-S179 PolarHBondContact O-N 2.84Å; Y175-I184 HydrophobicContact CD1-CD1 4.21Å; Y175-I184 HydrophobicContact CD1-CG2 4.5Å; Y175-I184 HydrophobicContact CE1-CD1 4.22Å; Y175-I184 HydrophobicContact CE1-CG1 4.12Å; Y175-I184 HydrophobicContact CE1-CG2 4.01Å; Y175-L201 HydrophobicContact CD1-CB 4.18Å; Y175-L201 HydrophobicContact CE1-CB 4.11Å; Y175-L201 WeakPolarHBondContact CE1-O 3.36Å; Y175-F202 WeakPolarHBondContact OH-CA 3.38Å; Y175-H203 AromaticContact CE2-NE2 3.82Å; Y175-H203 AromaticContact CZ-CD2 3.89Å; Y175-H203 AromaticContact CZ-CE1 3.84Å; Y175-H203 AromaticContact CZ-NE2 3.69Å; Y175-H203 PolarHBondContact OH-CD2 3.25Å; Y175-H203 VanDerWaalsContact OH-CG 3.32Å; Y175-H203 PolarHBondContact OH-N 3.09Å; Y175-H203 PolarHBondContact OH-NE2 3.18Å
176	F	70.8	Confident	67.2	Low	5 Å²	5	55.2 Å²	55.2	2%	0.022	26%	0.256	C	S	.	.	H	α-helix	trans	-59.7	-51.8	171.3	-79.9	-68.1	0	0	0	110.8	L109 P111 Y172 L173 E178 S179 I184 L201	L109-F176 HydrophobicContact CB-CE1 3.77Å; L109-F176 HydrophobicContact CD1-CE1 3.49Å; L109-F176 VanDerWaalsContact CD1-CE1 3.49Å; L109-F176 HydrophobicContact CD1-CZ 3.38Å; L109-F176 HydrophobicContact CG-CE1 4.28Å; P111-F176 WeakPolarHBondContact CG-O 3.23Å; Y172-F176 WeakPolarHBondContact O-CD2 3.34Å; Y172-F176 PolarHBondContact O-N 2.97Å; L173-F176 WeakPolarHBondContact O-CB 3.45Å; L173-F176 PolarHBondContact O-N 2.98Å; F176-E178 VanDerWaalsContact C-N 3.33Å; F176-E178 PolarHBondContact O-N 2.84Å; F176-S179 WeakPolarHBondContact O-CB 3.37Å; F176-S179 PolarHBondContact O-N 3.03Å; F176-S179 VanDerWaalsContact O-N 3.11Å; F176-S179 PolarHBondContact O-OG 2.91Å; F176-I184 HydrophobicContact CD1-CD1 3.34Å; F176-I184 HydrophobicContact CE1-CB 4.49Å; F176-I184 HydrophobicContact CE1-CD1 3.71Å; F176-I184 HydrophobicContact CE1-CG2 4.44Å; F176-I184 HydrophobicContact CG-CD1 4.17Å; F176-L201 HydrophobicContact CE1-CD1 4.09Å; F176-L201 HydrophobicContact CE2-CD1 3.57Å; F176-L201 HydrophobicContact CZ-CD1 3.28Å
177	L	68.8	Low	68.6	Low	45 Å²	45	52.8 Å²	52.8	24%	0.236	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-39	-178.6	-66.5	172.8	0	0	0	112.4	E115 I128 L173 S174 S179	E115-L177 HydrophobicContact CB-CD2 3.84Å; I128-L177 HydrophobicContact CD1-CD2 3.62Å; L173-L177 HydrophobicContact CG-CD1 4.13Å; L173-L177 VanDerWaalsContact O-CG 3.23Å; L173-L177 WeakPolarHBondContact O-CG 3.28Å; L173-L177 PolarHBondContact O-N 3.43Å; S174-L177 PolarHBondContact O-N 2.82Å; L177-S179 PolarHBondContact O-N 3.24Å
178	E	72.1	Confident	70	Confident	137 Å²	137	51.8 Å²	51.8	64%	0.64	24%	0.244	S	C	*	.	H	α-helix	trans	-70.1	-16.5	178.2	-75	172.5	-161.2	0	0	113.7	S174 F176 R180	S174-E178 WeakPolarHBondContact O-CB 3.35Å; S174-E178 VanDerWaalsContact O-CG 3.26Å; S174-E178 WeakPolarHBondContact O-CG 3.29Å; S174-E178 PolarHBondContact O-N 3.09Å; F176-E178 VanDerWaalsContact C-N 3.33Å; F176-E178 PolarHBondContact O-N 2.84Å; E178-R180 PolarHBondContact O-N 3.31Å
179	S	71.9	Confident	71.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.007	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-11.7	-175.1	73.5	0	0	0	0	114.7	P111 Y175 F176 L177 G181 K182 H203	P111-S179 VanDerWaalsContact CD-OG 3.27Å; P111-S179 WeakPolarHBondContact CD-OG 3.43Å; P111-S179 WeakPolarHBondContact CG-OG 3.07Å; Y175-S179 PolarHBondContact O-N 2.84Å; F176-S179 WeakPolarHBondContact O-CB 3.37Å; F176-S179 PolarHBondContact O-N 3.03Å; F176-S179 VanDerWaalsContact O-N 3.11Å; F176-S179 PolarHBondContact O-OG 2.91Å; L177-S179 PolarHBondContact O-N 3.24Å; S179-G181 VanDerWaalsContact C-N 3.26Å; S179-G181 PolarHBondContact O-N 3.49Å; S179-G181 VanDerWaalsContact O-N 3.16Å; S179-K182 WeakPolarHBondContact O-CB 3.34Å; S179-K182 WeakPolarHBondContact O-CD 3Å; S179-K182 WeakPolarHBondContact O-CG 3.03Å; S179-K182 PolarHBondContact O-N 2.88Å; S179-H203 VanDerWaalsContact CB-CE1 3.48Å; S179-H203 WeakPolarHBondContact CB-CE1 3.44Å
180	R	70.9	Confident	73.2	Confident	225 Å²	225	46.9 Å²	46.9	85%	0.849	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.8	45.1	173.7	-61.3	-175.5	-175.2	-167	0	113.7	E178 K182	E178-R180 PolarHBondContact O-N 3.31Å; R180-K182 VanDerWaalsContact C-N 3.34Å; R180-K182 PolarHBondContact O-N 2.83Å
181	G	73	Confident	74.7	Confident	29 Å²	29	48.3 Å²	48.3	30%	0.299	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	8.3	-179.9	0	0	0	0	0	116	R110 P111 S179	R110-G181 WeakPolarHBondContact CD-O 3.41Å; R110-G181 WeakPolarHBondContact CG-O 3.25Å; R110-G181 PolarHBondContact NE-O 3.16Å; R110-G181 VanDerWaalsContact NE-O 3.15Å; P111-G181 WeakPolarHBondContact O-CA 3.44Å; S179-G181 VanDerWaalsContact C-N 3.26Å; S179-G181 PolarHBondContact O-N 3.49Å; S179-G181 VanDerWaalsContact O-N 3.16Å
182	K	76.1	Confident	75.7	Confident	97 Å²	97	45 Å²	45	42%	0.422	21%	0.213	S	C	.	.			trans	-74.7	154.7	171.1	-66.3	174.6	-178.5	-178.2	0	111.5	S179 R180 D205	S179-K182 WeakPolarHBondContact O-CB 3.34Å; S179-K182 WeakPolarHBondContact O-CD 3Å; S179-K182 WeakPolarHBondContact O-CG 3.03Å; S179-K182 PolarHBondContact O-N 2.88Å; R180-K182 VanDerWaalsContact C-N 3.34Å; R180-K182 PolarHBondContact O-N 2.83Å; K182-D205 WeakPolarHBondContact CB-OD2 3.44Å
183	W	77.1	Confident	76.6	Confident	17 Å²	17	47 Å²	47	6%	0.064	23%	0.228	C	C	.	.			trans	-78.7	137.5	175.3	-72.6	98	0	0	0	111.7	F57 F108 R110 E131 Q133 H203 C204 D205	F57-W183 AromaticContact CD2-CD1 3.69Å; F57-W183 AromaticContact CD2-CD2 3.86Å; F57-W183 HydrophobicContact CD2-CD2 3.86Å; F57-W183 AromaticContact CD2-CE2 3.43Å; F57-W183 VanDerWaalsContact CD2-CE2 3.43Å; F57-W183 AromaticContact CD2-CG 3.98Å; F57-W183 HydrophobicContact CD2-CG 3.98Å; F57-W183 AromaticContact CD2-CZ2 3.86Å; F57-W183 HydrophobicContact CD2-CZ2 3.86Å; F57-W183 AromaticContact CD2-NE1 3.35Å; F57-W183 VanDerWaalsContact CD2-NE1 3.35Å; F57-W183 HydrophobicContact CE2-CB 4.36Å; F57-W183 AromaticContact CE2-CD1 3.76Å; F57-W183 AromaticContact CE2-CD2 3.19Å; F57-W183 HydrophobicContact CE2-CD2 3.19Å; F57-W183 AromaticContact CE2-CE2 3.18Å; F57-W183 AromaticContact CE2-CE3 3.61Å; F57-W183 HydrophobicContact CE2-CE3 3.61Å; F57-W183 AromaticContact CE2-CG 3.55Å; F57-W183 HydrophobicContact CE2-CG 3.55Å; F57-W183 AromaticContact CE2-CH2 3.94Å; F57-W183 HydrophobicContact CE2-CH2 3.94Å; F57-W183 AromaticContact CE2-CZ2 3.58Å; F57-W183 HydrophobicContact CE2-CZ2 3.58Å; F57-W183 AromaticContact CE2-CZ3 3.96Å; F57-W183 HydrophobicContact CE2-CZ3 3.96Å; F57-W183 AromaticContact CE2-NE1 3.56Å; F57-W183 HydrophobicContact CZ-CD2 4.08Å; F57-W183 HydrophobicContact CZ-CE3 4.04Å; F57-W183 HydrophobicContact CZ-CH2 4.06Å; F57-W183 HydrophobicContact CZ-CZ2 4.1Å; F57-W183 HydrophobicContact CZ-CZ3 4.04Å; F108-W183 HydrophobicContact CB-CE3 3.55Å; F108-W183 HydrophobicContact CB-CZ3 3.75Å; R110-W183 HydrophobicContact CB-CD2 3.69Å; R110-W183 HydrophobicContact CB-CE3 3.59Å; R110-W183 HydrophobicContact CB-CG 4.34Å; R110-W183 HydrophobicContact CB-CH2 4.24Å; R110-W183 HydrophobicContact CB-CZ2 4.31Å; R110-W183 HydrophobicContact CB-CZ3 3.88Å; R110-W183 HydrophobicContact CG-CD2 4.46Å; E131-W183 HydrophobicContact CG-CH2 4.15Å; Q133-W183 HydrophobicContact CB-CH2 4.29Å; Q133-W183 HydrophobicContact CB-CZ3 4.27Å; W183-H203 WeakPolarHBondContact O-CA 3.39Å; W183-C204 HydrophobicContact CB-CB 4.02Å; W183-C204 PolarHBondContact O-N 3.06Å; W183-D205 PolarHBondContact N-OD2 3.14Å
184	I	77.8	Confident	77.4	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	132.6	178.2	-62.5	164.2	0	0	0	108.9	F108 L109 Y175 F176 L201 F202	F108-I184 WeakPolarHBondContact CA-O 3.21Å; L109-I184 PolarHBondContact N-O 3.46Å; L109-I184 PolarHBondContact O-N 3.39Å; Y175-I184 HydrophobicContact CD1-CD1 4.21Å; Y175-I184 HydrophobicContact CD1-CG2 4.5Å; Y175-I184 HydrophobicContact CE1-CD1 4.22Å; Y175-I184 HydrophobicContact CE1-CG1 4.12Å; Y175-I184 HydrophobicContact CE1-CG2 4.01Å; F176-I184 HydrophobicContact CD1-CD1 3.34Å; F176-I184 HydrophobicContact CE1-CB 4.49Å; F176-I184 HydrophobicContact CE1-CD1 3.71Å; F176-I184 HydrophobicContact CE1-CG2 4.44Å; F176-I184 HydrophobicContact CG-CD1 4.17Å; I184-L201 HydrophobicContact CG2-CB 3.59Å; I184-L201 HydrophobicContact CG2-CD1 4.05Å; I184-L201 HydrophobicContact CG2-CD2 4.06Å; I184-L201 HydrophobicContact CG2-CG 4.11Å; I184-F202 CarbonylContact C-O 3.31Å; I184-F202 WeakPolarHBondContact CA-O 3.48Å
185	C	78.8	Confident	78.2	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.007	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	137.6	-176.8	-77.2	0	0	0	0	109.1	L58 F104 F108 L201 F202 C204	L58-C185 VanDerWaalsContact CD2-SG 3.57Å; F104-C185 HydrophobicContact CD1-CB 4.3Å; F108-C185 HydrophobicContact CD1-CB 4.49Å; F108-C185 WeakPolarHBondContact CD1-SG 3.39Å; F108-C185 WeakPolarHBondContact CE1-SG 3.3Å; C185-L201 WeakPolarHBondContact O-CA 3.13Å; C185-F202 PolarHBondContact N-O 3.43Å; C185-F202 PolarHBondContact O-N 2.92Å; C185-C204 WeakPolarHBondContact CA-SG 3.02Å; C185-C204 HydrophobicContact CB-CB 4.31Å; C185-C204 WeakPolarHBondContact CB-SG 3.35Å; C185-C204 PolarHBondContact N-SG 2.87Å; C185-C204 WeakPolarHBondContact SG-CB 3.45Å; C185-C204 CovalentContact SG-SG 2.01Å; C185-C204 PolarHBondContact SG-SG 3.21Å
186	Q	77.7	Confident	78.8	Confident	15 Å²	15	51.2 Å²	51.2	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	136.2	158.6	-173.8	-170	37.7	0	0	109.5	V79 G105 F107 L201	V79-Q186 PolarHBondContact O-NE2 3.5Å; V79-Q186 PolarHBondContact O-OE1 3.33Å; G105-Q186 PolarHBondContact N-O 2.63Å; F107-Q186 HydrophobicContact CD1-CB 4.46Å; F107-Q186 HydrophobicContact CE1-CB 3.66Å; F107-Q186 VanDerWaalsContact CE1-CD 3.43Å; F107-Q186 HydrophobicContact CE1-CG 4.06Å; F107-Q186 HydrophobicContact CE2-CB 4.31Å; F107-Q186 HydrophobicContact CZ-CB 3.54Å; F107-Q186 HydrophobicContact CZ-CG 4.12Å; Q186-L201 HydrophobicContact CB-CD2 4.37Å
187	T	80.7	Confident	79.5	Confident	6 Å²	6	53.1 Å²	53.1	4%	0.037	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	157.7	169.7	67.4	0	0	0	0	109.7	A103 F104 G199 V200 F202	A103-T187 WeakPolarHBondContact O-CA 3.24Å; F104-T187 HydrophobicContact CD1-CG2 4.48Å; T187-G199 CarbonylContact O-C 3.6Å; T187-G199 WeakPolarHBondContact O-CA 3.33Å; T187-G199 PolarHBondContact O-N 3.05Å; T187-V200 PolarHBondContact OG1-O 3.16Å; T187-F202 HydrophobicContact CG2-CB 4.06Å
188	Y	83.6	Confident	80.2	Confident	1 Å²	1	56.7 Å²	56.7	0%	0.004	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	161.3	170.6	61.4	-78.8	0	0	0	109.3	W46 F78 L81 A103 F104 I190 Y197 T216	W46-Y188 AromaticContact NE1-CE2 3.85Å; W46-Y188 AromaticContact NE1-CZ 3.69Å; W46-Y188 PolarHBondContact NE1-OH 3.43Å; F78-Y188 HydrophobicContact CE1-CE1 4.42Å; F78-Y188 HydrophobicContact CE2-CD1 4.29Å; F78-Y188 AromaticContact CE2-CE1 3.95Å; F78-Y188 HydrophobicContact CE2-CE1 3.95Å; F78-Y188 HydrophobicContact CZ-CD1 4.13Å; F78-Y188 AromaticContact CZ-CE1 3.35Å; F78-Y188 HydrophobicContact CZ-CE1 3.35Å; F78-Y188 HydrophobicContact CZ-CE2 4.46Å; F78-Y188 AromaticContact CZ-CZ 3.52Å; F78-Y188 WeakPolarHBondContact CZ-OH 3.37Å; L81-Y188 HydrophobicContact CD2-CD2 3.84Å; L81-Y188 HydrophobicContact CD2-CG 3.78Å; A103-Y188 HydrophobicContact CB-CD1 4.45Å; A103-Y188 HydrophobicContact CB-CD2 4.39Å; A103-Y188 HydrophobicContact CB-CE1 3.7Å; A103-Y188 HydrophobicContact CB-CE2 3.69Å; A103-Y188 WeakPolarHBondContact CB-OH 3.43Å; A103-Y188 PolarHBondContact N-O 2.84Å; A103-Y188 WeakPolarHBondContact O-CD1 3.22Å; A103-Y188 PolarHBondContact O-N 2.81Å; A103-Y188 VanDerWaalsContact O-N 3.08Å; F104-Y188 VanDerWaalsContact C-CE1 3.49Å; F104-Y188 WeakPolarHBondContact O-CE1 3.25Å; Y188-I190 HydrophobicContact CD2-CG1 4.43Å; Y188-I190 HydrophobicContact CE2-CD1 4.4Å; Y188-I190 HydrophobicContact CE2-CG1 4.29Å; Y188-Y197 WeakPolarHBondContact CA-O 3.45Å; Y188-Y197 VanDerWaalsContact CB-O 3.3Å; Y188-Y197 WeakPolarHBondContact CB-O 3Å; Y188-T216 PolarHBondContact OH-OG1 3.34Å
189	G	85.6	Confident	80.4	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	149.2	176.8	0	0	0	0	0	112.2	T101 P196 Y197	T101-G189 CarbonylContact O-C 3.55Å; T101-G189 WeakPolarHBondContact O-CA 3.32Å; G189-P196 WeakPolarHBondContact O-CA 3.12Å; G189-Y197 PolarHBondContact N-O 3.48Å; G189-Y197 PolarHBondContact O-N 3.44Å
190	I	86.2	Confident	80.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	115	168.2	-51.5	173.2	0	0	0	107.1	W86 Y91 T101 Y188	W86-I190 HydrophobicContact CH2-CD1 3.92Å; W86-I190 HydrophobicContact CH2-CG1 3.81Å; W86-I190 HydrophobicContact CZ3-CD1 3.86Å; W86-I190 HydrophobicContact CZ3-CG1 3.86Å; W86-I190 HydrophobicContact CZ3-CG2 4.22Å; Y91-I190 HydrophobicContact CD2-CG2 3.95Å; Y91-I190 HydrophobicContact CE2-CB 4.19Å; Y91-I190 HydrophobicContact CE2-CG2 3.67Å; T101-I190 PolarHBondContact N-O 2.97Å; T101-I190 PolarHBondContact O-N 3.21Å; Y188-I190 HydrophobicContact CD2-CG1 4.43Å; Y188-I190 HydrophobicContact CE2-CD1 4.4Å; Y188-I190 HydrophobicContact CE2-CG1 4.29Å
191	R	85.1	Confident	80.6	Confident	108 Å²	108	45.1 Å²	45.1	41%	0.408	23%	0.23	S	C	.	.			trans	-68.8	158.9	176.4	-65.8	-164.8	-166.9	114.5	-2	111.4	D100 D193 R194 T195 Y197	D100-R191 WeakPolarHBondContact OD1-CA 3.37Å; R191-D193 WeakPolarHBondContact CB-OD1 3.34Å; R191-D193 PolarHBondContact O-N 3.35Å; R191-D193 VanDerWaalsContact O-N 3.07Å; R191-R194 WeakPolarHBondContact O-CA 3.28Å; R191-R194 PolarHBondContact O-N 2.93Å; R191-T195 WeakPolarHBondContact CB-O 2.97Å; R191-T195 VanDerWaalsContact CD-OG1 3.32Å; R191-T195 WeakPolarHBondContact CD-OG1 3.44Å; R191-T195 PolarHBondContact N-O 3.3Å; R191-T195 PolarHBondContact NH1-OG1 2.93Å; R191-Y197 HydrophobicContact CG-CD1 3.87Å; R191-Y197 HydrophobicContact CG-CE1 3.79Å
192	P	81.5	Confident	80.7	Confident	58 Å²	58	47.5 Å²	47.5	38%	0.377	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-27.6	173.6	-26.9	31.7	0	0	0	114.9	D100 R194	D100-P192 VanDerWaalsContact OD1-CD 3.26Å; D100-P192 WeakPolarHBondContact OD1-CD 3.38Å; P192-R194 PolarHBondContact O-N 2.8Å
193	D	82.8	Confident	80.6	Confident	104 Å²	104	44.7 Å²	44.7	56%	0.556	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83	6.2	176.5	71.3	-6.9	0	0	0	113.9	R191 T195	R191-D193 WeakPolarHBondContact CB-OD1 3.34Å; R191-D193 PolarHBondContact O-N 3.35Å; R191-D193 VanDerWaalsContact O-N 3.07Å; D193-T195 VanDerWaalsContact C-N 3.26Å; D193-T195 PolarHBondContact O-N 2.77Å; D193-T195 WeakPolarHBondContact OD1-CB 2.99Å; D193-T195 WeakPolarHBondContact OD1-CG2 3.33Å; D193-T195 PolarHBondContact OD1-N 3.18Å; D193-T195 PolarHBondContact OD1-OG1 3.27Å; D193-T195 PolarHBondContact OD2-OG1 3.07Å
194	R	82.4	Confident	80.4	Confident	138 Å²	138	44.1 Å²	44.1	52%	0.521	22%	0.22	S	C	.	.	S	Bend	trans	70.9	11.1	-176.7	-44.8	177.4	-173.7	179.4	2	114.7	Y91 R191 P192 P196	Y91-R194 HydrophobicContact CD1-CG 3.98Å; Y91-R194 HydrophobicContact CG-CG 4.1Å; R191-R194 WeakPolarHBondContact O-CA 3.28Å; R191-R194 PolarHBondContact O-N 2.93Å; P192-R194 PolarHBondContact O-N 2.8Å; R194-P196 WeakPolarHBondContact O-CD 3.14Å
195	T	85	Confident	79.8	Confident	48 Å²	48	48.3 Å²	48.3	29%	0.294	24%	0.242	S	C	.	.			trans	-77.3	124.1	172.2	59.9	0	0	0	0	110.3	R191 D193	R191-T195 WeakPolarHBondContact CB-O 2.97Å; R191-T195 VanDerWaalsContact CD-OG1 3.32Å; R191-T195 WeakPolarHBondContact CD-OG1 3.44Å; R191-T195 PolarHBondContact N-O 3.3Å; R191-T195 PolarHBondContact NH1-OG1 2.93Å; D193-T195 VanDerWaalsContact C-N 3.26Å; D193-T195 PolarHBondContact O-N 2.77Å; D193-T195 WeakPolarHBondContact OD1-CB 2.99Å; D193-T195 WeakPolarHBondContact OD1-CG2 3.33Å; D193-T195 PolarHBondContact OD1-N 3.18Å; D193-T195 PolarHBondContact OD1-OG1 3.27Å; D193-T195 PolarHBondContact OD2-OG1 3.07Å
196	P	87.2	Confident	78.8	Confident	41 Å²	41	51.3 Å²	51.3	27%	0.266	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	153.5	174.1	37.7	-38.7	0	0	0	110.9	L81 W86 G189 R194	L81-P196 HydrophobicContact CD1-CB 4.15Å; W86-P196 HydrophobicContact CD2-CB 3.97Å; W86-P196 HydrophobicContact CD2-CG 3.66Å; W86-P196 VanDerWaalsContact CE2-CG 3.5Å; W86-P196 HydrophobicContact CE3-CB 4.04Å; W86-P196 HydrophobicContact CE3-CG 4.05Å; W86-P196 HydrophobicContact CG-CG 4.15Å; W86-P196 HydrophobicContact CH2-CB 3.46Å; W86-P196 VanDerWaalsContact CH2-CB 3.46Å; W86-P196 HydrophobicContact CH2-CG 4.26Å; W86-P196 HydrophobicContact CZ2-CB 3.31Å; W86-P196 HydrophobicContact CZ2-CG 3.83Å; W86-P196 HydrophobicContact CZ3-CB 3.79Å; W86-P196 HydrophobicContact CZ3-CG 4.33Å; G189-P196 WeakPolarHBondContact O-CA 3.12Å; R194-P196 WeakPolarHBondContact O-CD 3.14Å
197	Y	86.1	Confident	77.9	Confident	45 Å²	45	51.1 Å²	51.1	18%	0.176	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	146.3	169.5	63.9	-88.4	0	0	0	110.5	D100 W102 Y188 G189 R191	D100-Y197 HydrophobicContact CB-CE1 4.44Å; D100-Y197 PolarHBondContact OD2-OH 3.01Å; W102-Y197 AromaticContact CH2-CE2 3.84Å; W102-Y197 HydrophobicContact CH2-CE2 3.84Å; W102-Y197 VanDerWaalsContact CH2-OH 3.31Å; W102-Y197 WeakPolarHBondContact CH2-OH 3.48Å; W102-Y197 WeakPolarHBondContact CZ2-OH 3.27Å; W102-Y197 HydrophobicContact CZ3-CE2 4.1Å; Y188-Y197 WeakPolarHBondContact CA-O 3.45Å; Y188-Y197 VanDerWaalsContact CB-O 3.3Å; Y188-Y197 WeakPolarHBondContact CB-O 3Å; G189-Y197 PolarHBondContact N-O 3.48Å; G189-Y197 PolarHBondContact O-N 3.44Å; R191-Y197 HydrophobicContact CG-CD1 3.87Å; R191-Y197 HydrophobicContact CG-CE1 3.79Å
198	E	82.1	Confident	76.4	Confident	119 Å²	119	53.8 Å²	53.8	56%	0.556	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.5	177	-65.7	-172.5	168.4	0	0	110.1	L81	L81-E198 HydrophobicContact CD1-CB 4.42Å; L81-E198 HydrophobicContact CD1-CG 3.46Å; L81-E198 VanDerWaalsContact CD1-CG 3.46Å; L81-E198 HydrophobicContact CG-CG 3.92Å
199	G	76.7	Confident	74.6	Confident	14 Å²	14	59.1 Å²	59.1	14%	0.144	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-94.4	173.7	173.2	0	0	0	0	0	111.1	T187	T187-G199 CarbonylContact O-C 3.6Å; T187-G199 WeakPolarHBondContact O-CA 3.33Å; T187-G199 PolarHBondContact O-N 3.05Å
200	V	72	Confident	72.7	Confident	93 Å²	93	69.5 Å²	69.5	56%	0.564	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-76	155.9	175.2	-64.7	0	0	0	0	111.2	T187 F202	T187-V200 PolarHBondContact OG1-O 3.16Å; V200-F202 PolarHBondContact O-N 3.25Å
201	L	75	Confident	71.1	Confident	14 Å²	14	74 Å²	74	7%	0.073	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-61.9	132.1	166.5	-70.3	-174.4	0	0	0	110.1	Y172 Y175 F176 I184 C185 Q186	Y172-L201 HydrophobicContact CD1-CB 4.11Å; Y172-L201 HydrophobicContact CD1-CD1 3.99Å; Y172-L201 HydrophobicContact CD1-CG 4.05Å; Y172-L201 HydrophobicContact CD2-CD1 4.1Å; Y172-L201 HydrophobicContact CD2-CG 4.49Å; Y172-L201 HydrophobicContact CE1-CB 4.38Å; Y172-L201 HydrophobicContact CE1-CG 4.29Å; Y172-L201 HydrophobicContact CG-CD1 3.67Å; Y172-L201 HydrophobicContact CG-CG 4.16Å; Y175-L201 HydrophobicContact CD1-CB 4.18Å; Y175-L201 HydrophobicContact CE1-CB 4.11Å; Y175-L201 WeakPolarHBondContact CE1-O 3.36Å; F176-L201 HydrophobicContact CE1-CD1 4.09Å; F176-L201 HydrophobicContact CE2-CD1 3.57Å; F176-L201 HydrophobicContact CZ-CD1 3.28Å; I184-L201 HydrophobicContact CG2-CB 3.59Å; I184-L201 HydrophobicContact CG2-CD1 4.05Å; I184-L201 HydrophobicContact CG2-CD2 4.06Å; I184-L201 HydrophobicContact CG2-CG 4.11Å; C185-L201 WeakPolarHBondContact O-CA 3.13Å; Q186-L201 HydrophobicContact CB-CD2 4.37Å
202	F	75.5	Confident	70	Confident	79 Å²	79	71.6 Å²	71.6	35%	0.346	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	149.2	-176.7	-161.5	-94.7	0	0	0	111.8	Y175 I184 C185 T187 V200 C204 L207	Y175-F202 WeakPolarHBondContact OH-CA 3.38Å; I184-F202 CarbonylContact C-O 3.31Å; I184-F202 WeakPolarHBondContact CA-O 3.48Å; C185-F202 PolarHBondContact N-O 3.43Å; C185-F202 PolarHBondContact O-N 2.92Å; T187-F202 HydrophobicContact CG2-CB 4.06Å; V200-F202 PolarHBondContact O-N 3.25Å; F202-C204 PolarHBondContact O-N 3.25Å; F202-C204 VanDerWaalsContact O-N 3.08Å; F202-L207 HydrophobicContact CD1-CD2 3.47Å; F202-L207 VanDerWaalsContact CD1-CD2 3.47Å; F202-L207 HydrophobicContact CD1-CG 4.02Å; F202-L207 HydrophobicContact CE1-CD2 3.71Å; F202-L207 HydrophobicContact CE1-CG 4.13Å; F202-L207 HydrophobicContact CG-CD2 4.44Å
203	H	74.2	Confident	69.9	Low	37 Å²	37	69.5 Å²	69.5	17%	0.171	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	107	172.8	-69	-57	0	0	0	109.7	Y175 S179 W183 D205 S206	Y175-H203 AromaticContact CE2-NE2 3.82Å; Y175-H203 AromaticContact CZ-CD2 3.89Å; Y175-H203 AromaticContact CZ-CE1 3.84Å; Y175-H203 AromaticContact CZ-NE2 3.69Å; Y175-H203 PolarHBondContact OH-CD2 3.25Å; Y175-H203 VanDerWaalsContact OH-CG 3.32Å; Y175-H203 PolarHBondContact OH-N 3.09Å; Y175-H203 PolarHBondContact OH-NE2 3.18Å; S179-H203 VanDerWaalsContact CB-CE1 3.48Å; S179-H203 WeakPolarHBondContact CB-CE1 3.44Å; W183-H203 WeakPolarHBondContact O-CA 3.39Å; H203-D205 PolarHBondContact O-N 3.4Å; H203-D205 VanDerWaalsContact O-N 3.16Å; H203-S206 PolarHBondContact O-N 3.12Å
204	C	71.6	Confident	70	Confident	6 Å²	6	64.7 Å²	64.7	4%	0.041	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-54.3	-34.4	177.4	-57	0	0	0	0	112.2	L58 W183 C185 F202 S206 L207	L58-C204 HydrophobicContact CB-CB 4.46Å; L58-C204 HydrophobicContact CD2-CB 3.57Å; W183-C204 HydrophobicContact CB-CB 4.02Å; W183-C204 PolarHBondContact O-N 3.06Å; C185-C204 WeakPolarHBondContact CA-SG 3.02Å; C185-C204 HydrophobicContact CB-CB 4.31Å; C185-C204 WeakPolarHBondContact CB-SG 3.35Å; C185-C204 PolarHBondContact N-SG 2.87Å; C185-C204 WeakPolarHBondContact SG-CB 3.45Å; C185-C204 CovalentContact SG-SG 2.01Å; C185-C204 PolarHBondContact SG-SG 3.21Å; F202-C204 PolarHBondContact O-N 3.25Å; F202-C204 VanDerWaalsContact O-N 3.08Å; C204-S206 PolarHBondContact O-N 3.48Å; C204-L207 VanDerWaalsContact O-CD1 3.28Å; C204-L207 WeakPolarHBondContact O-CD1 3.38Å
205	D	65.5	Low	70.2	Confident	88 Å²	88	58.2 Å²	58.2	47%	0.471	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-76.1	-13.2	-175.7	-51.2	-37.4	0	0	0	112.5	K182 W183 H203	K182-D205 WeakPolarHBondContact CB-OD2 3.44Å; W183-D205 PolarHBondContact N-OD2 3.14Å; H203-D205 PolarHBondContact O-N 3.4Å; H203-D205 VanDerWaalsContact O-N 3.16Å
206	S	58.8	Low	70.4	Confident	64 Å²	64	56.1 Å²	56.1	45%	0.448	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-113.5	12.7	-173	-56.5	0	0	0	0	113.8	H203 C204 S208	H203-S206 PolarHBondContact O-N 3.12Å; C204-S206 PolarHBondContact O-N 3.48Å; S206-S208 PolarHBondContact O-N 3.3Å
207	L	57.8	Low	70.7	Confident	11 Å²	11	54.1 Å²	54.1	6%	0.058	28%	0.282	C	S	.	.			trans	-63.9	119.4	-178.8	-70.2	159.2	0	0	0	110.5	F52 L58 F104 F202 C204	F52-L207 HydrophobicContact CD1-CB 3.8Å; F52-L207 WeakPolarHBondContact CD1-O 3.36Å; F52-L207 HydrophobicContact CE1-CB 3.17Å; F52-L207 HydrophobicContact CE1-CD1 3.94Å; F52-L207 HydrophobicContact CE1-CG 4.19Å; F52-L207 WeakPolarHBondContact CG-O 3.5Å; F52-L207 HydrophobicContact CZ-CB 3.65Å; L58-L207 HydrophobicContact CD2-CD1 4.03Å; F104-L207 HydrophobicContact CD1-CD1 4.45Å; F104-L207 HydrophobicContact CE1-CD1 3.31Å; F104-L207 HydrophobicContact CE1-CD2 3.72Å; F104-L207 HydrophobicContact CE1-CG 4.16Å; F104-L207 HydrophobicContact CE2-CD1 4.3Å; F104-L207 HydrophobicContact CZ-CD1 3.23Å; F104-L207 HydrophobicContact CZ-CD2 3.89Å; F104-L207 HydrophobicContact CZ-CG 4.15Å; F202-L207 HydrophobicContact CD1-CD2 3.47Å; F202-L207 VanDerWaalsContact CD1-CD2 3.47Å; F202-L207 HydrophobicContact CD1-CG 4.02Å; F202-L207 HydrophobicContact CE1-CD2 3.71Å; F202-L207 HydrophobicContact CE1-CG 4.13Å; F202-L207 HydrophobicContact CG-CD2 4.44Å; C204-L207 VanDerWaalsContact O-CD1 3.28Å; C204-L207 WeakPolarHBondContact O-CD1 3.38Å
208	S	49.6	Very low	71	Confident	61 Å²	61	52.5 Å²	52.5	43%	0.427	28%	0.276	S	S	.	.			trans	-78.5	146.1	-179	177.1	0	0	0	0	111.4	S206 R210 N211	S206-S208 PolarHBondContact O-N 3.3Å; S208-R210 PolarHBondContact O-N 3.38Å; S208-R210 PolarHBondContact OG-N 3.03Å; S208-N211 PolarHBondContact O-N 3.28Å
209	T	46.6	Very low	71.6	Confident	114 Å²	114	46.8 Å²	46.8	70%	0.699	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-14	169.8	53.6	0	0	0	0	114.6	F52	F52-T209 HydrophobicContact CD2-CG2 4.16Å
210	R	44	Very low	72.5	Confident	218 Å²	218	47.6 Å²	47.6	82%	0.823	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-25.4	-179.1	-75.5	-171.9	-177.4	-176.1	2	114.7	S208	S208-R210 PolarHBondContact O-N 3.38Å; S208-R210 PolarHBondContact OG-N 3.03Å
211	N	53.4	Low	73.6	Confident	95 Å²	95	44.3 Å²	44.3	51%	0.508	23%	0.233	S	C	.	.	S	Bend	trans	-109.6	109.3	-177.7	-70.5	1.6	0	0	0	108.8	S208 H213	S208-N211 PolarHBondContact O-N 3.28Å; N211-H213 PolarHBondContact O-CE1 3.35Å; N211-H213 PolarHBondContact O-N 3.33Å; N211-H213 PolarHBondContact O-ND1 3.03Å
212	D	63.2	Low	74.4	Confident	57 Å²	57	43.9 Å²	43.9	31%	0.305	23%	0.231	S	C	.	.			trans	-68.2	115.2	174.2	-63	-56.5	0	0	0	109.9	R48	R48-D212 HydrophobicContact CG-CB 4.44Å; R48-D212 IonicContact CZ-OD1 2.97Å; R48-D212 IonicContact CZ-OD2 3.96Å; R48-D212 IonicContact NE-OD1 3.66Å; R48-D212 PolarHBondContact NE-OD1 3.11Å; R48-D212 IonicContact NE-OD2 3.95Å; R48-D212 IonicContact NH1-OD2 3.55Å; R48-D212 PolarHBondContact NH1-OD2 3.14Å; R48-D212 IonicContact NH2-OD1 3.78Å; R48-D212 PolarHBondContact NH2-OD1 3.33Å; R48-D212 IonicContact NH2-OD2 3.13Å; R48-D212 PolarHBondContact NH2-OD2 3.22Å
213	H	78.4	Confident	75.1	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.06	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	132.2	174.2	-65.3	77.3	0	0	0	109.6	Y49 W102 F104 N211	Y49-H213 WeakPolarHBondContact CB-O 3.48Å; Y49-H213 PolarHBondContact N-O 2.64Å; W102-H213 CarbonylContact O-C 3.54Å; W102-H213 WeakPolarHBondContact O-CA 3.13Å; F104-H213 HydrophobicContact CD2-CB 3.88Å; F104-H213 HydrophobicContact CE1-CB 4.1Å; F104-H213 AromaticContact CE1-CD2 3.52Å; F104-H213 AromaticContact CE1-CG 3.83Å; F104-H213 HydrophobicContact CE2-CB 3.16Å; F104-H213 AromaticContact CE2-CG 3.78Å; F104-H213 HydrophobicContact CZ-CB 3.24Å; F104-H213 AromaticContact CZ-CD2 3.48Å; F104-H213 VanDerWaalsContact CZ-CD2 3.48Å; F104-H213 WeakPolarHBondContact CZ-CD2 3.49Å; F104-H213 AromaticContact CZ-CG 3.26Å; F104-H213 AromaticContact CZ-ND1 3.88Å; N211-H213 PolarHBondContact O-CE1 3.35Å; N211-H213 PolarHBondContact O-N 3.33Å; N211-H213 PolarHBondContact O-ND1 3.03Å
