A0A077ZHL8_TRITR Loading...

Elongation factor G, mitochondrial

Mitochondrial GTPase that catalyzes the GTP-dependent ribosomal translocation step during translation elongation. During this step, the ribosome changes from the pre-translocational (PRE) to the post-translocational (POST) state as the newly formed A-site-bound peptidyl-tRNA and P-site-bound deacylated tRNA move to the P and E sites, respectively. Catalyzes the coordinated movement of the two tRNA molecules, the mRNA and conformational changes in the ribosome.

AlphaFold DB , UniProt , Accession A0A077ZHL8, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 694 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.5	Very low	83.1	Confident	230 Å²	230	71.1 Å²	71.1	100%	1.133	37%	0.372	S	S	*	.				0	141.8	0	-68.3	175.9	-165.5	0	0	107.1	R3	M1-R3 PolarHBondContact O-N 3.36Å
2	A	72.3	Confident	84	Confident	83 Å²	83	65.2 Å²	65.2	69%	0.686	34%	0.341	S	S	*	.			trans	-70	-24.7	-179.1	0	0	0	0	0	112.3	Y369	A2-Y369 HydrophobicContact CB-CE1 4.28Å; A2-Y369 PolarHBondContact O-OH 3.22Å
3	R	77.5	Confident	84.7	Confident	51 Å²	51	60.4 Å²	60.4	19%	0.192	32%	0.316	C	S	.	.			trans	-94.9	144.5	177.2	-64.8	175.7	141.2	162.6	-17.9	112.3	M1 F5 L7 D304 Y369 S370	M1-R3 PolarHBondContact O-N 3.36Å; R3-F5 VanDerWaalsContact CB-O 3.3Å; R3-F5 WeakPolarHBondContact CB-O 3.23Å; R3-L7 VanDerWaalsContact NH1-CG 3.29Å; R3-D304 WeakPolarHBondContact CD-OD2 3.34Å; R3-D304 IonicContact CZ-OD1 3.07Å; R3-D304 IonicContact CZ-OD2 2.69Å; R3-D304 IonicContact NE-OD1 3.16Å; R3-D304 IonicContact NE-OD2 3.94Å; R3-D304 PolarHBondContact NE-OD2 2.78Å; R3-D304 IonicContact NH1-OD1 3.08Å; R3-D304 PolarHBondContact NH1-OD1 3.29Å; R3-D304 VanDerWaalsContact NH1-OD1 3.15Å; R3-D304 IonicContact NH1-OD2 3.55Å; R3-D304 PolarHBondContact NH1-OD2 3.21Å; R3-D304 IonicContact NH2-OD1 3.38Å; R3-D304 PolarHBondContact NH2-OD1 2.74Å; R3-D304 IonicContact NH2-OD2 2.74Å; R3-Y369 HydrophobicContact CG-CD1 3.92Å; R3-Y369 HydrophobicContact CG-CD2 4Å; R3-Y369 HydrophobicContact CG-CE1 4.16Å; R3-Y369 HydrophobicContact CG-CE2 4.21Å; R3-Y369 HydrophobicContact CG-CG 3.86Å; R3-Y369 VanDerWaalsContact NE-CB 3.27Å; R3-S370 PolarHBondContact NH2-O 3.3Å; R3-S370 PolarHBondContact NH2-OG 2.92Å
4	E	79.5	Confident	85.3	Confident	148 Å²	148	56.1 Å²	56.1	69%	0.692	29%	0.294	S	S	*	.	S	Bend	trans	-73.2	-37.3	170.4	-168.8	-178.3	168.7	0	0	111.2	Q71	E4-Q71 PolarHBondContact OE1-NE2 3.47Å
5	F	84.7	Confident	85.7	Confident	33 Å²	33	52.5 Å²	52.5	15%	0.145	28%	0.275	C	S	.	.	S	Bend	trans	-126.6	140.4	177.3	-61.5	-87	0	0	0	109.6	R3 Q71 G74 R76	R3-F5 VanDerWaalsContact CB-O 3.3Å; R3-F5 WeakPolarHBondContact CB-O 3.23Å; F5-Q71 HydrophobicContact CE2-CG 4.2Å; F5-Q71 HydrophobicContact CZ-CG 3.81Å; F5-G74 WeakPolarHBondContact CD1-O 3.47Å; F5-G74 WeakPolarHBondContact CE1-O 3.39Å; F5-R76 HydrophobicContact CB-CB 4.06Å; F5-R76 HydrophobicContact CD1-CB 4.19Å; F5-R76 HydrophobicContact CD2-CB 3.83Å; F5-R76 HydrophobicContact CD2-CG 4.49Å; F5-R76 HydrophobicContact CE2-CB 4.36Å; F5-R76 HydrophobicContact CG-CB 3.74Å
6	S	90.4	Very high	86	Confident	41 Å²	41	49.3 Å²	49.3	29%	0.287	26%	0.258	S	S	.	.			trans	-72.5	168	172.8	78.2	0	0	0	0	111	E8 N9 T10	S6-E8 VanDerWaalsContact C-N 3.3Å; S6-E8 WeakPolarHBondContact CB-OE2 3.37Å; S6-E8 PolarHBondContact O-N 3.48Å; S6-E8 PolarHBondContact OG-OE2 2.83Å; S6-N9 CarbonylContact O-C 3.26Å; S6-N9 PolarHBondContact O-N 2.95Å; S6-N9 PolarHBondContact OG-N 2.86Å; S6-T10 PolarHBondContact O-N 3.12Å; S6-T10 PolarHBondContact O-OG1 3Å
7	L	89.2	Confident	86	Confident	13 Å²	13	46.4 Å²	46.4	7%	0.068	24%	0.243	C	C	.	.	S	Bend	trans	-62.8	-41.4	176.3	-77.2	168.3	0	0	0	111	R3 N9 T10 P281 T282 A302 S370	R3-L7 VanDerWaalsContact NH1-CG 3.29Å; L7-N9 PolarHBondContact O-N 3.29Å; L7-T10 WeakPolarHBondContact O-CB 3.04Å; L7-T10 PolarHBondContact O-N 2.99Å; L7-P281 HydrophobicContact CD2-CB 4.08Å; L7-P281 HydrophobicContact CD2-CG 4.2Å; L7-P281 WeakPolarHBondContact O-CD 3.26Å; L7-T282 HydrophobicContact CB-CG2 3.69Å; L7-T282 HydrophobicContact CD1-CG2 4.11Å; L7-A302 VanDerWaalsContact CD1-O 3.24Å; L7-A302 WeakPolarHBondContact CD1-O 3.12Å; L7-S370 VanDerWaalsContact CD2-O 3.23Å; L7-S370 WeakPolarHBondContact CD2-O 3.39Å
8	E	91.4	Very high	85.9	Confident	107 Å²	107	46.2 Å²	46.2	50%	0.5	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.4	178.9	-53.1	80.1	-175.6	0	0	111.6	S6 R11	S6-E8 VanDerWaalsContact C-N 3.3Å; S6-E8 WeakPolarHBondContact CB-OE2 3.37Å; S6-E8 PolarHBondContact O-N 3.48Å; S6-E8 PolarHBondContact OG-OE2 2.83Å; E8-R11 PolarHBondContact O-NH1 2.65Å
9	N	93.2	Very high	85.6	Confident	61 Å²	61	46.3 Å²	46.3	33%	0.326	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	16	178.3	-66.6	-4.1	0	0	0	113.1	S6 L7 H75 R76	S6-N9 CarbonylContact O-C 3.26Å; S6-N9 PolarHBondContact O-N 2.95Å; S6-N9 PolarHBondContact OG-N 2.86Å; L7-N9 PolarHBondContact O-N 3.29Å; N9-H75 CarbonylContact O-C 3.49Å; N9-H75 VanDerWaalsContact O-CA 3.23Å; N9-H75 WeakPolarHBondContact O-CA 3.44Å; N9-H75 WeakPolarHBondContact O-CB 3.42Å; N9-R76 PolarHBondContact O-N 3.35Å
10	T	92.5	Very high	85.3	Confident	4 Å²	4	48.8 Å²	48.8	3%	0.025	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.7	175.4	-59.7	0	0	0	0	109.9	S6 L7 R76 A280 P281	S6-T10 PolarHBondContact O-N 3.12Å; S6-T10 PolarHBondContact O-OG1 3Å; L7-T10 WeakPolarHBondContact O-CB 3.04Å; L7-T10 PolarHBondContact O-N 2.99Å; T10-R76 CarbonylContact C-O 3.55Å; T10-R76 WeakPolarHBondContact CA-O 3.35Å; T10-A280 WeakPolarHBondContact O-CA 3.47Å; T10-P281 HydrophobicContact CG2-CG 4.22Å; T10-P281 VanDerWaalsContact O-CD 3.3Å; T10-P281 WeakPolarHBondContact O-CD 3.34Å
11	R	94.1	Very high	85.4	Confident	11 Å²	11	46.5 Å²	46.5	4%	0.042	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.2	172.6	-61.9	-64.8	178.8	-85.2	-1.2	108.7	E8 I13 R76 V77 N78 V274 I275 L278 P279	E8-R11 PolarHBondContact O-NH1 2.65Å; R11-I13 HydrophobicContact CB-CG2 4.33Å; R11-R76 PolarHBondContact N-O 2.91Å; R11-V77 HydrophobicContact CB-CG1 4.48Å; R11-V77 CarbonylContact O-C 3.56Å; R11-V77 WeakPolarHBondContact O-CA 3.36Å; R11-N78 PolarHBondContact O-N 3.4Å; R11-V274 HydrophobicContact CB-CG1 4.23Å; R11-V274 HydrophobicContact CG-CG1 4.24Å; R11-V274 PolarHBondContact NE-O 3.08Å; R11-I275 PolarHBondContact NE-O 3.16Å; R11-I275 PolarHBondContact NH2-O 3.07Å; R11-L278 PolarHBondContact NE-O 3.41Å; R11-L278 VanDerWaalsContact NE-O 3.1Å; R11-P279 WeakPolarHBondContact CD-O 3.23Å