214	D	85	Confident	75.9	Confident	4 Å²	4	43 Å²	43	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	141.6	169.6	-82.1	17.6	0	0	0	109.7	W46 K47 R48 R94 T101 W102 A103 F104	W46-D214 HydrophobicContact CB-CB 4.36Å; K47-D214 WeakPolarHBondContact O-CA 3.4Å; R48-D214 WeakPolarHBondContact CA-OD1 3.38Å; R48-D214 WeakPolarHBondContact CB-OD1 3.39Å; R48-D214 PolarHBondContact N-OD1 2.97Å; R94-D214 IonicContact CZ-OD2 2.8Å; R94-D214 IonicContact NE-OD1 3.64Å; R94-D214 IonicContact NE-OD2 2.64Å; R94-D214 PolarHBondContact NE-OD2 3.15Å; R94-D214 IonicContact NH2-OD2 3.18Å; T101-D214 HydrophobicContact CG2-CB 4.23Å; W102-D214 PolarHBondContact O-N 3.35Å; A103-D214 CarbonylContact C-O 3.58Å; A103-D214 WeakPolarHBondContact CA-O 3.45Å; A103-D214 HydrophobicContact CB-CB 4.04Å; A103-D214 VanDerWaalsContact CB-O 3.27Å; A103-D214 WeakPolarHBondContact CB-O 3.14Å; F104-D214 PolarHBondContact N-O 3.4Å
215	V	86.3	Confident	76.7	Confident	2 Å²	2	43.1 Å²	43.1	1%	0.012	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134.2	170.6	165.6	0	0	0	0	107.9	W46 K47 Y49 I62 F65 F104	W46-V215 WeakPolarHBondContact CA-O 3.23Å; K47-V215 PolarHBondContact N-O 2.67Å; K47-V215 PolarHBondContact O-N 3.43Å; Y49-V215 HydrophobicContact CD2-CG2 4.35Å; Y49-V215 HydrophobicContact CG-CG2 3.9Å; I62-V215 HydrophobicContact CD1-CG2 4.11Å; I62-V215 HydrophobicContact CG1-CG2 3.91Å; I62-V215 HydrophobicContact CG2-CG1 3.46Å; I62-V215 VanDerWaalsContact CG2-CG1 3.46Å; I62-V215 HydrophobicContact CG2-CG2 4.33Å; F65-V215 HydrophobicContact CD1-CB 4.32Å; F65-V215 HydrophobicContact CD1-CG1 4.18Å; F65-V215 HydrophobicContact CE1-CB 4.13Å; F65-V215 HydrophobicContact CE1-CG1 4.36Å; F104-V215 HydrophobicContact CD2-CG2 3.93Å
216	T	90.3	Very high	77.7	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	119.7	172.7	-43	0	0	0	0	110.2	V44 W46 Y76 F78 Y188	V44-T216 HydrophobicContact CG1-CG2 3.42Å; V44-T216 VanDerWaalsContact CG1-CG2 3.42Å; W46-T216 HydrophobicContact CD2-CG2 3.92Å; W46-T216 VanDerWaalsContact CE2-OG1 3.24Å; W46-T216 HydrophobicContact CE3-CG2 4.04Å; W46-T216 HydrophobicContact CH2-CG2 3.58Å; W46-T216 HydrophobicContact CZ2-CG2 3.49Å; W46-T216 VanDerWaalsContact CZ2-CG2 3.49Å; W46-T216 HydrophobicContact CZ3-CG2 3.88Å; W46-T216 PolarHBondContact NE1-OG1 2.8Å; W46-T216 VanDerWaalsContact NE1-OG1 3.09Å; Y76-T216 HydrophobicContact CD1-CG2 3.79Å; Y76-T216 HydrophobicContact CG-CG2 4.24Å; Y76-T216 PolarHBondContact N-O 3.34Å; F78-T216 HydrophobicContact CE1-CG2 4.4Å; Y188-T216 PolarHBondContact OH-OG1 3.34Å
217	C	91.7	Very high	79.1	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.7	177	-58.8	0	0	0	0	110.4	V44 T45 C66 F70 R74	V44-C217 CarbonylContact C-O 3.12Å; V44-C217 WeakPolarHBondContact CA-O 3.39Å; T45-C217 PolarHBondContact N-O 2.82Å; T45-C217 PolarHBondContact O-N 3.39Å; C66-C217 WeakPolarHBondContact CA-SG 3.48Å; C66-C217 HydrophobicContact CB-CB 3.73Å; C66-C217 WeakPolarHBondContact CB-SG 3.14Å; C66-C217 VanDerWaalsContact SG-CA 3.6Å; C66-C217 WeakPolarHBondContact SG-CB 3.44Å; C66-C217 CovalentContact SG-SG 2.04Å; C66-C217 PolarHBondContact SG-SG 2.61Å; F70-C217 HydrophobicContact CD2-CB 3.64Å; F70-C217 HydrophobicContact CE2-CB 3.73Å; R74-C217 CarbonylContact O-C 3.57Å; R74-C217 VanDerWaalsContact O-CA 3.29Å; R74-C217 WeakPolarHBondContact O-CA 3.42Å
218	I	93.8	Very high	80.4	Confident	10 Å²	10	46.5 Å²	46.5	5%	0.051	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.8	165	-171.3	167.1	0	0	0	109.1	L39 E42 C43 V44 R74 Y76	L39-I218 HydrophobicContact CD2-CD1 4.17Å; E42-I218 HydrophobicContact CB-CD1 4.06Å; E42-I218 HydrophobicContact CB-CG1 3.87Å; E42-I218 HydrophobicContact CG-CG1 4.47Å; E42-I218 WeakPolarHBondContact OE2-CD1 3.32Å; C43-I218 CarbonylContact O-C 3.27Å; C43-I218 VanDerWaalsContact O-CA 3.27Å; C43-I218 WeakPolarHBondContact O-CA 3.27Å; V44-I218 HydrophobicContact CG2-CD1 4.45Å; V44-I218 HydrophobicContact CG2-CG1 4.38Å; R74-I218 HydrophobicContact CG-CG2 3.44Å; R74-I218 VanDerWaalsContact CG-CG2 3.44Å; R74-I218 PolarHBondContact N-O 2.65Å; R74-I218 PolarHBondContact O-N 3.28Å; Y76-I218 HydrophobicContact CD2-CB 3.8Å; Y76-I218 HydrophobicContact CD2-CD1 3.85Å; Y76-I218 HydrophobicContact CD2-CG1 4.36Å; Y76-I218 HydrophobicContact CD2-CG2 4.13Å; Y76-I218 HydrophobicContact CE2-CD1 4.04Å; Y76-I218 HydrophobicContact CG-CB 4.31Å
219	H	94.6	Very high	82.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	164.4	-170.4	68.2	84.1	0	0	0	112.7	C43 T45 F70 L71 Y222	C43-H219 WeakPolarHBondContact CB-CE1 3.26Å; C43-H219 PolarHBondContact N-O 2.8Å; C43-H219 PolarHBondContact O-N 2.94Å; T45-H219 WeakPolarHBondContact CB-NE2 3.5Å; T45-H219 PolarHBondContact OG1-NE2 2.88Å; F70-H219 HydrophobicContact CB-CB 3.44Å; F70-H219 VanDerWaalsContact CB-CB 3.44Å; F70-H219 VanDerWaalsContact CB-CG 3.47Å; F70-H219 AromaticContact CD1-CD2 3.68Å; F70-H219 AromaticContact CD1-CE1 3.85Å; F70-H219 AromaticContact CD1-NE2 3.53Å; F70-H219 AromaticContact CD2-CD2 3.99Å; F70-H219 AromaticContact CE1-NE2 3.83Å; F70-H219 HydrophobicContact CG-CB 4.22Å; F70-H219 AromaticContact CG-CD2 3.54Å; F70-H219 AromaticContact CG-CG 3.81Å; F70-H219 AromaticContact CG-NE2 3.93Å; L71-H219 WeakPolarHBondContact O-CB 3.19Å; H219-Y222 AromaticContact CE1-CE2 3.85Å; H219-Y222 AromaticContact ND1-CE2 3.94Å
220	S	94.8	Very high	84	Confident	31 Å²	31	43.7 Å²	43.7	22%	0.217	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-66.9	147.1	175.2	-67	0	0	0	0	111.8	L71 D72	L71-S220 PolarHBondContact O-N 2.97Å; D72-S220 WeakPolarHBondContact OD2-CB 3.36Å; D72-S220 PolarHBondContact OD2-OG 2.02Å
221	P	95.3	Very high	86	Confident	23 Å²	23	39.2 Å²	39.2	15%	0.149	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-74.2	159.9	175.4	34.8	-38	0	0	0	111.2	Y25 E41 C43	Y25-P221 HydrophobicContact CD1-CG 4.26Å; Y25-P221 HydrophobicContact CG-CG 4.13Å; E41-P221 VanDerWaalsContact O-CD 3.23Å; E41-P221 WeakPolarHBondContact O-CD 3.12Å; E41-P221 WeakPolarHBondContact O-CG 3.03Å; C43-P221 VanDerWaalsContact SG-CA 3.55Å; C43-P221 VanDerWaalsContact SG-CB 3.59Å
222	Y	91.5	Very high	87.2	Confident	5 Å²	5	38.1 Å²	38.1	2%	0.02	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.9	-174.2	-72.5	-105.2	0	0	0	110.9	Y25 R26 F70 L71 H219 N224 Q254 S255 Y257	Y25-Y222 CarbonylContact C-O 3.52Å; Y25-Y222 VanDerWaalsContact CA-O 3.24Å; Y25-Y222 WeakPolarHBondContact CA-O 3.42Å; R26-Y222 PolarHBondContact N-O 3.12Å; R26-Y222 PolarHBondContact O-N 3.45Å; F70-Y222 WeakPolarHBondContact CA-OH 3.28Å; L71-Y222 HydrophobicContact CD1-CD1 3.54Å; L71-Y222 HydrophobicContact CD1-CD2 4.15Å; L71-Y222 HydrophobicContact CD1-CE1 3.49Å; L71-Y222 VanDerWaalsContact CD1-CE1 3.49Å; L71-Y222 HydrophobicContact CD1-CE2 4.1Å; L71-Y222 HydrophobicContact CD1-CG 3.87Å; L71-Y222 HydrophobicContact CD2-CE1 4.39Å; L71-Y222 HydrophobicContact CG-CD1 4.21Å; L71-Y222 HydrophobicContact CG-CE1 3.62Å; L71-Y222 HydrophobicContact CG-CE2 4.28Å; L71-Y222 PolarHBondContact N-OH 3.12Å; H219-Y222 AromaticContact CE1-CE2 3.85Å; H219-Y222 AromaticContact ND1-CE2 3.94Å; Y222-N224 PolarHBondContact O-N 2.04Å; Y222-Q254 HydrophobicContact CD1-CB 4.29Å; Y222-Q254 HydrophobicContact CD1-CG 4.07Å; Y222-S255 WeakPolarHBondContact CD1-O 3.03Å; Y222-S255 VanDerWaalsContact CE1-O 3.23Å; Y222-S255 WeakPolarHBondContact CE1-O 3.47Å; Y222-Y257 HydrophobicContact CD1-CD2 4.19Å; Y222-Y257 AromaticContact CD2-CD2 3.83Å; Y222-Y257 HydrophobicContact CD2-CD2 3.83Å; Y222-Y257 HydrophobicContact CD2-CG 4.29Å; Y222-Y257 AromaticContact CE1-CD2 3.8Å; Y222-Y257 HydrophobicContact CE1-CD2 3.8Å; Y222-Y257 AromaticContact CE2-CD2 3.41Å; Y222-Y257 HydrophobicContact CE2-CD2 3.41Å; Y222-Y257 VanDerWaalsContact CE2-CD2 3.41Å; Y222-Y257 HydrophobicContact CE2-CE2 4.12Å; Y222-Y257 HydrophobicContact CE2-CG 4.3Å; Y222-Y257 HydrophobicContact CG-CD2 4.21Å; Y222-Y257 AromaticContact CZ-CD2 3.4Å; Y222-Y257 VanDerWaalsContact CZ-CD2 3.4Å; Y222-Y257 AromaticContact CZ-CE2 3.95Å
223	R	90.8	Very high	88.1	Confident	87 Å²	87	37 Å²	37	33%	0.328	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	129.9	180	-174.5	-179.8	59.6	-114.6	-3.7	111.2	T24 Y25 E252 A253 Q254	T24-R223 WeakPolarHBondContact O-CA 3.09Å; Y25-R223 HydrophobicContact CD1-CB 3.95Å; Y25-R223 HydrophobicContact CE1-CB 3.79Å; Y25-R223 HydrophobicContact CE1-CG 4.27Å; R223-E252 PolarHBondContact NE-O 3.37Å; R223-E252 PolarHBondContact NH2-O 2.78Å; R223-A253 CarbonylContact O-C 3.26Å; R223-A253 WeakPolarHBondContact O-CA 3.12Å; R223-Q254 HydrophobicContact CB-CB 4.06Å; R223-Q254 PolarHBondContact O-N 2.62Å
224	N	91.7	Very high	88	Confident	12 Å²	12	38.6 Å²	38.6	6%	0.064	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-78.9	155.8	171.7	-69	-34.5	0	0	0	110.8	D23 T24 R26 Y222 N226 I259	D23-N224 PolarHBondContact O-ND2 3.18Å; T24-N224 PolarHBondContact O-N 2.92Å; R26-N224 WeakPolarHBondContact CD-OD1 3.42Å; R26-N224 WeakPolarHBondContact CG-OD1 3.44Å; Y222-N224 PolarHBondContact O-N 2.04Å; N224-N226 PolarHBondContact O-N 3.18Å; N224-I259 HydrophobicContact CB-CB 4.22Å; N224-I259 WeakPolarHBondContact OD1-CG1 3.5Å; N224-I259 PolarHBondContact OD1-N 2.92Å
225	C	87.4	Confident	87.6	Confident	7 Å²	7	42.5 Å²	42.5	5%	0.047	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-60	127.4	170.6	179.5	0	0	0	0	110.1	S251 A253 I259 C261	C225-S251 WeakPolarHBondContact CA-O 3.5Å; C225-A253 HydrophobicContact CB-CB 4.09Å; C225-I259 WeakPolarHBondContact CB-O 3.02Å; C225-I259 PolarHBondContact N-O 3.27Å; C225-C261 HydrophobicContact CB-CB 3.87Å; C225-C261 WeakPolarHBondContact CB-SG 3.47Å; C225-C261 WeakPolarHBondContact SG-CA 3.5Å; C225-C261 WeakPolarHBondContact SG-CB 3.08Å; C225-C261 CovalentContact SG-SG 2.02Å; C225-C261 PolarHBondContact SG-SG 2.86Å
226	N	87.4	Confident	87.2	Confident	72 Å²	72	44.1 Å²	44.1	39%	0.385	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	121.2	170.9	-172.9	-2.8	0	0	0	107.9	N224 L250 S251	N224-N226 PolarHBondContact O-N 3.18Å; N226-L250 HydrophobicContact CB-CB 4.25Å; N226-L250 WeakPolarHBondContact O-CA 3.44Å; N226-L250 WeakPolarHBondContact O-CB 3.47Å; N226-L250 PolarHBondContact O-N 2.94Å; N226-S251 VanDerWaalsContact CB-OG 3.22Å; N226-S251 WeakPolarHBondContact CB-OG 3.1Å; N226-S251 PolarHBondContact N-O 3.33Å; N226-S251 PolarHBondContact O-N 2.85Å
227	Y	87	Confident	86.4	Confident	51 Å²	51	46.3 Å²	46.3	20%	0.2	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	153.2	179.3	64.6	-87.6	0	0	0	110.6	T21 V247 S248 P262 W269	T21-Y227 HydrophobicContact CG2-CE1 4.46Å; Y227-V247 HydrophobicContact CD2-CG1 3.73Å; Y227-V247 HydrophobicContact CG-CG1 3.95Å; Y227-S248 CarbonylContact C-O 3.39Å; Y227-S248 VanDerWaalsContact CA-O 3.23Å; Y227-S248 WeakPolarHBondContact CA-O 3.1Å; Y227-S248 WeakPolarHBondContact CB-O 3.47Å; Y227-P262 HydrophobicContact CD1-CG 4.08Å; Y227-P262 HydrophobicContact CD2-CG 4.26Å; Y227-P262 HydrophobicContact CE1-CG 3.53Å; Y227-P262 HydrophobicContact CE2-CG 3.74Å; Y227-P262 HydrophobicContact CG-CG 4.41Å; Y227-W269 AromaticContact CD2-CH2 3.83Å; Y227-W269 HydrophobicContact CD2-CH2 3.83Å; Y227-W269 HydrophobicContact CD2-CZ3 4.32Å; Y227-W269 AromaticContact CE2-CH2 3.73Å; Y227-W269 HydrophobicContact CE2-CH2 3.73Å; Y227-W269 HydrophobicContact CE2-CZ2 4.42Å; Y227-W269 HydrophobicContact CE2-CZ3 4.39Å
228	K	86.5	Confident	85.6	Confident	112 Å²	112	53 Å²	53	49%	0.487	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.7	177.1	69.6	177.6	-179.4	-169.7	0	111.8	S248 L250	K228-S248 PolarHBondContact N-O 3.04Å; K228-S248 WeakPolarHBondContact O-CB 3.23Å; K228-S248 PolarHBondContact O-N 3.05Å; K228-L250 HydrophobicContact CB-CD1 4.27Å; K228-L250 HydrophobicContact CD-CD1 4.16Å; K228-L250 HydrophobicContact CD-CD2 3.89Å; K228-L250 HydrophobicContact CD-CG 4.36Å; K228-L250 HydrophobicContact CG-CD1 4.23Å; K228-L250 HydrophobicContact CG-CD2 4.05Å; K228-L250 HydrophobicContact CG-CG 4.19Å
229	K	87.6	Confident	85.2	Confident	88 Å²	88	55.3 Å²	55.3	38%	0.383	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	127.6	169.3	-171.3	176.2	-177.6	174.9	0	109.6	Y245 W269	K229-Y245 HydrophobicContact CD-CD1 4.13Å; K229-Y245 HydrophobicContact CD-CE1 4.41Å; K229-Y245 HydrophobicContact CD-CG 4.31Å; K229-Y245 VanDerWaalsContact CE-CE1 3.44Å; K229-Y245 HydrophobicContact CG-CD1 3.87Å; K229-Y245 HydrophobicContact CG-CG 4.14Å; K229-W269 HydrophobicContact CB-CD2 4.18Å; K229-W269 HydrophobicContact CB-CE3 4.08Å; K229-W269 HydrophobicContact CB-CH2 3.76Å; K229-W269 HydrophobicContact CB-CZ2 3.85Å; K229-W269 HydrophobicContact CB-CZ3 3.87Å; K229-W269 HydrophobicContact CD-CD2 3.99Å; K229-W269 HydrophobicContact CD-CG 4.08Å; K229-W269 HydrophobicContact CG-CD2 3.93Å; K229-W269 HydrophobicContact CG-CE3 3.99Å; K229-W269 HydrophobicContact CG-CG 4.41Å; K229-W269 HydrophobicContact CG-CZ2 4.48Å; K229-W269 HydrophobicContact CG-CZ3 4.29Å
230	A	83.8	Confident	84.5	Confident	27 Å²	27	65.1 Å²	65.1	22%	0.223	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	146.6	173.7	0	0	0	0	0	111.2	H232 Y245 I246	A230-H232 PolarHBondContact O-N 2.52Å; A230-Y245 CarbonylContact O-C 3.49Å; A230-Y245 VanDerWaalsContact O-CA 3.29Å; A230-Y245 WeakPolarHBondContact O-CA 3.35Å; A230-I246 HydrophobicContact CB-CD1 4.41Å; A230-I246 HydrophobicContact CB-CG1 3.94Å; A230-I246 PolarHBondContact N-O 3.19Å; A230-I246 VanDerWaalsContact N-O 3.13Å; A230-I246 PolarHBondContact O-N 2.91Å
231	E	85.5	Confident	84.1	Confident	125 Å²	125	68 Å²	68	58%	0.584	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	111.5	175.7	-58.6	-146.3	151.2	0	0	110.1	K244 Y245	E231-K244 VanDerWaalsContact CD-CE 3.44Å; E231-K244 WeakPolarHBondContact OE1-CE 3.1Å; E231-K244 IonicContact OE1-NZ 2.91Å; E231-K244 PolarHBondContact OE1-NZ 3.34Å; E231-K244 WeakPolarHBondContact OE2-CE 3.45Å; E231-K244 IonicContact OE2-NZ 3.28Å; E231-K244 PolarHBondContact OE2-NZ 3.45Å; E231-Y245 HydrophobicContact CG-CD1 3.96Å; E231-Y245 HydrophobicContact CG-CE1 3.61Å; E231-Y245 WeakPolarHBondContact OE1-CE1 2.99Å; E231-Y245 PolarHBondContact OE1-OH 2.93Å
232	H	79.6	Confident	83.5	Confident	72 Å²	72	70.2 Å²	70.2	33%	0.333	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	110.5	173.1	-172.2	70.9	0	0	0	108.6	A230 H234 K244 I246	A230-H232 PolarHBondContact O-N 2.52Å; H232-H234 PolarHBondContact O-N 2.92Å; H232-H234 PolarHBondContact O-ND1 2.95Å; H232-K244 CarbonylContact C-O 3.53Å; H232-K244 VanDerWaalsContact C-O 3.26Å; H232-K244 PolarHBondContact N-O 3.22Å; H232-K244 CarbonylContact O-C 3.48Å; H232-I246 HydrophobicContact CB-CD1 3.75Å; H232-I246 HydrophobicContact CB-CG1 3.91Å; H232-I246 HydrophobicContact CB-CG2 4.07Å
233	C	81.1	Confident	83.3	Confident	34 Å²	34	70.5 Å²	70.5	23%	0.23	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	116.6	179.2	-172.1	0	0	0	0	109.8	Y243 C273 E274	C233-Y243 WeakPolarHBondContact CA-O 3.4Å; C233-C273 WeakPolarHBondContact CA-SG 3.45Å; C233-C273 HydrophobicContact CB-CB 3.95Å; C233-C273 WeakPolarHBondContact CB-SG 3.44Å; C233-C273 WeakPolarHBondContact SG-CB 3.12Å; C233-C273 CovalentContact SG-SG 2.03Å; C233-C273 PolarHBondContact SG-SG 3.12Å; C233-E274 PolarHBondContact SG-O 2.77Å
234	H	75.7	Confident	83.1	Confident	46 Å²	46	68.9 Å²	68.9	21%	0.213	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.3	-176.4	75.1	-71.9	0	0	0	111.3	H232 W242 Y243 Y245 I246	H232-H234 PolarHBondContact O-N 2.92Å; H232-H234 PolarHBondContact O-ND1 2.95Å; H234-W242 VanDerWaalsContact C-CE3 3.41Å; H234-W242 CarbonylContact O-C 3.54Å; H234-W242 WeakPolarHBondContact O-CA 3.49Å; H234-Y243 PolarHBondContact N-O 2.04Å; H234-Y243 PolarHBondContact ND1-O 3.42Å; H234-Y243 VanDerWaalsContact ND1-O 3.08Å; H234-Y243 PolarHBondContact O-N 2.79Å; H234-Y245 PolarHBondContact CE1-O 2.82Å; H234-Y245 PolarHBondContact ND1-O 2.03Å; H234-I246 HydrophobicContact CB-CG2 4.24Å; H234-I246 WeakPolarHBondContact ND1-CG2 3.27Å
235	F	78.5	Confident	82.9	Confident	85 Å²	85	69.6 Å²	69.6	37%	0.373	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	124.4	177.2	-177.6	-105.7	0	0	0	111	R240 W242	F235-R240 VanDerWaalsContact CE2-C 3.44Å; F235-R240 HydrophobicContact CE2-CB 4.47Å; F235-R240 HydrophobicContact CZ-CB 4.22Å; F235-W242 HydrophobicContact CB-CD2 4Å; F235-W242 HydrophobicContact CB-CE3 4.23Å; F235-W242 HydrophobicContact CB-CH2 4.2Å; F235-W242 HydrophobicContact CB-CZ2 3.97Å; F235-W242 HydrophobicContact CB-CZ3 4.33Å; F235-W242 AromaticContact CD2-CD1 3.79Å; F235-W242 HydrophobicContact CD2-CD2 4.39Å; F235-W242 AromaticContact CD2-CE2 3.96Å; F235-W242 HydrophobicContact CD2-CG 4.29Å; F235-W242 AromaticContact CD2-NE1 3.55Å
236	H	77.6	Confident	82.7	Confident	36 Å²	36	71.4 Å²	71.4	17%	0.167	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.2	173.7	-164.3	-66	0	0	0	109.6	D238 R240 K241 Y243	H236-D238 IonicContact CE1-OD2 3.71Å; H236-D238 PolarHBondContact CE1-OD2 2.91Å; H236-D238 PolarHBondContact ND1-N 2.86Å; H236-D238 IonicContact ND1-OD2 3.96Å; H236-D238 PolarHBondContact O-N 2.84Å; H236-R240 WeakPolarHBondContact O-CA 3.33Å; H236-R240 PolarHBondContact O-N 3.09Å; H236-K241 PolarHBondContact N-O 3.48Å; H236-K241 PolarHBondContact O-N 2.88Å; H236-Y243 HydrophobicContact CB-CD2 3.66Å; H236-Y243 HydrophobicContact CB-CE2 3.61Å; H236-Y243 AromaticContact CG-CE2 3.93Å
237	A	73	Confident	82.5	Confident	50 Å²	50	69.7 Å²	69.7	41%	0.413	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-43.9	-171.9	0	0	0	0	0	113	D239 R240	A237-D239 PolarHBondContact O-N 3.28Å; A237-R240 PolarHBondContact O-N 2.92Å
238	D	75.7	Confident	82.3	Confident	139 Å²	139	69 Å²	69	74%	0.743	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-41.7	-176.5	-53.8	-35.4	0	0	0	112.4	H236	H236-D238 IonicContact CE1-OD2 3.71Å; H236-D238 PolarHBondContact CE1-OD2 2.91Å; H236-D238 PolarHBondContact ND1-N 2.86Å; H236-D238 IonicContact ND1-OD2 3.96Å; H236-D238 PolarHBondContact O-N 2.84Å
239	D	83.8	Confident	82.2	Confident	59 Å²	59	67.6 Å²	67.6	32%	0.316	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.7	-179	-67.3	-22.8	0	0	0	112.3	A237 K241 Y243 K270	A237-D239 PolarHBondContact O-N 3.28Å; D239-K241 HydrophobicContact CB-CB 4.23Å; D239-K241 HydrophobicContact CB-CD 4.39Å; D239-K241 WeakPolarHBondContact O-CG 2.96Å; D239-K241 PolarHBondContact O-N 3.28Å; D239-Y243 HydrophobicContact CB-CE2 4.22Å; D239-Y243 WeakPolarHBondContact OD2-CE2 2.94Å; D239-Y243 PolarHBondContact OD2-OH 2.9Å; D239-K270 IonicContact OD1-NZ 2.61Å; D239-K270 IonicContact OD2-NZ 2.67Å; D239-K270 PolarHBondContact OD2-NZ 3.31Å
240	R	81.4	Confident	82	Confident	207 Å²	207	67.7 Å²	67.7	78%	0.781	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	32.9	-169.9	-61.6	180	-70.1	178.6	-2.8	113.7	F235 H236 A237	F235-R240 VanDerWaalsContact CE2-C 3.44Å; F235-R240 HydrophobicContact CE2-CB 4.47Å; F235-R240 HydrophobicContact CZ-CB 4.22Å; H236-R240 WeakPolarHBondContact O-CA 3.33Å; H236-R240 PolarHBondContact O-N 3.09Å; A237-R240 PolarHBondContact O-N 2.92Å
241	K	86.3	Confident	82	Confident	90 Å²	90	68.1 Å²	68.1	39%	0.391	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	155.9	-175.3	-76.3	172.3	173.3	-149.1	0	111.3	H236 D239 Y243 E272	H236-K241 PolarHBondContact N-O 3.48Å; H236-K241 PolarHBondContact O-N 2.88Å; D239-K241 HydrophobicContact CB-CB 4.23Å; D239-K241 HydrophobicContact CB-CD 4.39Å; D239-K241 WeakPolarHBondContact O-CG 2.96Å; D239-K241 PolarHBondContact O-N 3.28Å; K241-Y243 HydrophobicContact CB-CE1 4.38Å; K241-Y243 HydrophobicContact CB-CE2 4.48Å; K241-E272 WeakPolarHBondContact CD-OE1 3.09Å; K241-E272 WeakPolarHBondContact CE-OE1 3.34Å; K241-E272 IonicContact NZ-OE1 3.54Å; K241-E272 PolarHBondContact NZ-OE1 2.86Å
242	W	82.7	Confident	82	Confident	70 Å²	70	68.8 Å²	68.8	27%	0.265	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.7	173	-75.1	84.4	0	0	0	109.6	H234 F235 E272 C273 K275	H234-W242 VanDerWaalsContact C-CE3 3.41Å; H234-W242 CarbonylContact O-C 3.54Å; H234-W242 WeakPolarHBondContact O-CA 3.49Å; F235-W242 HydrophobicContact CB-CD2 4Å; F235-W242 HydrophobicContact CB-CE3 4.23Å; F235-W242 HydrophobicContact CB-CH2 4.2Å; F235-W242 HydrophobicContact CB-CZ2 3.97Å; F235-W242 HydrophobicContact CB-CZ3 4.33Å; F235-W242 AromaticContact CD2-CD1 3.79Å; F235-W242 HydrophobicContact CD2-CD2 4.39Å; F235-W242 AromaticContact CD2-CE2 3.96Å; F235-W242 HydrophobicContact CD2-CG 4.29Å; F235-W242 AromaticContact CD2-NE1 3.55Å; W242-E272 CarbonylContact O-C 3.26Å; W242-E272 WeakPolarHBondContact O-CA 3.34Å; W242-C273 WeakPolarHBondContact CB-O 3.23Å; W242-C273 PolarHBondContact O-N 2.73Å; W242-K275 HydrophobicContact CZ2-CB 4.22Å
243	Y	87.2	Confident	82.2	Confident	12 Å²	12	66.6 Å²	66.6	5%	0.047	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	135.7	178.5	-65.4	-57.6	0	0	0	112.1	C233 H234 H236 D239 K241 Y245 L265 K270 R271 E272 C273	C233-Y243 WeakPolarHBondContact CA-O 3.4Å; H234-Y243 PolarHBondContact N-O 2.04Å; H234-Y243 PolarHBondContact ND1-O 3.42Å; H234-Y243 VanDerWaalsContact ND1-O 3.08Å; H234-Y243 PolarHBondContact O-N 2.79Å; H236-Y243 HydrophobicContact CB-CD2 3.66Å; H236-Y243 HydrophobicContact CB-CE2 3.61Å; H236-Y243 AromaticContact CG-CE2 3.93Å; D239-Y243 HydrophobicContact CB-CE2 4.22Å; D239-Y243 WeakPolarHBondContact OD2-CE2 2.94Å; D239-Y243 PolarHBondContact OD2-OH 2.9Å; K241-Y243 HydrophobicContact CB-CE1 4.38Å; K241-Y243 HydrophobicContact CB-CE2 4.48Å; Y243-Y245 VanDerWaalsContact C-N 3.29Å; Y243-Y245 PolarHBondContact O-N 2.94Å; Y243-L265 HydrophobicContact CD2-CD2 4.11Å; Y243-L265 HydrophobicContact CG-CD2 4.02Å; Y243-K270 HydrophobicContact CD1-CB 4.25Å; Y243-K270 HydrophobicContact CE1-CB 3.86Å; Y243-K270 HydrophobicContact CE1-CD 4.5Å; Y243-K270 HydrophobicContact CE1-CG 4.25Å; Y243-R271 CarbonylContact C-O 3.46Å; Y243-R271 VanDerWaalsContact CA-O 3.28Å; Y243-R271 WeakPolarHBondContact CA-O 3.04Å; Y243-E272 HydrophobicContact CD1-CG 4.3Å; Y243-E272 HydrophobicContact CE1-CG 4.17Å; Y243-C273 PolarHBondContact O-SG 3.29Å; Y243-C273 VanDerWaalsContact O-SG 3.4Å
244	K	87	Confident	82.4	Confident	53 Å²	53	67.6 Å²	67.6	23%	0.23	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	-32.6	-177.7	-172.8	177.6	-173.3	-153.7	0	112.9	E231 H232 R271 C273	E231-K244 VanDerWaalsContact CD-CE 3.44Å; E231-K244 WeakPolarHBondContact OE1-CE 3.1Å; E231-K244 IonicContact OE1-NZ 2.91Å; E231-K244 PolarHBondContact OE1-NZ 3.34Å; E231-K244 WeakPolarHBondContact OE2-CE 3.45Å; E231-K244 IonicContact OE2-NZ 3.28Å; E231-K244 PolarHBondContact OE2-NZ 3.45Å; H232-K244 CarbonylContact C-O 3.53Å; H232-K244 VanDerWaalsContact C-O 3.26Å; H232-K244 PolarHBondContact N-O 3.22Å; H232-K244 CarbonylContact O-C 3.48Å; K244-R271 HydrophobicContact CB-CB 4.41Å; K244-R271 HydrophobicContact CB-CG 4.41Å; K244-R271 WeakPolarHBondContact CB-O 3.32Å; K244-R271 PolarHBondContact N-O 3.38Å; K244-C273 HydrophobicContact CB-CB 4.05Å; K244-C273 PolarHBondContact N-SG 3.38Å; K244-C273 VanDerWaalsContact N-SG 3.37Å
245	Y	86.6	Confident	82.6	Confident	27 Å²	27	68.1 Å²	68.1	11%	0.106	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	145.5	-171.3	-59.5	-69.1	0	0	0	111.6	K229 A230 E231 H234 Y243 W269 R271	K229-Y245 HydrophobicContact CD-CD1 4.13Å; K229-Y245 HydrophobicContact CD-CE1 4.41Å; K229-Y245 HydrophobicContact CD-CG 4.31Å; K229-Y245 VanDerWaalsContact CE-CE1 3.44Å; K229-Y245 HydrophobicContact CG-CD1 3.87Å; K229-Y245 HydrophobicContact CG-CG 4.14Å; A230-Y245 CarbonylContact O-C 3.49Å; A230-Y245 VanDerWaalsContact O-CA 3.29Å; A230-Y245 WeakPolarHBondContact O-CA 3.35Å; E231-Y245 HydrophobicContact CG-CD1 3.96Å; E231-Y245 HydrophobicContact CG-CE1 3.61Å; E231-Y245 WeakPolarHBondContact OE1-CE1 2.99Å; E231-Y245 PolarHBondContact OE1-OH 2.93Å; H234-Y245 PolarHBondContact CE1-O 2.82Å; H234-Y245 PolarHBondContact ND1-O 2.03Å; Y243-Y245 VanDerWaalsContact C-N 3.29Å; Y243-Y245 PolarHBondContact O-N 2.94Å; Y245-W269 WeakPolarHBondContact CD2-O 3.34Å; Y245-R271 HydrophobicContact CD2-CB 4.02Å; Y245-R271 HydrophobicContact CE2-CB 3.88Å; Y245-R271 HydrophobicContact CE2-CG 4.42Å; Y245-R271 PolarHBondContact OH-NH1 3.46Å
246	I	83.1	Confident	82.7	Confident	45 Å²	45	66.9 Å²	66.9	23%	0.231	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	159.2	170.1	59.3	169.2	0	0	0	110.6	A230 H232 H234	A230-I246 HydrophobicContact CB-CD1 4.41Å; A230-I246 HydrophobicContact CB-CG1 3.94Å; A230-I246 PolarHBondContact N-O 3.19Å; A230-I246 VanDerWaalsContact N-O 3.13Å; A230-I246 PolarHBondContact O-N 2.91Å; H232-I246 HydrophobicContact CB-CD1 3.75Å; H232-I246 HydrophobicContact CB-CG1 3.91Å; H232-I246 HydrophobicContact CB-CG2 4.07Å; H234-I246 HydrophobicContact CB-CG2 4.24Å; H234-I246 WeakPolarHBondContact ND1-CG2 3.27Å
247	V	84	Confident	83.1	Confident	36 Å²	36	66 Å²	66	22%	0.218	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.2	162.7	-178.5	0	0	0	0	107.8	Y227 L265 W269	Y227-V247 HydrophobicContact CD2-CG1 3.73Å; Y227-V247 HydrophobicContact CG-CG1 3.95Å; V247-L265 HydrophobicContact CG2-CD1 4.1Å; V247-W269 HydrophobicContact CB-CZ3 4.45Å; V247-W269 HydrophobicContact CG2-CE3 4.18Å; V247-W269 HydrophobicContact CG2-CZ3 3.88Å
248	S	82.4	Confident	83.8	Confident	36 Å²	36	64 Å²	64	25%	0.252	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	106.9	172.4	176.2	0	0	0	0	108.5	Y227 K228 L250	Y227-S248 CarbonylContact C-O 3.39Å; Y227-S248 VanDerWaalsContact CA-O 3.23Å; Y227-S248 WeakPolarHBondContact CA-O 3.1Å; Y227-S248 WeakPolarHBondContact CB-O 3.47Å; K228-S248 PolarHBondContact N-O 3.04Å; K228-S248 WeakPolarHBondContact O-CB 3.23Å; K228-S248 PolarHBondContact O-N 3.05Å; S248-L250 PolarHBondContact O-N 2.88Å
249	I	83.7	Confident	84.4	Confident	82 Å²	82	61 Å²	61	42%	0.421	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.9	175	-58.9	170.9	0	0	0	108.2	E252 C261	I249-E252 HydrophobicContact CG2-CG 4.05Å; I249-C261 HydrophobicContact CD1-CB 4.08Å; I249-C261 HydrophobicContact CG1-CB 4.35Å