12	N	93.1	Very high	87.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	103.5	173.6	-58.6	-80.4	0	0	0	108.5	N78 D100 G101 R328 G371	N12-N78 WeakPolarHBondContact CA-O 3.44Å; N12-N78 VanDerWaalsContact OD1-CB 3.28Å; N12-N78 WeakPolarHBondContact OD1-CB 3.37Å; N12-N78 PolarHBondContact OD1-ND2 3.21Å; N12-D100 HydrophobicContact CB-CB 4.29Å; N12-D100 VanDerWaalsContact CB-OD2 3.32Å; N12-D100 WeakPolarHBondContact CB-OD2 3.26Å; N12-D100 PolarHBondContact ND2-OD2 2.91Å; N12-D100 PolarHBondContact O-N 3.34Å; N12-G101 PolarHBondContact O-N 2.86Å; N12-R328 PolarHBondContact ND2-NH1 3.35Å; N12-R328 PolarHBondContact ND2-NH2 2.99Å; N12-R328 PolarHBondContact OD1-NH1 2.8Å; N12-G371 PolarHBondContact ND2-O 2.74Å; N12-G371 PolarHBondContact OD1-O 3.49Å
13	I	93.8	Very high	87.8	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.015	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.5	-171.3	65.5	165.1	0	0	0	112.7	R11 V77 N78 I79 I80 L99 G101 V103 V274 L278	R11-I13 HydrophobicContact CB-CG2 4.33Å; I13-V77 HydrophobicContact CD1-CG1 3.82Å; I13-V77 HydrophobicContact CG1-CG1 3.91Å; I13-N78 PolarHBondContact N-O 3.4Å; I13-I79 HydrophobicContact CD1-CG1 4.22Å; I13-I79 HydrophobicContact CG1-CG1 4.03Å; I13-I79 CarbonylContact O-C 3.49Å; I13-I79 VanDerWaalsContact O-CA 3.29Å; I13-I79 WeakPolarHBondContact O-CA 3.35Å; I13-I80 PolarHBondContact O-N 3.31Å; I13-L99 VanDerWaalsContact O-CD2 3.31Å; I13-L99 WeakPolarHBondContact O-CD2 3.36Å; I13-G101 VanDerWaalsContact CA-O 3.25Å; I13-G101 WeakPolarHBondContact CA-O 3.44Å; I13-V103 HydrophobicContact CD1-CG2 4.13Å; I13-V274 HydrophobicContact CD1-CG1 4Å; I13-V274 HydrophobicContact CD1-CG2 3.96Å; I13-V274 HydrophobicContact CG2-CG1 4.03Å; I13-L278 HydrophobicContact CB-CD1 4.47Å; I13-L278 HydrophobicContact CG2-CD1 3.59Å
14	G	92.3	Very high	88	Confident	1 Å²	1	30.7 Å²	30.7	1%	0.01	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	147.6	164.9	0	0	0	0	0	111	I80 L99 G101 A102 V103	G14-I80 WeakPolarHBondContact CA-O 3.46Å; G14-L99 VanDerWaalsContact N-CD1 3.32Å; G14-G101 PolarHBondContact N-O 2.8Å; G14-A102 CarbonylContact O-C 3.52Å; G14-A102 VanDerWaalsContact O-CA 3.25Å; G14-A102 WeakPolarHBondContact O-CA 3.34Å; G14-V103 PolarHBondContact O-N 2.9Å
15	I	92	Very high	88.4	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	121.1	165.6	-54.3	176.4	0	0	0	106.7	K23 T27 I79 I80 T82 V103 V105	I15-K23 HydrophobicContact CB-CG 4.1Å; I15-K23 HydrophobicContact CG2-CG 3.48Å; I15-K23 VanDerWaalsContact CG2-CG 3.48Å; I15-K23 WeakPolarHBondContact O-CD 3.46Å; I15-T27 HydrophobicContact CD1-CG2 4.26Å; I15-T27 WeakPolarHBondContact CD1-OG1 3.41Å; I15-I79 HydrophobicContact CD1-CG2 3.8Å; I15-I79 HydrophobicContact CG1-CG2 4.03Å; I15-I80 PolarHBondContact N-O 2.96Å; I15-T82 PolarHBondContact O-N 2.91Å; I15-T82 PolarHBondContact O-OG1 3.17Å; I15-V103 WeakPolarHBondContact CA-O 3.38Å; I15-V103 HydrophobicContact CG1-CB 4.45Å; I15-V105 HydrophobicContact CG2-CG2 3.55Å