250	L	84.2	Confident	84.5	Confident	91 Å²	91	62.7 Å²	62.7	48%	0.476	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-39.6	174.3	-60.7	-178.9	0	0	0	111	N226 K228 S248	N226-L250 HydrophobicContact CB-CB 4.25Å; N226-L250 WeakPolarHBondContact O-CA 3.44Å; N226-L250 WeakPolarHBondContact O-CB 3.47Å; N226-L250 PolarHBondContact O-N 2.94Å; K228-L250 HydrophobicContact CB-CD1 4.27Å; K228-L250 HydrophobicContact CD-CD1 4.16Å; K228-L250 HydrophobicContact CD-CD2 3.89Å; K228-L250 HydrophobicContact CD-CG 4.36Å; K228-L250 HydrophobicContact CG-CD1 4.23Å; K228-L250 HydrophobicContact CG-CD2 4.05Å; K228-L250 HydrophobicContact CG-CG 4.19Å; S248-L250 PolarHBondContact O-N 2.88Å
251	S	83.9	Confident	84.6	Confident	36 Å²	36	54.1 Å²	54.1	25%	0.252	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	137.8	170.5	64.3	0	0	0	0	110.5	C225 N226	C225-S251 WeakPolarHBondContact CA-O 3.5Å; N226-S251 VanDerWaalsContact CB-OG 3.22Å; N226-S251 WeakPolarHBondContact CB-OG 3.1Å; N226-S251 PolarHBondContact N-O 3.33Å; N226-S251 PolarHBondContact O-N 2.85Å
252	E	85.5	Confident	84.6	Confident	138 Å²	138	51.8 Å²	51.8	65%	0.645	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-72.2	153.8	175.3	-66.8	-176.7	175.4	0	0	112.2	R223 I249	R223-E252 PolarHBondContact NE-O 3.37Å; R223-E252 PolarHBondContact NH2-O 2.78Å; I249-E252 HydrophobicContact CG2-CG 4.05Å
253	A	83.6	Confident	84.4	Confident	27 Å²	27	55.8 Å²	55.8	22%	0.223	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-64.8	144.2	173.2	0	0	0	0	0	111	R223 C225 I259	R223-A253 CarbonylContact O-C 3.26Å; R223-A253 WeakPolarHBondContact O-CA 3.12Å; C225-A253 HydrophobicContact CB-CB 4.09Å; A253-I259 WeakPolarHBondContact CB-O 3.06Å
254	Q	84.1	Confident	84	Confident	54 Å²	54	56.9 Å²	56.9	25%	0.252	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-87	121.4	176	-165.7	164.3	6.7	0	0	110.7	L71 Y222 R223 G258	L71-Q254 HydrophobicContact CD1-CG 4.05Å; Y222-Q254 HydrophobicContact CD1-CB 4.29Å; Y222-Q254 HydrophobicContact CD1-CG 4.07Å; R223-Q254 HydrophobicContact CB-CB 4.06Å; R223-Q254 PolarHBondContact O-N 2.62Å; Q254-G258 WeakPolarHBondContact O-CA 3.49Å; Q254-G258 PolarHBondContact O-N 2.87Å
255	S	80.1	Confident	83.9	Confident	58 Å²	58	55.3 Å²	55.3	41%	0.406	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	150.3	176.5	-177.3	0	0	0	0	111.9	Y222 H360	Y222-S255 WeakPolarHBondContact CD1-O 3.03Å; Y222-S255 VanDerWaalsContact CE1-O 3.23Å; Y222-S255 WeakPolarHBondContact CE1-O 3.47Å; S255-H360 PolarHBondContact OG-O 3.36Å
256	P	81.4	Confident	84	Confident	59 Å²	59	55.1 Å²	55.1	38%	0.383	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.8	-10.5	-7.3	35	-33.3	0	0	0	113.2
257	Y	86.4	Confident	84.2	Confident	17 Å²	17	61.8 Å²	61.8	7%	0.067	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-4.4	-168.2	-52.9	-76.6	0	0	0	114.7	R26 P28 M33 E34 F70 Y222	R26-Y257 PolarHBondContact NE-O 2.96Å; R26-Y257 PolarHBondContact NH2-O 2.99Å; P28-Y257 HydrophobicContact CB-CD1 3.61Å; P28-Y257 HydrophobicContact CB-CD2 4.4Å; P28-Y257 HydrophobicContact CB-CE1 3.78Å; P28-Y257 HydrophobicContact CB-CG 3.95Å; P28-Y257 HydrophobicContact CG-CD1 3.84Å; P28-Y257 HydrophobicContact CG-CD2 3.72Å; P28-Y257 HydrophobicContact CG-CE1 4.08Å; P28-Y257 HydrophobicContact CG-CE2 3.94Å; P28-Y257 HydrophobicContact CG-CG 3.66Å; M33-Y257 HydrophobicContact CB-CD1 4.02Å; M33-Y257 HydrophobicContact CB-CE1 4.15Å; M33-Y257 HydrophobicContact CG-CD1 4.46Å; M33-Y257 HydrophobicContact SD-CD1 3.69Å; M33-Y257 HydrophobicContact SD-CE1 4.49Å; E34-Y257 HydrophobicContact CG-CE1 3.8Å; F70-Y257 HydrophobicContact CD1-CE2 4.03Å; F70-Y257 AromaticContact CE1-CE2 3.89Å; F70-Y257 HydrophobicContact CE1-CE2 3.89Å; Y222-Y257 HydrophobicContact CD1-CD2 4.19Å; Y222-Y257 AromaticContact CD2-CD2 3.83Å; Y222-Y257 HydrophobicContact CD2-CD2 3.83Å; Y222-Y257 HydrophobicContact CD2-CG 4.29Å; Y222-Y257 AromaticContact CE1-CD2 3.8Å; Y222-Y257 HydrophobicContact CE1-CD2 3.8Å; Y222-Y257 AromaticContact CE2-CD2 3.41Å; Y222-Y257 HydrophobicContact CE2-CD2 3.41Å; Y222-Y257 VanDerWaalsContact CE2-CD2 3.41Å; Y222-Y257 HydrophobicContact CE2-CE2 4.12Å; Y222-Y257 HydrophobicContact CE2-CG 4.3Å; Y222-Y257 HydrophobicContact CG-CD2 4.21Å; Y222-Y257 AromaticContact CZ-CD2 3.4Å; Y222-Y257 VanDerWaalsContact CZ-CD2 3.4Å; Y222-Y257 AromaticContact CZ-CE2 3.95Å
258	G	87.1	Confident	84.5	Confident	7 Å²	7	67.1 Å²	67.1	7%	0.072	38%	0.379	C	S	.	.	S	Bend	trans	-72.5	152.9	175.1	0	0	0	0	0	113.2	R26 Q254 P260	R26-G258 PolarHBondContact NH2-O 2.65Å; Q254-G258 WeakPolarHBondContact O-CA 3.49Å; Q254-G258 PolarHBondContact O-N 2.87Å; G258-P260 WeakPolarHBondContact O-CD 3.06Å
259	I	87.8	Confident	84.8	Confident	78 Å²	78	66.4 Å²	66.4	40%	0.4	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-69	118.1	174.4	-63.4	167.6	0	0	0	108.6	N224 C225 A253	N224-I259 HydrophobicContact CB-CB 4.22Å; N224-I259 WeakPolarHBondContact OD1-CG1 3.5Å; N224-I259 PolarHBondContact OD1-N 2.92Å; C225-I259 WeakPolarHBondContact CB-O 3.02Å; C225-I259 PolarHBondContact N-O 3.27Å; A253-I259 WeakPolarHBondContact CB-O 3.06Å
260	P	86.1	Confident	85.1	Confident	94 Å²	94	66.7 Å²	66.7	61%	0.61	37%	0.369	S	S	*	.	P	Polyproline II helix	trans	-65.5	157.4	179.8	28.7	-35.3	0	0	0	112.1	G258	G258-P260 WeakPolarHBondContact O-CD 3.06Å
261	C	83.2	Confident	85.5	Confident	26 Å²	26	69 Å²	69	18%	0.176	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65	151.7	175.8	-57.7	0	0	0	0	111.4	C225 I249 T263	C225-C261 HydrophobicContact CB-CB 3.87Å; C225-C261 WeakPolarHBondContact CB-SG 3.47Å; C225-C261 WeakPolarHBondContact SG-CA 3.5Å; C225-C261 WeakPolarHBondContact SG-CB 3.08Å; C225-C261 CovalentContact SG-SG 2.02Å; C225-C261 PolarHBondContact SG-SG 2.86Å; I249-C261 HydrophobicContact CD1-CB 4.08Å; I249-C261 HydrophobicContact CG1-CB 4.35Å; C261-T263 PolarHBondContact O-N 3.23Å
262	P	85.7	Confident	85.7	Confident	41 Å²	41	72.7 Å²	72.7	27%	0.266	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-56.3	126.8	172.8	-21.5	31	0	0	0	110.5	Y227 G264	Y227-P262 HydrophobicContact CD1-CG 4.08Å; Y227-P262 HydrophobicContact CD2-CG 4.26Å; Y227-P262 HydrophobicContact CE1-CG 3.53Å; Y227-P262 HydrophobicContact CE2-CG 3.74Å; Y227-P262 HydrophobicContact CG-CG 4.41Å; P262-G264 WeakPolarHBondContact CB-O 3.29Å; P262-G264 PolarHBondContact O-N 3.18Å
263	T	79.8	Confident	85.7	Confident	154 Å²	154	67.7 Å²	67.7	95%	0.945	37%	0.365	S	S	*	.	S	Bend	trans	-74.9	-7.2	177	54.3	0	0	0	0	113	C261	C261-T263 PolarHBondContact O-N 3.23Å
264	G	79.3	Confident	85.5	Confident	36 Å²	36	74.9 Å²	74.9	37%	0.371	39%	0.394	S	S	.	.	S	Bend	trans	-153.4	171.4	-179.1	0	0	0	0	0	111.7	P262 P266	P262-G264 WeakPolarHBondContact CB-O 3.29Å; P262-G264 PolarHBondContact O-N 3.18Å; G264-P266 WeakPolarHBondContact O-CD 3.43Å
265	L	84.4	Confident	84.7	Confident	19 Å²	19	79.8 Å²	79.8	10%	0.099	41%	0.414	C	S	.	.			trans	-67.9	124.2	178.9	-167.6	65.4	0	0	0	109.8	Y243 V247 W269 K270	Y243-L265 HydrophobicContact CD2-CD2 4.11Å; Y243-L265 HydrophobicContact CG-CD2 4.02Å; V247-L265 HydrophobicContact CG2-CD1 4.1Å; L265-W269 HydrophobicContact CD1-CB 3.74Å; L265-W269 HydrophobicContact CD1-CE3 3.85Å; L265-W269 HydrophobicContact CD2-CB 4.34Å; L265-W269 HydrophobicContact CG-CB 3.86Å; L265-K270 HydrophobicContact CD2-CG 4.08Å; L265-K270 HydrophobicContact CG-CG 4.45Å
266	P	87.6	Confident	84	Confident	23 Å²	23	82 Å²	82	15%	0.149	43%	0.426	C	S	.	.			trans	-52.4	144.5	173	-26.5	34.9	0	0	0	111.2	G264 E268 W269	G264-P266 WeakPolarHBondContact O-CD 3.43Å; P266-E268 HydrophobicContact CB-CG 4.19Å; P266-E268 WeakPolarHBondContact CB-OE1 3.01Å; P266-E268 PolarHBondContact O-N 3.35Å; P266-W269 HydrophobicContact CB-CD2 4.37Å; P266-W269 HydrophobicContact CB-CG 4.35Å; P266-W269 HydrophobicContact CG-CD2 4.1Å; P266-W269 HydrophobicContact CG-CE3 4.14Å; P266-W269 HydrophobicContact CG-CZ3 4.42Å; P266-W269 PolarHBondContact O-N 3.14Å
267	K	88.3	Confident	83.6	Confident	185 Å²	185	80.3 Å²	80.3	80%	0.804	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-56.6	-40.8	-172.5	-72	-177.4	179.2	178.1	0	111.5	W269 K270	K267-W269 PolarHBondContact O-N 3.25Å; K267-K270 WeakPolarHBondContact O-CB 3.34Å; K267-K270 PolarHBondContact O-N 2.82Å
268	E	89.1	Confident	83.2	Confident	148 Å²	148	89 Å²	89	69%	0.692	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-64.5	-14.3	177.3	59.5	-90.5	-162.3	0	0	114.6	P266	P266-E268 HydrophobicContact CB-CG 4.19Å; P266-E268 WeakPolarHBondContact CB-OE1 3.01Å; P266-E268 PolarHBondContact O-N 3.35Å
269	W	90.4	Very high	83	Confident	22 Å²	22	89.2 Å²	89.2	8%	0.083	45%	0.449	C	S	.	.	G	3₁₀ helix	trans	-100.8	-5.1	178.9	-62.9	4.8	0	0	0	112.9	Y227 K229 Y245 V247 L265 P266 K267 R271	Y227-W269 AromaticContact CD2-CH2 3.83Å; Y227-W269 HydrophobicContact CD2-CH2 3.83Å; Y227-W269 HydrophobicContact CD2-CZ3 4.32Å; Y227-W269 AromaticContact CE2-CH2 3.73Å; Y227-W269 HydrophobicContact CE2-CH2 3.73Å; Y227-W269 HydrophobicContact CE2-CZ2 4.42Å; Y227-W269 HydrophobicContact CE2-CZ3 4.39Å; K229-W269 HydrophobicContact CB-CD2 4.18Å; K229-W269 HydrophobicContact CB-CE3 4.08Å; K229-W269 HydrophobicContact CB-CH2 3.76Å; K229-W269 HydrophobicContact CB-CZ2 3.85Å; K229-W269 HydrophobicContact CB-CZ3 3.87Å; K229-W269 HydrophobicContact CD-CD2 3.99Å; K229-W269 HydrophobicContact CD-CG 4.08Å; K229-W269 HydrophobicContact CG-CD2 3.93Å; K229-W269 HydrophobicContact CG-CE3 3.99Å; K229-W269 HydrophobicContact CG-CG 4.41Å; K229-W269 HydrophobicContact CG-CZ2 4.48Å; K229-W269 HydrophobicContact CG-CZ3 4.29Å; Y245-W269 WeakPolarHBondContact CD2-O 3.34Å; V247-W269 HydrophobicContact CB-CZ3 4.45Å; V247-W269 HydrophobicContact CG2-CE3 4.18Å; V247-W269 HydrophobicContact CG2-CZ3 3.88Å; L265-W269 HydrophobicContact CD1-CB 3.74Å; L265-W269 HydrophobicContact CD1-CE3 3.85Å; L265-W269 HydrophobicContact CD2-CB 4.34Å; L265-W269 HydrophobicContact CG-CB 3.86Å; P266-W269 HydrophobicContact CB-CD2 4.37Å; P266-W269 HydrophobicContact CB-CG 4.35Å; P266-W269 HydrophobicContact CG-CD2 4.1Å; P266-W269 HydrophobicContact CG-CE3 4.14Å; P266-W269 HydrophobicContact CG-CZ3 4.42Å; P266-W269 PolarHBondContact O-N 3.14Å; K267-W269 PolarHBondContact O-N 3.25Å; W269-R271 VanDerWaalsContact C-N 3.35Å; W269-R271 PolarHBondContact O-N 3.41Å
270	K	90.3	Very high	82.9	Confident	88 Å²	88	92.7 Å²	92.7	38%	0.383	47%	0.469	S	S	.	.			trans	-71.1	83.1	178.3	-68.3	-167	172.4	-157	0	111.8	D239 Y243 L265 K267	D239-K270 IonicContact OD1-NZ 2.61Å; D239-K270 IonicContact OD2-NZ 2.67Å; D239-K270 PolarHBondContact OD2-NZ 3.31Å; Y243-K270 HydrophobicContact CD1-CB 4.25Å; Y243-K270 HydrophobicContact CE1-CB 3.86Å; Y243-K270 HydrophobicContact CE1-CD 4.5Å; Y243-K270 HydrophobicContact CE1-CG 4.25Å; L265-K270 HydrophobicContact CD2-CG 4.08Å; L265-K270 HydrophobicContact CG-CG 4.45Å; K267-K270 WeakPolarHBondContact O-CB 3.34Å; K267-K270 PolarHBondContact O-N 2.82Å
271	R	92.1	Very high	82.9	Confident	139 Å²	139	92.1 Å²	92.1	53%	0.525	45%	0.454	S	S	.	.			trans	-115.6	125.1	172.7	179.3	-178.7	178.3	-179.6	4.6	109.9	Y243 K244 Y245 W269	Y243-R271 CarbonylContact C-O 3.46Å; Y243-R271 VanDerWaalsContact CA-O 3.28Å; Y243-R271 WeakPolarHBondContact CA-O 3.04Å; K244-R271 HydrophobicContact CB-CB 4.41Å; K244-R271 HydrophobicContact CB-CG 4.41Å; K244-R271 WeakPolarHBondContact CB-O 3.32Å; K244-R271 PolarHBondContact N-O 3.38Å; Y245-R271 HydrophobicContact CD2-CB 4.02Å; Y245-R271 HydrophobicContact CE2-CB 3.88Å; Y245-R271 HydrophobicContact CE2-CG 4.42Å; Y245-R271 PolarHBondContact OH-NH1 3.46Å; W269-R271 VanDerWaalsContact C-N 3.35Å; W269-R271 PolarHBondContact O-N 3.41Å
272	E	88.5	Confident	83.1	Confident	114 Å²	114	92.8 Å²	92.8	53%	0.533	47%	0.466	S	S	.	.	B	Isolated β-bridge	trans	-71.6	155.4	-177.3	-63.2	-176.4	-153.5	0	0	113.5	K241 W242 Y243	K241-E272 WeakPolarHBondContact CD-OE1 3.09Å; K241-E272 WeakPolarHBondContact CE-OE1 3.34Å; K241-E272 IonicContact NZ-OE1 3.54Å; K241-E272 PolarHBondContact NZ-OE1 2.86Å; W242-E272 CarbonylContact O-C 3.26Å; W242-E272 WeakPolarHBondContact O-CA 3.34Å; Y243-E272 HydrophobicContact CD1-CG 4.3Å; Y243-E272 HydrophobicContact CE1-CG 4.17Å
273	C	85	Confident	83.2	Confident	32 Å²	32	100.5 Å²	100.5	22%	0.216	50%	0.495	C	S	.	.			trans	-144.5	162.6	176.2	58.7	0	0	0	0	111.9	C233 W242 Y243 K244	C233-C273 WeakPolarHBondContact CA-SG 3.45Å; C233-C273 HydrophobicContact CB-CB 3.95Å; C233-C273 WeakPolarHBondContact CB-SG 3.44Å; C233-C273 WeakPolarHBondContact SG-CB 3.12Å; C233-C273 CovalentContact SG-SG 2.03Å; C233-C273 PolarHBondContact SG-SG 3.12Å; W242-C273 WeakPolarHBondContact CB-O 3.23Å; W242-C273 PolarHBondContact O-N 2.73Å; Y243-C273 PolarHBondContact O-SG 3.29Å; Y243-C273 VanDerWaalsContact O-SG 3.4Å; K244-C273 HydrophobicContact CB-CB 4.05Å; K244-C273 PolarHBondContact N-SG 3.38Å; K244-C273 VanDerWaalsContact N-SG 3.37Å
274	E	78.6	Confident	83.6	Confident	179 Å²	179	96.6 Å²	96.6	84%	0.836	46%	0.463	S	S	*	.			trans	-95.7	148	177.4	-67.5	-179.5	-176.8	0	0	112.5	C233	C233-E274 PolarHBondContact SG-O 2.77Å
275	K	68.3	Low	83.9	Confident	157 Å²	157	97.8 Å²	97.8	68%	0.683	46%	0.463	S	S	*	.			trans	-64.4	130.6	179	64.7	-179.3	-177.1	176.2	0	111.6	W242	W242-K275 HydrophobicContact CZ2-CB 4.22Å
276	T	65.2	Low	83.8	Confident	105 Å²	105	105.3 Å²	105.3	64%	0.644	50%	0.498	S	S	*	.			trans	-94.1	-19.1	175.8	39.9	0	0	0	0	114.4
277	C	72.5	Confident	83.2	Confident	23 Å²	23	108.3 Å²	108.3	16%	0.155	51%	0.51	C	S	.	.			trans	-81.3	121.7	-168.8	-40.9	0	0	0	0	112	W281 C321	C277-W281 HydrophobicContact CB-CZ2 4.22Å; C277-C321 VanDerWaalsContact CA-SG 3.6Å; C277-C321 HydrophobicContact CB-CB 3.76Å; C277-C321 WeakPolarHBondContact CB-SG 3.47Å; C277-C321 WeakPolarHBondContact SG-CB 3.42Å; C277-C321 CovalentContact SG-SG 2.01Å; C277-C321 PolarHBondContact SG-SG 2.87Å
278	R	78.7	Confident	82.4	Confident	200 Å²	200	102.5 Å²	102.5	76%	0.755	49%	0.491	S	S	*	.			trans	-104.1	-16.4	-179.8	-58.5	-176	-179.3	-166.1	-0.1	114.2	A306	R278-A306 WeakPolarHBondContact CB-O 3.43Å; R278-A306 PolarHBondContact N-O 3.2Å
279	G	81.7	Confident	81.4	Confident	10 Å²	10	101.2 Å²	101.2	10%	0.103	50%	0.498	C	S	.	.	S	Bend	trans	-79.1	170.4	177.2	0	0	0	0	0	114.2	P305	G279-P305 WeakPolarHBondContact CA-O 3.03Å; G279-P305 PolarHBondContact N-O 2.77Å
280	N	85.8	Confident	80.2	Confident	152 Å²	152	104.9 Å²	104.9	81%	0.813	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-75.8	137	176.2	-70.4	-24.9	0	0	0	111.2	P305	N280-P305 WeakPolarHBondContact O-CD 3.47Å
281	W	85.8	Confident	78.8	Confident	82 Å²	82	106.8 Å²	106.8	31%	0.311	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-73.1	131.8	175.1	-71.3	95.5	0	0	0	111.7	C277 R302 A304 C321 A323	C277-W281 HydrophobicContact CB-CZ2 4.22Å; W281-R302 HydrophobicContact CD2-CG 4.44Å; W281-R302 HydrophobicContact CE3-CB 4.41Å; W281-R302 HydrophobicContact CE3-CG 3.62Å; W281-R302 HydrophobicContact CZ3-CG 4.06Å; W281-R302 WeakPolarHBondContact CZ3-O 3.02Å; W281-A304 HydrophobicContact CD2-CB 3.49Å; W281-A304 VanDerWaalsContact CD2-CB 3.49Å; W281-A304 HydrophobicContact CE3-CB 3.47Å; W281-A304 VanDerWaalsContact CE3-CB 3.47Å; W281-A304 HydrophobicContact CG-CB 3.96Å; W281-A304 HydrophobicContact CH2-CB 4.14Å; W281-A304 HydrophobicContact CZ2-CB 4.15Å; W281-A304 HydrophobicContact CZ3-CB 3.8Å; W281-C321 HydrophobicContact CH2-CB 3.85Å; W281-C321 HydrophobicContact CZ2-CB 4.48Å; W281-C321 HydrophobicContact CZ3-CB 4.4Å; W281-A323 HydrophobicContact CE3-CB 4.17Å; W281-A323 HydrophobicContact CH2-CB 3.45Å; W281-A323 VanDerWaalsContact CH2-CB 3.45Å; W281-A323 HydrophobicContact CZ2-CB 4.16Å; W281-A323 HydrophobicContact CZ3-CB 3.46Å; W281-A323 VanDerWaalsContact CZ3-CB 3.46Å
282	G	87.3	Confident	77.3	Confident	40 Å²	40	105 Å²	105	41%	0.412	52%	0.524	S	S	.	.			trans	-68.2	174.9	165.5	0	0	0	0	0	112.6	F303	G282-F303 PolarHBondContact N-O 3.22Å
283	K	89.6	Confident	76.2	Confident	203 Å²	203	104.4 Å²	104.4	88%	0.883	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-66.4	154.6	173	-64.2	-176.8	-179.6	-179.8	0	110.4
284	W	87.4	Confident	75.6	Confident	71 Å²	71	106 Å²	106	27%	0.269	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-65.7	140.2	168.8	-68.1	101.4	0	0	0	110.3	E286 R300 E301 R302 A323 K325	W284-E286 PolarHBondContact O-N 3.45Å; W284-R300 HydrophobicContact CE3-CB 3.84Å; W284-R300 HydrophobicContact CZ3-CB 4.45Å; W284-R300 WeakPolarHBondContact CZ3-O 3.28Å; W284-R300 PolarHBondContact O-NH2 2.93Å; W284-E301 CarbonylContact C-O 3.56Å; W284-E301 WeakPolarHBondContact CA-O 3.26Å; W284-R302 HydrophobicContact CD2-CB 3.93Å; W284-R302 HydrophobicContact CD2-CG 3.85Å; W284-R302 VanDerWaalsContact CE2-CD 3.47Å; W284-R302 HydrophobicContact CE3-CB 3.84Å; W284-R302 HydrophobicContact CE3-CG 3.78Å; W284-R302 HydrophobicContact CG-CB 4.32Å; W284-R302 HydrophobicContact CH2-CG 3.81Å; W284-R302 HydrophobicContact CZ2-CG 3.9Å; W284-R302 HydrophobicContact CZ3-CB 4.25Å; W284-R302 HydrophobicContact CZ3-CG 3.74Å; W284-A323 HydrophobicContact CH2-CB 4.18Å; W284-A323 VanDerWaalsContact CZ3-O 3.26Å; W284-A323 WeakPolarHBondContact CZ3-O 3.25Å; W284-K325 HydrophobicContact CE3-CB 4.48Å; W284-K325 HydrophobicContact CH2-CB 3.48Å; W284-K325 VanDerWaalsContact CH2-CB 3.48Å; W284-K325 HydrophobicContact CZ2-CB 4Å; W284-K325 HydrophobicContact CZ3-CB 3.76Å
285	T	86.4	Confident	75.6	Confident	61 Å²	61	98.7 Å²	98.7	37%	0.374	49%	0.494	S	S	.	.	P	Polyproline II helix	trans	-48.5	133.7	170.6	50.3	0	0	0	0	110.1	R300 E301	T285-R300 PolarHBondContact O-NE 3.44Å; T285-R300 PolarHBondContact O-NH2 3.33Å; T285-E301 HydrophobicContact CG2-CB 4.2Å; T285-E301 WeakPolarHBondContact CG2-O 3.44Å; T285-E301 PolarHBondContact N-O 3.4Å; T285-E301 PolarHBondContact OG1-N 3.32Å; T285-E301 VanDerWaalsContact OG1-N 3.08Å; T285-E301 PolarHBondContact OG1-O 2.94Å
286	E	81.6	Confident	76	Confident	178 Å²	178	95.2 Å²	95.2	83%	0.832	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-54.1	153.8	-174.4	-67.2	179.4	173	0	0	113.4	W284	W284-E286 PolarHBondContact O-N 3.45Å
287	E	75.5	Confident	76.3	Confident	86 Å²	86	92.8 Å²	92.8	40%	0.402	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-73	144.6	172.1	-66.7	178.4	-171.2	0	0	108.9	S289 R300	E287-S289 PolarHBondContact O-N 2.89Å; E287-R300 VanDerWaalsContact CG-NH1 3.34Å; E287-R300 IonicContact OE1-CZ 3.91Å; E287-R300 IonicContact OE1-NH1 2.88Å; E287-R300 PolarHBondContact OE1-NH1 2.95Å
288	P	70.4	Confident	76.5	Confident	62 Å²	62	93.2 Å²	93.2	40%	0.403	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-51.5	136.8	170.1	-23.3	32.7	0	0	0	110.2	E290	P288-E290 PolarHBondContact O-N 3.18Å
289	S	69	Low	76.4	Confident	121 Å²	121	87.1 Å²	87.1	85%	0.846	45%	0.453	S	S	*	.	S	Bend	trans	-66	-20	-171.4	51.9	0	0	0	0	114.3	E287	E287-S289 PolarHBondContact O-N 2.89Å
290	E	64.8	Low	76.5	Confident	99 Å²	99	88.8 Å²	88.8	46%	0.463	46%	0.456	S	S	.	.			trans	-103.1	126.2	-176.1	-61.1	-170.6	-180	0	0	111.9	P288 H292 L293	P288-E290 PolarHBondContact O-N 3.18Å; E290-H292 PolarHBondContact O-N 3.45Å; E290-L293 HydrophobicContact CB-CB 4.48Å; E290-L293 HydrophobicContact CB-CD1 3.94Å; E290-L293 HydrophobicContact CB-CG 4.04Å; E290-L293 HydrophobicContact CG-CD1 4.33Å; E290-L293 PolarHBondContact O-N 2.96Å
291	E	61.4	Low	76.5	Confident	128 Å²	128	84 Å²	84	60%	0.598	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-56.7	-32.3	175.5	162.4	150.6	-134.6	0	0	112.6	R294	E291-R294 VanDerWaalsContact CA-NE 3.34Å; E291-R294 VanDerWaalsContact CB-NH2 3.3Å; E291-R294 VanDerWaalsContact O-CB 3.26Å; E291-R294 WeakPolarHBondContact O-CB 3.15Å; E291-R294 VanDerWaalsContact O-CG 3.24Å; E291-R294 WeakPolarHBondContact O-CG 3.37Å; E291-R294 PolarHBondContact O-N 2.86Å; E291-R294 PolarHBondContact O-NE 2.75Å; E291-R294 VanDerWaalsContact O-NE 3.1Å; E291-R294 IonicContact OE1-CZ 3.92Å; E291-R294 IonicContact OE1-NH2 3.18Å; E291-R294 PolarHBondContact OE1-NH2 3.34Å; E291-R294 IonicContact OE2-NH2 3.81Å
292	H	59	Low	76.7	Confident	103 Å²	103	83.7 Å²	83.7	48%	0.477	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-85.5	-8.7	-173.8	-50.1	-62.9	0	0	0	114.7	E290 R294 F336 T341	E290-H292 PolarHBondContact O-N 3.45Å; H292-R294 PolarHBondContact O-N 2.91Å; H292-F336 WeakPolarHBondContact O-CE1 3.39Å; H292-T341 HydrophobicContact CB-CG2 3.49Å; H292-T341 VanDerWaalsContact CB-CG2 3.49Å
293	L	66.1	Low	76.8	Confident	101 Å²	101	83 Å²	83	53%	0.529	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-82	3.7	169.4	-69.7	172	0	0	0	112.3	E290 C295	E290-L293 HydrophobicContact CB-CB 4.48Å; E290-L293 HydrophobicContact CB-CD1 3.94Å; E290-L293 HydrophobicContact CB-CG 4.04Å; E290-L293 HydrophobicContact CG-CD1 4.33Å; E290-L293 PolarHBondContact O-N 2.96Å; L293-C295 PolarHBondContact O-N 2.04Å
294	R	72.4	Confident	76.7	Confident	66 Å²	66	73.3 Å²	73.3	25%	0.249	37%	0.371	C	S	.	.			trans	-91.5	84.8	-172.4	-59.9	-169.5	-69.8	-164.8	-3.6	111.3	E291 H292 Y329	E291-R294 VanDerWaalsContact CA-NE 3.34Å; E291-R294 VanDerWaalsContact CB-NH2 3.3Å; E291-R294 VanDerWaalsContact O-CB 3.26Å; E291-R294 WeakPolarHBondContact O-CB 3.15Å; E291-R294 VanDerWaalsContact O-CG 3.24Å; E291-R294 WeakPolarHBondContact O-CG 3.37Å; E291-R294 PolarHBondContact O-N 2.86Å; E291-R294 PolarHBondContact O-NE 2.75Å; E291-R294 VanDerWaalsContact O-NE 3.1Å; E291-R294 IonicContact OE1-CZ 3.92Å; E291-R294 IonicContact OE1-NH2 3.18Å; E291-R294 PolarHBondContact OE1-NH2 3.34Å; E291-R294 IonicContact OE2-NH2 3.81Å; H292-R294 PolarHBondContact O-N 2.91Å; R294-Y329 HydrophobicContact CB-CD1 3.87Å; R294-Y329 HydrophobicContact CB-CD2 3.95Å; R294-Y329 HydrophobicContact CB-CE1 3.79Å; R294-Y329 HydrophobicContact CB-CE2 3.82Å; R294-Y329 HydrophobicContact CB-CG 3.96Å; R294-Y329 WeakPolarHBondContact CD-OH 3.34Å; R294-Y329 HydrophobicContact CG-CE1 4.11Å; R294-Y329 HydrophobicContact CG-CE2 4.15Å
295	C	77.9	Confident	76.6	Confident	25 Å²	25	70.2 Å²	70.2	17%	0.169	36%	0.36	C	S	.	.			trans	-131.9	158.3	175.6	64.7	0	0	0	0	111.7	L293 T297 D331 C333 F336	L293-C295 PolarHBondContact O-N 2.04Å; C295-T297 PolarHBondContact O-N 3.06Å; C295-D331 CarbonylContact C-O 3.37Å; C295-D331 WeakPolarHBondContact CA-O 3.42Å; C295-C333 VanDerWaalsContact CB-CA 3.49Å; C295-C333 HydrophobicContact CB-CB 3.86Å; C295-C333 WeakPolarHBondContact CB-SG 3.43Å; C295-C333 WeakPolarHBondContact SG-CA 3.46Å; C295-C333 WeakPolarHBondContact SG-CB 3.18Å; C295-C333 CovalentContact SG-SG 2.04Å; C295-C333 PolarHBondContact SG-SG 3.47Å; C295-F336 HydrophobicContact CB-CD2 4.08Å; C295-F336 HydrophobicContact CB-CE2 3.65Å; C295-F336 HydrophobicContact CB-CZ 4.46Å
296	D	77	Confident	76.4	Confident	84 Å²	84	68.7 Å²	68.7	45%	0.449	35%	0.354	S	S	.	.	S	Bend	trans	50.5	-125.9	-178.3	-161.6	-19.3	0	0	0	111.9	Y329 D331	D296-Y329 PolarHBondContact O-N 2.87Å; D296-D331 PolarHBondContact N-O 3.38Å
297	T	72	Confident	76.5	Confident	53 Å²	53	67 Å²	67	33%	0.325	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.2	-171.6	-48.9	0	0	0	0	109.2	C295 L326 M327	C295-T297 PolarHBondContact O-N 3.06Å; T297-L326 HydrophobicContact CG2-CB 3.66Å; T297-L326 HydrophobicContact CG2-CD2 3.59Å; T297-L326 HydrophobicContact CG2-CG 4.03Å; T297-M327 WeakPolarHBondContact CA-O 3.37Å
298	I	76.4	Confident	76.8	Confident	33 Å²	33	67.7 Å²	67.7	17%	0.169	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	142.9	171.5	69.6	168.3	0	0	0	109.4	R300 L326 M327 Y329	I298-R300 HydrophobicContact CD1-CG 4.36Å; I298-L326 WeakPolarHBondContact O-CA 3.28Å; I298-M327 HydrophobicContact CD1-CB 4.28Å; I298-M327 HydrophobicContact CD1-SD 4.5Å; I298-M327 HydrophobicContact CG1-CB 3.72Å; I298-M327 PolarHBondContact N-O 3.08Å; I298-M327 PolarHBondContact O-N 2.83Å; I298-Y329 HydrophobicContact CB-CE2 4.36Å; I298-Y329 HydrophobicContact CD1-CE2 3.62Å; I298-Y329 WeakPolarHBondContact CD1-OH 3.41Å; I298-Y329 HydrophobicContact CG1-CD2 4.5Å; I298-Y329 HydrophobicContact CG1-CE2 3.66Å; I298-Y329 HydrophobicContact CG2-CD2 4.29Å; I298-Y329 HydrophobicContact CG2-CE2 3.85Å
299	T	76.9	Confident	77.5	Confident	72 Å²	72	68.5 Å²	68.5	44%	0.442	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	113.8	172.7	-61.4	0	0	0	0	108.5	E301 R324	T299-E301 HydrophobicContact CG2-CG 4.11Å; T299-R324 HydrophobicContact CG2-CB 3.96Å; T299-R324 HydrophobicContact CG2-CG 3.99Å
300	R	83.8	Confident	78.2	Confident	45 Å²	45	65 Å²	65	17%	0.17	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	139.8	165.3	-65.6	-165.5	71.7	-178.2	-1.5	108.8	W284 T285 E287 I298 R324 K325 M327	W284-R300 HydrophobicContact CE3-CB 3.84Å; W284-R300 HydrophobicContact CZ3-CB 4.45Å; W284-R300 WeakPolarHBondContact CZ3-O 3.28Å; W284-R300 PolarHBondContact O-NH2 2.93Å; T285-R300 PolarHBondContact O-NE 3.44Å; T285-R300 PolarHBondContact O-NH2 3.33Å; E287-R300 VanDerWaalsContact CG-NH1 3.34Å; E287-R300 IonicContact OE1-CZ 3.91Å; E287-R300 IonicContact OE1-NH1 2.88Å; E287-R300 PolarHBondContact OE1-NH1 2.95Å; I298-R300 HydrophobicContact CD1-CG 4.36Å; R300-R324 WeakPolarHBondContact O-CA 3.46Å; R300-K325 PolarHBondContact N-O 2.88Å; R300-K325 PolarHBondContact O-N 3.32Å; R300-M327 WeakPolarHBondContact CD-SD 3.41Å; R300-M327 HydrophobicContact CG-SD 3.86Å
301	E	86.4	Confident	79.2	Confident	50 Å²	50	64.1 Å²	64.1	23%	0.234	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	146.5	180	-55.8	-164	139.8	0	0	110.2	W284 T285 T299 F303 V322 A323 R324	W284-E301 CarbonylContact C-O 3.56Å; W284-E301 WeakPolarHBondContact CA-O 3.26Å; T285-E301 HydrophobicContact CG2-CB 4.2Å; T285-E301 WeakPolarHBondContact CG2-O 3.44Å; T285-E301 PolarHBondContact N-O 3.4Å; T285-E301 PolarHBondContact OG1-N 3.32Å; T285-E301 VanDerWaalsContact OG1-N 3.08Å; T285-E301 PolarHBondContact OG1-O 2.94Å; T299-E301 HydrophobicContact CG2-CG 4.11Å; E301-F303 HydrophobicContact CB-CE2 4.1Å; E301-F303 HydrophobicContact CB-CZ 4.08Å; E301-F303 WeakPolarHBondContact OE2-CZ 3.31Å; E301-V322 HydrophobicContact CB-CG2 4.31Å; E301-A323 WeakPolarHBondContact CA-O 3.21Å; E301-R324 HydrophobicContact CG-CG 4.22Å; E301-R324 IonicContact OE1-CZ 2.65Å; E301-R324 VanDerWaalsContact OE1-CZ 3.23Å; E301-R324 IonicContact OE1-NE 2.94Å; E301-R324 PolarHBondContact OE1-NE 2.85Å; E301-R324 IonicContact OE1-NH2 3.01Å; E301-R324 PolarHBondContact OE1-NH2 3.43Å
302	R	89.3	Confident	80.5	Confident	76 Å²	76	64.2 Å²	64.2	29%	0.287	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	157	164.3	64.3	172.9	-176.7	-175.4	0.1	108.9	W281 W284 A323	W281-R302 HydrophobicContact CD2-CG 4.44Å; W281-R302 HydrophobicContact CE3-CB 4.41Å; W281-R302 HydrophobicContact CE3-CG 3.62Å; W281-R302 HydrophobicContact CZ3-CG 4.06Å; W281-R302 WeakPolarHBondContact CZ3-O 3.02Å; W284-R302 HydrophobicContact CD2-CB 3.93Å; W284-R302 HydrophobicContact CD2-CG 3.85Å; W284-R302 VanDerWaalsContact CE2-CD 3.47Å; W284-R302 HydrophobicContact CE3-CB 3.84Å; W284-R302 HydrophobicContact CE3-CG 3.78Å; W284-R302 HydrophobicContact CG-CB 4.32Å; W284-R302 HydrophobicContact CH2-CG 3.81Å; W284-R302 HydrophobicContact CZ2-CG 3.9Å; W284-R302 HydrophobicContact CZ3-CB 4.25Å; W284-R302 HydrophobicContact CZ3-CG 3.74Å; R302-A323 HydrophobicContact CG-CB 3.89Å; R302-A323 PolarHBondContact N-O 2.89Å; R302-A323 PolarHBondContact O-N 2.73Å
303	F	89	Confident	81.7	Confident	26 Å²	26	61.1 Å²	61.1	11%	0.114	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	145.8	-171	-61.9	-81.9	0	0	0	111	G282 E301 C313 N314 C321 V322	G282-F303 PolarHBondContact N-O 3.22Å; E301-F303 HydrophobicContact CB-CE2 4.1Å; E301-F303 HydrophobicContact CB-CZ 4.08Å; E301-F303 WeakPolarHBondContact OE2-CZ 3.31Å; F303-C313 WeakPolarHBondContact CB-O 3.47Å; F303-N314 WeakPolarHBondContact CE2-O 3.33Å; F303-C321 VanDerWaalsContact CA-O 3.29Å; F303-C321 WeakPolarHBondContact CA-O 3.45Å; F303-V322 HydrophobicContact CD1-CB 4.04Å; F303-V322 HydrophobicContact CD1-CG2 4.13Å; F303-V322 HydrophobicContact CE1-CB 3.86Å; F303-V322 HydrophobicContact CE1-CG2 3.63Å; F303-V322 HydrophobicContact CZ-CG2 4.17Å
304	A	87.6	Confident	82.8	Confident	0 Å²	0	63 Å²	63	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	141	173.5	0	0	0	0	0	110.1	W281 C313 C320 C321	W281-A304 HydrophobicContact CD2-CB 3.49Å; W281-A304 VanDerWaalsContact CD2-CB 3.49Å; W281-A304 HydrophobicContact CE3-CB 3.47Å; W281-A304 VanDerWaalsContact CE3-CB 3.47Å; W281-A304 HydrophobicContact CG-CB 3.96Å; W281-A304 HydrophobicContact CH2-CB 4.14Å; W281-A304 HydrophobicContact CZ2-CB 4.15Å; W281-A304 HydrophobicContact CZ3-CB 3.8Å; A304-C313 PolarHBondContact O-SG 3.15Å; A304-C320 CarbonylContact O-C 3.58Å; A304-C321 HydrophobicContact CB-CB 4.44Å; A304-C321 PolarHBondContact N-O 3.39Å; A304-C321 WeakPolarHBondContact O-CB 3.34Å; A304-C321 PolarHBondContact O-N 3.47Å
305	P	86.9	Confident	83.3	Confident	6 Å²	6	67.5 Å²	67.5	4%	0.039	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	142.1	171.3	-18.7	31.1	0	0	0	111.1	G279 N280 E307 A310 A311	G279-P305 WeakPolarHBondContact CA-O 3.03Å; G279-P305 PolarHBondContact N-O 2.77Å; N280-P305 WeakPolarHBondContact O-CD 3.47Å; P305-E307 VanDerWaalsContact C-N 3.31Å; P305-E307 PolarHBondContact O-N 2.64Å; P305-A310 HydrophobicContact CB-CB 3.7Å; P305-A310 HydrophobicContact CG-CB 4.5Å; P305-A311 WeakPolarHBondContact CG-O 3.41Å
306	A	82	Confident	83.2	Confident	28 Å²	28	69.5 Å²	69.5	23%	0.231	42%	0.416	C	S	.	.	S	Bend	trans	-64	-39.3	177.7	0	0	0	0	0	111.4	R278 A319	R278-A306 WeakPolarHBondContact CB-O 3.43Å; R278-A306 PolarHBondContact N-O 3.2Å; A306-A319 PolarHBondContact N-O 2.95Å
307	E	82.8	Confident	83.2	Confident	143 Å²	143	67.3 Å²	67.3	67%	0.668	41%	0.413	S	S	*	.	S	Bend	trans	-97.7	149.8	-179.3	-65.3	-179.1	-179.5	0	0	112.8	P305 G309 A310	P305-E307 VanDerWaalsContact C-N 3.31Å; P305-E307 PolarHBondContact O-N 2.64Å; E307-G309 PolarHBondContact O-N 3.33Å; E307-A310 HydrophobicContact CB-CB 4.31Å
308	S	82.8	Confident	83.3	Confident	100 Å²	100	71.6 Å²	71.6	70%	0.699	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	126.4	175	-177	0	0	0	0	110
309	G	83.3	Confident	83.5	Confident	80 Å²	80	73.6 Å²	73.6	83%	0.825	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.7	-5	179.8	0	0	0	0	0	115.7	E307	E307-G309 PolarHBondContact O-N 3.33Å
310	A	85.4	Confident	83.7	Confident	46 Å²	46	70.7 Å²	70.7	38%	0.38	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-67.8	154.5	173.7	0	0	0	0	0	112.1	P305 E307	P305-A310 HydrophobicContact CB-CB 3.7Å; P305-A310 HydrophobicContact CG-CB 4.5Å; E307-A310 HydrophobicContact CB-CB 4.31Å
311	A	85.9	Confident	83.6	Confident	82 Å²	82	69.4 Å²	69.4	68%	0.678	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-60.5	144.8	-179.8	0	0	0	0	0	111.9	P305 C313	P305-A311 WeakPolarHBondContact CG-O 3.41Å; A311-C313 PolarHBondContact O-N 3.36Å
312	P	87.9	Confident	83.4	Confident	130 Å²	130	67.9 Å²	67.9	84%	0.844	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-54.2	135.6	176.1	-24.4	33.4	0	0	0	111.9
313	C	85	Confident	82.9	Confident	37 Å²	37	64.9 Å²	64.9	25%	0.25	43%	0.429	C	S	.	.			trans	-116.5	152.8	179.7	61.5	0	0	0	0	110.7	F303 A304 A311 C320	F303-C313 WeakPolarHBondContact CB-O 3.47Å; A304-C313 PolarHBondContact O-SG 3.15Å; A311-C313 PolarHBondContact O-N 3.36Å; C313-C320 HydrophobicContact CB-CB 3.65Å; C313-C320 WeakPolarHBondContact CB-SG 3.22Å; C313-C320 WeakPolarHBondContact SG-CB 3.22Å; C313-C320 CovalentContact SG-SG 2.03Å; C313-C320 PolarHBondContact SG-SG 3.24Å
314	N	87.5	Confident	82.5	Confident	141 Å²	141	68.9 Å²	68.9	75%	0.754	44%	0.443	S	S	*	.			trans	-129.2	10.7	-176.5	65.4	-9.2	0	0	0	113.6	F303	F303-N314 WeakPolarHBondContact CE2-O 3.33Å
315	K	82.6	Confident	82.1	Confident	160 Å²	160	73.5 Å²	73.5	70%	0.696	46%	0.463	S	S	*	.	S	Bend	trans	-143.8	139.5	-179	-170.9	175.9	-177.7	178.2	0	110.1	C320	K315-C320 WeakPolarHBondContact O-CB 3.43Å; K315-C320 PolarHBondContact O-SG 3.38Å
316	S	76.9	Confident	81.5	Confident	68 Å²	68	78.4 Å²	78.4	48%	0.476	49%	0.489	S	S	.	.			trans	-61.2	135.4	178	61.2	0	0	0	0	111.8
317	G	77	Confident	81.2	Confident	38 Å²	38	79 Å²	79	39%	0.392	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-178.6	-178.9	177.2	0	0	0	0	0	112.4	A319 C320	G317-A319 PolarHBondContact O-N 3.19Å; G317-C320 PolarHBondContact N-O 2.95Å; G317-C320 CarbonylContact O-C 3.42Å; G317-C320 PolarHBondContact O-N 2.69Å
318	P	74.6	Confident	80.8	Confident	143 Å²	143	80.1 Å²	80.1	93%	0.929	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-35.7	-177.7	-22.8	32	0	0	0	113.4
319	A	79.1	Confident	80.6	Confident	75 Å²	75	77.3 Å²	77.3	62%	0.62	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.9	178.4	0	0	0	0	0	113.8	A306 G317	A306-A319 PolarHBondContact N-O 2.95Å; G317-A319 PolarHBondContact O-N 3.19Å
320	C	81	Confident	80.5	Confident	11 Å²	11	80.7 Å²	80.7	7%	0.074	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	114	-169.7	-166.3	0	0	0	0	112.3	A304 C313 K315 G317	A304-C320 CarbonylContact O-C 3.58Å; C313-C320 HydrophobicContact CB-CB 3.65Å; C313-C320 WeakPolarHBondContact CB-SG 3.22Å; C313-C320 WeakPolarHBondContact SG-CB 3.22Å; C313-C320 CovalentContact SG-SG 2.03Å; C313-C320 PolarHBondContact SG-SG 3.24Å; K315-C320 WeakPolarHBondContact O-CB 3.43Å; K315-C320 PolarHBondContact O-SG 3.38Å; G317-C320 PolarHBondContact N-O 2.95Å; G317-C320 CarbonylContact O-C 3.42Å; G317-C320 PolarHBondContact O-N 2.69Å
321	C	81.8	Confident	80.3	Confident	18 Å²	18	79.8 Å²	79.8	12%	0.122	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.3	169.2	-71.2	0	0	0	0	111.4	C277 W281 F303 A304	C277-C321 VanDerWaalsContact CA-SG 3.6Å; C277-C321 HydrophobicContact CB-CB 3.76Å; C277-C321 WeakPolarHBondContact CB-SG 3.47Å; C277-C321 WeakPolarHBondContact SG-CB 3.42Å; C277-C321 CovalentContact SG-SG 2.01Å; C277-C321 PolarHBondContact SG-SG 2.87Å; W281-C321 HydrophobicContact CH2-CB 3.85Å; W281-C321 HydrophobicContact CZ2-CB 4.48Å; W281-C321 HydrophobicContact CZ3-CB 4.4Å; F303-C321 VanDerWaalsContact CA-O 3.29Å; F303-C321 WeakPolarHBondContact CA-O 3.45Å; A304-C321 HydrophobicContact CB-CB 4.44Å; A304-C321 PolarHBondContact N-O 3.39Å; A304-C321 WeakPolarHBondContact O-CB 3.34Å; A304-C321 PolarHBondContact O-N 3.47Å
322	V	82.6	Confident	80.3	Confident	18 Å²	18	77.8 Å²	77.8	11%	0.109	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.6	168.1	61.1	0	0	0	0	108.8	E301 F303 R324	E301-V322 HydrophobicContact CB-CG2 4.31Å; F303-V322 HydrophobicContact CD1-CB 4.04Å; F303-V322 HydrophobicContact CD1-CG2 4.13Å; F303-V322 HydrophobicContact CE1-CB 3.86Å; F303-V322 HydrophobicContact CE1-CG2 3.63Å; F303-V322 HydrophobicContact CZ-CG2 4.17Å; V322-R324 HydrophobicContact CG2-CG 4.18Å
323	A	80.1	Confident	80	Confident	13 Å²	13	73.7 Å²	73.7	11%	0.107	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	132.6	163.6	0	0	0	0	0	107.7	W281 W284 E301 R302	W281-A323 HydrophobicContact CE3-CB 4.17Å; W281-A323 HydrophobicContact CH2-CB 3.45Å; W281-A323 VanDerWaalsContact CH2-CB 3.45Å; W281-A323 HydrophobicContact CZ2-CB 4.16Å; W281-A323 HydrophobicContact CZ3-CB 3.46Å; W281-A323 VanDerWaalsContact CZ3-CB 3.46Å; W284-A323 HydrophobicContact CH2-CB 4.18Å; W284-A323 VanDerWaalsContact CZ3-O 3.26Å; W284-A323 WeakPolarHBondContact CZ3-O 3.25Å; E301-A323 WeakPolarHBondContact CA-O 3.21Å; R302-A323 HydrophobicContact CG-CB 3.89Å; R302-A323 PolarHBondContact N-O 2.89Å; R302-A323 PolarHBondContact O-N 2.73Å
324	R	79.9	Confident	80	Confident	109 Å²	109	74 Å²	74	41%	0.411	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	135.8	175.3	-64.3	-174.9	168.8	97.7	8.5	108.6	T299 R300 E301 V322	T299-R324 HydrophobicContact CG2-CB 3.96Å; T299-R324 HydrophobicContact CG2-CG 3.99Å; R300-R324 WeakPolarHBondContact O-CA 3.46Å; E301-R324 HydrophobicContact CG-CG 4.22Å; E301-R324 IonicContact OE1-CZ 2.65Å; E301-R324 VanDerWaalsContact OE1-CZ 3.23Å; E301-R324 IonicContact OE1-NE 2.94Å; E301-R324 PolarHBondContact OE1-NE 2.85Å; E301-R324 IonicContact OE1-NH2 3.01Å; E301-R324 PolarHBondContact OE1-NH2 3.43Å; V322-R324 HydrophobicContact CG2-CG 4.18Å
325	K	79	Confident	80	Confident	97 Å²	97	67.5 Å²	67.5	42%	0.422	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.2	165.1	179	-177.3	175.9	-170.5	0	106.7	W284 R300 M327	W284-K325 HydrophobicContact CE3-CB 4.48Å; W284-K325 HydrophobicContact CH2-CB 3.48Å; W284-K325 VanDerWaalsContact CH2-CB 3.48Å; W284-K325 HydrophobicContact CZ2-CB 4Å; W284-K325 HydrophobicContact CZ3-CB 3.76Å; R300-K325 PolarHBondContact N-O 2.88Å; R300-K325 PolarHBondContact O-N 3.32Å; K325-M327 HydrophobicContact CD-CG 4.45Å; K325-M327 HydrophobicContact CG-CG 4.47Å
326	L	74.7	Confident	80.3	Confident	110 Å²	110	60.7 Å²	60.7	58%	0.576	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	124.7	168.1	-68.8	90.8	0	0	0	107.2	T297 I298	T297-L326 HydrophobicContact CG2-CB 3.66Å; T297-L326 HydrophobicContact CG2-CD2 3.59Å; T297-L326 HydrophobicContact CG2-CG 4.03Å; I298-L326 WeakPolarHBondContact O-CA 3.28Å
327	M	76.4	Confident	80.8	Confident	41 Å²	41	57.8 Å²	57.8	20%	0.202	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.2	167.7	-67.2	179.8	59.4	0	0	106.6	T297 I298 R300 K325	T297-M327 WeakPolarHBondContact CA-O 3.37Å; I298-M327 HydrophobicContact CD1-CB 4.28Å; I298-M327 HydrophobicContact CD1-SD 4.5Å; I298-M327 HydrophobicContact CG1-CB 3.72Å; I298-M327 PolarHBondContact N-O 3.08Å; I298-M327 PolarHBondContact O-N 2.83Å; R300-M327 WeakPolarHBondContact CD-SD 3.41Å; R300-M327 HydrophobicContact CG-SD 3.86Å; K325-M327 HydrophobicContact CD-CG 4.45Å; K325-M327 HydrophobicContact CG-CG 4.47Å
328	K	73.9	Confident	81.1	Confident	165 Å²	165	58.7 Å²	58.7	72%	0.717	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.7	125	178.3	-172.3	175.5	-177.1	179.1	0	109
329	Y	78.8	Confident	81.4	Confident	41 Å²	41	59.8 Å²	59.8	16%	0.161	32%	0.322	C	S	.	.			trans	-91.7	148.8	166.1	-64.4	-74.9	0	0	0	109.3	R294 D296 I298 D331	R294-Y329 HydrophobicContact CB-CD1 3.87Å; R294-Y329 HydrophobicContact CB-CD2 3.95Å; R294-Y329 HydrophobicContact CB-CE1 3.79Å; R294-Y329 HydrophobicContact CB-CE2 3.82Å; R294-Y329 HydrophobicContact CB-CG 3.96Å; R294-Y329 WeakPolarHBondContact CD-OH 3.34Å; R294-Y329 HydrophobicContact CG-CE1 4.11Å; R294-Y329 HydrophobicContact CG-CE2 4.15Å; D296-Y329 PolarHBondContact O-N 2.87Å; I298-Y329 HydrophobicContact CB-CE2 4.36Å; I298-Y329 HydrophobicContact CD1-CE2 3.62Å; I298-Y329 WeakPolarHBondContact CD1-OH 3.41Å; I298-Y329 HydrophobicContact CG1-CD2 4.5Å; I298-Y329 HydrophobicContact CG1-CE2 3.66Å; I298-Y329 HydrophobicContact CG2-CD2 4.29Å; I298-Y329 HydrophobicContact CG2-CE2 3.85Å; Y329-D331 PolarHBondContact O-N 3.42Å
330	N	79.8	Confident	81.8	Confident	151 Å²	151	58.3 Å²	58.3	81%	0.807	31%	0.306	S	S	*	.	S	Bend	trans	-70.7	-21	179.9	-78.6	-6.3	0	0	0	112.9	R345	N330-R345 PolarHBondContact O-NH2 3.32Å
331	D	83.1	Confident	81.9	Confident	28 Å²	28	60.6 Å²	60.6	15%	0.15	32%	0.319	C	S	.	.	S	Bend	trans	-87.4	132.9	-177.9	-60.2	-26.3	0	0	0	110	C295 D296 Y329 F336 K346	C295-D331 CarbonylContact C-O 3.37Å; C295-D331 WeakPolarHBondContact CA-O 3.42Å; D296-D331 PolarHBondContact N-O 3.38Å; Y329-D331 PolarHBondContact O-N 3.42Å; D331-F336 HydrophobicContact CB-CE2 3.88Å; D331-F336 HydrophobicContact CB-CZ 4.33Å; D331-K346 WeakPolarHBondContact OD1-CE 3.5Å; D331-K346 IonicContact OD1-NZ 3.74Å; D331-K346 PolarHBondContact OD1-NZ 2.97Å; D331-K346 IonicContact OD2-NZ 2.77Å; D331-K346 PolarHBondContact OD2-NZ 3.44Å
332	S	84.3	Confident	82.3	Confident	40 Å²	40	61.3 Å²	61.3	28%	0.28	32%	0.321	S	S	.	.			trans	-80.1	144	172.1	178.3	0	0	0	0	109.4	T334 D335 F336	S332-T334 PolarHBondContact O-N 2.91Å; S332-T334 VanDerWaalsContact O-N 3.17Å; S332-T334 PolarHBondContact OG-N 3.36Å; S332-T334 PolarHBondContact OG-OG1 3.05Å; S332-D335 PolarHBondContact N-OD2 3.27Å; S332-D335 WeakPolarHBondContact O-CB 3.15Å; S332-D335 PolarHBondContact O-N 3.14Å; S332-F336 WeakPolarHBondContact O-CD2 3.39Å
333	C	82.4	Confident	82.6	Confident	44 Å²	44	60.8 Å²	60.8	30%	0.297	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-60.6	-27.2	173.5	-61.7	0	0	0	0	112.2	C295 D335 F336	C295-C333 VanDerWaalsContact CB-CA 3.49Å; C295-C333 HydrophobicContact CB-CB 3.86Å; C295-C333 WeakPolarHBondContact CB-SG 3.43Å; C295-C333 WeakPolarHBondContact SG-CA 3.46Å; C295-C333 WeakPolarHBondContact SG-CB 3.18Å; C295-C333 CovalentContact SG-SG 2.04Å; C295-C333 PolarHBondContact SG-SG 3.47Å; C333-D335 PolarHBondContact O-N 3Å; C333-F336 PolarHBondContact O-N 2.69Å
334	T	84.8	Confident	83.1	Confident	42 Å²	42	60.2 Å²	60.2	26%	0.258	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-74.2	-9.3	174.2	68.3	0	0	0	0	113.8	S332 F336 R357 G361 H362 L363	S332-T334 PolarHBondContact O-N 2.91Å; S332-T334 VanDerWaalsContact O-N 3.17Å; S332-T334 PolarHBondContact OG-N 3.36Å; S332-T334 PolarHBondContact OG-OG1 3.05Å; T334-F336 VanDerWaalsContact C-N 3.28Å; T334-R357 PolarHBondContact OG1-NH1 2.95Å; T334-G361 WeakPolarHBondContact CB-O 3.35Å; T334-H362 CarbonylContact O-C 3.5Å; T334-H362 WeakPolarHBondContact O-CA 3.12Å; T334-L363 WeakPolarHBondContact O-CG 3.4Å; T334-L363 PolarHBondContact O-N 2.81Å
335	D	87.7	Confident	83.5	Confident	6 Å²	6	61.5 Å²	61.5	3%	0.032	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-76.9	-19.2	173	-61.3	-30.8	0	0	0	112.6	S332 C333 L344 R345 L363	S332-D335 PolarHBondContact N-OD2 3.27Å; S332-D335 WeakPolarHBondContact O-CB 3.15Å; S332-D335 PolarHBondContact O-N 3.14Å; C333-D335 PolarHBondContact O-N 3Å; D335-L344 PolarHBondContact O-N 2.82Å; D335-R345 HydrophobicContact CB-CB 3.82Å; D335-R345 PolarHBondContact O-N 2.91Å; D335-R345 WeakPolarHBondContact OD1-CD 3.15Å; D335-R345 IonicContact OD1-CZ 3.35Å; D335-R345 IonicContact OD1-NE 3.23Å; D335-R345 PolarHBondContact OD1-NE 3.42Å; D335-R345 IonicContact OD2-CZ 3.58Å; D335-R345 IonicContact OD2-NE 2.8Å; D335-R345 PolarHBondContact OD2-NE 2.73Å; D335-R345 IonicContact OD2-NH2 2.93Å; D335-R345 PolarHBondContact OD2-NH2 2.71Å; D335-L363 HydrophobicContact CB-CD1 4.41Å
336	F	89	Confident	84	Confident	16 Å²	16	63.5 Å²	63.5	7%	0.07	33%	0.327	C	S	.	.	B	Isolated β-bridge	trans	-86.7	145.9	179.6	-66.7	-103.8	0	0	0	110	H292 C295 D331 S332 C333 T334 I342 N343 H362	H292-F336 WeakPolarHBondContact O-CE1 3.39Å; C295-F336 HydrophobicContact CB-CD2 4.08Å; C295-F336 HydrophobicContact CB-CE2 3.65Å; C295-F336 HydrophobicContact CB-CZ 4.46Å; D331-F336 HydrophobicContact CB-CE2 3.88Å; D331-F336 HydrophobicContact CB-CZ 4.33Å; S332-F336 WeakPolarHBondContact O-CD2 3.39Å; C333-F336 PolarHBondContact O-N 2.69Å; T334-F336 VanDerWaalsContact C-N 3.28Å; F336-I342 CarbonylContact C-O 3.54Å; F336-I342 WeakPolarHBondContact CA-O 3.32Å; F336-N343 HydrophobicContact CD1-CB 3.94Å; F336-N343 HydrophobicContact CE1-CB 3.7Å; F336-N343 HydrophobicContact CE2-CB 4.34Å; F336-N343 HydrophobicContact CG-CB 4.38Å; F336-N343 HydrophobicContact CZ-CB 3.92Å; F336-H362 WeakPolarHBondContact O-CB 3.37Å
337	A	87.9	Confident	84.7	Confident	8 Å²	8	63.2 Å²	63.2	7%	0.066	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-63.3	137.2	168.1	0	0	0	0	0	110	N339 T340 I342 L344 L363 I374	A337-N339 PolarHBondContact O-N 3.09Å; A337-T340 HydrophobicContact CB-CG2 4.34Å; A337-T340 VanDerWaalsContact CB-OG1 3.25Å; A337-T340 WeakPolarHBondContact CB-OG1 3.5Å; A337-T340 PolarHBondContact O-N 3.11Å; A337-T340 PolarHBondContact O-OG1 2.71Å; A337-I342 PolarHBondContact N-O 3Å; A337-L344 HydrophobicContact CB-CD1 3.81Å; A337-L344 HydrophobicContact CB-CG 4.1Å; A337-L363 WeakPolarHBondContact CA-O 3Å; A337-I374 HydrophobicContact CB-CG2 3.57Å
338	S	82.9	Confident	85.5	Confident	57 Å²	57	62.1 Å²	62.1	40%	0.399	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.4	129.7	-174.5	171.7	0	0	0	0	111.9	T340 D358	S338-T340 WeakPolarHBondContact O-CG2 3.15Å; S338-T340 PolarHBondContact O-N 2.86Å; S338-D358 WeakPolarHBondContact CB-OD2 3.4Å
339	N	81.5	Confident	86.2	Confident	166 Å²	166	55.6 Å²	55.6	89%	0.888	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	29	179.5	-161.1	37.5	0	0	0	114.3	A337	A337-N339 PolarHBondContact O-N 3.09Å
340	T	85.5	Confident	86.9	Confident	44 Å²	44	56.9 Å²	56.9	27%	0.27	31%	0.306	S	S	.	.	S	Bend	trans	-135	167.3	176.9	75.9	0	0	0	0	111	A337 S338 I342 I374	A337-T340 HydrophobicContact CB-CG2 4.34Å; A337-T340 VanDerWaalsContact CB-OG1 3.25Å; A337-T340 WeakPolarHBondContact CB-OG1 3.5Å; A337-T340 PolarHBondContact O-N 3.11Å; A337-T340 PolarHBondContact O-OG1 2.71Å; S338-T340 WeakPolarHBondContact O-CG2 3.15Å; S338-T340 PolarHBondContact O-N 2.86Å; T340-I342 VanDerWaalsContact C-N 3.33Å; T340-I342 PolarHBondContact OG1-N 2.83Å; T340-I374 HydrophobicContact CG2-CD1 3.8Å
341	T	84.9	Confident	87.4	Confident	58 Å²	58	53 Å²	53	36%	0.356	29%	0.285	S	S	.	.	S	Bend	trans	-92.5	7.4	173.9	48.6	0	0	0	0	113	H292 N343	H292-T341 HydrophobicContact CB-CG2 3.49Å; H292-T341 VanDerWaalsContact CB-CG2 3.49Å; T341-N343 PolarHBondContact O-N 3.37Å
342	I	88.5	Confident	87.5	Confident	33 Å²	33	59.1 Å²	59.1	17%	0.169	32%	0.318	C	S	.	.			trans	-87.2	106.6	-173.8	-63.6	172	0	0	0	109.4	F336 A337 T340 L344 I374 Q375	F336-I342 CarbonylContact C-O 3.54Å; F336-I342 WeakPolarHBondContact CA-O 3.32Å; A337-I342 PolarHBondContact N-O 3Å; T340-I342 VanDerWaalsContact C-N 3.33Å; T340-I342 PolarHBondContact OG1-N 2.83Å; I342-L344 HydrophobicContact CG2-CD2 3.72Å; I342-L344 HydrophobicContact CG2-CG 4.18Å; I342-L344 PolarHBondContact O-N 3.46Å; I342-L344 VanDerWaalsContact O-N 3.17Å; I342-I374 HydrophobicContact CD1-CB 4.13Å; I342-I374 HydrophobicContact CD1-CD1 3.99Å; I342-I374 HydrophobicContact CD1-CG2 3.78Å; I342-I374 HydrophobicContact CG2-CG2 4.42Å; I342-Q375 HydrophobicContact CG2-CG 3.97Å
343	N	89.2	Confident	87.5	Confident	8 Å²	8	58 Å²	58	4%	0.043	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-78.8	94.3	173	-172.1	-46.3	0	0	0	110.1	F336 T341 R345 K346 Q347	F336-N343 HydrophobicContact CD1-CB 3.94Å; F336-N343 HydrophobicContact CE1-CB 3.7Å; F336-N343 HydrophobicContact CE2-CB 4.34Å; F336-N343 HydrophobicContact CG-CB 4.38Å; F336-N343 HydrophobicContact CZ-CB 3.92Å; T341-N343 PolarHBondContact O-N 3.37Å; N343-R345 PolarHBondContact O-N 3.41Å; N343-R345 WeakPolarHBondContact OD1-CB 3.07Å; N343-R345 PolarHBondContact OD1-N 3.46Å; N343-R345 VanDerWaalsContact OD1-N 3.17Å; N343-K346 HydrophobicContact CB-CB 4.4Å; N343-K346 PolarHBondContact O-N 3.27Å; N343-K346 PolarHBondContact OD1-N 3.03Å; N343-Q347 WeakPolarHBondContact O-CB 3.24Å; N343-Q347 WeakPolarHBondContact O-CG 3.37Å; N343-Q347 PolarHBondContact O-N 3.34Å
344	L	90.7	Very high	87.5	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-67.7	-22.8	-178.1	-71.4	-179.1	0	0	0	113.3	D335 A337 I342 K346 G348 L363 Q375	D335-L344 PolarHBondContact O-N 2.82Å; A337-L344 HydrophobicContact CB-CD1 3.81Å; A337-L344 HydrophobicContact CB-CG 4.1Å; I342-L344 HydrophobicContact CG2-CD2 3.72Å; I342-L344 HydrophobicContact CG2-CG 4.18Å; I342-L344 PolarHBondContact O-N 3.46Å; I342-L344 VanDerWaalsContact O-N 3.17Å; L344-K346 VanDerWaalsContact C-N 3.3Å; L344-K346 PolarHBondContact O-N 2.97Å; L344-G348 VanDerWaalsContact O-CA 3.26Å; L344-G348 WeakPolarHBondContact O-CA 3.34Å; L344-G348 PolarHBondContact O-N 2.92Å; L344-L363 HydrophobicContact CB-CB 3.87Å; L344-L363 HydrophobicContact CB-CD1 4.14Å; L344-L363 HydrophobicContact CD1-CB 3.99Å; L344-L363 WeakPolarHBondContact CD1-O 3.42Å; L344-Q375 HydrophobicContact CD2-CG 3.73Å
345	R	88.4	Confident	87.4	Confident	136 Å²	136	62.1 Å²	62.1	51%	0.513	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-35.6	173.7	-174.9	163.5	66.8	149.1	-3.4	111.8	N330 D335 N343 L363	N330-R345 PolarHBondContact O-NH2 3.32Å; D335-R345 HydrophobicContact CB-CB 3.82Å; D335-R345 PolarHBondContact O-N 2.91Å; D335-R345 WeakPolarHBondContact OD1-CD 3.15Å; D335-R345 IonicContact OD1-CZ 3.35Å; D335-R345 IonicContact OD1-NE 3.23Å; D335-R345 PolarHBondContact OD1-NE 3.42Å; D335-R345 IonicContact OD2-CZ 3.58Å; D335-R345 IonicContact OD2-NE 2.8Å; D335-R345 PolarHBondContact OD2-NE 2.73Å; D335-R345 IonicContact OD2-NH2 2.93Å; D335-R345 PolarHBondContact OD2-NH2 2.71Å; N343-R345 PolarHBondContact O-N 3.41Å; N343-R345 WeakPolarHBondContact OD1-CB 3.07Å; N343-R345 PolarHBondContact OD1-N 3.46Å; N343-R345 VanDerWaalsContact OD1-N 3.17Å; R345-L363 HydrophobicContact CB-CD1 3.81Å
346	K	90.1	Very high	87.2	Confident	140 Å²	140	63.3 Å²	63.3	61%	0.609	34%	0.343	S	S	*	.	H	α-helix	trans	-88.3	-44.7	178.7	-72.9	178.7	174	169.7	0	112.7	D331 N343 L344	D331-K346 WeakPolarHBondContact OD1-CE 3.5Å; D331-K346 IonicContact OD1-NZ 3.74Å; D331-K346 PolarHBondContact OD1-NZ 2.97Å; D331-K346 IonicContact OD2-NZ 2.77Å; D331-K346 PolarHBondContact OD2-NZ 3.44Å; N343-K346 HydrophobicContact CB-CB 4.4Å; N343-K346 PolarHBondContact O-N 3.27Å; N343-K346 PolarHBondContact OD1-N 3.03Å; L344-K346 VanDerWaalsContact C-N 3.3Å; L344-K346 PolarHBondContact O-N 2.97Å
347	Q	90	Very high	86.7	Confident	104 Å²	104	69 Å²	69	49%	0.486	36%	0.364	S	S	.	.	H	α-helix	trans	-85.3	-24.3	-173.1	-61.1	-177.5	9.8	0	0	112.6	N343	N343-Q347 WeakPolarHBondContact O-CB 3.24Å; N343-Q347 WeakPolarHBondContact O-CG 3.37Å; N343-Q347 PolarHBondContact O-N 3.34Å
348	G	91.5	Very high	86	Confident	18 Å²	18	70.3 Å²	70.3	19%	0.186	37%	0.37	C	S	.	.			trans	68	-169.5	-176.6	0	0	0	0	0	113.4	L344 Q375	L344-G348 VanDerWaalsContact O-CA 3.26Å; L344-G348 WeakPolarHBondContact O-CA 3.34Å; L344-G348 PolarHBondContact O-N 2.92Å; G348-Q375 PolarHBondContact O-NE2 3.45Å
349	C	90.4	Very high	85.2	Confident	27 Å²	27	70.9 Å²	70.9	18%	0.182	37%	0.374	C	S	.	.			trans	-110.2	143.2	174.7	-54.3	0	0	0	0	109.3	G353 C365	C349-G353 WeakPolarHBondContact CB-O 3.02Å; C349-C365 VanDerWaalsContact CA-SG 3.51Å; C349-C365 HydrophobicContact CB-CB 3.81Å; C349-C365 WeakPolarHBondContact CB-SG 3.22Å; C349-C365 WeakPolarHBondContact SG-CA 3.32Å; C349-C365 WeakPolarHBondContact SG-CB 3.22Å; C349-C365 CovalentContact SG-SG 2.03Å; C349-C365 PolarHBondContact SG-SG 2.87Å
350	N	92.8	Very high	84.6	Confident	69 Å²	69	68.8 Å²	68.8	37%	0.369	36%	0.359	S	S	.	.	S	Bend	trans	-83	170.7	175.2	-62.8	-36.1	0	0	0	111.1	N352 G353 Q375	N350-N352 VanDerWaalsContact C-N 3.33Å; N350-N352 PolarHBondContact O-N 2.84Å; N350-N352 VanDerWaalsContact O-N 3.15Å; N350-G353 PolarHBondContact O-N 3.19Å; N350-Q375 WeakPolarHBondContact CA-O 3.48Å; N350-Q375 WeakPolarHBondContact CB-O 3.11Å; N350-Q375 PolarHBondContact N-O 3.32Å
351	N	90	Very high	84.1	Confident	69 Å²	69	66.9 Å²	66.9	37%	0.369	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.5	42.5	167.5	-63	-40.7	0	0	0	115.2	G353 P368 Y371 C376	N351-G353 PolarHBondContact O-N 3.06Å; N351-P368 WeakPolarHBondContact O-CG 3.44Å; N351-Y371 HydrophobicContact CB-CD1 3.64Å; N351-Y371 HydrophobicContact CB-CD2 3.66Å; N351-Y371 HydrophobicContact CB-CE1 3.63Å; N351-Y371 HydrophobicContact CB-CE2 3.66Å; N351-Y371 HydrophobicContact CB-CG 3.65Å; N351-Y371 WeakPolarHBondContact ND2-CD1 3.3Å; N351-Y371 VanDerWaalsContact ND2-CE1 3.31Å; N351-Y371 WeakPolarHBondContact ND2-CE1 3.4Å; N351-C376 PolarHBondContact ND2-O 3.49Å
352	N	85.3	Confident	84	Confident	157 Å²	157	66.5 Å²	66.5	84%	0.84	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	20.6	-174.8	-69.2	-11	0	0	0	115.1	N350	N350-N352 VanDerWaalsContact C-N 3.33Å; N350-N352 PolarHBondContact O-N 2.84Å; N350-N352 VanDerWaalsContact O-N 3.15Å
353	G	84	Confident	83.9	Confident	15 Å²	15	65.5 Å²	65.5	16%	0.155	34%	0.337	C	S	.	.			trans	-60	148.5	168.2	0	0	0	0	0	111.8	C349 N350 N351 V366	C349-G353 WeakPolarHBondContact CB-O 3.02Å; N350-G353 PolarHBondContact O-N 3.19Å; N351-G353 PolarHBondContact O-N 3.06Å; G353-V366 WeakPolarHBondContact CA-O 3.04Å
354	T	81.8	Confident	83.7	Confident	88 Å²	88	69.8 Å²	69.8	54%	0.54	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	145.6	178.6	57	0	0	0	0	111.2	C365 V366	T354-C365 CarbonylContact O-C 3.48Å; T354-C365 WeakPolarHBondContact O-CA 3.35Å; T354-V366 PolarHBondContact N-O 3.22Å; T354-V366 PolarHBondContact O-N 2.75Å