16	M	90.3	Very high	88.7	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	142.8	-178.8	61.3	179.1	165.3	0	0	110.4	L96 A102 V103 T104 V105 V119 A123 R130	M16-L96 HydrophobicContact SD-CD2 4.15Å; M16-A102 HydrophobicContact CE-CB 3.66Å; M16-A102 HydrophobicContact SD-CB 4.42Å; M16-V103 PolarHBondContact N-O 2.95Å; M16-T104 WeakPolarHBondContact CE-OG1 3.31Å; M16-T104 CarbonylContact O-C 3.58Å; M16-T104 WeakPolarHBondContact O-CA 3.43Å; M16-V105 PolarHBondContact O-N 3.37Å; M16-V119 HydrophobicContact CB-CG2 4.32Å; M16-V119 HydrophobicContact CG-CG2 4.42Å; M16-V119 HydrophobicContact SD-CB 4.32Å; M16-V119 HydrophobicContact SD-CG2 4.18Å; M16-A123 HydrophobicContact CE-CB 4.04Å; M16-A123 HydrophobicContact SD-CB 4.13Å; M16-R130 HydrophobicContact CE-CG 3.49Å; M16-R130 VanDerWaalsContact CE-CG 3.49Å
17	A	86.8	Confident	88.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	166.1	-174.3	0	0	0	0	0	111.7	A21 K23 G84 V105	A17-A21 HydrophobicContact CB-CB 3.73Å; A17-K23 HydrophobicContact CB-CB 3.8Å; A17-K23 HydrophobicContact CB-CG 4.14Å; A17-G84 VanDerWaalsContact O-CA 3.27Å; A17-G84 WeakPolarHBondContact O-CA 3.19Å; A17-V105 HydrophobicContact CB-CB 3.8Å; A17-V105 WeakPolarHBondContact CB-O 3.32Å
18	H	83.8	Confident	88.4	Confident	43 Å²	43	20.6 Å²	20.6	20%	0.199	11%	0.109	C	C	.	.			trans	-65.3	164.4	161	-167	61.8	0	0	0	111.5	D20 A21 E113 Q115	H18-D20 PolarHBondContact O-N 2.68Å; H18-A21 WeakPolarHBondContact O-CB 3.03Å; H18-A21 PolarHBondContact O-N 3.05Å; H18-E113 HydrophobicContact CB-CB 3.94Å; H18-E113 WeakPolarHBondContact CB-OE2 3.3Å; H18-E113 IonicContact CD2-OE1 3.07Å; H18-E113 PolarHBondContact CD2-OE1 3.14Å; H18-E113 IonicContact CD2-OE2 2.77Å; H18-E113 PolarHBondContact CD2-OE2 2.7Å; H18-E113 IonicContact CG-OE2 3.41Å; H18-E113 IonicContact NE2-OE1 3.95Å; H18-Q115 WeakPolarHBondContact ND1-CB 3.25Å
19	V	79.1	Confident	88.3	Confident	48 Å²	48	15.9 Å²	15.9	29%	0.291	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137.1	171.4	-173.9	0	0	0	0	108.8	A21 I61 G84 H85	V19-A21 PolarHBondContact O-N 3.29Å; V19-A21 VanDerWaalsContact O-N 3.12Å; V19-I61 HydrophobicContact CG1-CG2 4.07Å; V19-G84 VanDerWaalsContact CG2-O 3.23Å; V19-G84 WeakPolarHBondContact CG2-O 3.36Å; V19-H85 HydrophobicContact CG2-CB 4.08Å
20	D	80.9	Confident	88.1	Confident	96 Å²	96	13.1 Å²	13.1	51%	0.513	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	17.5	-178.5	-166	30.4	0	0	0	115.7	H18 G22 K136	H18-D20 PolarHBondContact O-N 2.68Å; D20-G22 PolarHBondContact O-N 2.82Å; D20-G22 VanDerWaalsContact O-N 3.17Å; D20-K136 WeakPolarHBondContact O-CE 3.45Å; D20-K136 PolarHBondContact O-NZ 3.27Å; D20-K136 IonicContact OD1-NZ 3.91Å; D20-K136 PolarHBondContact OD1-NZ 3.31Å; D20-K136 IonicContact OD2-NZ 3.43Å; D20-K136 PolarHBondContact OD2-NZ 3.29Å
21	A	86.3	Confident	87.8	Confident	1 Å²	1	13.1 Å²	13.1	1%	0.008	7%	0.072	C	C	.	.	S	Bend	trans	-71.8	-3.7	167.3	0	0	0	0	0	113	A17 H18 V19 V105 N135	A17-A21 HydrophobicContact CB-CB 3.73Å; H18-A21 WeakPolarHBondContact O-CB 3.03Å; H18-A21 PolarHBondContact O-N 3.05Å; V19-A21 PolarHBondContact O-N 3.29Å; V19-A21 VanDerWaalsContact O-N 3.12Å; A21-V105 HydrophobicContact CB-CG1 4.33Å; A21-V105 WeakPolarHBondContact O-CG1 3.45Å; A21-N135 PolarHBondContact O-ND2 3.02Å
22	G	85.7	Confident	87.4	Confident	8 Å²	8	15 Å²	15	8%	0.082	8%	0.079	C	C	.	.	S	Bend	trans	84	27.4	-178.4	0	0	0	0	0	114	D20 T25 T26	D20-G22 PolarHBondContact O-N 2.82Å; D20-G22 VanDerWaalsContact O-N 3.17Å; G22-T25 PolarHBondContact O-N 3.34Å; G22-T26 WeakPolarHBondContact O-CB 3.42Å; G22-T26 PolarHBondContact O-N 3.1Å; G22-T26 PolarHBondContact O-OG1 2.99Å
23	K	88	Confident	87.1	Confident	13 Å²	13	16.2 Å²	16.2	6%	0.057	8%	0.084	C	C	.	.	H	α-helix	trans	-52.2	-58.9	176.7	-170.4	-158.1	62.3	-120.2	0	112.6	I15 A17 T25 T26 T27 T62 D81 T82	I15-K23 HydrophobicContact CB-CG 4.1Å; I15-K23 HydrophobicContact CG2-CG 3.48Å; I15-K23 VanDerWaalsContact CG2-CG 3.48Å; I15-K23 WeakPolarHBondContact O-CD 3.46Å; A17-K23 HydrophobicContact CB-CB 3.8Å; A17-K23 HydrophobicContact CB-CG 4.14Å; K23-T25 VanDerWaalsContact C-N 3.35Å; K23-T25 PolarHBondContact O-N 3.03Å; K23-T26 WeakPolarHBondContact O-CB 3.46Å; K23-T26 PolarHBondContact O-N 2.94Å; K23-T26 VanDerWaalsContact O-N 3.14Å; K23-T27 PolarHBondContact O-N 2.88Å; K23-T27 PolarHBondContact O-OG1 2.87Å; K23-T27 VanDerWaalsContact O-OG1 3.04Å; K23-T62 PolarHBondContact NZ-OG1 3.15Å; K23-D81 WeakPolarHBondContact CD-OD1 3.48Å; K23-D81 VanDerWaalsContact CE-CG 3.46Å; K23-D81 WeakPolarHBondContact CE-OD1 3.23Å; K23-D81 WeakPolarHBondContact CG-OD1 3.43Å; K23-T82 WeakPolarHBondContact CD-O 3.06Å; K23-T82 WeakPolarHBondContact CE-O 3.21Å; K23-T82 PolarHBondContact NZ-O 2.98Å
24	T	81.8	Confident	86.6	Confident	11 Å²	11	17 Å²	17	7%	0.067	9%	0.089	C	C	.	.	H	α-helix	trans	-66.3	-38.5	-177.1	-52.3	0	0	0	0	111.7	T26 T27 E28 T43 M50 D51 T62 D81	T24-T26 VanDerWaalsContact C-N 3.31Å; T24-T26 PolarHBondContact O-N 3.1Å; T24-T27 WeakPolarHBondContact O-CB 3.36Å; T24-T27 PolarHBondContact O-N 3.12Å; T24-T27 VanDerWaalsContact O-N 3.13Å; T24-E28 WeakPolarHBondContact O-CG 3.37Å; T24-E28 PolarHBondContact O-N 3.42Å; T24-T43 HydrophobicContact CG2-CG2 3.78Å; T24-M50 HydrophobicContact CG2-CB 3.75Å; T24-M50 HydrophobicContact CG2-CG 4.46Å; T24-D51 WeakPolarHBondContact CG2-OD2 3.23Å; T24-T62 PolarHBondContact OG1-OG1 2.79Å; T24-D81 PolarHBondContact OG1-OD2 3.34Å
25	T	86.7	Confident	85.9	Confident	22 Å²	22	18.9 Å²	18.9	14%	0.135	11%	0.108	C	C	.	.	H	α-helix	trans	-57.4	-44.7	172.5	-45.8	0	0	0	0	111.5	G22 K23 E28 R29 A261	G22-T25 PolarHBondContact O-N 3.34Å; K23-T25 VanDerWaalsContact C-N 3.35Å; K23-T25 PolarHBondContact O-N 3.03Å; T25-E28 PolarHBondContact O-N 3.4Å; T25-R29 WeakPolarHBondContact O-CG 3.5Å; T25-R29 PolarHBondContact O-N 3.06Å; T25-A261 HydrophobicContact CG2-CB 4.19Å
26	T	91.1	Very high	85	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-46	174.6	-61	0	0	0	0	111.1	G22 K23 T24 E28 R29 V30 F133 A261 M270	G22-T26 WeakPolarHBondContact O-CB 3.42Å; G22-T26 PolarHBondContact O-N 3.1Å; G22-T26 PolarHBondContact O-OG1 2.99Å; K23-T26 WeakPolarHBondContact O-CB 3.46Å; K23-T26 PolarHBondContact O-N 2.94Å; K23-T26 VanDerWaalsContact O-N 3.14Å; T24-T26 VanDerWaalsContact C-N 3.31Å; T24-T26 PolarHBondContact O-N 3.1Å; T26-E28 VanDerWaalsContact C-N 3.33Å; T26-E28 PolarHBondContact O-N 3.03Å; T26-R29 WeakPolarHBondContact O-CB 3.36Å; T26-R29 PolarHBondContact O-N 3.47Å; T26-V30 WeakPolarHBondContact O-CG2 3.16Å; T26-V30 PolarHBondContact O-N 3.38Å; T26-F133 HydrophobicContact CG2-CD1 4.31Å; T26-F133 HydrophobicContact CG2-CE1 4.3Å; T26-A261 WeakPolarHBondContact OG1-CB 3.39Å; T26-M270 HydrophobicContact CG2-CE 3.88Å