355	I	84.5	Confident	83.5	Confident	85 Å²	85	70.7 Å²	70.7	44%	0.436	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.1	178.2	-63.4	175.5	0	0	0	109.1	L363	I355-L363 HydrophobicContact CG2-CB 4.32Å; I355-L363 HydrophobicContact CG2-CD1 3.96Å; I355-L363 HydrophobicContact CG2-CD2 3.61Å; I355-L363 HydrophobicContact CG2-CG 4.15Å
356	A	81.6	Confident	83.1	Confident	32 Å²	32	67.4 Å²	67.4	26%	0.264	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	-177	170.2	0	0	0	0	0	110.7	L363 K364 V366	A356-L363 CarbonylContact O-C 3.42Å; A356-L363 VanDerWaalsContact O-CA 3.3Å; A356-L363 WeakPolarHBondContact O-CA 3.48Å; A356-K364 HydrophobicContact CB-CG 4.23Å; A356-K364 PolarHBondContact N-O 2.95Å; A356-K364 PolarHBondContact O-N 2.86Å; A356-V366 HydrophobicContact CB-CG2 3.53Å
357	R	79.7	Confident	82.6	Confident	135 Å²	135	62.4 Å²	62.4	51%	0.509	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	145.7	170.2	-70.7	-177.4	-173.8	-87.5	-1.1	111.2	T334 G361 H362 L363	T334-R357 PolarHBondContact OG1-NH1 2.95Å; R357-G361 PolarHBondContact NH1-O 3.44Å; R357-H362 CarbonylContact C-O 3.46Å; R357-H362 WeakPolarHBondContact CA-O 3.08Å; R357-L363 HydrophobicContact CG-CD2 3.9Å
358	D	72.5	Confident	81.9	Confident	35 Å²	35	59.8 Å²	59.8	19%	0.187	33%	0.331	C	S	.	.			trans	-79.1	179.9	169.4	77.4	2.5	0	0	0	111.9	S338 H360 G361 H362 K364	S338-D358 WeakPolarHBondContact CB-OD2 3.4Å; D358-H360 PolarHBondContact O-N 2.82Å; D358-H360 WeakPolarHBondContact OD1-CA 3.38Å; D358-H360 WeakPolarHBondContact OD1-CB 3.32Å; D358-H360 PolarHBondContact OD1-N 2.03Å; D358-H360 IonicContact OD2-ND1 3.23Å; D358-G361 PolarHBondContact O-N 2.82Å; D358-G361 VanDerWaalsContact O-N 3.17Å; D358-G361 PolarHBondContact OD1-N 2.83Å; D358-H362 PolarHBondContact N-O 2.75Å; D358-H362 PolarHBondContact OD1-N 2.92Å; D358-H362 IonicContact OD1-ND1 2.76Å; D358-H362 IonicContact OD2-CG 2.72Å; D358-H362 IonicContact OD2-ND1 2.89Å; D358-K364 HydrophobicContact CB-CD 4.17Å
359	S	65.4	Low	80.9	Confident	69 Å²	69	64.4 Å²	64.4	48%	0.483	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.4	179.1	56.9	0	0	0	0	114	A68	A68-S359 VanDerWaalsContact O-CB 3.3Å; A68-S359 WeakPolarHBondContact O-CB 3.46Å
360	H	70.6	Confident	80	Confident	122 Å²	122	68.7 Å²	68.7	57%	0.565	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	-11.3	178.3	-57	102.8	0	0	0	112.4	S255 D358	S255-H360 PolarHBondContact OG-O 3.36Å; D358-H360 PolarHBondContact O-N 2.82Å; D358-H360 WeakPolarHBondContact OD1-CA 3.38Å; D358-H360 WeakPolarHBondContact OD1-CB 3.32Å; D358-H360 PolarHBondContact OD1-N 2.03Å; D358-H360 IonicContact OD2-ND1 3.23Å
361	G	74.3	Confident	79.5	Confident	5 Å²	5	68 Å²	68	5%	0.052	36%	0.356	C	S	.	.	S	Bend	trans	100.6	-2.5	179.5	0	0	0	0	0	114.8	T334 R357 D358	T334-G361 WeakPolarHBondContact CB-O 3.35Å; R357-G361 PolarHBondContact NH1-O 3.44Å; D358-G361 PolarHBondContact O-N 2.82Å; D358-G361 VanDerWaalsContact O-N 3.17Å; D358-G361 PolarHBondContact OD1-N 2.83Å
362	H	82.4	Confident	79.3	Confident	49 Å²	49	67.7 Å²	67.7	23%	0.227	35%	0.354	C	S	.	.			trans	-67.6	147.3	175.9	-62	96.4	0	0	0	111	T334 F336 R357 D358	T334-H362 CarbonylContact O-C 3.5Å; T334-H362 WeakPolarHBondContact O-CA 3.12Å; F336-H362 WeakPolarHBondContact O-CB 3.37Å; R357-H362 CarbonylContact C-O 3.46Å; R357-H362 WeakPolarHBondContact CA-O 3.08Å; D358-H362 PolarHBondContact N-O 2.75Å; D358-H362 PolarHBondContact OD1-N 2.92Å; D358-H362 IonicContact OD1-ND1 2.76Å; D358-H362 IonicContact OD2-CG 2.72Å; D358-H362 IonicContact OD2-ND1 2.89Å
363	L	86.7	Confident	79.4	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	142.8	169.9	-67.6	-171.6	0	0	0	109.6	T334 D335 A337 L344 R345 I355 A356 R357	T334-L363 WeakPolarHBondContact O-CG 3.4Å; T334-L363 PolarHBondContact O-N 2.81Å; D335-L363 HydrophobicContact CB-CD1 4.41Å; A337-L363 WeakPolarHBondContact CA-O 3Å; L344-L363 HydrophobicContact CB-CB 3.87Å; L344-L363 HydrophobicContact CB-CD1 4.14Å; L344-L363 HydrophobicContact CD1-CB 3.99Å; L344-L363 WeakPolarHBondContact CD1-O 3.42Å; R345-L363 HydrophobicContact CB-CD1 3.81Å; I355-L363 HydrophobicContact CG2-CB 4.32Å; I355-L363 HydrophobicContact CG2-CD1 3.96Å; I355-L363 HydrophobicContact CG2-CD2 3.61Å; I355-L363 HydrophobicContact CG2-CG 4.15Å; A356-L363 CarbonylContact O-C 3.42Å; A356-L363 VanDerWaalsContact O-CA 3.3Å; A356-L363 WeakPolarHBondContact O-CA 3.48Å; R357-L363 HydrophobicContact CG-CD2 3.9Å
364	K	86	Confident	79.8	Confident	99 Å²	99	64.7 Å²	64.7	43%	0.43	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	150.1	169.2	67.8	172.6	-175.6	172.7	0	109.3	A356 D358	A356-K364 HydrophobicContact CB-CG 4.23Å; A356-K364 PolarHBondContact N-O 2.95Å; A356-K364 PolarHBondContact O-N 2.86Å; D358-K364 HydrophobicContact CB-CD 4.17Å
365	C	86.4	Confident	80.3	Confident	18 Å²	18	61.9 Å²	61.9	12%	0.122	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	135.4	168.2	-67.1	0	0	0	0	110.3	C349 T354 I374 C376	C349-C365 VanDerWaalsContact CA-SG 3.51Å; C349-C365 HydrophobicContact CB-CB 3.81Å; C349-C365 WeakPolarHBondContact CB-SG 3.22Å; C349-C365 WeakPolarHBondContact SG-CA 3.32Å; C349-C365 WeakPolarHBondContact SG-CB 3.22Å; C349-C365 CovalentContact SG-SG 2.03Å; C349-C365 PolarHBondContact SG-SG 2.87Å; T354-C365 CarbonylContact O-C 3.48Å; T354-C365 WeakPolarHBondContact O-CA 3.35Å; C365-I374 WeakPolarHBondContact CB-O 3.47Å; C365-I374 PolarHBondContact SG-O 2.9Å; C365-C376 VanDerWaalsContact CB-SG 3.54Å
366	V	79.5	Confident	80.7	Confident	68 Å²	68	57.9 Å²	57.9	41%	0.412	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	110.1	165.1	179.9	0	0	0	0	106.4	G353 T354 A356	G353-V366 WeakPolarHBondContact CA-O 3.04Å; T354-V366 PolarHBondContact N-O 3.22Å; T354-V366 PolarHBondContact O-N 2.75Å; A356-V366 HydrophobicContact CB-CG2 3.53Å
367	C	79.2	Confident	81.2	Confident	35 Å²	35	60.2 Å²	60.2	24%	0.236	31%	0.307	C	S	.	.			trans	-86.1	144.4	-176.2	-52.6	0	0	0	0	111.1	Y371 C376	C367-Y371 WeakPolarHBondContact CB-O 3.4Å; C367-C376 WeakPolarHBondContact CA-SG 3.39Å; C367-C376 HydrophobicContact CB-CB 3.64Å; C367-C376 WeakPolarHBondContact CB-SG 3.39Å; C367-C376 WeakPolarHBondContact SG-CA 3.37Å; C367-C376 WeakPolarHBondContact SG-CB 3.33Å; C367-C376 CovalentContact SG-SG 2.03Å; C367-C376 PolarHBondContact SG-SG 3.08Å
368	P	75.1	Confident	81.7	Confident	49 Å²	49	59 Å²	59	32%	0.318	31%	0.307	S	S	.	.			trans	-58.6	155.1	163.9	-17.5	30.5	0	0	0	110.2	N351 R370 Y371	N351-P368 WeakPolarHBondContact O-CG 3.44Å; P368-R370 PolarHBondContact O-N 2.03Å; P368-Y371 HydrophobicContact CB-CD2 4.17Å; P368-Y371 HydrophobicContact CG-CD2 4.1Å; P368-Y371 PolarHBondContact O-N 3.42Å
369	D	70.2	Confident	82.4	Confident	115 Å²	115	58.6 Å²	58.6	62%	0.615	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.7	-28.3	-174.5	-68.1	-33.1	0	0	0	114.6	P393	D369-P393 WeakPolarHBondContact O-CB 3.36Å
370	R	72.2	Confident	83.2	Confident	116 Å²	116	56 Å²	56	44%	0.438	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-19	179.8	-170.9	166.1	172	174.1	-5.1	115	P368 D379 V380 P393	P368-R370 PolarHBondContact O-N 2.03Å; R370-D379 VanDerWaalsContact CG-OD1 3.22Å; R370-D379 WeakPolarHBondContact CG-OD1 3.24Å; R370-D379 IonicContact CZ-OD2 2.87Å; R370-D379 VanDerWaalsContact CZ-OD2 3.25Å; R370-D379 IonicContact NE-OD1 3.96Å; R370-D379 PolarHBondContact NE-OD1 2.87Å; R370-D379 VanDerWaalsContact NE-OD1 3.13Å; R370-D379 IonicContact NE-OD2 3.34Å; R370-D379 PolarHBondContact NE-OD2 2.79Å; R370-D379 IonicContact NH2-OD2 2.73Å; R370-D379 PolarHBondContact NH2-OD2 3.38Å; R370-V380 WeakPolarHBondContact O-CB 3.33Å; R370-V380 WeakPolarHBondContact O-CG2 3.13Å; R370-V380 PolarHBondContact O-N 3.44Å; R370-P393 HydrophobicContact CB-CB 4.13Å; R370-P393 HydrophobicContact CB-CG 3.77Å; R370-P393 HydrophobicContact CG-CB 4.41Å; R370-P393 HydrophobicContact CG-CG 4.09Å
371	Y	82.9	Confident	83.6	Confident	54 Å²	54	50.9 Å²	50.9	21%	0.212	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	144.9	-171.2	-59.6	-80.4	0	0	0	112	N351 C367 P368 E378 D379	N351-Y371 HydrophobicContact CB-CD1 3.64Å; N351-Y371 HydrophobicContact CB-CD2 3.66Å; N351-Y371 HydrophobicContact CB-CE1 3.63Å; N351-Y371 HydrophobicContact CB-CE2 3.66Å; N351-Y371 HydrophobicContact CB-CG 3.65Å; N351-Y371 WeakPolarHBondContact ND2-CD1 3.3Å; N351-Y371 VanDerWaalsContact ND2-CE1 3.31Å; N351-Y371 WeakPolarHBondContact ND2-CE1 3.4Å; C367-Y371 WeakPolarHBondContact CB-O 3.4Å; P368-Y371 HydrophobicContact CB-CD2 4.17Å; P368-Y371 HydrophobicContact CG-CD2 4.1Å; P368-Y371 PolarHBondContact O-N 3.42Å; Y371-E378 CarbonylContact C-O 3.59Å; Y371-E378 WeakPolarHBondContact CA-O 3.23Å; Y371-D379 HydrophobicContact CD1-CB 3.99Å; Y371-D379 HydrophobicContact CE1-CB 3.82Å
372	I	84.3	Confident	84.1	Confident	63 Å²	63	58 Å²	58	32%	0.323	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	177.5	174.4	64.3	176	0	0	0	110.3	C376 E377 E378 V380	I372-C376 CarbonylContact O-C 3.33Å; I372-C376 VanDerWaalsContact O-C 3.27Å; I372-C376 VanDerWaalsContact O-CA 3.26Å; I372-C376 WeakPolarHBondContact O-CA 3.35Å; I372-E377 PolarHBondContact O-N 3.1Å; I372-E378 HydrophobicContact CG1-CB 3.72Å; I372-E378 PolarHBondContact N-O 3.12Å; I372-E378 PolarHBondContact O-N 3.29Å; I372-V380 HydrophobicContact CB-CG2 4.24Å; I372-V380 HydrophobicContact CD1-CG2 4.12Å; I372-V380 HydrophobicContact CG1-CG2 3.93Å; I372-V380 HydrophobicContact CG2-CG2 3.54Å
373	G	89	Confident	84	Confident	35 Å²	35	59.1 Å²	59.1	36%	0.361	32%	0.321	S	S	.	.	S	Bend	trans	105	172.5	-175.6	0	0	0	0	0	113.1	Q375 C376	G373-Q375 VanDerWaalsContact C-N 3.27Å; G373-Q375 PolarHBondContact O-N 2.79Å; G373-C376 PolarHBondContact O-N 3.02Å
374	I	91.1	Very high	83.8	Confident	74 Å²	74	60.6 Å²	60.6	38%	0.379	33%	0.33	S	S	.	.	S	Bend	trans	-69.8	-30.8	-175.8	-66.2	159	0	0	0	110.8	A337 T340 I342 C365 E377	A337-I374 HydrophobicContact CB-CG2 3.57Å; T340-I374 HydrophobicContact CG2-CD1 3.8Å; I342-I374 HydrophobicContact CD1-CB 4.13Å; I342-I374 HydrophobicContact CD1-CD1 3.99Å; I342-I374 HydrophobicContact CD1-CG2 3.78Å; I342-I374 HydrophobicContact CG2-CG2 4.42Å; C365-I374 WeakPolarHBondContact CB-O 3.47Å; C365-I374 PolarHBondContact SG-O 2.9Å; I374-E377 PolarHBondContact N-OE1 3.2Å; I374-E377 PolarHBondContact N-OE2 2.81Å
375	Q	93.2	Very high	83.5	Confident	30 Å²	30	56.9 Å²	56.9	14%	0.14	32%	0.317	C	S	.	.	S	Bend	trans	-114.2	13.6	177.6	-61.3	-172.2	-92.1	0	0	112.8	I342 L344 G348 N350 G373 E377	I342-Q375 HydrophobicContact CG2-CG 3.97Å; L344-Q375 HydrophobicContact CD2-CG 3.73Å; G348-Q375 PolarHBondContact O-NE2 3.45Å; N350-Q375 WeakPolarHBondContact CA-O 3.48Å; N350-Q375 WeakPolarHBondContact CB-O 3.11Å; N350-Q375 PolarHBondContact N-O 3.32Å; G373-Q375 VanDerWaalsContact C-N 3.27Å; G373-Q375 PolarHBondContact O-N 2.79Å; Q375-E377 VanDerWaalsContact C-N 3.27Å; Q375-E377 WeakPolarHBondContact CA-OE2 3.49Å; Q375-E377 WeakPolarHBondContact CB-OE2 3.35Å; Q375-E377 PolarHBondContact N-OE2 2.58Å; Q375-E377 PolarHBondContact O-N 2.94Å
376	C	91.3	Very high	83.5	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	33%	0.331	C	S	.	.	S	Bend	trans	62.1	32.8	-174.4	-44.4	0	0	0	0	113.6	N351 C365 C367 I372 G373	N351-C376 PolarHBondContact ND2-O 3.49Å; C365-C376 VanDerWaalsContact CB-SG 3.54Å; C367-C376 WeakPolarHBondContact CA-SG 3.39Å; C367-C376 HydrophobicContact CB-CB 3.64Å; C367-C376 WeakPolarHBondContact CB-SG 3.39Å; C367-C376 WeakPolarHBondContact SG-CA 3.37Å; C367-C376 WeakPolarHBondContact SG-CB 3.33Å; C367-C376 CovalentContact SG-SG 2.03Å; C367-C376 PolarHBondContact SG-SG 3.08Å; I372-C376 CarbonylContact O-C 3.33Å; I372-C376 VanDerWaalsContact O-C 3.27Å; I372-C376 VanDerWaalsContact O-CA 3.26Å; I372-C376 WeakPolarHBondContact O-CA 3.35Å; G373-C376 PolarHBondContact O-N 3.02Å
377	E	92.4	Very high	83.5	Confident	82 Å²	82	59.9 Å²	59.9	38%	0.383	33%	0.329	S	S	.	.			trans	-81.3	-21.4	-174.2	67	-78.3	-170.2	0	0	114.3	I372 I374 Q375	I372-E377 PolarHBondContact O-N 3.1Å; I374-E377 PolarHBondContact N-OE1 3.2Å; I374-E377 PolarHBondContact N-OE2 2.81Å; Q375-E377 VanDerWaalsContact C-N 3.27Å; Q375-E377 WeakPolarHBondContact CA-OE2 3.49Å; Q375-E377 WeakPolarHBondContact CB-OE2 3.35Å; Q375-E377 PolarHBondContact N-OE2 2.58Å; Q375-E377 PolarHBondContact O-N 2.94Å
378	E	90.4	Very high	83.2	Confident	108 Å²	108	61.1 Å²	61.1	51%	0.505	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	122.7	-177.2	-60.6	-179.3	178.7	0	0	110.1	Y371 I372	Y371-E378 CarbonylContact C-O 3.59Å; Y371-E378 WeakPolarHBondContact CA-O 3.23Å; I372-E378 HydrophobicContact CG1-CB 3.72Å; I372-E378 PolarHBondContact N-O 3.12Å; I372-E378 PolarHBondContact O-N 3.29Å
379	D	87.5	Confident	83.1	Confident	28 Å²	28	59.4 Å²	59.4	15%	0.15	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	118	169.7	-176.6	-12.2	0	0	0	109.1	R370 Y371 C381 E382	R370-D379 VanDerWaalsContact CG-OD1 3.22Å; R370-D379 WeakPolarHBondContact CG-OD1 3.24Å; R370-D379 IonicContact CZ-OD2 2.87Å; R370-D379 VanDerWaalsContact CZ-OD2 3.25Å; R370-D379 IonicContact NE-OD1 3.96Å; R370-D379 PolarHBondContact NE-OD1 2.87Å; R370-D379 VanDerWaalsContact NE-OD1 3.13Å; R370-D379 IonicContact NE-OD2 3.34Å; R370-D379 PolarHBondContact NE-OD2 2.79Å; R370-D379 IonicContact NH2-OD2 2.73Å; R370-D379 PolarHBondContact NH2-OD2 3.38Å; Y371-D379 HydrophobicContact CD1-CB 3.99Å; Y371-D379 HydrophobicContact CE1-CB 3.82Å; D379-C381 PolarHBondContact O-N 3.35Å; D379-C381 WeakPolarHBondContact OD1-CB 3.46Å; D379-C381 PolarHBondContact OD1-N 2.76Å; D379-E382 HydrophobicContact CB-CB 3.85Å; D379-E382 PolarHBondContact O-N 2.95Å
380	V	81.8	Confident	83.1	Confident	13 Å²	13	58.2 Å²	58.2	8%	0.079	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.5	-178.8	178.7	0	0	0	0	111.9	R370 I372 T384 G396 P398	R370-V380 WeakPolarHBondContact O-CB 3.33Å; R370-V380 WeakPolarHBondContact O-CG2 3.13Å; R370-V380 PolarHBondContact O-N 3.44Å; I372-V380 HydrophobicContact CB-CG2 4.24Å; I372-V380 HydrophobicContact CD1-CG2 4.12Å; I372-V380 HydrophobicContact CG1-CG2 3.93Å; I372-V380 HydrophobicContact CG2-CG2 3.54Å; V380-T384 PolarHBondContact O-OG1 2.83Å; V380-G396 WeakPolarHBondContact CG1-O 3.26Å; V380-G396 WeakPolarHBondContact CG2-O 3.32Å; V380-P398 HydrophobicContact CG1-CB 3.84Å; V380-P398 HydrophobicContact CG1-CG 3.92Å; V380-P398 WeakPolarHBondContact O-CB 3.43Å
381	C	79	Confident	83.1	Confident	16 Å²	16	54.2 Å²	54.2	11%	0.108	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-5.9	-176.6	-80.3	0	0	0	0	114.5	D379 G383 C391	D379-C381 PolarHBondContact O-N 3.35Å; D379-C381 WeakPolarHBondContact OD1-CB 3.46Å; D379-C381 PolarHBondContact OD1-N 2.76Å; C381-G383 PolarHBondContact O-N 3.35Å; C381-C391 WeakPolarHBondContact CA-SG 3.22Å; C381-C391 HydrophobicContact CB-CB 3.52Å; C381-C391 WeakPolarHBondContact CB-SG 3.23Å; C381-C391 WeakPolarHBondContact SG-CB 3.31Å; C381-C391 CovalentContact SG-SG 2.03Å; C381-C391 PolarHBondContact SG-SG 3.46Å
382	E	85.9	Confident	82.4	Confident	155 Å²	155	54.6 Å²	54.6	72%	0.724	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	118.2	-178.5	-174.8	169.5	-164.3	0	0	110.6	D379 T384	D379-E382 HydrophobicContact CB-CB 3.85Å; D379-E382 PolarHBondContact O-N 2.95Å; E382-T384 PolarHBondContact O-N 3.5Å; E382-T384 VanDerWaalsContact O-N 3.17Å
383	G	79.2	Confident	81.1	Confident	72 Å²	72	53.2 Å²	53.2	74%	0.742	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.9	4.1	178	0	0	0	0	0	115.8	C381	C381-G383 PolarHBondContact O-N 3.35Å
384	T	83.1	Confident	79.4	Confident	42 Å²	42	54 Å²	54	26%	0.258	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-49.4	-175.8	-35.6	0	0	0	0	113.2	V380 E382 P398 N410	V380-T384 PolarHBondContact O-OG1 2.83Å; E382-T384 PolarHBondContact O-N 3.5Å; E382-T384 VanDerWaalsContact O-N 3.17Å; T384-P398 HydrophobicContact CG2-CB 3.72Å; T384-P398 HydrophobicContact CG2-CG 3.44Å; T384-P398 VanDerWaalsContact CG2-CG 3.44Å; T384-N410 VanDerWaalsContact O-CB 3.29Å; T384-N410 WeakPolarHBondContact O-CB 3.44Å
385	C	80.5	Confident	77.7	Confident	22 Å²	22	58.8 Å²	58.8	15%	0.149	35%	0.345	C	S	.	.	S	Bend	trans	-92.2	118.5	-176.2	-52	0	0	0	0	110.9	C391 C400	C385-C391 HydrophobicContact CB-CB 4.39Å; C385-C391 WeakPolarHBondContact SG-CA 3.31Å; C385-C391 WeakPolarHBondContact SG-CB 3.22Å; C385-C400 WeakPolarHBondContact CA-SG 3.47Å; C385-C400 HydrophobicContact CB-CB 3.85Å; C385-C400 WeakPolarHBondContact CB-SG 3.47Å; C385-C400 WeakPolarHBondContact SG-CA 3.44Å; C385-C400 WeakPolarHBondContact SG-CB 3.35Å; C385-C400 CovalentContact SG-SG 2.03Å; C385-C400 PolarHBondContact SG-SG 2.85Å
386	L	85.2	Confident	76	Confident	78 Å²	78	58.3 Å²	58.3	41%	0.408	35%	0.347	S	S	.	.			trans	-90.8	172.5	-178.9	-57.3	-177.2	0	0	0	111.8	G388 G389 N410 C411	L386-G388 PolarHBondContact O-N 3.31Å; L386-G389 PolarHBondContact O-N 2.95Å; L386-N410 WeakPolarHBondContact CB-O 3.33Å; L386-N410 PolarHBondContact N-O 3.15Å; L386-C411 WeakPolarHBondContact O-CB 3.42Å
387	N	80.7	Confident	74.6	Confident	71 Å²	71	65.3 Å²	65.3	38%	0.38	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	30	172.8	-58.5	-37.5	0	0	0	115	F406 C411	N387-F406 HydrophobicContact CB-CD1 3.55Å; N387-F406 HydrophobicContact CB-CD2 4.08Å; N387-F406 HydrophobicContact CB-CE1 3.5Å; N387-F406 VanDerWaalsContact CB-CE1 3.5Å; N387-F406 HydrophobicContact CB-CE2 4.03Å; N387-F406 HydrophobicContact CB-CG 3.85Å; N387-F406 HydrophobicContact CB-CZ 3.75Å; N387-F406 VanDerWaalsContact CG-CE1 3.41Å; N387-F406 VanDerWaalsContact ND2-CD1 3.32Å; N387-F406 WeakPolarHBondContact ND2-CD1 3.36Å; N387-F406 WeakPolarHBondContact ND2-CE1 3.2Å; N387-C411 PolarHBondContact ND2-O 3.25Å
388	G	71.8	Confident	73.6	Confident	60 Å²	60	63.9 Å²	63.9	62%	0.619	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	20.2	-178.6	0	0	0	0	0	114.4	L386	L386-G388 PolarHBondContact O-N 3.31Å
389	G	73.4	Confident	72.6	Confident	14 Å²	14	63.9 Å²	63.9	14%	0.144	38%	0.378	C	S	.	.	P	Polyproline II helix	trans	-60.4	144.4	169.5	0	0	0	0	0	112	L386 F401	L386-G389 PolarHBondContact O-N 2.95Å; G389-F401 CarbonylContact C-O 3.55Å; G389-F401 VanDerWaalsContact CA-O 3.28Å; G389-F401 WeakPolarHBondContact CA-O 3.48Å
390	T	70.4	Confident	71.6	Confident	90 Å²	90	63.2 Å²	63.2	55%	0.552	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.2	176.4	-58.5	0	0	0	0	109.1	F401	T390-F401 PolarHBondContact N-O 2.9Å; T390-F401 PolarHBondContact O-N 3.26Å
391	C	72.3	Confident	70.7	Confident	31 Å²	31	68 Å²	68	21%	0.209	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	129.7	173.4	-168.7	0	0	0	0	110.9	C381 C385	C381-C391 WeakPolarHBondContact CA-SG 3.22Å; C381-C391 HydrophobicContact CB-CB 3.52Å; C381-C391 WeakPolarHBondContact CB-SG 3.23Å; C381-C391 WeakPolarHBondContact SG-CB 3.31Å; C381-C391 CovalentContact SG-SG 2.03Å; C381-C391 PolarHBondContact SG-SG 3.46Å; C385-C391 HydrophobicContact CB-CB 4.39Å; C385-C391 WeakPolarHBondContact SG-CA 3.31Å; C385-C391 WeakPolarHBondContact SG-CB 3.22Å
392	V	68.2	Low	70.1	Confident	63 Å²	63	69.3 Å²	69.3	38%	0.382	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	118.5	167.5	176.7	0	0	0	0	107.9	H399 F401	V392-H399 PolarHBondContact N-O 2.99Å; V392-H399 WeakPolarHBondContact O-CB 2.96Å; V392-H399 PolarHBondContact O-N 3.03Å; V392-F401 HydrophobicContact CB-CD2 4.33Å; V392-F401 HydrophobicContact CB-CE2 3.91Å; V392-F401 HydrophobicContact CG2-CD2 3.73Å; V392-F401 HydrophobicContact CG2-CE2 3.53Å
393	P	57	Low	69	Low	34 Å²	34	68.8 Å²	68.8	22%	0.221	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	130.7	175.9	29	-31.5	0	0	0	110.2	D369 R370	D369-P393 WeakPolarHBondContact O-CB 3.36Å; R370-P393 HydrophobicContact CB-CB 4.13Å; R370-P393 HydrophobicContact CB-CG 3.77Å; R370-P393 HydrophobicContact CG-CB 4.41Å; R370-P393 HydrophobicContact CG-CG 4.09Å
394	A	53.4	Low	68	Low	51 Å²	51	70.1 Å²	70.1	42%	0.421	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	112.7	176.5	0	0	0	0	0	109.4	G396 E397	A394-G396 PolarHBondContact O-N 3.44Å; A394-E397 PolarHBondContact N-O 3.48Å; A394-E397 PolarHBondContact O-N 3.5Å
395	R	54.9	Low	66.8	Low	175 Å²	175	68.4 Å²	68.4	66%	0.66	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	34.5	179.3	-55.6	-170.6	-173.3	138.3	21.2	115	G53 E397	G53-R395 PolarHBondContact O-NE 3.21Å; G53-R395 VanDerWaalsContact O-NE 3.09Å; G53-R395 PolarHBondContact O-NH2 3.11Å; R395-E397 VanDerWaalsContact C-N 3.31Å
396	G	57.7	Low	66.3	Low	19 Å²	19	68.1 Å²	68.1	20%	0.196	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.2	6.8	-177.4	0	0	0	0	0	114.8	V380 A394	V380-G396 WeakPolarHBondContact CG1-O 3.26Å; V380-G396 WeakPolarHBondContact CG2-O 3.32Å; A394-G396 PolarHBondContact O-N 3.44Å
397	E	62.2	Low	65.5	Low	147 Å²	147	67.1 Å²	67.1	69%	0.687	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113	144.4	170.8	-66	-177.5	175.5	0	0	110.9	A394 R395	A394-E397 PolarHBondContact N-O 3.48Å; A394-E397 PolarHBondContact O-N 3.5Å; R395-E397 VanDerWaalsContact C-N 3.31Å
398	P	72.2	Confident	64.9	Low	53 Å²	53	64.9 Å²	64.9	34%	0.344	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.7	179.4	27.6	-23.9	0	0	0	110.4	V380 T384	V380-P398 HydrophobicContact CG1-CB 3.84Å; V380-P398 HydrophobicContact CG1-CG 3.92Å; V380-P398 WeakPolarHBondContact O-CB 3.43Å; T384-P398 HydrophobicContact CG2-CB 3.72Å; T384-P398 HydrophobicContact CG2-CG 3.44Å; T384-P398 VanDerWaalsContact CG2-CG 3.44Å
399	H	67.7	Low	64.9	Low	108 Å²	108	67.5 Å²	67.5	50%	0.5	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	119.5	167.9	-162.5	72.5	0	0	0	110.1	V392 F401	V392-H399 PolarHBondContact N-O 2.99Å; V392-H399 WeakPolarHBondContact O-CB 2.96Å; V392-H399 PolarHBondContact O-N 3.03Å; H399-F401 AromaticContact CD2-CE2 3.96Å; H399-F401 AromaticContact CD2-CZ 3.94Å
400	C	66.4	Low	65.3	Low	14 Å²	14	69.3 Å²	69.3	10%	0.095	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	120.3	-179	-63.9	0	0	0	0	111.8	C385 S409	C385-C400 WeakPolarHBondContact CA-SG 3.47Å; C385-C400 HydrophobicContact CB-CB 3.85Å; C385-C400 WeakPolarHBondContact CB-SG 3.47Å; C385-C400 WeakPolarHBondContact SG-CA 3.44Å; C385-C400 WeakPolarHBondContact SG-CB 3.35Å; C385-C400 CovalentContact SG-SG 2.03Å; C385-C400 PolarHBondContact SG-SG 2.85Å; C400-S409 WeakPolarHBondContact CB-O 3.48Å; C400-S409 PolarHBondContact SG-O 2.86Å
401	F	64.7	Low	65.6	Low	113 Å²	113	65 Å²	65	50%	0.496	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	108.5	164.2	-68.9	-82.6	0	0	0	109.4	G389 T390 V392 H399	G389-F401 CarbonylContact C-O 3.55Å; G389-F401 VanDerWaalsContact CA-O 3.28Å; G389-F401 WeakPolarHBondContact CA-O 3.48Å; T390-F401 PolarHBondContact N-O 2.9Å; T390-F401 PolarHBondContact O-N 3.26Å; V392-F401 HydrophobicContact CB-CD2 4.33Å; V392-F401 HydrophobicContact CB-CE2 3.91Å; V392-F401 HydrophobicContact CG2-CD2 3.73Å; V392-F401 HydrophobicContact CG2-CE2 3.53Å; H399-F401 AromaticContact CD2-CE2 3.96Å; H399-F401 AromaticContact CD2-CZ 3.94Å
402	C	65	Low	66	Low	44 Å²	44	66.2 Å²	66.2	30%	0.297	35%	0.353	S	S	.	.			trans	-74	137.4	179.6	-55.2	0	0	0	0	111.4	F406 G408 C411	C402-F406 HydrophobicContact CB-CB 4.27Å; C402-F406 VanDerWaalsContact CB-O 3.31Å; C402-F406 WeakPolarHBondContact CB-O 3.34Å; C402-G408 PolarHBondContact SG-O 2.87Å; C402-G408 VanDerWaalsContact SG-O 3.34Å; C402-C411 WeakPolarHBondContact CA-SG 2.97Å; C402-C411 HydrophobicContact CB-CB 3.75Å; C402-C411 WeakPolarHBondContact CB-SG 3.2Å; C402-C411 PolarHBondContact N-SG 3.25Å; C402-C411 WeakPolarHBondContact SG-CA 3.05Å; C402-C411 WeakPolarHBondContact SG-CB 2.98Å; C402-C411 CovalentContact SG-SG 2.04Å; C402-C411 PolarHBondContact SG-SG 3.29Å
403	R	62.2	Low	66	Low	144 Å²	144	68.7 Å²	68.7	54%	0.543	36%	0.361	S	S	.	.			trans	-64.8	149.2	171.6	-162.3	173.4	-170.2	-174.6	1.2	109	G405 F406	R403-G405 PolarHBondContact O-N 2.73Å; R403-F406 PolarHBondContact O-N 3.16Å
404	R	58.7	Low	66.4	Low	100 Å²	100	69.2 Å²	69.2	38%	0.377	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-45.6	124.2	175.2	-173.6	177.1	178.9	87.7	7.3	110	L433 I435 E477	R404-L433 HydrophobicContact CB-CD1 4.43Å; R404-L433 HydrophobicContact CG-CD1 3.82Å; R404-I435 WeakPolarHBondContact O-CD1 3.04Å; R404-E477 IonicContact CZ-OE1 3.94Å; R404-E477 IonicContact NH1-OE1 3.33Å; R404-E477 PolarHBondContact NH1-OE1 2.88Å
405	G	59.1	Low	66.7	Low	5 Å²	5	68.8 Å²	68.8	5%	0.052	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.7	-2.3	-176.5	0	0	0	0	0	115.6	R403 A414 L415	R403-G405 PolarHBondContact O-N 2.73Å; G405-A414 CarbonylContact O-C 3.52Å; G405-L415 WeakPolarHBondContact O-CB 3.35Å; G405-L415 PolarHBondContact O-N 3.26Å
406	F	68.4	Low	66.6	Low	17 Å²	17	69.7 Å²	69.7	8%	0.075	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	154.9	172.6	-64.7	-86	0	0	0	111.7	N387 C402 R403 C411 E413 A414 I435 V440	N387-F406 HydrophobicContact CB-CD1 3.55Å; N387-F406 HydrophobicContact CB-CD2 4.08Å; N387-F406 HydrophobicContact CB-CE1 3.5Å; N387-F406 VanDerWaalsContact CB-CE1 3.5Å; N387-F406 HydrophobicContact CB-CE2 4.03Å; N387-F406 HydrophobicContact CB-CG 3.85Å; N387-F406 HydrophobicContact CB-CZ 3.75Å; N387-F406 VanDerWaalsContact CG-CE1 3.41Å; N387-F406 VanDerWaalsContact ND2-CD1 3.32Å; N387-F406 WeakPolarHBondContact ND2-CD1 3.36Å; N387-F406 WeakPolarHBondContact ND2-CE1 3.2Å; C402-F406 HydrophobicContact CB-CB 4.27Å; C402-F406 VanDerWaalsContact CB-O 3.31Å; C402-F406 WeakPolarHBondContact CB-O 3.34Å; R403-F406 PolarHBondContact O-N 3.16Å; F406-C411 HydrophobicContact CB-CB 4.38Å; F406-E413 CarbonylContact C-O 3.5Å; F406-E413 WeakPolarHBondContact CA-O 3.19Å; F406-A414 HydrophobicContact CD1-CB 4.32Å; F406-A414 HydrophobicContact CE1-CB 4.18Å; F406-I435 HydrophobicContact CE2-CD1 4.07Å; F406-I435 HydrophobicContact CE2-CG2 4.23Å; F406-V440 HydrophobicContact CE2-CG2 4.36Å; F406-V440 HydrophobicContact CZ-CG2 4.29Å
407	T	68.8	Low	66.5	Low	56 Å²	56	69 Å²	69	34%	0.344	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	178	179.2	-166.7	0	0	0	0	111.5	C411 S412 E413 L415	T407-C411 CarbonylContact O-C 3.53Å; T407-C411 VanDerWaalsContact O-C 3.31Å; T407-C411 VanDerWaalsContact O-CA 3.22Å; T407-C411 WeakPolarHBondContact O-CA 3.4Å; T407-S412 PolarHBondContact O-N 3.36Å; T407-E413 HydrophobicContact CG2-CB 3.7Å; T407-E413 PolarHBondContact N-O 2.8Å; T407-E413 WeakPolarHBondContact O-CB 3.39Å; T407-E413 PolarHBondContact O-N 3.47Å; T407-E413 VanDerWaalsContact O-N 3.08Å; T407-L415 HydrophobicContact CG2-CD1 3.69Å