27	T	88.6	Confident	83.8	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.6	-43.4	176.6	-51.5	0	0	0	0	112.1	I15 K23 T24 V30 L31 M50 I79 D81	I15-T27 HydrophobicContact CD1-CG2 4.26Å; I15-T27 WeakPolarHBondContact CD1-OG1 3.41Å; K23-T27 PolarHBondContact O-N 2.88Å; K23-T27 PolarHBondContact O-OG1 2.87Å; K23-T27 VanDerWaalsContact O-OG1 3.04Å; T24-T27 WeakPolarHBondContact O-CB 3.36Å; T24-T27 PolarHBondContact O-N 3.12Å; T24-T27 VanDerWaalsContact O-N 3.13Å; T27-V30 WeakPolarHBondContact O-CB 3.04Å; T27-V30 PolarHBondContact O-N 3.11Å; T27-L31 WeakPolarHBondContact O-CG 3.33Å; T27-L31 PolarHBondContact O-N 2.74Å; T27-L31 VanDerWaalsContact O-N 3.1Å; T27-M50 HydrophobicContact CG2-CE 3.53Å; T27-M50 HydrophobicContact CG2-CG 4.09Å; T27-M50 HydrophobicContact CG2-SD 4.26Å; T27-I79 HydrophobicContact CG2-CG2 4.22Å; T27-D81 HydrophobicContact CG2-CB 4.23Å; T27-D81 PolarHBondContact OG1-OD1 3.11Å; T27-D81 VanDerWaalsContact OG1-OD1 3.14Å
28	E	85.4	Confident	82.7	Confident	2 Å²	2	32 Å²	32	1%	0.009	17%	0.168	C	C	.	.	H	α-helix	trans	-65	-40.7	176.2	-66.7	-148.2	125.7	0	0	112.5	T24 T25 T26 V30 L31 Y32 I37 G41 S48 Q49 M50	T24-E28 WeakPolarHBondContact O-CG 3.37Å; T24-E28 PolarHBondContact O-N 3.42Å; T25-E28 PolarHBondContact O-N 3.4Å; T26-E28 VanDerWaalsContact C-N 3.33Å; T26-E28 PolarHBondContact O-N 3.03Å; E28-V30 VanDerWaalsContact C-N 3.31Å; E28-V30 PolarHBondContact O-N 2.96Å; E28-L31 PolarHBondContact O-N 2.78Å; E28-Y32 PolarHBondContact O-N 2.94Å; E28-I37 WeakPolarHBondContact O-CD1 3.4Å; E28-G41 VanDerWaalsContact OE2-C 3.28Å; E28-S48 WeakPolarHBondContact OE1-CA 3.3Å; E28-Q49 PolarHBondContact OE1-N 3.42Å; E28-M50 HydrophobicContact CG-CG 4.25Å
29	R	88.3	Confident	81.5	Confident	8 Å²	8	38.5 Å²	38.5	3%	0.03	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-43.1	174.4	-70.6	-47	100	152.2	18.3	111.6	T25 T26 L31 Y32 Y33 I40 G41 A261 N264 V267	T25-R29 WeakPolarHBondContact O-CG 3.5Å; T25-R29 PolarHBondContact O-N 3.06Å; T26-R29 WeakPolarHBondContact O-CB 3.36Å; T26-R29 PolarHBondContact O-N 3.47Å; R29-L31 VanDerWaalsContact C-N 3.29Å; R29-L31 PolarHBondContact O-N 2.89Å; R29-Y32 WeakPolarHBondContact O-CB 3.42Å; R29-Y32 PolarHBondContact O-N 3.37Å; R29-Y32 VanDerWaalsContact O-N 3.11Å; R29-Y33 HydrophobicContact CB-CD2 4.25Å; R29-Y33 HydrophobicContact CB-CE2 4.01Å; R29-Y33 WeakPolarHBondContact O-CD2 3.46Å; R29-Y33 PolarHBondContact O-N 3Å; R29-I40 VanDerWaalsContact CZ-CG2 3.48Å; R29-G41 PolarHBondContact NH2-O 2.82Å; R29-A261 VanDerWaalsContact CD-O 3.24Å; R29-A261 WeakPolarHBondContact CD-O 3.36Å; R29-A261 HydrophobicContact CG-CB 4.1Å; R29-A261 WeakPolarHBondContact CG-O 3.25Å; R29-N264 WeakPolarHBondContact CD-OD1 3.48Å; R29-N264 PolarHBondContact NH1-OD1 2.93Å; R29-V267 HydrophobicContact CB-CB 4.26Å; R29-V267 HydrophobicContact CB-CG1 3.8Å; R29-V267 HydrophobicContact CB-CG2 3.95Å; R29-V267 HydrophobicContact CG-CG2 4.19Å
30	V	89.5	Confident	80.5	Confident	2 Å²	2	39 Å²	39	1%	0.012	20%	0.196	C	C	.	.	H	α-helix	trans	-56.7	-46.3	175.5	166.9	0	0	0	0	110.7	T26 T27 E28 Y32 Y33 T34 I79 V267 M270 L271	T26-V30 WeakPolarHBondContact O-CG2 3.16Å; T26-V30 PolarHBondContact O-N 3.38Å; T27-V30 WeakPolarHBondContact O-CB 3.04Å; T27-V30 PolarHBondContact O-N 3.11Å; E28-V30 VanDerWaalsContact C-N 3.31Å; E28-V30 PolarHBondContact O-N 2.96Å; V30-Y32 VanDerWaalsContact C-N 3.29Å; V30-Y32 PolarHBondContact O-N 3.11Å; V30-Y33 PolarHBondContact O-N 2.78Å; V30-T34 HydrophobicContact CG1-CG2 4.29Å; V30-T34 WeakPolarHBondContact O-CB 3.21Å; V30-T34 WeakPolarHBondContact O-CG2 3.41Å; V30-T34 PolarHBondContact O-N 2.77Å; V30-T34 PolarHBondContact O-OG1 3.14Å; V30-I79 HydrophobicContact CB-CD1 4.31Å; V30-I79 HydrophobicContact CG1-CD1 3.32Å; V30-V267 HydrophobicContact CG2-CG1 3.8Å; V30-M270 HydrophobicContact CG2-CE 3.62Å; V30-L271 HydrophobicContact CB-CD1 4.44Å; V30-L271 HydrophobicContact CB-CD2 4.37Å; V30-L271 HydrophobicContact CG1-CD1 4.15Å; V30-L271 HydrophobicContact CG1-CD2 3.62Å; V30-L271 HydrophobicContact CG1-CG 4.34Å; V30-L271 HydrophobicContact CG2-CD1 4.25Å; V30-L271 HydrophobicContact CG2-CD2 3.95Å; V30-L271 HydrophobicContact CG2-CG 4.09Å
31	L	86.6	Confident	79.1	Confident	4 Å²	4	34.8 Å²	34.8	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-35.7	177.3	-67.4	177.4	0	0	0	112.7	T27 E28 R29 T34 K36 I37 M50 T68 A70	T27-L31 WeakPolarHBondContact O-CG 3.33Å; T27-L31 PolarHBondContact O-N 2.74Å; T27-L31 VanDerWaalsContact O-N 3.1Å; E28-L31 PolarHBondContact O-N 2.78Å; R29-L31 VanDerWaalsContact C-N 3.29Å; R29-L31 PolarHBondContact O-N 2.89Å; L31-T34 WeakPolarHBondContact CA-OG1 3.48Å; L31-T34 PolarHBondContact O-OG1 2.99Å; L31-T34 VanDerWaalsContact O-OG1 3.14Å; L31-K36 HydrophobicContact CD2-CB 4.26Å; L31-K36 HydrophobicContact CD2-CG 4.31Å; L31-K36 WeakPolarHBondContact O-CB 3.35Å; L31-K36 PolarHBondContact O-N 2.71Å; L31-I37 HydrophobicContact CB-CD1 3.74Å; L31-I37 HydrophobicContact CB-CG1 3.79Å; L31-I37 HydrophobicContact CB-CG2 4.22Å; L31-I37 PolarHBondContact O-N 2.8Å; L31-I37 VanDerWaalsContact O-N 3.11Å; L31-M50 HydrophobicContact CD1-CG 4.36Å; L31-M50 HydrophobicContact CD1-SD 3.69Å; L31-T68 HydrophobicContact CD1-CG2 4.4Å; L31-T68 HydrophobicContact CD2-CG2 3.81Å; L31-T68 HydrophobicContact CG-CG2 4.48Å; L31-A70 HydrophobicContact CD2-CB 4.41Å
32	Y	85.6	Confident	77.5	Confident	52 Å²	52	38.3 Å²	38.3	20%	0.204	19%	0.192	C	C	.	.	H	α-helix	trans	-67.8	-51	178.2	175.2	-105.3	0	0	0	111.6	E28 R29 V30 T34 G35 I40	E28-Y32 PolarHBondContact O-N 2.94Å; R29-Y32 WeakPolarHBondContact O-CB 3.42Å; R29-Y32 PolarHBondContact O-N 3.37Å; R29-Y32 VanDerWaalsContact O-N 3.11Å; V30-Y32 VanDerWaalsContact C-N 3.29Å; V30-Y32 PolarHBondContact O-N 3.11Å; Y32-T34 VanDerWaalsContact C-N 3.34Å; Y32-T34 PolarHBondContact O-N 2.8Å; Y32-G35 WeakPolarHBondContact O-CA 3.41Å; Y32-G35 PolarHBondContact O-N 3Å; Y32-I40 HydrophobicContact CD1-CD1 3.91Å; Y32-I40 HydrophobicContact CD1-CG1 4.11Å; Y32-I40 HydrophobicContact CD2-CD1 4.05Å; Y32-I40 HydrophobicContact CD2-CG1 3.66Å; Y32-I40 HydrophobicContact CE1-CD1 3.75Å; Y32-I40 HydrophobicContact CE1-CG1 4.37Å; Y32-I40 HydrophobicContact CE2-CD1 3.89Å; Y32-I40 HydrophobicContact CE2-CG1 3.93Å; Y32-I40 HydrophobicContact CG-CD1 4.04Å; Y32-I40 HydrophobicContact CG-CG1 3.74Å