408	G	67.6	Low	66.4	Low	25 Å²	25	62.2 Å²	62.2	26%	0.258	33%	0.328	S	S	.	.	S	Bend	trans	94.7	160	-174.1	0	0	0	0	0	112.4	C402 N410 C411	C402-G408 PolarHBondContact SG-O 2.87Å; C402-G408 VanDerWaalsContact SG-O 3.34Å; G408-N410 PolarHBondContact O-N 3.4Å; G408-N410 VanDerWaalsContact O-N 3.1Å; G408-C411 PolarHBondContact O-N 3.49Å
409	S	73	Confident	65.4	Low	114 Å²	114	62 Å²	62	80%	0.797	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-23.1	-176.8	54.4	0	0	0	0	114.1	C400	C400-S409 WeakPolarHBondContact CB-O 3.48Å; C400-S409 PolarHBondContact SG-O 2.86Å
410	N	81.7	Confident	64.7	Low	52 Å²	52	66.8 Å²	66.8	28%	0.278	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.5	11.7	176.4	67.5	-7	0	0	0	113	T384 L386 G408 S412	T384-N410 VanDerWaalsContact O-CB 3.29Å; T384-N410 WeakPolarHBondContact O-CB 3.44Å; L386-N410 WeakPolarHBondContact CB-O 3.33Å; L386-N410 PolarHBondContact N-O 3.15Å; G408-N410 PolarHBondContact O-N 3.4Å; G408-N410 VanDerWaalsContact O-N 3.1Å; N410-S412 PolarHBondContact O-N 3.3Å; N410-S412 WeakPolarHBondContact OD1-CB 3.29Å; N410-S412 PolarHBondContact OD1-N 3.37Å; N410-S412 VanDerWaalsContact OD1-N 3.12Å; N410-S412 PolarHBondContact OD1-OG 3.37Å
411	C	77.2	Confident	64.2	Low	1 Å²	1	70.7 Å²	70.7	1%	0.007	39%	0.385	C	S	.	.	S	Bend	trans	60.5	21.9	-178.2	-47.8	0	0	0	0	115.6	L386 N387 C402 F406 T407 G408 E413	L386-C411 WeakPolarHBondContact O-CB 3.42Å; N387-C411 PolarHBondContact ND2-O 3.25Å; C402-C411 WeakPolarHBondContact CA-SG 2.97Å; C402-C411 HydrophobicContact CB-CB 3.75Å; C402-C411 WeakPolarHBondContact CB-SG 3.2Å; C402-C411 PolarHBondContact N-SG 3.25Å; C402-C411 WeakPolarHBondContact SG-CA 3.05Å; C402-C411 WeakPolarHBondContact SG-CB 2.98Å; C402-C411 CovalentContact SG-SG 2.04Å; C402-C411 PolarHBondContact SG-SG 3.29Å; F406-C411 HydrophobicContact CB-CB 4.38Å; T407-C411 CarbonylContact O-C 3.53Å; T407-C411 VanDerWaalsContact O-C 3.31Å; T407-C411 VanDerWaalsContact O-CA 3.22Å; T407-C411 WeakPolarHBondContact O-CA 3.4Å; G408-C411 PolarHBondContact O-N 3.49Å; C411-E413 VanDerWaalsContact C-N 3.3Å; C411-E413 PolarHBondContact O-N 3.28Å
412	S	80.8	Confident	64	Low	56 Å²	56	66.8 Å²	66.8	39%	0.392	38%	0.377	S	S	.	.			trans	-71.6	-20.3	-179.3	58.2	0	0	0	0	114.3	T407 N410	T407-S412 PolarHBondContact O-N 3.36Å; N410-S412 PolarHBondContact O-N 3.3Å; N410-S412 WeakPolarHBondContact OD1-CB 3.29Å; N410-S412 PolarHBondContact OD1-N 3.37Å; N410-S412 VanDerWaalsContact OD1-N 3.12Å; N410-S412 PolarHBondContact OD1-OG 3.37Å
413	E	66.9	Low	64.4	Low	115 Å²	115	69.2 Å²	69.2	54%	0.537	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	122.7	-171.8	-60.3	177.4	-167.4	0	0	110.8	F406 T407 C411	F406-E413 CarbonylContact C-O 3.5Å; F406-E413 WeakPolarHBondContact CA-O 3.19Å; T407-E413 HydrophobicContact CG2-CB 3.7Å; T407-E413 PolarHBondContact N-O 2.8Å; T407-E413 WeakPolarHBondContact O-CB 3.39Å; T407-E413 PolarHBondContact O-N 3.47Å; T407-E413 VanDerWaalsContact O-N 3.08Å; C411-E413 VanDerWaalsContact C-N 3.3Å; C411-E413 PolarHBondContact O-N 3.28Å
414	A	65.6	Low	65.2	Low	44 Å²	44	63.1 Å²	63.1	36%	0.364	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	130.5	171.2	0	0	0	0	0	110.9	G405 F406 K416	G405-A414 CarbonylContact O-C 3.52Å; F406-A414 HydrophobicContact CD1-CB 4.32Å; F406-A414 HydrophobicContact CE1-CB 4.18Å; A414-K416 PolarHBondContact O-N 3.36Å
415	L	59	Low	66.3	Low	42 Å²	42	63.3 Å²	63.3	22%	0.22	37%	0.374	C	S	.	.			trans	-72.3	96.2	175.7	-142.3	83.3	0	0	0	108.9	G405 T407 S417 V452	G405-L415 WeakPolarHBondContact O-CB 3.35Å; G405-L415 PolarHBondContact O-N 3.26Å; T407-L415 HydrophobicContact CG2-CD1 3.69Å; L415-S417 PolarHBondContact O-N 3Å; L415-V452 HydrophobicContact CD2-CG1 3.86Å; L415-V452 HydrophobicContact CD2-CG2 4.18Å; L415-V452 HydrophobicContact CG-CG1 4.03Å
416	K	53.8	Low	67.6	Low	195 Å²	195	66.3 Å²	66.3	85%	0.848	39%	0.389	S	S	*	.			trans	-74.3	75	173.6	-66.5	-176.3	-177.8	179.6	0	110.1	A414	A414-K416 PolarHBondContact O-N 3.36Å
417	S	55.6	Low	68.1	Low	4 Å²	4	68.5 Å²	68.5	3%	0.028	42%	0.417	C	S	.	.			trans	-78.4	-41.2	-172.2	158.2	0	0	0	0	113.2	L415 C443 V452 T453	L415-S417 PolarHBondContact O-N 3Å; S417-C443 PolarHBondContact OG-N 2.84Å; S417-C443 PolarHBondContact OG-SG 2.7Å; S417-V452 WeakPolarHBondContact CB-O 3Å; S417-V452 PolarHBondContact OG-O 2.92Å; S417-T453 WeakPolarHBondContact O-CG2 3.39Å
418	C	59.6	Low	68.7	Low	5 Å²	5	66.5 Å²	66.5	3%	0.034	41%	0.407	C	S	.	.	S	Bend	trans	-93.3	-0.1	-175.7	-56.4	0	0	0	0	116.1	G422 C430 K441 C443	C418-G422 WeakPolarHBondContact O-CA 3.3Å; C418-G422 PolarHBondContact O-N 3.15Å; C418-C430 HydrophobicContact CB-CB 4.1Å; C418-C430 WeakPolarHBondContact CB-SG 3.35Å; C418-C430 WeakPolarHBondContact SG-CB 3.5Å; C418-C430 CovalentContact SG-SG 2.04Å; C418-C430 PolarHBondContact SG-SG 2.79Å; C418-K441 HydrophobicContact CB-CB 4.04Å; C418-C443 VanDerWaalsContact SG-SG 3.68Å
419	G	52.4	Low	69.4	Low	47 Å²	47	69.2 Å²	69.2	49%	0.485	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	-174.1	-170	0	0	0	0	0	113.2	S421	G419-S421 PolarHBondContact O-N 2.84Å
420	E	52.4	Low	69.8	Low	209 Å²	209	65.8 Å²	65.8	98%	0.977	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-25.4	170.4	-84.9	176	161.5	0	0	112.2	G422	E420-G422 VanDerWaalsContact C-N 3.34Å; E420-G422 PolarHBondContact O-N 2.78Å
421	S	55.6	Low	69.6	Low	97 Å²	97	66.6 Å²	66.6	68%	0.678	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8	-176.4	54.8	0	0	0	0	114.6	G419 T423	G419-S421 PolarHBondContact O-N 2.84Å; S421-T423 PolarHBondContact O-N 2.9Å; S421-T423 VanDerWaalsContact O-N 3.12Å; S421-T423 PolarHBondContact O-OG1 3.23Å
422	G	61.6	Low	69.4	Low	31 Å²	31	69.9 Å²	69.9	32%	0.32	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	15.2	171.4	0	0	0	0	0	115.4	C418 E420 C430	C418-G422 WeakPolarHBondContact O-CA 3.3Å; C418-G422 PolarHBondContact O-N 3.15Å; E420-G422 VanDerWaalsContact C-N 3.34Å; E420-G422 PolarHBondContact O-N 2.78Å; G422-C430 WeakPolarHBondContact O-CB 3.49Å
423	T	72.2	Confident	68.7	Low	94 Å²	94	69.5 Å²	69.5	58%	0.577	41%	0.41	S	S	*	.			trans	-108.7	115.9	-167.9	-10.9	0	0	0	0	111.4	S421	S421-T423 PolarHBondContact O-N 2.9Å; S421-T423 VanDerWaalsContact O-N 3.12Å; S421-T423 PolarHBondContact O-OG1 3.23Å
424	C	80.1	Confident	68.6	Low	16 Å²	16	68.9 Å²	68.9	11%	0.108	41%	0.414	C	S	.	.			trans	-85.1	144.2	167.8	-55.5	0	0	0	0	110	G428 T429 C430 C443	C424-G428 WeakPolarHBondContact CB-O 3.4Å; C424-T429 VanDerWaalsContact SG-C 3.59Å; C424-C430 WeakPolarHBondContact SG-CA 3.42Å; C424-C430 PolarHBondContact SG-N 2.83Å; C424-C430 VanDerWaalsContact SG-N 3.39Å; C424-C443 VanDerWaalsContact CA-SG 3.5Å; C424-C443 HydrophobicContact CB-CB 3.75Å; C424-C443 WeakPolarHBondContact CB-SG 3.14Å; C424-C443 WeakPolarHBondContact SG-CA 3.45Å; C424-C443 WeakPolarHBondContact SG-CB 3.22Å; C424-C443 CovalentContact SG-SG 2.02Å; C424-C443 PolarHBondContact SG-SG 2.83Å
425	Q	81.5	Confident	68.1	Low	104 Å²	104	68 Å²	68	49%	0.486	40%	0.403	S	S	.	.	S	Bend	trans	-79.6	168.3	179.9	-59.1	-170.7	10.6	0	0	111.3	G427 G428 T453 E455	Q425-G427 PolarHBondContact O-N 3.13Å; Q425-G428 PolarHBondContact O-N 2.85Å; Q425-T453 WeakPolarHBondContact CB-O 3.38Å; Q425-T453 PolarHBondContact N-O 2.88Å; Q425-E455 VanDerWaalsContact OE1-CB 3.31Å
426	N	85.1	Confident	68.2	Low	69 Å²	69	69.3 Å²	69.3	37%	0.369	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	29.2	171.3	-60.2	-43.5	0	0	0	115.6	Y449 C454	N426-Y449 HydrophobicContact CB-CD1 3.45Å; N426-Y449 VanDerWaalsContact CB-CD1 3.45Å; N426-Y449 HydrophobicContact CB-CD2 3.85Å; N426-Y449 HydrophobicContact CB-CE1 3.53Å; N426-Y449 HydrophobicContact CB-CE2 3.91Å; N426-Y449 HydrophobicContact CB-CG 3.61Å; N426-Y449 VanDerWaalsContact CG-CD1 3.48Å; N426-Y449 VanDerWaalsContact ND2-CD1 3.29Å; N426-Y449 WeakPolarHBondContact ND2-CD1 3.32Å; N426-Y449 WeakPolarHBondContact ND2-CE1 3.49Å; N426-C454 PolarHBondContact ND2-O 3.25Å
427	G	79.1	Confident	68.7	Low	63 Å²	63	65.5 Å²	65.5	65%	0.649	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	18.4	-179.2	0	0	0	0	0	114.2	Q425	Q425-G427 PolarHBondContact O-N 3.13Å
428	G	82.5	Confident	68.8	Low	14 Å²	14	70.2 Å²	70.2	14%	0.144	45%	0.453	C	S	.	.			trans	-65.4	156	168.8	0	0	0	0	0	112.3	C424 Q425 K444	C424-G428 WeakPolarHBondContact CB-O 3.4Å; Q425-G428 PolarHBondContact O-N 2.85Å; G428-K444 CarbonylContact C-O 3.57Å; G428-K444 WeakPolarHBondContact CA-O 3.43Å
429	T	82.1	Confident	69.1	Low	81 Å²	81	76.7 Å²	76.7	50%	0.497	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.9	176.5	43	0	0	0	0	110.3	C424 E431 K444	C424-T429 VanDerWaalsContact SG-C 3.59Å; T429-E431 PolarHBondContact O-N 2.03Å; T429-K444 PolarHBondContact N-O 3.26Å; T429-K444 PolarHBondContact O-N 3.04Å
430	C	80.9	Confident	69.7	Low	42 Å²	42	74.9 Å²	74.9	28%	0.284	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	111.7	174.2	-173.9	0	0	0	0	109.4	C418 G422 C424	C418-C430 HydrophobicContact CB-CB 4.1Å; C418-C430 WeakPolarHBondContact CB-SG 3.35Å; C418-C430 WeakPolarHBondContact SG-CB 3.5Å; C418-C430 CovalentContact SG-SG 2.04Å; C418-C430 PolarHBondContact SG-SG 2.79Å; G422-C430 WeakPolarHBondContact O-CB 3.49Å; C424-C430 WeakPolarHBondContact SG-CA 3.42Å; C424-C430 PolarHBondContact SG-N 2.83Å; C424-C430 VanDerWaalsContact SG-N 3.39Å
431	E	78	Confident	70.5	Confident	69 Å²	69	69.3 Å²	69.3	32%	0.322	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	131.5	176.9	-65.7	-178.1	170.4	0	0	109.2	T429 K441 V442 K444	T429-E431 PolarHBondContact O-N 2.03Å; E431-K441 WeakPolarHBondContact O-CA 3.33Å; E431-V442 HydrophobicContact CB-CG2 4.46Å; E431-V442 PolarHBondContact N-O 2.83Å; E431-V442 PolarHBondContact O-N 2.9Å; E431-K444 HydrophobicContact CG-CB 4.37Å; E431-K444 WeakPolarHBondContact OE1-CD 3.01Å; E431-K444 IonicContact OE1-NZ 2.93Å
432	T	72.9	Confident	71.3	Confident	71 Å²	71	65 Å²	65	44%	0.436	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	112.1	171.3	-55.8	0	0	0	0	108	E439 K441	T432-E439 HydrophobicContact CG2-CB 3.98Å; T432-E439 HydrophobicContact CG2-CG 4.26Å; T432-K441 HydrophobicContact CG2-CG 4.35Å
433	L	66.8	Low	72.1	Confident	47 Å²	47	64 Å²	64	25%	0.246	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	120.7	172.8	-62.4	177.4	0	0	0	108.7	R404 I435 V440 V442	R404-L433 HydrophobicContact CB-CD1 4.43Å; R404-L433 HydrophobicContact CG-CD1 3.82Å; L433-I435 HydrophobicContact CB-CD1 4.47Å; L433-I435 HydrophobicContact CB-CG1 4.25Å; L433-I435 PolarHBondContact O-N 3.24Å; L433-V440 PolarHBondContact N-O 2.85Å; L433-V440 PolarHBondContact O-N 2.83Å; L433-V442 HydrophobicContact CD1-CB 4.45Å; L433-V442 HydrophobicContact CD1-CG1 4.17Å; L433-V442 HydrophobicContact CD1-CG2 3.42Å; L433-V442 VanDerWaalsContact CD1-CG2 3.42Å; L433-V442 HydrophobicContact CG-CG2 3.76Å
434	V	63.9	Low	72.4	Confident	103 Å²	103	64.8 Å²	64.8	62%	0.624	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.9	170.1	-175.2	0	0	0	0	107.6	E439	V434-E439 HydrophobicContact CG2-CG 4.42Å
435	I	56.2	Low	72.4	Confident	24 Å²	24	65.7 Å²	65.7	12%	0.123	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	94.2	178.3	-57.4	178.6	0	0	0	107.7	R404 F406 L433 A437 E438 V440	R404-I435 WeakPolarHBondContact O-CD1 3.04Å; F406-I435 HydrophobicContact CE2-CD1 4.07Å; F406-I435 HydrophobicContact CE2-CG2 4.23Å; L433-I435 HydrophobicContact CB-CD1 4.47Å; L433-I435 HydrophobicContact CB-CG1 4.25Å; L433-I435 PolarHBondContact O-N 3.24Å; I435-A437 PolarHBondContact O-N 3.17Å; I435-E438 PolarHBondContact N-O 3.17Å; I435-E438 PolarHBondContact O-N 2.89Å; I435-V440 HydrophobicContact CD1-CB 4.45Å; I435-V440 HydrophobicContact CD1-CG2 4.25Å
436	G	59.6	Low	72.4	Confident	71 Å²	71	67.4 Å²	67.4	73%	0.732	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-120.8	-173	0	0	0	0	0	111.1
437	A	65.5	Low	72	Confident	114 Å²	114	71 Å²	71	94%	0.942	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-2.2	177.3	0	0	0	0	0	113.7	I435	I435-A437 PolarHBondContact O-N 3.17Å
438	E	57.3	Low	72	Confident	104 Å²	104	77 Å²	77	49%	0.486	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.9	-176.1	-160.6	172	-170.4	0	0	110.8	I435	I435-E438 PolarHBondContact N-O 3.17Å; I435-E438 PolarHBondContact O-N 2.89Å
439	E	64.7	Low	71.9	Confident	141 Å²	141	80 Å²	80	66%	0.659	43%	0.429	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	112.1	173.5	-68.8	-173.3	174.6	0	0	109.8	T432 V434	T432-E439 HydrophobicContact CG2-CB 3.98Å; T432-E439 HydrophobicContact CG2-CG 4.26Å; V434-E439 HydrophobicContact CG2-CG 4.42Å
440	V	66.3	Low	71.6	Confident	8 Å²	8	76.1 Å²	76.1	5%	0.048	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.9	176.8	-172.1	0	0	0	0	109.3	F406 L433 I435 V442	F406-V440 HydrophobicContact CE2-CG2 4.36Å; F406-V440 HydrophobicContact CZ-CG2 4.29Å; L433-V440 PolarHBondContact N-O 2.85Å; L433-V440 PolarHBondContact O-N 2.83Å; I435-V440 HydrophobicContact CD1-CB 4.45Å; I435-V440 HydrophobicContact CD1-CG2 4.25Å; V440-V442 HydrophobicContact CG1-CG1 4.19Å
441	K	68.7	Low	71	Confident	93 Å²	93	74.5 Å²	74.5	40%	0.404	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119.6	178.3	-66.4	-174.4	-177.8	178.8	0	110.6	C418 E431 T432	C418-K441 HydrophobicContact CB-CB 4.04Å; E431-K441 WeakPolarHBondContact O-CA 3.33Å; T432-K441 HydrophobicContact CG2-CG 4.35Å
442	V	73.4	Confident	70.7	Confident	6 Å²	6	73.7 Å²	73.7	4%	0.036	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	142.9	-179.9	-60.5	0	0	0	0	111.7	E431 L433 V440	E431-V442 HydrophobicContact CB-CG2 4.46Å; E431-V442 PolarHBondContact N-O 2.83Å; E431-V442 PolarHBondContact O-N 2.9Å; L433-V442 HydrophobicContact CD1-CB 4.45Å; L433-V442 HydrophobicContact CD1-CG1 4.17Å; L433-V442 HydrophobicContact CD1-CG2 3.42Å; L433-V442 VanDerWaalsContact CD1-CG2 3.42Å; L433-V442 HydrophobicContact CG-CG2 3.76Å; V440-V442 HydrophobicContact CG1-CG1 4.19Å
443	C	76.8	Confident	70.7	Confident	9 Å²	9	72.1 Å²	72.1	6%	0.061	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	133.2	172	-71.5	0	0	0	0	111.9	S417 C418 C424	S417-C443 PolarHBondContact OG-N 2.84Å; S417-C443 PolarHBondContact OG-SG 2.7Å; C418-C443 VanDerWaalsContact SG-SG 3.68Å; C424-C443 VanDerWaalsContact CA-SG 3.5Å; C424-C443 HydrophobicContact CB-CB 3.75Å; C424-C443 WeakPolarHBondContact CB-SG 3.14Å; C424-C443 WeakPolarHBondContact SG-CA 3.45Å; C424-C443 WeakPolarHBondContact SG-CB 3.22Å; C424-C443 CovalentContact SG-SG 2.02Å; C424-C443 PolarHBondContact SG-SG 2.83Å
444	K	79.2	Confident	71.4	Confident	112 Å²	112	69.9 Å²	69.9	49%	0.487	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	117.7	163.6	177.5	177.3	179.3	179.5	0	108.7	G428 T429 E431	G428-K444 CarbonylContact C-O 3.57Å; G428-K444 WeakPolarHBondContact CA-O 3.43Å; T429-K444 PolarHBondContact N-O 3.26Å; T429-K444 PolarHBondContact O-N 3.04Å; E431-K444 HydrophobicContact CG-CB 4.37Å; E431-K444 WeakPolarHBondContact OE1-CD 3.01Å; E431-K444 IonicContact OE1-NZ 2.93Å
445	C	79.2	Confident	71.8	Confident	35 Å²	35	67.9 Å²	67.9	24%	0.236	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-84.9	146.1	-176.2	-51.5	0	0	0	0	111.7	Y449 C454	C445-Y449 WeakPolarHBondContact CB-O 3.47Å; C445-C454 WeakPolarHBondContact CA-SG 3.35Å; C445-C454 HydrophobicContact CB-CB 3.66Å; C445-C454 WeakPolarHBondContact CB-SG 3.45Å; C445-C454 PolarHBondContact N-SG 3.35Å; C445-C454 VanDerWaalsContact N-SG 3.39Å; C445-C454 WeakPolarHBondContact SG-CA 3.29Å; C445-C454 WeakPolarHBondContact SG-CB 3.28Å; C445-C454 CovalentContact SG-SG 2.03Å; C445-C454 PolarHBondContact SG-SG 3.06Å
446	K	82.1	Confident	72.8	Confident	140 Å²	140	72.5 Å²	72.5	61%	0.609	37%	0.374	S	S	*	.	P	Polyproline II helix	trans	-73.4	151.6	170.6	-172.4	176	-179.8	180	0	109.3	R448 Y449	K446-R448 PolarHBondContact O-N 3.17Å; K446-Y449 PolarHBondContact O-N 2.77Å
447	D	77.5	Confident	73.9	Confident	143 Å²	143	75.2 Å²	75.2	77%	0.765	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.3	132	174.1	-64.4	-12.5	0	0	0	111.7
448	R	78.4	Confident	74.5	Confident	191 Å²	191	70.9 Å²	70.9	72%	0.721	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	-6.9	-172	-54.4	179.7	-113.2	-175	-7.6	116.8	K446 E457 V458	K446-R448 PolarHBondContact O-N 3.17Å; R448-E457 CarbonylContact O-C 3.59Å; R448-E457 WeakPolarHBondContact O-CA 3.36Å; R448-E457 WeakPolarHBondContact O-CG 3.25Å; R448-V458 PolarHBondContact O-N 3.11Å
449	Y	80.4	Confident	75.5	Confident	76 Å²	76	70.1 Å²	70.1	30%	0.298	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	148.7	173.4	-63.3	-83.6	0	0	0	111.6	N426 C445 K446 R456	N426-Y449 HydrophobicContact CB-CD1 3.45Å; N426-Y449 VanDerWaalsContact CB-CD1 3.45Å; N426-Y449 HydrophobicContact CB-CD2 3.85Å; N426-Y449 HydrophobicContact CB-CE1 3.53Å; N426-Y449 HydrophobicContact CB-CE2 3.91Å; N426-Y449 HydrophobicContact CB-CG 3.61Å; N426-Y449 VanDerWaalsContact CG-CD1 3.48Å; N426-Y449 VanDerWaalsContact ND2-CD1 3.29Å; N426-Y449 WeakPolarHBondContact ND2-CD1 3.32Å; N426-Y449 WeakPolarHBondContact ND2-CE1 3.49Å; C445-Y449 WeakPolarHBondContact CB-O 3.47Å; K446-Y449 PolarHBondContact O-N 2.77Å; Y449-R456 CarbonylContact C-O 3.55Å; Y449-R456 VanDerWaalsContact CA-O 3.23Å; Y449-R456 WeakPolarHBondContact CA-O 3.43Å
450	G	76.5	Confident	76.5	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	-177.1	174.9	0	0	0	0	0	111.1	C454 E455 R456	G450-C454 CarbonylContact O-C 3.54Å; G450-C454 WeakPolarHBondContact O-CA 3.26Å; G450-E455 PolarHBondContact O-N 3.19Å; G450-R456 PolarHBondContact N-O 3.05Å; G450-R456 WeakPolarHBondContact O-CB 3.18Å; G450-R456 PolarHBondContact O-N 3.26Å; G450-R456 VanDerWaalsContact O-O 3.1Å
451	G	67.5	Low	77.3	Confident	7 Å²	7	72.4 Å²	72.4	7%	0.072	34%	0.338	C	S	.	.	S	Bend	trans	102.1	168.8	-175.1	0	0	0	0	0	111.6	T453 C454 E477 Y478	G451-T453 VanDerWaalsContact C-N 3.25Å; G451-T453 PolarHBondContact O-N 2.9Å; G451-C454 PolarHBondContact O-N 3.03Å; G451-C454 VanDerWaalsContact O-N 3.14Å; G451-E477 PolarHBondContact N-O 2.8Å; G451-E477 VanDerWaalsContact N-O 3.1Å; G451-Y478 WeakPolarHBondContact CA-O 3Å; G451-Y478 PolarHBondContact N-O 2.88Å
452	V	71.2	Confident	77.9	Confident	53 Å²	53	74.2 Å²	74.2	32%	0.321	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-33.3	-170.2	179	0	0	0	0	111.3	L415 S417 E455	L415-V452 HydrophobicContact CD2-CG1 3.86Å; L415-V452 HydrophobicContact CD2-CG2 4.18Å; L415-V452 HydrophobicContact CG-CG1 4.03Å; S417-V452 WeakPolarHBondContact CB-O 3Å; S417-V452 PolarHBondContact OG-O 2.92Å; V452-E455 PolarHBondContact N-OE2 2.82Å
453	T	74.2	Confident	78.1	Confident	37 Å²	37	81 Å²	81	23%	0.227	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	14.1	175.4	52.5	0	0	0	0	112.6	S417 Q425 G451 E455	S417-T453 WeakPolarHBondContact O-CG2 3.39Å; Q425-T453 WeakPolarHBondContact CB-O 3.38Å; Q425-T453 PolarHBondContact N-O 2.88Å; G451-T453 VanDerWaalsContact C-N 3.25Å; G451-T453 PolarHBondContact O-N 2.9Å; T453-E455 PolarHBondContact N-OE2 3.23Å; T453-E455 PolarHBondContact O-N 2.84Å; T453-E455 PolarHBondContact OG1-OE2 3.22Å
454	C	80.4	Confident	78.3	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	40%	0.401	C	S	.	.	S	Bend	trans	62	27.5	-169.7	-47.4	0	0	0	0	113.5	N426 C445 G450 G451 R456	N426-C454 PolarHBondContact ND2-O 3.25Å; C445-C454 WeakPolarHBondContact CA-SG 3.35Å; C445-C454 HydrophobicContact CB-CB 3.66Å; C445-C454 WeakPolarHBondContact CB-SG 3.45Å; C445-C454 PolarHBondContact N-SG 3.35Å; C445-C454 VanDerWaalsContact N-SG 3.39Å; C445-C454 WeakPolarHBondContact SG-CA 3.29Å; C445-C454 WeakPolarHBondContact SG-CB 3.28Å; C445-C454 CovalentContact SG-SG 2.03Å; C445-C454 PolarHBondContact SG-SG 3.06Å; G450-C454 CarbonylContact O-C 3.54Å; G450-C454 WeakPolarHBondContact O-CA 3.26Å; G451-C454 PolarHBondContact O-N 3.03Å; G451-C454 VanDerWaalsContact O-N 3.14Å; C454-R456 VanDerWaalsContact C-N 3.33Å
455	E	73.6	Confident	78.6	Confident	61 Å²	61	80 Å²	80	29%	0.285	39%	0.385	S	S	.	.			trans	-75.3	-20.1	-175.9	74	-71.3	-178.8	0	0	113.7	Q425 G450 V452 T453	Q425-E455 VanDerWaalsContact OE1-CB 3.31Å; G450-E455 PolarHBondContact O-N 3.19Å; V452-E455 PolarHBondContact N-OE2 2.82Å; T453-E455 PolarHBondContact N-OE2 3.23Å; T453-E455 PolarHBondContact O-N 2.84Å; T453-E455 PolarHBondContact OG1-OE2 3.22Å
456	R	77	Confident	78.9	Confident	122 Å²	122	78.5 Å²	78.5	46%	0.46	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	140.8	-175.4	-54.9	-176.5	-170.2	159.4	-1.8	110.8	Y449 G450 C454	Y449-R456 CarbonylContact C-O 3.55Å; Y449-R456 VanDerWaalsContact CA-O 3.23Å; Y449-R456 WeakPolarHBondContact CA-O 3.43Å; G450-R456 PolarHBondContact N-O 3.05Å; G450-R456 WeakPolarHBondContact O-CB 3.18Å; G450-R456 PolarHBondContact O-N 3.26Å; G450-R456 VanDerWaalsContact O-O 3.1Å; C454-R456 VanDerWaalsContact C-N 3.33Å
457	E	81.3	Confident	79.1	Confident	127 Å²	127	75.2 Å²	75.2	59%	0.593	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	136	161.2	-167.1	169.4	-167.2	0	0	108.2	R448 Q459	R448-E457 CarbonylContact O-C 3.59Å; R448-E457 WeakPolarHBondContact O-CA 3.36Å; R448-E457 WeakPolarHBondContact O-CG 3.25Å; E457-Q459 PolarHBondContact O-N 3.15Å
458	V	78.5	Confident	79.3	Confident	24 Å²	24	76.1 Å²	76.1	15%	0.145	36%	0.358	C	S	.	.			trans	-60.6	111.8	179.8	178.2	0	0	0	0	108.4	R448 K460 A476	R448-V458 PolarHBondContact O-N 3.11Å; V458-K460 PolarHBondContact O-N 2.86Å; V458-A476 HydrophobicContact CG2-CB 4.46Å
459	Q	79.5	Confident	79.5	Confident	88 Å²	88	68.4 Å²	68.4	41%	0.411	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61.7	130.6	172.2	-68	179.6	-24.6	0	0	109.4	E457 I481	E457-Q459 PolarHBondContact O-N 3.15Å; Q459-I481 HydrophobicContact CB-CG2 3.9Å; Q459-I481 WeakPolarHBondContact O-CG2 3.41Å
460	K	84.3	Confident	79.5	Confident	150 Å²	150	65.3 Å²	65.3	65%	0.652	32%	0.322	S	S	*	.	P	Polyproline II helix	trans	-88.1	151.6	174.3	-67.6	-174.8	179	-179.7	0	110.2	V458 E462 E474	V458-K460 PolarHBondContact O-N 2.86Å; K460-E462 PolarHBondContact O-N 2.75Å; K460-E474 VanDerWaalsContact CA-OE1 3.26Å; K460-E474 WeakPolarHBondContact CA-OE1 3.39Å; K460-E474 WeakPolarHBondContact CB-OE1 3.19Å
461	C	82.9	Confident	79.6	Confident	46 Å²	46	68.6 Å²	68.6	31%	0.311	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-73.6	116.9	172.1	-75.4	0	0	0	0	110.3	C472 R473 E474	C461-C472 WeakPolarHBondContact CA-SG 3.44Å; C461-C472 HydrophobicContact CB-CB 3.71Å; C461-C472 WeakPolarHBondContact CB-SG 3.45Å; C461-C472 WeakPolarHBondContact SG-CB 3.26Å; C461-C472 CovalentContact SG-SG 2.04Å; C461-C472 PolarHBondContact SG-SG 2.02Å; C461-R473 PolarHBondContact SG-N 3.04Å; C461-R473 VanDerWaalsContact SG-N 3.37Å; C461-E474 HydrophobicContact CB-CG 4.26Å; C461-E474 PolarHBondContact N-OE1 3.4Å; C461-E474 VanDerWaalsContact N-OE1 3.11Å
462	E	83.2	Confident	80.3	Confident	131 Å²	131	69.7 Å²	69.7	61%	0.612	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-103.9	159.5	167.3	-59.7	-177.6	176.5	0	0	109.4	K460 D464 S465	K460-E462 PolarHBondContact O-N 2.75Å; E462-D464 PolarHBondContact O-N 3.48Å; E462-D464 VanDerWaalsContact O-N 3.13Å; E462-S465 WeakPolarHBondContact CA-OG 3.5Å; E462-S465 WeakPolarHBondContact CB-OG 3.33Å; E462-S465 PolarHBondContact N-OG 2.76Å; E462-S465 WeakPolarHBondContact O-CB 3.49Å; E462-S465 PolarHBondContact O-N 3.33Å; E462-S465 PolarHBondContact O-OG 2.03Å
463	D	77.3	Confident	80.8	Confident	149 Å²	149	75.3 Å²	75.3	80%	0.797	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-30.2	-173.3	-68.1	-29.5	0	0	0	113.1	Y468	D463-Y468 HydrophobicContact CB-CE1 4.15Å; D463-Y468 WeakPolarHBondContact O-CD1 3.43Å
464	D	79.4	Confident	81	Confident	77 Å²	77	78.6 Å²	78.6	41%	0.412	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	0.1	178.6	70.2	-18.9	0	0	0	114	E462 C466 N467 Y468	E462-D464 PolarHBondContact O-N 3.48Å; E462-D464 VanDerWaalsContact O-N 3.13Å; D464-C466 PolarHBondContact O-N 3.46Å; D464-C466 VanDerWaalsContact O-N 3.1Å; D464-N467 WeakPolarHBondContact O-CA 3.02Å; D464-N467 PolarHBondContact O-N 2.74Å; D464-Y468 HydrophobicContact CB-CD2 4.28Å; D464-Y468 HydrophobicContact CB-CE1 4.27Å; D464-Y468 HydrophobicContact CB-CE2 3.52Å
465	S	85.5	Confident	80.7	Confident	22 Å²	22	80.7 Å²	80.7	15%	0.154	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.4	-174.3	-78.5	0	0	0	0	113.8	E462	E462-S465 WeakPolarHBondContact CA-OG 3.5Å; E462-S465 WeakPolarHBondContact CB-OG 3.33Å; E462-S465 PolarHBondContact N-OG 2.76Å; E462-S465 WeakPolarHBondContact O-CB 3.49Å; E462-S465 PolarHBondContact O-N 3.33Å; E462-S465 PolarHBondContact O-OG 2.03Å
466	C	87.1	Confident	80.5	Confident	4 Å²	4	80.9 Å²	80.9	3%	0.027	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	31.3	172.8	-55	0	0	0	0	112.3	D464 Y468 N469 C472 C483 Y493	D464-C466 PolarHBondContact O-N 3.46Å; D464-C466 VanDerWaalsContact O-N 3.1Å; C466-Y468 PolarHBondContact O-N 2.9Å; C466-Y468 VanDerWaalsContact O-N 3.11Å; C466-N469 PolarHBondContact O-N 3.21Å; C466-C472 VanDerWaalsContact SG-CA 3.53Å; C466-C472 WeakPolarHBondContact SG-CB 3.46Å; C466-C483 WeakPolarHBondContact CA-SG 3.35Å; C466-C483 HydrophobicContact CB-CB 3.79Å; C466-C483 WeakPolarHBondContact CB-SG 3.23Å; C466-C483 VanDerWaalsContact SG-CA 3.55Å; C466-C483 WeakPolarHBondContact SG-CB 3.42Å; C466-C483 CovalentContact SG-SG 2.03Å; C466-C483 PolarHBondContact SG-SG 3.18Å; C466-Y493 CarbonylContact C-O 3.58Å; C466-Y493 WeakPolarHBondContact CA-O 3.5Å
467	N	85.1	Confident	79.8	Confident	71 Å²	71	80.5 Å²	80.5	38%	0.38	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	28.5	-176	-68.1	-72.8	0	0	0	114.2	D464 N469 Y493	D464-N467 WeakPolarHBondContact O-CA 3.02Å; D464-N467 PolarHBondContact O-N 2.74Å; N467-N469 PolarHBondContact O-N 3.46Å; N467-N469 PolarHBondContact O-ND2 2.99Å; N467-Y493 PolarHBondContact ND2-O 3.32Å
468	Y	82.3	Confident	79.3	Confident	162 Å²	162	80 Å²	80	64%	0.635	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	7.1	-168.4	-51.1	-84.6	0	0	0	115	D463 D464 C466 Y486	D463-Y468 HydrophobicContact CB-CE1 4.15Å; D463-Y468 WeakPolarHBondContact O-CD1 3.43Å; D464-Y468 HydrophobicContact CB-CD2 4.28Å; D464-Y468 HydrophobicContact CB-CE1 4.27Å; D464-Y468 HydrophobicContact CB-CE2 3.52Å; C466-Y468 PolarHBondContact O-N 2.9Å; C466-Y468 VanDerWaalsContact O-N 3.11Å; Y468-Y486 WeakPolarHBondContact O-CE2 3.43Å
469	N	83.3	Confident	79	Confident	30 Å²	30	79 Å²	79	16%	0.16	39%	0.39	C	S	.	.	S	Bend	trans	-108.1	21	-173.1	-59.3	-45.2	0	0	0	112.3	C466 N467 C485 Y486 Y489 C494	C466-N469 PolarHBondContact O-N 3.21Å; N467-N469 PolarHBondContact O-N 3.46Å; N467-N469 PolarHBondContact O-ND2 2.99Å; N469-C485 CarbonylContact O-C 3.52Å; N469-C485 WeakPolarHBondContact O-CA 3.33Å; N469-Y486 WeakPolarHBondContact O-CD2 3.33Å; N469-Y486 PolarHBondContact O-N 2.8Å; N469-Y489 HydrophobicContact CB-CD1 3.62Å; N469-Y489 HydrophobicContact CB-CD2 3.74Å; N469-Y489 HydrophobicContact CB-CE1 3.97Å; N469-Y489 HydrophobicContact CB-CE2 4.09Å; N469-Y489 HydrophobicContact CB-CG 3.48Å; N469-Y489 VanDerWaalsContact CB-CG 3.48Å; N469-Y489 VanDerWaalsContact CG-CD1 3.45Å; N469-Y489 VanDerWaalsContact ND2-CD1 3.34Å; N469-Y489 WeakPolarHBondContact ND2-CD1 3.44Å; N469-Y489 WeakPolarHBondContact ND2-CE1 3.23Å; N469-Y489 WeakPolarHBondContact OD1-CE2 3.4Å; N469-Y489 PolarHBondContact OD1-OH 3.43Å; N469-C494 HydrophobicContact CB-CB 3.79Å; N469-C494 PolarHBondContact ND2-O 2.78Å
470	G	79.3	Confident	79	Confident	10 Å²	10	77.2 Å²	77.2	10%	0.103	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	176.3	178.7	0	0	0	0	0	113.3	T484	G470-T484 CarbonylContact C-O 3.31Å; G470-T484 WeakPolarHBondContact CA-O 3.48Å
471	V	79.4	Confident	78.9	Confident	70 Å²	70	70.4 Å²	70.4	42%	0.424	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124	175.5	-178.5	0	0	0	0	109.3	C483 T484 Y486	V471-C483 WeakPolarHBondContact O-CA 3.43Å; V471-T484 PolarHBondContact N-O 3.35Å; V471-T484 PolarHBondContact O-N 3.29Å; V471-Y486 HydrophobicContact CG2-CE1 3.96Å
472	C	81.7	Confident	78.7	Confident	29 Å²	29	73.8 Å²	73.8	20%	0.196	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	138.8	177.8	-173.9	0	0	0	0	111.8	C461 C466	C461-C472 WeakPolarHBondContact CA-SG 3.44Å; C461-C472 HydrophobicContact CB-CB 3.71Å; C461-C472 WeakPolarHBondContact CB-SG 3.45Å; C461-C472 WeakPolarHBondContact SG-CB 3.26Å; C461-C472 CovalentContact SG-SG 2.04Å; C461-C472 PolarHBondContact SG-SG 2.02Å; C466-C472 VanDerWaalsContact SG-CA 3.53Å; C466-C472 WeakPolarHBondContact SG-CB 3.46Å
473	R	81.9	Confident	78.6	Confident	172 Å²	172	68.5 Å²	68.5	65%	0.649	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	138.7	166.2	-71.2	-176.6	173.3	-174.1	-1.1	111	C461 I481 E482	C461-R473 PolarHBondContact SG-N 3.04Å; C461-R473 VanDerWaalsContact SG-N 3.37Å; R473-I481 CarbonylContact O-C 3.55Å; R473-I481 WeakPolarHBondContact O-CA 3.22Å; R473-E482 PolarHBondContact N-O 2.75Å; R473-E482 PolarHBondContact O-N 2.83Å
474	E	78.3	Confident	78.6	Confident	106 Å²	106	65.5 Å²	65.5	50%	0.495	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	128.5	175.7	-60.6	-179.5	178.8	0	0	110.5	K460 C461	K460-E474 VanDerWaalsContact CA-OE1 3.26Å; K460-E474 WeakPolarHBondContact CA-OE1 3.39Å; K460-E474 WeakPolarHBondContact CB-OE1 3.19Å; C461-E474 HydrophobicContact CB-CG 4.26Å; C461-E474 PolarHBondContact N-OE1 3.4Å; C461-E474 VanDerWaalsContact N-OE1 3.11Å
475	N	73.4	Confident	78.6	Confident	43 Å²	43	63.8 Å²	63.8	23%	0.23	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	93.6	171.8	-168.3	-32.4	0	0	0	110	E477 Y478 G479 M480	N475-E477 PolarHBondContact O-N 3.24Å; N475-E477 WeakPolarHBondContact OD1-CB 3.3Å; N475-E477 PolarHBondContact OD1-N 2.64Å; N475-E477 VanDerWaalsContact OD1-N 3.12Å; N475-Y478 WeakPolarHBondContact ND2-CD2 3.5Å; N475-Y478 PolarHBondContact O-N 3.17Å; N475-Y478 PolarHBondContact OD1-N 2.9Å; N475-G479 PolarHBondContact O-N 3.45Å; N475-M480 WeakPolarHBondContact CA-O 3.08Å; N475-M480 VanDerWaalsContact CB-O 3.22Å; N475-M480 WeakPolarHBondContact CB-O 3.01Å; N475-M480 PolarHBondContact N-O 3.45Å; N475-M480 PolarHBondContact O-N 3.46Å
476	A	70.3	Confident	78.1	Confident	66 Å²	66	68.4 Å²	68.4	55%	0.545	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-28.2	179.8	0	0	0	0	0	113.3	V458	V458-A476 HydrophobicContact CG2-CB 4.46Å
477	E	62.6	Low	76.9	Confident	113 Å²	113	73.4 Å²	73.4	53%	0.528	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-46.1	-177.9	-167.2	98.8	-141.4	0	0	111.4	R404 G451 N475	R404-E477 IonicContact CZ-OE1 3.94Å; R404-E477 IonicContact NH1-OE1 3.33Å; R404-E477 PolarHBondContact NH1-OE1 2.88Å; G451-E477 PolarHBondContact N-O 2.8Å; G451-E477 VanDerWaalsContact N-O 3.1Å; N475-E477 PolarHBondContact O-N 3.24Å; N475-E477 WeakPolarHBondContact OD1-CB 3.3Å; N475-E477 PolarHBondContact OD1-N 2.64Å; N475-E477 VanDerWaalsContact OD1-N 3.12Å
478	Y	70.3	Confident	76	Confident	118 Å²	118	72.6 Å²	72.6	46%	0.463	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	-6	-179.2	-65.9	-81.2	0	0	0	114.1	G451 N475 M480	G451-Y478 WeakPolarHBondContact CA-O 3Å; G451-Y478 PolarHBondContact N-O 2.88Å; N475-Y478 WeakPolarHBondContact ND2-CD2 3.5Å; N475-Y478 PolarHBondContact O-N 3.17Å; N475-Y478 PolarHBondContact OD1-N 2.9Å; Y478-M480 VanDerWaalsContact C-N 3.32Å
479	G	72.8	Confident	75.8	Confident	1 Å²	1	68 Å²	68	1%	0.01	34%	0.343	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	31.3	-179.6	0	0	0	0	0	113.4	N475	N475-G479 PolarHBondContact O-N 3.45Å
480	M	78.8	Confident	75.6	Confident	52 Å²	52	71.3 Å²	71.3	26%	0.256	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	164.2	-178.1	63.7	-172.8	-71.5	0	0	110.8	N475 Y478	N475-M480 WeakPolarHBondContact CA-O 3.08Å; N475-M480 VanDerWaalsContact CB-O 3.22Å; N475-M480 WeakPolarHBondContact CB-O 3.01Å; N475-M480 PolarHBondContact N-O 3.45Å; N475-M480 PolarHBondContact O-N 3.46Å; Y478-M480 VanDerWaalsContact C-N 3.32Å
481	I	82.8	Confident	75.5	Confident	7 Å²	7	72.4 Å²	72.4	4%	0.036	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	152.1	167.7	59.2	170.9	0	0	0	110.8	Q459 R473 Y493	Q459-I481 HydrophobicContact CB-CG2 3.9Å; Q459-I481 WeakPolarHBondContact O-CG2 3.41Å; R473-I481 CarbonylContact O-C 3.55Å; R473-I481 WeakPolarHBondContact O-CA 3.22Å; I481-Y493 HydrophobicContact CD1-CD1 4.04Å; I481-Y493 HydrophobicContact CD1-CE1 3.92Å; I481-Y493 HydrophobicContact CG1-CE1 4.03Å
482	E	78.4	Confident	75.7	Confident	116 Å²	116	74.5 Å²	74.5	54%	0.542	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	119	170.5	-175	176.7	-161.8	0	0	108.9	R473	R473-E482 PolarHBondContact N-O 2.75Å; R473-E482 PolarHBondContact O-N 2.83Å
483	C	81.5	Confident	75.9	Confident	20 Å²	20	76.9 Å²	76.9	14%	0.135	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.4	178.4	-69.8	0	0	0	0	111.5	C466 V471 E492	C466-C483 WeakPolarHBondContact CA-SG 3.35Å; C466-C483 HydrophobicContact CB-CB 3.79Å; C466-C483 WeakPolarHBondContact CB-SG 3.23Å; C466-C483 VanDerWaalsContact SG-CA 3.55Å; C466-C483 WeakPolarHBondContact SG-CB 3.42Å; C466-C483 CovalentContact SG-SG 2.03Å; C466-C483 PolarHBondContact SG-SG 3.18Å; V471-C483 WeakPolarHBondContact O-CA 3.43Å; C483-E492 VanDerWaalsContact CB-O 3.3Å; C483-E492 WeakPolarHBondContact CB-O 3.43Å
484	T	77.2	Confident	76	Confident	87 Å²	87	68.7 Å²	68.7	53%	0.534	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.3	165.9	-53.6	0	0	0	0	109.3	G470 V471	G470-T484 CarbonylContact C-O 3.31Å; G470-T484 WeakPolarHBondContact CA-O 3.48Å; V471-T484 PolarHBondContact N-O 3.35Å; V471-T484 PolarHBondContact O-N 3.29Å
485	C	78.2	Confident	76.2	Confident	40 Å²	40	68 Å²	68	27%	0.27	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	143.2	-174	-55.2	0	0	0	0	114.1	N469 Y489 G491 C494	N469-C485 CarbonylContact O-C 3.52Å; N469-C485 WeakPolarHBondContact O-CA 3.33Å; C485-Y489 WeakPolarHBondContact CB-O 3.49Å; C485-G491 PolarHBondContact SG-O 3.18Å; C485-G491 VanDerWaalsContact SG-O 3.34Å; C485-C494 WeakPolarHBondContact CA-SG 3.29Å; C485-C494 HydrophobicContact CB-CB 3.78Å; C485-C494 WeakPolarHBondContact CB-SG 3.24Å; C485-C494 WeakPolarHBondContact SG-CA 2.77Å; C485-C494 WeakPolarHBondContact SG-CB 2.85Å; C485-C494 CovalentContact SG-SG 2.04Å; C485-C494 PolarHBondContact SG-SG 2.82Å
486	Y	75.5	Confident	76.3	Confident	120 Å²	120	72.3 Å²	72.3	47%	0.471	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-67.9	156.2	167.5	-59.4	-41	0	0	0	110.9	Y468 N469 V471 S488 Y489	Y468-Y486 WeakPolarHBondContact O-CE2 3.43Å; N469-Y486 WeakPolarHBondContact O-CD2 3.33Å; N469-Y486 PolarHBondContact O-N 2.8Å; V471-Y486 HydrophobicContact CG2-CE1 3.96Å; Y486-S488 PolarHBondContact O-N 3.02Å; Y486-Y489 PolarHBondContact O-N 3.17Å
487	Q	62.3	Low	76.4	Confident	108 Å²	108	76.2 Å²	76.2	51%	0.505	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	136.2	-178.6	-156.6	175	9.3	0	0	111.1
488	S	65.2	Low	76.3	Confident	55 Å²	55	73 Å²	73	39%	0.385	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.7	3.6	-169.3	-49.2	0	0	0	0	116.4	Y486 K497 D498	Y486-S488 PolarHBondContact O-N 3.02Å; S488-K497 CarbonylContact O-C 3.48Å; S488-K497 VanDerWaalsContact O-CA 3.28Å; S488-K497 WeakPolarHBondContact O-CA 3.37Å; S488-D498 PolarHBondContact O-N 2.88Å
489	Y	78.3	Confident	75.5	Confident	65 Å²	65	70.2 Å²	70.2	26%	0.255	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	147	169.1	-66.4	-94	0	0	0	111.1	N469 C485 Y486 C494 K496 K497	N469-Y489 HydrophobicContact CB-CD1 3.62Å; N469-Y489 HydrophobicContact CB-CD2 3.74Å; N469-Y489 HydrophobicContact CB-CE1 3.97Å; N469-Y489 HydrophobicContact CB-CE2 4.09Å; N469-Y489 HydrophobicContact CB-CG 3.48Å; N469-Y489 VanDerWaalsContact CB-CG 3.48Å; N469-Y489 VanDerWaalsContact CG-CD1 3.45Å; N469-Y489 VanDerWaalsContact ND2-CD1 3.34Å; N469-Y489 WeakPolarHBondContact ND2-CD1 3.44Å; N469-Y489 WeakPolarHBondContact ND2-CE1 3.23Å; N469-Y489 WeakPolarHBondContact OD1-CE2 3.4Å; N469-Y489 PolarHBondContact OD1-OH 3.43Å; C485-Y489 WeakPolarHBondContact CB-O 3.49Å; Y486-Y489 PolarHBondContact O-N 3.17Å; Y489-C494 WeakPolarHBondContact CD1-O 3.47Å; Y489-K496 CarbonylContact C-O 3.49Å; Y489-K496 VanDerWaalsContact CA-O 3.25Å; Y489-K496 WeakPolarHBondContact CA-O 3.01Å; Y489-K497 HydrophobicContact CD1-CB 4.31Å; Y489-K497 HydrophobicContact CE1-CB 4.1Å; Y489-K497 HydrophobicContact CE1-CG 4.26Å
490	Q	78.7	Confident	74.4	Confident	100 Å²	100	75.3 Å²	75.3	47%	0.467	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	165.2	-178.9	-67.1	179.6	7.8	0	0	109.1	K496 D498	Q490-K496 PolarHBondContact N-O 2.91Å; Q490-K496 WeakPolarHBondContact O-CB 3.49Å; Q490-K496 PolarHBondContact O-N 2.89Å; Q490-D498 HydrophobicContact CG-CB 4.42Å; Q490-D498 PolarHBondContact NE2-OD2 3.49Å
491	G	78.9	Confident	73.1	Confident	33 Å²	33	79.2 Å²	79.2	34%	0.34	41%	0.405	S	S	.	.	S	Bend	trans	105.7	163.7	-178.8	0	0	0	0	0	112.1	C485 Y493 C494	C485-G491 PolarHBondContact SG-O 3.18Å; C485-G491 VanDerWaalsContact SG-O 3.34Å; G491-Y493 PolarHBondContact O-N 3.17Å; G491-C494 PolarHBondContact O-N 3Å; G491-C494 VanDerWaalsContact O-N 3.17Å
492	E	81.7	Confident	71.3	Confident	114 Å²	114	84.8 Å²	84.8	53%	0.533	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-31.3	-178	-172.7	-176.1	156.4	0	0	112.6	C483	C483-E492 VanDerWaalsContact CB-O 3.3Å; C483-E492 WeakPolarHBondContact CB-O 3.43Å
493	Y	86.5	Confident	69.9	Low	78 Å²	78	85.2 Å²	85.2	31%	0.306	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	13.7	178.5	-57.1	-84.6	0	0	0	112.5	C466 N467 I481 G491 D495	C466-Y493 CarbonylContact C-O 3.58Å; C466-Y493 WeakPolarHBondContact CA-O 3.5Å; N467-Y493 PolarHBondContact ND2-O 3.32Å; I481-Y493 HydrophobicContact CD1-CD1 4.04Å; I481-Y493 HydrophobicContact CD1-CE1 3.92Å; I481-Y493 HydrophobicContact CG1-CE1 4.03Å; G491-Y493 PolarHBondContact O-N 3.17Å; Y493-D495 PolarHBondContact O-N 3.49Å
494	C	84	Confident	68.4	Low	0 Å²	0	90.6 Å²	90.6	0%	0	45%	0.453	C	S	.	.	S	Bend	trans	57.6	34.6	-176.6	-45.3	0	0	0	0	114.1	N469 C485 Y489 G491	N469-C494 HydrophobicContact CB-CB 3.79Å; N469-C494 PolarHBondContact ND2-O 2.78Å; C485-C494 WeakPolarHBondContact CA-SG 3.29Å; C485-C494 HydrophobicContact CB-CB 3.78Å; C485-C494 WeakPolarHBondContact CB-SG 3.24Å; C485-C494 WeakPolarHBondContact SG-CA 2.77Å; C485-C494 WeakPolarHBondContact SG-CB 2.85Å; C485-C494 CovalentContact SG-SG 2.04Å; C485-C494 PolarHBondContact SG-SG 2.82Å; Y489-C494 WeakPolarHBondContact CD1-O 3.47Å; G491-C494 PolarHBondContact O-N 3Å; G491-C494 VanDerWaalsContact O-N 3.17Å
495	D	82.8	Confident	67.1	Low	93 Å²	93	93 Å²	93	50%	0.497	46%	0.462	S	S	.	.			trans	-82.7	-25.5	-178.8	65.3	-46.7	0	0	0	112.8	Y493	Y493-D495 PolarHBondContact O-N 3.49Å
496	K	75.4	Confident	65.6	Low	132 Å²	132	97.2 Å²	97.2	57%	0.574	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	114.4	-177.9	-60.3	173.9	-173.1	169.7	0	109.6	Y489 Q490 D498	Y489-K496 CarbonylContact C-O 3.49Å; Y489-K496 VanDerWaalsContact CA-O 3.25Å; Y489-K496 WeakPolarHBondContact CA-O 3.01Å; Q490-K496 PolarHBondContact N-O 2.91Å; Q490-K496 WeakPolarHBondContact O-CB 3.49Å; Q490-K496 PolarHBondContact O-N 2.89Å; K496-D498 PolarHBondContact O-N 3.34Å
497	K	71.7	Confident	64.3	Low	149 Å²	149	96 Å²	96	65%	0.648	48%	0.482	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	116.9	166.1	-166.2	171.7	-176.2	170	0	109	S488 Y489 G499	S488-K497 CarbonylContact O-C 3.48Å; S488-K497 VanDerWaalsContact O-CA 3.28Å; S488-K497 WeakPolarHBondContact O-CA 3.37Å; Y489-K497 HydrophobicContact CD1-CB 4.31Å; Y489-K497 HydrophobicContact CE1-CB 4.1Å; Y489-K497 HydrophobicContact CE1-CG 4.26Å; K497-G499 PolarHBondContact O-N 3.32Å
498	D	62.1	Low	63.8	Low	46 Å²	46	95.3 Å²	95.3	25%	0.246	49%	0.488	C	S	.	.			trans	-60.1	104.4	173.2	-170.3	10.1	0	0	0	108.9	S488 Q490 K496 K500	S488-D498 PolarHBondContact O-N 2.88Å; Q490-D498 HydrophobicContact CG-CB 4.42Å; Q490-D498 PolarHBondContact NE2-OD2 3.49Å; K496-D498 PolarHBondContact O-N 3.34Å; D498-K500 PolarHBondContact O-N 3.17Å; D498-K500 VanDerWaalsContact O-N 3.1Å; D498-K500 VanDerWaalsContact OD1-CB 3.28Å; D498-K500 WeakPolarHBondContact OD1-CB 3.37Å; D498-K500 WeakPolarHBondContact OD1-CD 3.21Å; D498-K500 WeakPolarHBondContact OD1-CG 3.13Å; D498-K500 PolarHBondContact OD1-N 3.17Å
499	G	51.8	Low	63.8	Low	58 Å²	58	96.5 Å²	96.5	60%	0.598	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	1.8	178	0	0	0	0	0	113.7	K497 L501 I502	K497-G499 PolarHBondContact O-N 3.32Å; G499-L501 PolarHBondContact O-N 2.92Å; G499-L501 VanDerWaalsContact O-N 3.09Å; G499-I502 PolarHBondContact O-N 3.42Å
500	K	50.1	Low	63.1	Low	109 Å²	109	98.1 Å²	98.1	47%	0.474	51%	0.513	S	S	.	.	H	α-helix	trans	-69	-2.7	-175.7	-75	-178.3	176.1	-178.4	0	115.7	D498 I502 E503 R504	D498-K500 PolarHBondContact O-N 3.17Å; D498-K500 VanDerWaalsContact O-N 3.1Å; D498-K500 VanDerWaalsContact OD1-CB 3.28Å; D498-K500 WeakPolarHBondContact OD1-CB 3.37Å; D498-K500 WeakPolarHBondContact OD1-CD 3.21Å; D498-K500 WeakPolarHBondContact OD1-CG 3.13Å; D498-K500 PolarHBondContact OD1-N 3.17Å; K500-I502 VanDerWaalsContact C-N 3.26Å; K500-I502 PolarHBondContact O-N 2.91Å; K500-E503 HydrophobicContact CB-CB 4.44Å; K500-E503 HydrophobicContact CG-CB 4.36Å; K500-E503 WeakPolarHBondContact CG-OE2 2.93Å; K500-E503 PolarHBondContact O-N 3.29Å; K500-R504 PolarHBondContact O-N 2.04Å
501	L	51.6	Low	62.5	Low	133 Å²	133	96.7 Å²	96.7	70%	0.696	52%	0.515	S	S	*	.	H	α-helix	trans	-63.3	-33.9	168.7	-160.4	72.1	0	0	0	111.7	G499 L505	G499-L501 PolarHBondContact O-N 2.92Å; G499-L501 VanDerWaalsContact O-N 3.09Å; L501-L505 PolarHBondContact O-N 2.72Å
502	I	45	Very low	62	Low	125 Å²	125	99 Å²	99	64%	0.641	52%	0.519	S	S	*	.	H	α-helix	trans	-79	-30.5	174.7	-58.6	178.7	0	0	0	111.1	G499 K500 L505	G499-I502 PolarHBondContact O-N 3.42Å; K500-I502 VanDerWaalsContact C-N 3.26Å; K500-I502 PolarHBondContact O-N 2.91Å; I502-L505 PolarHBondContact O-N 3.01Å
503	E	50.3	Low	61.7	Low	124 Å²	124	96.4 Å²	96.4	58%	0.579	51%	0.511	S	S	*	.	H	α-helix	trans	-71.6	-36.5	178	-144.5	169	-148.7	0	0	111.7	K500 I506 N507	K500-E503 HydrophobicContact CB-CB 4.44Å; K500-E503 HydrophobicContact CG-CB 4.36Å; K500-E503 WeakPolarHBondContact CG-OE2 2.93Å; K500-E503 PolarHBondContact O-N 3.29Å; E503-I506 CarbonylContact O-C 3.6Å; E503-I506 PolarHBondContact O-N 3.24Å; E503-N507 PolarHBondContact O-N 3.2Å
504	R	48	Very low	61.4	Low	133 Å²	133	96.6 Å²	96.6	50%	0.502	52%	0.52	S	S	.	.	H	α-helix	trans	-72.2	-27.3	173.9	-76.9	-167	-168.7	179.4	5.5	114.4	D60 K500 I506 N507	D60-R504 IonicContact OD2-NH1 3.25Å; D60-R504 PolarHBondContact OD2-NH1 2.93Å; K500-R504 PolarHBondContact O-N 2.04Å; R504-I506 PolarHBondContact O-N 3.28Å; R504-I506 VanDerWaalsContact O-N 3.16Å; R504-N507 WeakPolarHBondContact O-CB 2.83Å; R504-N507 PolarHBondContact O-N 3.3Å
505	L	50.9	Low	61	Low	137 Å²	137	101.6 Å²	101.6	72%	0.717	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-20.6	170.6	-83.6	159	0	0	0	112.1	L501 I502	L501-L505 PolarHBondContact O-N 2.72Å; I502-L505 PolarHBondContact O-N 3.01Å
506	I	47.2	Very low	60.9	Low	129 Å²	129	101.1 Å²	101.1	66%	0.662	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	15.3	178.2	-45.9	171.9	0	0	0	110.5	E503 R504 P508	E503-I506 CarbonylContact O-C 3.6Å; E503-I506 PolarHBondContact O-N 3.24Å; R504-I506 PolarHBondContact O-N 3.28Å; R504-I506 VanDerWaalsContact O-N 3.16Å; I506-P508 WeakPolarHBondContact O-CD 3.02Å
507	N	48.6	Very low	61.3	Low	94 Å²	94	98.1 Å²	98.1	50%	0.503	54%	0.54	S	S	.	.			trans	-60	117.7	170.1	-94.3	-0.7	0	0	0	107.8	E503 R504 T509	E503-N507 PolarHBondContact O-N 3.2Å; R504-N507 WeakPolarHBondContact O-CB 2.83Å; R504-N507 PolarHBondContact O-N 3.3Å; N507-T509 PolarHBondContact O-N 2.9Å
508	P	52	Low	61.9	Low	95 Å²	95	94.5 Å²	94.5	62%	0.617	53%	0.53	S	S	*	.			trans	-68.3	95.8	-173.3	21	-26.4	0	0	0	109.4	I506 V513	I506-P508 WeakPolarHBondContact O-CD 3.02Å; P508-V513 HydrophobicContact CB-CG2 3.16Å; P508-V513 HydrophobicContact CG-CG2 4.39Å
509	T	63.4	Low	62.9	Low	80 Å²	80	94.5 Å²	94.5	49%	0.491	54%	0.54	S	S	.	.			trans	-66.4	145.2	158.6	56.3	0	0	0	0	107.6	N507 S511 N512 V513	N507-T509 PolarHBondContact O-N 2.9Å; T509-S511 PolarHBondContact O-N 3.13Å; T509-N512 WeakPolarHBondContact O-CA 2.79Å; T509-N512 WeakPolarHBondContact O-CB 3.43Å; T509-N512 PolarHBondContact O-N 3.16Å; T509-N512 PolarHBondContact OG1-ND2 3.21Å; T509-V513 WeakPolarHBondContact O-CG2 3.24Å; T509-V513 PolarHBondContact O-N 2.71Å
510	S	64.8	Low	64.7	Low	98 Å²	98	99.1 Å²	99.1	69%	0.685	54%	0.544	S	S	*	.	H	α-helix	trans	-50.8	-35	-177.9	51.8	0	0	0	0	112.4	V513 V514	S510-V513 PolarHBondContact O-N 3.23Å; S510-V514 WeakPolarHBondContact O-CB 2.86Å; S510-V514 WeakPolarHBondContact O-CG2 3.1Å; S510-V514 PolarHBondContact O-N 3.3Å
511	S	65.9	Low	66.5	Low	71 Å²	71	97.3 Å²	97.3	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-65	-42.5	174	-169.6	0	0	0	0	113.2	T509 V514 N515	T509-S511 PolarHBondContact O-N 3.13Å; S511-V514 PolarHBondContact O-N 2.85Å; S511-N515 PolarHBondContact O-N 3.24Å; S511-N515 PolarHBondContact O-ND2 2.88Å
512	N	69.2	Low	68.2	Low	81 Å²	81	96 Å²	96	43%	0.433	54%	0.536	S	S	.	.	H	α-helix	trans	-68.5	-39.5	177.2	-71	-5.8	0	0	0	111	T509 N515 V516	T509-N512 WeakPolarHBondContact O-CA 2.79Å; T509-N512 WeakPolarHBondContact O-CB 3.43Å; T509-N512 PolarHBondContact O-N 3.16Å; T509-N512 PolarHBondContact OG1-ND2 3.21Å; N512-N515 PolarHBondContact O-N 2.74Å; N512-V516 WeakPolarHBondContact O-CB 3.02Å; N512-V516 VanDerWaalsContact O-CG2 3.24Å; N512-V516 WeakPolarHBondContact O-CG2 3.09Å; N512-V516 PolarHBondContact O-N 3.35Å
513	V	75.3	Confident	70.2	Confident	59 Å²	59	91.8 Å²	91.8	36%	0.358	52%	0.523	S	S	.	.	H	α-helix	trans	-60.7	-47.6	171.7	-179.8	0	0	0	0	110.5	P508 T509 S510 N515 V516 V517	P508-V513 HydrophobicContact CB-CG2 3.16Å; P508-V513 HydrophobicContact CG-CG2 4.39Å; T509-V513 WeakPolarHBondContact O-CG2 3.24Å; T509-V513 PolarHBondContact O-N 2.71Å; S510-V513 PolarHBondContact O-N 3.23Å; V513-N515 VanDerWaalsContact C-N 3.33Å; V513-N515 PolarHBondContact O-N 3.39Å; V513-V516 PolarHBondContact O-N 2.8Å; V513-V517 HydrophobicContact CG1-CG2 3.75Å; V513-V517 WeakPolarHBondContact O-CA 3.38Å; V513-V517 WeakPolarHBondContact O-CB 3.46Å; V513-V517 WeakPolarHBondContact O-CG2 3.42Å; V513-V517 PolarHBondContact O-N 3.27Å
514	V	79.3	Confident	72	Confident	82 Å²	82	92.7 Å²	92.7	50%	0.497	53%	0.525	S	S	.	.	H	α-helix	trans	-60.2	-44.2	179.8	168.8	0	0	0	0	110.4	S510 S511 V517 V518	S510-V514 WeakPolarHBondContact O-CB 2.86Å; S510-V514 WeakPolarHBondContact O-CG2 3.1Å; S510-V514 PolarHBondContact O-N 3.3Å; S511-V514 PolarHBondContact O-N 2.85Å; V514-V517 CarbonylContact O-C 3.58Å; V514-V517 PolarHBondContact O-N 2.67Å; V514-V518 HydrophobicContact CG1-CG2 4.12Å; V514-V518 WeakPolarHBondContact O-CB 3.26Å; V514-V518 WeakPolarHBondContact O-CG2 3.47Å; V514-V518 PolarHBondContact O-N 2.85Å
515	N	76.5	Confident	73.8	Confident	105 Å²	105	91 Å²	91	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-65.8	-41.4	178.5	-71.6	-21.5	0	0	0	112.5	S511 N512 V513 V518 G519	S511-N515 PolarHBondContact O-N 3.24Å; S511-N515 PolarHBondContact O-ND2 2.88Å; N512-N515 PolarHBondContact O-N 2.74Å; V513-N515 VanDerWaalsContact C-N 3.33Å; V513-N515 PolarHBondContact O-N 3.39Å; N515-V518 PolarHBondContact O-N 2.78Å; N515-G519 PolarHBondContact O-N 2.92Å
516	V	80.4	Confident	75.3	Confident	84 Å²	84	90.7 Å²	90.7	51%	0.509	52%	0.522	S	S	.	.	H	α-helix	trans	-65.7	-41.5	174.9	169.1	0	0	0	0	110.9	N512 V513 G519 F520	N512-V516 WeakPolarHBondContact O-CB 3.02Å; N512-V516 VanDerWaalsContact O-CG2 3.24Å; N512-V516 WeakPolarHBondContact O-CG2 3.09Å; N512-V516 PolarHBondContact O-N 3.35Å; V513-V516 PolarHBondContact O-N 2.8Å; V516-G519 PolarHBondContact O-N 3.07Å; V516-F520 HydrophobicContact CG1-CD2 3.55Å; V516-F520 HydrophobicContact CG1-CE2 3.4Å; V516-F520 WeakPolarHBondContact O-CD2 3.41Å; V516-F520 PolarHBondContact O-N 3.41Å
517	V	83.9	Confident	77.2	Confident	69 Å²	69	89 Å²	89	42%	0.418	51%	0.514	S	S	.	.	H	α-helix	trans	-66	-44.5	176.6	168.2	0	0	0	0	110.6	V513 V514 G519 F520 V521	V513-V517 HydrophobicContact CG1-CG2 3.75Å; V513-V517 WeakPolarHBondContact O-CA 3.38Å; V513-V517 WeakPolarHBondContact O-CB 3.46Å; V513-V517 WeakPolarHBondContact O-CG2 3.42Å; V513-V517 PolarHBondContact O-N 3.27Å; V514-V517 CarbonylContact O-C 3.58Å; V514-V517 PolarHBondContact O-N 2.67Å; V517-G519 VanDerWaalsContact C-N 3.3Å; V517-G519 PolarHBondContact O-N 3.47Å; V517-F520 CarbonylContact O-C 3.59Å; V517-F520 PolarHBondContact O-N 3.28Å; V517-V521 HydrophobicContact CG1-CG2 4.02Å; V517-V521 VanDerWaalsContact O-CB 3.32Å; V517-V521 WeakPolarHBondContact O-CB 3.28Å; V517-V521 WeakPolarHBondContact O-CG2 3.39Å; V517-V521 PolarHBondContact O-N 2.74Å
518	V	83.9	Confident	78.8	Confident	72 Å²	72	87.5 Å²	87.5	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-60.7	-42.8	175.2	169.1	0	0	0	0	109.9	V514 N515 V521 L522	V514-V518 HydrophobicContact CG1-CG2 4.12Å; V514-V518 WeakPolarHBondContact O-CB 3.26Å; V514-V518 WeakPolarHBondContact O-CG2 3.47Å; V514-V518 PolarHBondContact O-N 2.85Å; N515-V518 PolarHBondContact O-N 2.78Å; V518-V521 PolarHBondContact O-N 3.44Å; V518-L522 HydrophobicContact CG1-CD1 4.05Å; V518-L522 HydrophobicContact CG1-CG 4.45Å; V518-L522 WeakPolarHBondContact O-CB 3.11Å; V518-L522 WeakPolarHBondContact O-CG 3.48Å; V518-L522 PolarHBondContact O-N 2.88Å
519	G	83.5	Confident	80.3	Confident	46 Å²	46	89.6 Å²	89.6	47%	0.474	51%	0.513	S	S	.	.	H	α-helix	trans	-59.8	-46.4	172.8	0	0	0	0	0	112.9	N515 V516 V517 G523	N515-G519 PolarHBondContact O-N 2.92Å; V516-G519 PolarHBondContact O-N 3.07Å; V517-G519 VanDerWaalsContact C-N 3.3Å; V517-G519 PolarHBondContact O-N 3.47Å; G519-G523 PolarHBondContact O-N 3.38Å
520	F	89.3	Confident	81.1	Confident	155 Å²	155	89.5 Å²	89.5	68%	0.68	52%	0.515	S	S	*	.	H	α-helix	trans	-64.4	-39.8	175.1	-83.3	-64.7	0	0	0	112.4	V516 V517 G523 F524	V516-F520 HydrophobicContact CG1-CD2 3.55Å; V516-F520 HydrophobicContact CG1-CE2 3.4Å; V516-F520 WeakPolarHBondContact O-CD2 3.41Å; V516-F520 PolarHBondContact O-N 3.41Å; V517-F520 CarbonylContact O-C 3.59Å; V517-F520 PolarHBondContact O-N 3.28Å; F520-G523 PolarHBondContact O-N 2.85Å; F520-F524 VanDerWaalsContact O-CB 3.23Å; F520-F524 WeakPolarHBondContact O-CB 3.33Å; F520-F524 PolarHBondContact O-N 3.15Å
521	V	88.5	Confident	81.9	Confident	72 Å²	72	88.9 Å²	88.9	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-46.3	-179.1	167.9	0	0	0	0	110.7	V517 V518 G523 F524 L525	V517-V521 HydrophobicContact CG1-CG2 4.02Å; V517-V521 VanDerWaalsContact O-CB 3.32Å; V517-V521 WeakPolarHBondContact O-CB 3.28Å; V517-V521 WeakPolarHBondContact O-CG2 3.39Å; V517-V521 PolarHBondContact O-N 2.74Å; V518-V521 PolarHBondContact O-N 3.44Å; V521-G523 VanDerWaalsContact C-N 3.32Å; V521-G523 PolarHBondContact O-N 3.45Å; V521-F524 PolarHBondContact O-N 3.02Å; V521-L525 HydrophobicContact CG1-CD1 3.98Å; V521-L525 HydrophobicContact CG1-CG 4.44Å; V521-L525 WeakPolarHBondContact O-CB 3.35Å; V521-L525 VanDerWaalsContact O-CG 3.31Å; V521-L525 WeakPolarHBondContact O-CG 3.22Å; V521-L525 PolarHBondContact O-N 3.17Å
522	L	85.6	Confident	82.4	Confident	106 Å²	106	87.6 Å²	87.6	56%	0.555	50%	0.498	S	S	*	.	H	α-helix	trans	-63.3	-40.5	176	-68.6	175.1	0	0	0	111.2	V518 M526	V518-L522 HydrophobicContact CG1-CD1 4.05Å; V518-L522 HydrophobicContact CG1-CG 4.45Å; V518-L522 WeakPolarHBondContact O-CB 3.11Å; V518-L522 WeakPolarHBondContact O-CG 3.48Å; V518-L522 PolarHBondContact O-N 2.88Å; L522-M526 WeakPolarHBondContact O-CG 3.46Å; L522-M526 PolarHBondContact O-N 2.87Å; L522-M526 VanDerWaalsContact O-N 3.16Å
523	G	87.9	Confident	82.5	Confident	36 Å²	36	87.1 Å²	87.1	37%	0.371	51%	0.513	S	S	.	.	H	α-helix	trans	-64.3	-39.7	174	0	0	0	0	0	113.4	G519 F520 V521 L527	G519-G523 PolarHBondContact O-N 3.38Å; F520-G523 PolarHBondContact O-N 2.85Å; V521-G523 VanDerWaalsContact C-N 3.32Å; V521-G523 PolarHBondContact O-N 3.45Å; G523-L527 WeakPolarHBondContact O-CG 3.32Å; G523-L527 PolarHBondContact O-N 3.35Å; G523-L527 VanDerWaalsContact O-N 3.15Å
524	F	87.4	Confident	82.2	Confident	143 Å²	143	86.9 Å²	86.9	63%	0.627	52%	0.516	S	S	*	.	H	α-helix	trans	-71.3	-39.1	179.8	-152.1	-91.7	0	0	0	111.8	F520 V521 L527 T528	F520-F524 VanDerWaalsContact O-CB 3.23Å; F520-F524 WeakPolarHBondContact O-CB 3.33Å; F520-F524 PolarHBondContact O-N 3.15Å; V521-F524 PolarHBondContact O-N 3.02Å; F524-L527 PolarHBondContact O-N 3.09Å; F524-T528 HydrophobicContact CD1-CG2 3.64Å; F524-T528 HydrophobicContact CE1-CG2 3.68Å; F524-T528 VanDerWaalsContact O-CG2 3.29Å; F524-T528 WeakPolarHBondContact O-CG2 3.4Å; F524-T528 PolarHBondContact O-N 3.47Å; F524-T528 PolarHBondContact O-OG1 3.48Å
525	L	87.1	Confident	81.5	Confident	96 Å²	96	86 Å²	86	50%	0.503	52%	0.518	S	S	.	.	H	α-helix	trans	-64.5	-39.3	175.1	-73.3	172.6	0	0	0	112.3	V521 L527 T528 L529	V521-L525 HydrophobicContact CG1-CD1 3.98Å; V521-L525 HydrophobicContact CG1-CG 4.44Å; V521-L525 WeakPolarHBondContact O-CB 3.35Å; V521-L525 VanDerWaalsContact O-CG 3.31Å; V521-L525 WeakPolarHBondContact O-CG 3.22Å; V521-L525 PolarHBondContact O-N 3.17Å; L525-L527 VanDerWaalsContact C-N 3.33Å; L525-L527 PolarHBondContact O-N 2.83Å; L525-T528 WeakPolarHBondContact CA-OG1 3.27Å; L525-T528 PolarHBondContact O-OG1 3.46Å; L525-T528 VanDerWaalsContact O-OG1 3.06Å; L525-L529 PolarHBondContact O-N 2.9Å
526	M	82.4	Confident	81	Confident	131 Å²	131	87.2 Å²	87.2	65%	0.645	53%	0.529	S	S	*	.	H	α-helix	trans	-63.9	-38.3	173.6	-75.8	-65.4	-69.9	0	0	111.9	L522 C530	L522-M526 WeakPolarHBondContact O-CG 3.46Å; L522-M526 PolarHBondContact O-N 2.87Å; L522-M526 VanDerWaalsContact O-N 3.16Å; M526-C530 PolarHBondContact O-N 3.38Å; M526-C530 PolarHBondContact O-SG 3.45Å
527	L	86.6	Confident	79.8	Confident	93 Å²	93	90.6 Å²	90.6	49%	0.487	54%	0.539	S	S	.	.	H	α-helix	trans	-73.5	-40.6	176.9	-74.9	165.2	0	0	0	112.8	G523 F524 L525 L529 C530 F531	G523-L527 WeakPolarHBondContact O-CG 3.32Å; G523-L527 PolarHBondContact O-N 3.35Å; G523-L527 VanDerWaalsContact O-N 3.15Å; F524-L527 PolarHBondContact O-N 3.09Å; L525-L527 VanDerWaalsContact C-N 3.33Å; L525-L527 PolarHBondContact O-N 2.83Å; L527-L529 VanDerWaalsContact C-N 3.28Å; L527-L529 PolarHBondContact O-N 3.1Å; L527-C530 PolarHBondContact O-N 2.73Å; L527-C530 VanDerWaalsContact O-N 3.11Å; L527-F531 HydrophobicContact CD2-CD2 4.44Å; L527-F531 HydrophobicContact CD2-CE2 3.86Å; L527-F531 VanDerWaalsContact O-CD2 3.28Å; L527-F531 WeakPolarHBondContact O-CD2 3.32Å; L527-F531 PolarHBondContact O-N 2.6Å
528	T	82.4	Confident	78.6	Confident	63 Å²	63	89.5 Å²	89.5	39%	0.387	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-33.6	179.8	53.9	0	0	0	0	112.4	F524 L525 G532	F524-T528 HydrophobicContact CD1-CG2 3.64Å; F524-T528 HydrophobicContact CE1-CG2 3.68Å; F524-T528 VanDerWaalsContact O-CG2 3.29Å; F524-T528 WeakPolarHBondContact O-CG2 3.4Å; F524-T528 PolarHBondContact O-N 3.47Å; F524-T528 PolarHBondContact O-OG1 3.48Å; L525-T528 WeakPolarHBondContact CA-OG1 3.27Å; L525-T528 PolarHBondContact O-OG1 3.46Å; L525-T528 VanDerWaalsContact O-OG1 3.06Å; T528-G532 WeakPolarHBondContact O-CA 3.4Å; T528-G532 PolarHBondContact O-N 3.34Å
529	L	83.5	Confident	77.4	Confident	139 Å²	139	90 Å²	90	73%	0.728	52%	0.523	S	S	*	.	H	α-helix	trans	-68.3	-38.1	171.8	-75	166.4	0	0	0	112.4	L525 L527	L525-L529 PolarHBondContact O-N 2.9Å; L527-L529 VanDerWaalsContact C-N 3.28Å; L527-L529 PolarHBondContact O-N 3.1Å
530	C	80	Confident	75.6	Confident	79 Å²	79	99.4 Å²	99.4	53%	0.534	54%	0.544	S	S	.	.	H	α-helix	trans	-68.7	-31.4	176.7	-67.9	0	0	0	0	113.9	M526 L527	M526-C530 PolarHBondContact O-N 3.38Å; M526-C530 PolarHBondContact O-SG 3.45Å; L527-C530 PolarHBondContact O-N 2.73Å; L527-C530 VanDerWaalsContact O-N 3.11Å
531	F	81.3	Confident	73.5	Confident	85 Å²	85	98.6 Å²	98.6	37%	0.373	54%	0.537	S	S	.	.	H	α-helix	trans	-105.9	-26.9	-175	-72.5	-99.2	0	0	0	115.1	L527 G533 A534 A535 F557	L527-F531 HydrophobicContact CD2-CD2 4.44Å; L527-F531 HydrophobicContact CD2-CE2 3.86Å; L527-F531 VanDerWaalsContact O-CD2 3.28Å; L527-F531 WeakPolarHBondContact O-CD2 3.32Å; L527-F531 PolarHBondContact O-N 2.6Å; F531-G533 VanDerWaalsContact C-N 3.31Å; F531-G533 PolarHBondContact O-N 2.84Å; F531-A534 WeakPolarHBondContact O-CA 3.15Å; F531-A534 WeakPolarHBondContact O-CB 3.26Å; F531-A534 PolarHBondContact O-N 3.27Å; F531-A535 PolarHBondContact O-N 2.93Å; F531-F557 HydrophobicContact CD1-CB 4.18Å; F531-F557 HydrophobicContact CD1-CD1 4.4Å; F531-F557 HydrophobicContact CD1-CG 4.48Å; F531-F557 HydrophobicContact CE1-CB 3.61Å; F531-F557 AromaticContact CE1-CD1 3.61Å; F531-F557 HydrophobicContact CE1-CD1 3.61Å; F531-F557 AromaticContact CE1-CG 3.93Å; F531-F557 HydrophobicContact CE1-CG 3.93Å; F531-F557 HydrophobicContact CE2-CD1 4.23Å; F531-F557 HydrophobicContact CZ-CB 4.36Å; F531-F557 AromaticContact CZ-CD1 3.49Å; F531-F557 HydrophobicContact CZ-CD1 3.49Å; F531-F557 VanDerWaalsContact CZ-CD1 3.49Å; F531-F557 HydrophobicContact CZ-CE1 4.17Å; F531-F557 HydrophobicContact CZ-CG 4.28Å
532	G	75.5	Confident	71.8	Confident	43 Å²	43	99.1 Å²	99.1	44%	0.443	53%	0.531	S	S	.	.	H	α-helix	trans	-65.8	-32.9	177.6	0	0	0	0	0	113.1	T528 A534 A535	T528-G532 WeakPolarHBondContact O-CA 3.4Å; T528-G532 PolarHBondContact O-N 3.34Å; G532-A534 PolarHBondContact O-N 3.19Å; G532-A534 VanDerWaalsContact O-N 3.17Å; G532-A535 PolarHBondContact O-N 2.82Å
533	G	72.1	Confident	69.9	Low	72 Å²	72	106.3 Å²	106.3	74%	0.742	55%	0.551	S	S	*	*	H	α-helix	trans	-58.5	-19.3	166.1	0	0	0	0	0	114.1	F531	F531-G533 VanDerWaalsContact C-N 3.31Å; F531-G533 PolarHBondContact O-N 2.84Å
534	A	68.6	Low	67.5	Low	53 Å²	53	115.6 Å²	115.6	44%	0.438	58%	0.575	S	S	.	*	H	α-helix	trans	-101.8	-11.1	-176.3	0	0	0	0	0	115.2	F531 G532 H537	F531-A534 WeakPolarHBondContact O-CA 3.15Å; F531-A534 WeakPolarHBondContact O-CB 3.26Å; F531-A534 PolarHBondContact O-N 3.27Å; G532-A534 PolarHBondContact O-N 3.19Å; G532-A534 VanDerWaalsContact O-N 3.17Å; A534-H537 VanDerWaalsContact O-CB 3.23Å; A534-H537 WeakPolarHBondContact O-CB 3.42Å
535	A	65.8	Low	64.9	Low	64 Å²	64	111.5 Å²	111.5	53%	0.529	57%	0.572	S	S	.	*	H	α-helix	trans	-108.2	-28.6	-170.3	0	0	0	0	0	114.9	F531 G532 H537 H538	F531-A535 PolarHBondContact O-N 2.93Å; G532-A535 PolarHBondContact O-N 2.82Å; A535-H537 PolarHBondContact O-N 3.37Å; A535-H538 PolarHBondContact O-N 2.03Å
536	V	64.8	Low	62.5	Low	131 Å²	131	109.8 Å²	109.8	79%	0.794	58%	0.578	S	S	*	*	H	α-helix	trans	-56	-30.1	163.7	172.3	0	0	0	0	111	H538	V536-H538 PolarHBondContact O-N 3.4Å; V536-H538 VanDerWaalsContact O-N 3.16Å
537	H	55.4	Low	60	Low	154 Å²	154	112.6 Å²	112.6	71%	0.713	59%	0.589	S	S	*	*	H	α-helix	trans	-47.2	-33.4	165.4	172.9	-105.2	0	0	0	114	A534 A535	A534-H537 VanDerWaalsContact O-CB 3.23Å; A534-H537 WeakPolarHBondContact O-CB 3.42Å; A535-H537 PolarHBondContact O-N 3.37Å
538	H	59.6	Low	57	Low	47 Å²	47	113.9 Å²	113.9	22%	0.218	61%	0.606	C	S	.	*	H	α-helix	trans	-86.6	-52.2	-166.2	-161.4	-111.1	0	0	0	113.6	A535 V536 R541 Y553	A535-H538 PolarHBondContact O-N 2.03Å; V536-H538 PolarHBondContact O-N 3.4Å; V536-H538 VanDerWaalsContact O-N 3.16Å; H538-R541 WeakPolarHBondContact CE1-CD 3.16Å; H538-R541 WeakPolarHBondContact NE2-CD 3.37Å; H538-R541 PolarHBondContact NE2-NH1 3.01Å; H538-R541 WeakPolarHBondContact O-CA 3.45Å; H538-R541 WeakPolarHBondContact O-CB 3.46Å; H538-R541 PolarHBondContact O-N 2.74Å; H538-Y553 AromaticContact CE1-CD1 3.68Å; H538-Y553 AromaticContact ND1-CD1 3.76Å; H538-Y553 AromaticContact ND1-CG 3.91Å
539	R	57.9	Low	55	Low	82 Å²	82	115 Å²	115	31%	0.309	60%	0.604	S	S	.	*	H	α-helix	trans	-99.3	20.5	-168.7	-82.9	-138.9	168.4	168.4	8.1	118.1	R541 R542 Y549 Y553	R539-R541 CarbonylContact C-O 3.55Å; R539-R541 WeakPolarHBondContact CA-O 3Å; R539-R541 WeakPolarHBondContact CB-O 3.44Å; R539-R541 WeakPolarHBondContact CD-O 3.38Å; R539-R541 HydrophobicContact CG-CB 4.16Å; R539-R541 WeakPolarHBondContact CG-O 3.29Å; R539-R541 CarbonylContact O-C 3.45Å; R539-R541 PolarHBondContact O-N 3.08Å; R539-R541 VanDerWaalsContact O-N 3.09Å; R539-R542 VanDerWaalsContact CZ-CB 3.5Å; R539-R542 VanDerWaalsContact NH2-CD 3.31Å; R539-Y549 PolarHBondContact NH2-OH 2.99Å; R539-Y553 HydrophobicContact CG-CE1 4.27Å; R539-Y553 VanDerWaalsContact CZ-CE1 3.48Å; R539-Y553 VanDerWaalsContact CZ-CZ 3.45Å; R539-Y553 VanDerWaalsContact NE-CZ 3.32Å; R539-Y553 PolarHBondContact NE-OH 3.2Å; R539-Y553 VanDerWaalsContact NE-OH 3.17Å; R539-Y553 PolarHBondContact NH1-OH 2.89Å; R539-Y553 PolarHBondContact NH2-OH 2.72Å; R539-Y553 VanDerWaalsContact NH2-OH 3.15Å
540	R	45.3	Very low	52.3	Low	243 Å²	243	115.8 Å²	115.8	92%	0.917	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn		-39.6	-28.8	125.7	-161.1	174.6	-179.5	178.6	-0.1	111.8
541	R	46	Very low	50	Low	139 Å²	139	114.3 Å²	114.3	53%	0.525	59%	0.594	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.9	126.8	159.9	-153.7	-179.8	-166.6	150.8	4.9	111.6	H538 R539	H538-R541 WeakPolarHBondContact CE1-CD 3.16Å; H538-R541 WeakPolarHBondContact NE2-CD 3.37Å; H538-R541 PolarHBondContact NE2-NH1 3.01Å; H538-R541 WeakPolarHBondContact O-CA 3.45Å; H538-R541 WeakPolarHBondContact O-CB 3.46Å; H538-R541 PolarHBondContact O-N 2.74Å; R539-R541 CarbonylContact C-O 3.55Å; R539-R541 WeakPolarHBondContact CA-O 3Å; R539-R541 WeakPolarHBondContact CB-O 3.44Å; R539-R541 WeakPolarHBondContact CD-O 3.38Å; R539-R541 HydrophobicContact CG-CB 4.16Å; R539-R541 WeakPolarHBondContact CG-O 3.29Å; R539-R541 CarbonylContact O-C 3.45Å; R539-R541 PolarHBondContact O-N 3.08Å; R539-R541 VanDerWaalsContact O-N 3.09Å
542	R	52.4	Low	47.9	Very low	82 Å²	82	115.6 Å²	115.6	31%	0.309	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	79.9	12.1	158.9	-24.6	-156.1	-163.9	137	-5.9	121.8	R539 R544 Y549	R539-R542 VanDerWaalsContact CZ-CB 3.5Å; R539-R542 VanDerWaalsContact NH2-CD 3.31Å; R542-R544 CarbonylContact O-C 3.59Å; R542-R544 VanDerWaalsContact O-C 3.26Å; R542-R544 PolarHBondContact O-N 2.82Å; R542-R544 VanDerWaalsContact O-N 3.07Å; R542-Y549 WeakPolarHBondContact CD-OH 3.2Å; R542-Y549 PolarHBondContact NH1-OH 3.47Å
543	R	47	Very low	46	Very low	258 Å²	258	117.9 Å²	117.9	97%	0.974	61%	0.61	S	S	*	*	S	Bend	trans	-60.5	4.2	137.7	-89.6	-176.5	-179.1	161	0.2	112.4
544	R	37.2	Very low	44.5	Very low	231 Å²	231	118.1 Å²	118.1	87%	0.872	61%	0.605	S	S	*	*	S	Bend	trans	-90.5	92.2	147.3	-69.5	178.8	178.8	150	-0.2	109.2	R542	R542-R544 CarbonylContact O-C 3.59Å; R542-R544 VanDerWaalsContact O-C 3.26Å; R542-R544 PolarHBondContact O-N 2.82Å; R542-R544 VanDerWaalsContact O-N 3.07Å
545	G	31.7	Very low	43.1	Very low	56 Å²	56	120 Å²	120	58%	0.577	61%	0.614	S	S	*	*			trans	77.9	130.4	146.1	0	0	0	0	0	119
546	G	37.2	Very low	42.2	Very low	61 Å²	61	121.7 Å²	121.7	63%	0.629	62%	0.619	S	S	*	*				110.5	122.8	122.4	0	0	0	0	0	115.3	Y549	G546-Y549 WeakPolarHBondContact O-CE1 3Å
547	H	28.8	Very low	41.3	Very low	190 Å²	190	121.8 Å²	121.8	88%	0.88	61%	0.609	S	S	*	*	S	Bend	trans	-58.1	155.6	-173	-86.6	-101.4	0	0	0	115.5
548	S	24.4	Very low	41.1	Very low	119 Å²	119	117.2 Å²	117.2	83%	0.832	59%	0.594	S	S	*	*	S	Bend	trans	65.4	67	160.2	176.2	0	0	0	0	113.8
549	Y	40	Very low	40.6	Very low	88 Å²	88	120.6 Å²	120.6	35%	0.345	62%	0.618	S	S	.	*			trans	-163.6	123.6	160.6	68.5	-57.1	0	0	0	110.7	R539 R542 G546	R539-Y549 PolarHBondContact NH2-OH 2.99Å; R542-Y549 WeakPolarHBondContact CD-OH 3.2Å; R542-Y549 PolarHBondContact NH1-OH 3.47Å; G546-Y549 WeakPolarHBondContact O-CE1 3Å
550	E	26.7	Very low	39.8	Very low	154 Å²	154	120.4 Å²	120.4	72%	0.72	63%	0.634	S	S	*	*				39.7	103.7	116	-56.8	172.5	134.6	0	0	111.8
551	S	31.8	Very low	39.9	Very low	48 Å²	48	114.3 Å²	114.3	34%	0.336	62%	0.618	S	S	.	*				-160.1	121.5	126.6	-95.8	0	0	0	0	111.8	Y553	S551-Y553 VanDerWaalsContact CB-N 3.32Å; S551-Y553 WeakPolarHBondContact CB-OH 2.81Å; S551-Y553 WeakPolarHBondContact OG-CD1 3.01Å; S551-Y553 WeakPolarHBondContact OG-CE1 3.43Å
552	S	36.9	Very low	40.1	Very low	113 Å²	113	111 Å²	111	79%	0.79	62%	0.617	S	S	*	*			cis	51.9	33.9	25.3	-1.8	0	0	0	0	111.8
553	Y	36.3	Very low	39.7	Very low	90 Å²	90	110.8 Å²	110.8	35%	0.353	63%	0.628	S	S	.	*			trans	-132.9	131.5	143.8	20.2	-111.8	0	0	0	104.7	H538 R539 S551	H538-Y553 AromaticContact CE1-CD1 3.68Å; H538-Y553 AromaticContact ND1-CD1 3.76Å; H538-Y553 AromaticContact ND1-CG 3.91Å; R539-Y553 HydrophobicContact CG-CE1 4.27Å; R539-Y553 VanDerWaalsContact CZ-CE1 3.48Å; R539-Y553 VanDerWaalsContact CZ-CZ 3.45Å; R539-Y553 VanDerWaalsContact NE-CZ 3.32Å; R539-Y553 PolarHBondContact NE-OH 3.2Å; R539-Y553 VanDerWaalsContact NE-OH 3.17Å; R539-Y553 PolarHBondContact NH1-OH 2.89Å; R539-Y553 PolarHBondContact NH2-OH 2.72Å; R539-Y553 VanDerWaalsContact NH2-OH 3.15Å; S551-Y553 VanDerWaalsContact CB-N 3.32Å; S551-Y553 WeakPolarHBondContact CB-OH 2.81Å; S551-Y553 WeakPolarHBondContact OG-CD1 3.01Å; S551-Y553 WeakPolarHBondContact OG-CE1 3.43Å
554	A	39.7	Very low	39.3	Very low	77 Å²	77	108.7 Å²	108.7	64%	0.636	62%	0.62	S	S	*	*			cis	-174.2	140.6	9.1	0	0	0	0	0	103.1
555	S	40.7	Very low	39.9	Very low	92 Å²	92	100.2 Å²	100.2	64%	0.643	60%	0.599	S	S	*	*			cis	64.6	115.3	47.4	82.4	0	0	0	0	114.7
556	T	46.7	Very low	40.9	Very low	101 Å²	101	100.4 Å²	100.4	62%	0.62	59%	0.592	S	S	*	*			trans	95.7	16.3	141.3	59.4	0	0	0	0	122.5	S558	T556-S558 VanDerWaalsContact CA-N 3.32Å; T556-S558 PolarHBondContact N-OG 2.95Å; T556-S558 VanDerWaalsContact N-OG 3.15Å; T556-S558 PolarHBondContact O-N 2.76Å
557	F	45.6	Very low	41.4	Very low	133 Å²	133	102.2 Å²	102.2	58%	0.583	59%	0.59	S	S	*	*	S	Bend	trans	-66.9	-3	135.7	-168	-93.5	0	0	0	110.9	F531 T559	F531-F557 HydrophobicContact CD1-CB 4.18Å; F531-F557 HydrophobicContact CD1-CD1 4.4Å; F531-F557 HydrophobicContact CD1-CG 4.48Å; F531-F557 HydrophobicContact CE1-CB 3.61Å; F531-F557 AromaticContact CE1-CD1 3.61Å; F531-F557 HydrophobicContact CE1-CD1 3.61Å; F531-F557 AromaticContact CE1-CG 3.93Å; F531-F557 HydrophobicContact CE1-CG 3.93Å; F531-F557 HydrophobicContact CE2-CD1 4.23Å; F531-F557 HydrophobicContact CZ-CB 4.36Å; F531-F557 AromaticContact CZ-CD1 3.49Å; F531-F557 HydrophobicContact CZ-CD1 3.49Å; F531-F557 VanDerWaalsContact CZ-CD1 3.49Å; F531-F557 HydrophobicContact CZ-CE1 4.17Å; F531-F557 HydrophobicContact CZ-CG 4.28Å; F557-T559 PolarHBondContact O-N 3.07Å
558	S	51.2	Low	42.2	Very low	58 Å²	58	99.9 Å²	99.9	41%	0.406	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.9	7	-173.6	-44.3	0	0	0	0	118.8	T556 S562	T556-S558 VanDerWaalsContact CA-N 3.32Å; T556-S558 PolarHBondContact N-OG 2.95Å; T556-S558 VanDerWaalsContact N-OG 3.15Å; T556-S558 PolarHBondContact O-N 2.76Å; S558-S562 PolarHBondContact O-OG 3.31Å
559	T	49.6	Very low	43.7	Very low	118 Å²	118	97.6 Å²	97.6	72%	0.724	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	-21.8	-176.1	46.9	0	0	0	0	115.5	F557	F557-T559 PolarHBondContact O-N 3.07Å
560	A	40.3	Very low	44.2	Very low	78 Å²	78	97 Å²	97	65%	0.645	57%	0.567	S	S	*	*	S	Bend	trans	-90.8	-32.6	-177.2	0	0	0	0	0	114.9	S563	A560-S563 PolarHBondContact O-OG 3.45Å
561	I	47	Very low	45.1	Very low	115 Å²	115	92.5 Å²	92.5	59%	0.59	56%	0.557	S	S	*	*	S	Bend	trans	-84	-26.8	-177.2	-67.8	172.6	0	0	0	112.4	S563 R564 A565	I561-S563 VanDerWaalsContact C-N 3.26Å; I561-S563 PolarHBondContact O-N 3.2Å; I561-R564 PolarHBondContact O-N 2.7Å; I561-A565 PolarHBondContact O-N 2.88Å
562	S	50.2	Low	46	Very low	70 Å²	70	93.8 Å²	93.8	49%	0.49	56%	0.559	S	S	.	*	H	α-helix	trans	-67.8	-19.2	-175.4	-54.9	0	0	0	0	114.6	S558 S566	S558-S562 PolarHBondContact O-OG 3.31Å; S562-S566 PolarHBondContact O-OG 3.19Å
563	S	45	Very low	46.8	Very low	77 Å²	77	91.7 Å²	91.7	54%	0.538	55%	0.545	S	S	.	.	H	α-helix	trans	-78.5	-25.8	177.9	59.6	0	0	0	0	113.6	A560 I561 S566	A560-S563 PolarHBondContact O-OG 3.45Å; I561-S563 VanDerWaalsContact C-N 3.26Å; I561-S563 PolarHBondContact O-N 3.2Å; S563-S566 PolarHBondContact O-OG 3.39Å; S563-S566 VanDerWaalsContact O-OG 3.12Å
564	R	38.6	Very low	47.2	Very low	213 Å²	213	96.7 Å²	96.7	80%	0.804	56%	0.563	S	S	*	*	H	α-helix	trans	-92.8	-25.9	-179.9	-67	-173.4	177.5	-170.4	-0.5	113.4	I561 T567	I561-R564 PolarHBondContact O-N 2.7Å; R564-T567 PolarHBondContact O-OG1 2.95Å
565	A	49.7	Very low	47.5	Very low	53 Å²	53	97 Å²	97	44%	0.438	57%	0.565	S	S	.	*	H	α-helix	trans	-74.5	-28.3	173.7	0	0	0	0	0	113	I561 T567 F568 S569	I561-A565 PolarHBondContact O-N 2.88Å; A565-T567 VanDerWaalsContact C-N 3.31Å; A565-T567 PolarHBondContact O-N 2.91Å; A565-F568 PolarHBondContact O-N 3.43Å; A565-S569 PolarHBondContact O-N 3.44Å; A565-S569 VanDerWaalsContact O-N 3.14Å; A565-S569 PolarHBondContact O-OG 3.43Å
566	S	51.5	Low	47.8	Very low	61 Å²	61	100.8 Å²	100.8	43%	0.427	57%	0.571	S	S	.	*	H	α-helix	trans	-66.2	-30	-179.7	24.9	0	0	0	0	112.8	S562 S563 T570	S562-S566 PolarHBondContact O-OG 3.19Å; S563-S566 PolarHBondContact O-OG 3.39Å; S563-S566 VanDerWaalsContact O-OG 3.12Å; S566-T570 PolarHBondContact O-N 2.9Å; S566-T570 PolarHBondContact O-OG1 2.78Å
567	T	47.7	Very low	47.3	Very low	98 Å²	98	99.2 Å²	99.2	60%	0.601	57%	0.574	S	S	*	*	H	α-helix	trans	-72.4	-39.8	175.6	52.7	0	0	0	0	112.4	R564 A565 T570 A571	R564-T567 PolarHBondContact O-OG1 2.95Å; A565-T567 VanDerWaalsContact C-N 3.31Å; A565-T567 PolarHBondContact O-N 2.91Å; T567-T570 PolarHBondContact O-N 2.98Å; T567-A571 PolarHBondContact O-N 3.25Å
568	F	47.6	Very low	46.8	Very low	142 Å²	142	103.8 Å²	103.8	62%	0.623	59%	0.588	S	S	*	*	H	α-helix	trans	-67.8	-42.9	178.4	-171.8	-104	0	0	0	112.6	A565 T570 A571 I572	A565-F568 PolarHBondContact O-N 3.43Å; F568-T570 VanDerWaalsContact C-N 3.25Å; F568-T570 PolarHBondContact O-N 2.82Å; F568-A571 WeakPolarHBondContact O-CB 3.34Å; F568-A571 PolarHBondContact O-N 3.08Å; F568-A571 VanDerWaalsContact O-N 3.14Å; F568-I572 HydrophobicContact CD1-CD1 3.99Å; F568-I572 HydrophobicContact CE1-CD1 3.44Å; F568-I572 VanDerWaalsContact CE1-CD1 3.44Å; F568-I572 HydrophobicContact CE1-CG1 4.44Å; F568-I572 HydrophobicContact CZ-CD1 3.88Å; F568-I572 PolarHBondContact O-N 2.94Å
569	S	54.8	Low	46	Very low	70 Å²	70	110.4 Å²	110.4	49%	0.49	61%	0.609	S	S	.	*	H	α-helix	trans	-63.9	-30.7	174	-60.9	0	0	0	0	112.9	A565 A571 S573	A565-S569 PolarHBondContact O-N 3.44Å; A565-S569 VanDerWaalsContact O-N 3.14Å; A565-S569 PolarHBondContact O-OG 3.43Å; S569-A571 VanDerWaalsContact C-N 3.34Å; S569-S573 WeakPolarHBondContact O-CB 3.11Å; S569-S573 PolarHBondContact O-N 3.19Å; S569-S573 PolarHBondContact O-OG 3.28Å
570	T	49.8	Very low	44.9	Very low	75 Å²	75	113.3 Å²	113.3	46%	0.46	62%	0.615	S	S	.	*	H	α-helix	trans	-68.8	-34.6	175.4	-50.3	0	0	0	0	111.5	S566 T567 F568 R574	S566-T570 PolarHBondContact O-N 2.9Å; S566-T570 PolarHBondContact O-OG1 2.78Å; T567-T570 PolarHBondContact O-N 2.98Å; F568-T570 VanDerWaalsContact C-N 3.25Å; F568-T570 PolarHBondContact O-N 2.82Å; T570-R574 PolarHBondContact O-N 2.64Å
571	A	46.9	Very low	44.5	Very low	60 Å²	60	116.1 Å²	116.1	50%	0.496	62%	0.624	S	S	.	*	H	α-helix	trans	-68	-42.8	176.2	0	0	0	0	0	112.3	T567 F568 S569 R574 A575	T567-A571 PolarHBondContact O-N 3.25Å; F568-A571 WeakPolarHBondContact O-CB 3.34Å; F568-A571 PolarHBondContact O-N 3.08Å; F568-A571 VanDerWaalsContact O-N 3.14Å; S569-A571 VanDerWaalsContact C-N 3.34Å; A571-R574 PolarHBondContact O-N 2.03Å; A571-A575 PolarHBondContact O-N 3.29Å
572	I	50.8	Low	43.6	Very low	76 Å²	76	116.6 Å²	116.6	39%	0.39	63%	0.632	S	S	.	*	H	α-helix	trans	-69.2	-38.2	177.5	-66.1	177.1	0	0	0	111.5	F568 R574 A575 F576	F568-I572 HydrophobicContact CD1-CD1 3.99Å; F568-I572 HydrophobicContact CE1-CD1 3.44Å; F568-I572 VanDerWaalsContact CE1-CD1 3.44Å; F568-I572 HydrophobicContact CE1-CG1 4.44Å; F568-I572 HydrophobicContact CZ-CD1 3.88Å; F568-I572 PolarHBondContact O-N 2.94Å; I572-R574 PolarHBondContact O-N 2.01Å; I572-A575 WeakPolarHBondContact O-CB 3.4Å; I572-A575 PolarHBondContact O-N 2.82Å; I572-F576 HydrophobicContact CG2-CD2 3.72Å; I572-F576 HydrophobicContact CG2-CE2 3.89Å; I572-F576 WeakPolarHBondContact O-CD2 3.32Å; I572-F576 PolarHBondContact O-N 2.96Å
573	S	52.5	Low	42.4	Very low	69 Å²	69	122.9 Å²	122.9	48%	0.483	65%	0.65	S	S	.	*	H	α-helix	trans	-64.2	-28.1	177.6	-58.7	0	0	0	0	113.2	S569	S569-S573 WeakPolarHBondContact O-CB 3.11Å; S569-S573 PolarHBondContact O-N 3.19Å; S569-S573 PolarHBondContact O-OG 3.28Å
574	R	45.4	Very low	41.5	Very low	194 Å²	194	124.4 Å²	124.4	73%	0.732	67%	0.668	S	S	*	*	H	α-helix	trans	-72.2	-37.2	170.8	-74.7	-179.9	178.4	165.5	-0.6	112.3	T570 A571 I572 F576 G577	T570-R574 PolarHBondContact O-N 2.64Å; A571-R574 PolarHBondContact O-N 2.03Å; I572-R574 PolarHBondContact O-N 2.01Å; R574-F576 VanDerWaalsContact C-N 3.31Å; R574-F576 PolarHBondContact O-N 2.89Å; R574-G577 PolarHBondContact O-N 3.49Å
575	A	47	Very low	40.9	Very low	84 Å²	84	123.4 Å²	123.4	69%	0.694	67%	0.669	S	S	*	*	H	α-helix	trans	-67.2	-30.5	177	0	0	0	0	0	112.8	A571 I572	A571-A575 PolarHBondContact O-N 3.29Å; I572-A575 WeakPolarHBondContact O-CB 3.4Å; I572-A575 PolarHBondContact O-N 2.82Å
576	F	45.2	Very low	39.6	Very low	171 Å²	171	130.3 Å²	130.3	75%	0.75	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	31.7	175.8	-70.6	-79.2	0	0	0	114.1	I572 R574 R578	I572-F576 HydrophobicContact CG2-CD2 3.72Å; I572-F576 HydrophobicContact CG2-CE2 3.89Å; I572-F576 WeakPolarHBondContact O-CD2 3.32Å; I572-F576 PolarHBondContact O-N 2.96Å; R574-F576 VanDerWaalsContact C-N 3.31Å; R574-F576 PolarHBondContact O-N 2.89Å; F576-R578 PolarHBondContact O-N 2.99Å; F576-R578 VanDerWaalsContact O-N 3.12Å
577	G	37.6	Very low	38.3	Very low	68 Å²	68	132.3 Å²	132.3	70%	0.701	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	64	24.8	155	0	0	0	0	0	118.2	R574	R574-G577 PolarHBondContact O-N 3.49Å
578	R	34.2	Very low	37.3	Very low	230 Å²	230	134.9 Å²	134.9	87%	0.868	72%	0.72	S	S	*	*			trans	-97.2	109.6	173.3	-102.5	179.1	174.3	161.2	-0.3	112.5	F576	F576-R578 PolarHBondContact O-N 2.99Å; F576-R578 VanDerWaalsContact O-N 3.12Å
579	K	33.7	Very low	36.2	Very low	196 Å²	196	134.7 Å²	134.7	85%	0.852	73%	0.73	S	S	*	*			trans	-60.5	138	174	-73	179.2	176.9	177	0	111.4	T581	K579-T581 PolarHBondContact O-N 3.49Å; K579-T581 VanDerWaalsContact O-N 3.11Å
580	Q	27.8	Very low	34.7	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	75%	0.748	S	S	*	*			trans	-61.2	109.6	168.5	-80.3	-179.9	-25	0	0	109.9	V582	Q580-V582 PolarHBondContact O-N 3.41Å
581	T	31.3	Very low	33.5	Very low	138 Å²	138	142.9 Å²	142.9	85%	0.847	76%	0.756	S	S	*	*			trans	-83.3	101.7	161.9	44.9	0	0	0	0	108.5	K579	K579-T581 PolarHBondContact O-N 3.49Å; K579-T581 VanDerWaalsContact O-N 3.11Å
582	V	29	Very low	32.4	Very low	124 Å²	124	147.8 Å²	147.8	75%	0.752	77%	0.773	S	S	*	*			trans	-57.2	136.3	169.4	175.6	0	0	0	0	109.5	Q580 A584	Q580-V582 PolarHBondContact O-N 3.41Å; V582-A584 PolarHBondContact O-N 3.49Å
583	K	23.9	Very low	31.2	Very low	202 Å²	202	148.5 Å²	148.5	88%	0.878	79%	0.79	S	S	*	*			trans	-3	110.3	164	-68.7	177.3	176.3	175.2	0	115.9
584	A	25.5	Very low	29.9	Very low	109 Å²	109	154.6 Å²	154.6	90%	0.901	81%	0.807	S	S	*	*			trans	-72.7	134.3	155.9	0	0	0	0	0	110.4	V582	V582-A584 PolarHBondContact O-N 3.49Å
585	K	25.9	Very low	28.8	Very low	193 Å²	193	148.9 Å²	148.9	84%	0.839	81%	0.809	S	S	*	*			trans	-124.3	127.4	166.7	-143.9	-176.6	-171	-179	0	106.8
586	K	22.4	Very low	27.6	Very low	197 Å²	197	149.7 Å²	149.7	86%	0.857	81%	0.81	S	S	*	*			trans	58.5	110.4	158.6	-75.4	-175.6	170.2	-172.3	0	120
587	A	24.9	Very low	26.5	Very low	103 Å²	103	145.6 Å²	145.6	85%	0.851	80%	0.803	S	S	*	*				-164.4	127.6	116.3	0	0	0	0	0	109.9
588	D	26.5	Very low	25.8	Very low	153 Å²	153	151.4 Å²	151.4	82%	0.818	81%	0.808	S	S	*	*			trans	-76.3	145.2	174.4	-71	-58.9	0	0	0	111.6
589	T	25	Very low	25.3	Very low	137 Å²	137	144.5 Å²	144.5	84%	0.84	80%	0.801	S	S	*	*				173.2	134.9	120.9	30.1	0	0	0	0	114.4
590	R	23.8	Very low	25.1	Very low	229 Å²	229	141.9 Å²	141.9	86%	0.864	80%	0.801	S	S	*	*			trans	58	92.4	146.3	-80.8	-177.7	164.5	167.1	-3.8	122.1
591	S	24.9	Very low	24.9	Very low	89 Å²	89	137.2 Å²	137.2	62%	0.622	80%	0.801	S	S	*	*				37.2	137.8	104.7	70.8	0	0	0	0	122.4
592	L	23.3	Very low	24.7	Very low	163 Å²	163	137.3 Å²	137.3	85%	0.853	80%	0.795	S	S	*	*			trans	73.2	102.5	146.1	-68	157.2	0	0	0	117.8
593	A	26	Very low	24.9	Very low	90 Å²	90	136.2 Å²	136.2	74%	0.744	79%	0.793	S	S	*	*				-157.5	116.7	127	0	0	0	0	0	106.7
594	K	24	Very low	24.9	Very low	197 Å²	197	135.5 Å²	135.5	86%	0.857	79%	0.79	S	S	*	*				44.7	101.9	82.2	-77.5	-178	172.9	177.7	0	109.2
595	G	23	Very low	25	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	79%	0.788	S	S	*	*			cis	77.6	108.8	39.8	0	0	0	0	0	108.5
596	S	22.4	Very low	25.2	Very low	100 Å²	100	135.1 Å²	135.1	70%	0.699	82%	0.822	S	S	*	*			trans	-170.3	115.6	149.7	173.5	0	0	0	0	108.4
597	S	21.6	Very low	25.4	Very low	86 Å²	86	132.1 Å²	132.1	60%	0.601	82%	0.821	S	S	*	*				27	143.5	111.2	24.3	0	0	0	0	117.4
598	K	22.3	Very low	25.4	Very low	189 Å²	189	133.6 Å²	133.6	82%	0.822	82%	0.819	S	S	*	*			cis	-178.6	133.6	27	-116.8	160.3	-172.3	-178.9	0	104.4
599	A	23.7	Very low	25.3	Very low	86 Å²	86	132.5 Å²	132.5	71%	0.711	82%	0.819	S	S	*	*				68.7	114.3	93.6	0	0	0	0	0	114
600	V	29.4	Very low	25.4	Very low	140 Å²	140	132.2 Å²	132.2	85%	0.848	82%	0.818	S	S	*	*			trans	-139.9	107.3	138.1	-176.7	0	0	0	0	107.6
601	G	24	Very low	25.5	Very low	82 Å²	82	126.2 Å²	126.2	85%	0.845	82%	0.815	S	S	*	*			trans	-149.6	74.6	169.1	0	0	0	0	0	106.1
602	I	26.5	Very low	25.5	Very low	140 Å²	140	128.7 Å²	128.7	72%	0.718	83%	0.828	S	S	*	*			trans	-99.9	147.2	177.4	-73.9	169.8	0	0	0	107.5
603	S	34.5	Very low	25.7	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	83%	0.826	S	S	*	*			trans	70.5	138.9	162.4	-86.7	0	0	0	0	115.1
604	K	23	Very low	25.6	Very low	187 Å²	187	129 Å²	129	81%	0.813	83%	0.832	S	S	*	*			cis	-137.7	134.2	11.2	-105.1	164.5	178	179.2	0	105.2
605	V	26.9	Very low	25.8	Very low	143 Å²	143	123.3 Å²	123.3	87%	0.867	83%	0.83	S	S	*	*				66.5	115.6	82.2	-179.9	0	0	0	0	111.4
606	G	31.9	Very low	26	Very low	151 Å²	151	127.7 Å²	127.7	100%	1.557	84%	0.835	S	S	*	*			trans	149.4	0	-179.9	0	0	0	0	0	108.9

Retrieved 606 of 606 residues in 346.2 ms (Link to these results)

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