33	Y	86	Confident	75.8	Confident	24 Å²	24	39 Å²	39	9%	0.094	19%	0.194	C	C	.	.	H	α-helix	trans	-67.6	-34.1	-177.9	-68.3	-58.6	0	0	0	113.3	R29 V30 G35 W72 N264 V267 Q268	R29-Y33 HydrophobicContact CB-CD2 4.25Å; R29-Y33 HydrophobicContact CB-CE2 4.01Å; R29-Y33 WeakPolarHBondContact O-CD2 3.46Å; R29-Y33 PolarHBondContact O-N 3Å; V30-Y33 PolarHBondContact O-N 2.78Å; Y33-G35 PolarHBondContact O-N 3.28Å; Y33-G35 VanDerWaalsContact O-N 3.12Å; Y33-W72 WeakPolarHBondContact O-CZ3 3.45Å; Y33-N264 VanDerWaalsContact OH-CA 3.23Å; Y33-N264 WeakPolarHBondContact OH-CA 3.42Å; Y33-N264 WeakPolarHBondContact OH-CB 3.23Å; Y33-N264 PolarHBondContact OH-O 2.67Å; Y33-N264 VanDerWaalsContact OH-O 3.06Å; Y33-V267 HydrophobicContact CD2-CB 4.1Å; Y33-V267 HydrophobicContact CD2-CG1 3.95Å; Y33-V267 HydrophobicContact CE2-CB 3.83Å; Y33-V267 HydrophobicContact CE2-CG1 4.14Å; Y33-V267 HydrophobicContact CE2-CG2 4.5Å; Y33-Q268 HydrophobicContact CD1-CG 3.88Å; Y33-Q268 HydrophobicContact CD2-CG 4.04Å; Y33-Q268 HydrophobicContact CE1-CG 4.21Å; Y33-Q268 HydrophobicContact CE2-CG 4.39Å; Y33-Q268 HydrophobicContact CG-CG 3.77Å
34	T	84.3	Confident	73.8	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.129	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	0.5	173.4	57.2	0	0	0	0	113	V30 L31 Y32 K36 A70 Q71 W72 L271	V30-T34 HydrophobicContact CG1-CG2 4.29Å; V30-T34 WeakPolarHBondContact O-CB 3.21Å; V30-T34 WeakPolarHBondContact O-CG2 3.41Å; V30-T34 PolarHBondContact O-N 2.77Å; V30-T34 PolarHBondContact O-OG1 3.14Å; L31-T34 WeakPolarHBondContact CA-OG1 3.48Å; L31-T34 PolarHBondContact O-OG1 2.99Å; L31-T34 VanDerWaalsContact O-OG1 3.14Å; Y32-T34 VanDerWaalsContact C-N 3.34Å; Y32-T34 PolarHBondContact O-N 2.8Å; T34-K36 PolarHBondContact O-N 2.88Å; T34-A70 HydrophobicContact CG2-CB 3.86Å; T34-Q71 VanDerWaalsContact CB-O 3.26Å; T34-Q71 WeakPolarHBondContact CB-O 3.41Å; T34-Q71 WeakPolarHBondContact CG2-O 3.47Å; T34-W72 HydrophobicContact CG2-CB 4.23Å; T34-W72 HydrophobicContact CG2-CD2 4.47Å; T34-W72 HydrophobicContact CG2-CE3 3.86Å; T34-L271 HydrophobicContact CG2-CD1 4.06Å
35	G	76.4	Confident	71.9	Confident	40 Å²	40	52 Å²	52	41%	0.412	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	11.5	178.3	0	0	0	0	0	113.6	Y32 Y33 H38	Y32-G35 WeakPolarHBondContact O-CA 3.41Å; Y32-G35 PolarHBondContact O-N 3Å; Y33-G35 PolarHBondContact O-N 3.28Å; Y33-G35 VanDerWaalsContact O-N 3.12Å; G35-H38 PolarHBondContact O-CE1 2.78Å
36	K	73.3	Confident	70	Confident	95 Å²	95	52.3 Å²	52.3	41%	0.413	26%	0.262	S	S	.	.	S	Bend	trans	-78.2	-34.3	-177.2	-165.3	62.8	172.5	-173.4	0	112	L31 T34 H358	L31-K36 HydrophobicContact CD2-CB 4.26Å; L31-K36 HydrophobicContact CD2-CG 4.31Å; L31-K36 WeakPolarHBondContact O-CB 3.35Å; L31-K36 PolarHBondContact O-N 2.71Å; T34-K36 PolarHBondContact O-N 2.88Å; K36-H358 WeakPolarHBondContact CE-CE1 3.15Å; K36-H358 WeakPolarHBondContact CE-ND1 3.29Å; K36-H358 WeakPolarHBondContact CE-NE2 3.45Å; K36-H358 PolarHBondContact NZ-CE1 2.79Å; K36-H358 PolarHBondContact NZ-NE2 2.94Å
37	I	66.1	Low	68.2	Low	15 Å²	15	54.9 Å²	54.9	8%	0.077	28%	0.283	C	S	.	.			trans	-116.6	138.8	168.8	64.3	178.8	0	0	0	109.8	E28 L31	E28-I37 WeakPolarHBondContact O-CD1 3.4Å; L31-I37 HydrophobicContact CB-CD1 3.74Å; L31-I37 HydrophobicContact CB-CG1 3.79Å; L31-I37 HydrophobicContact CB-CG2 4.22Å; L31-I37 PolarHBondContact O-N 2.8Å; L31-I37 VanDerWaalsContact O-N 3.11Å
38	H	64.2	Low	66.8	Low	167 Å²	167	55.1 Å²	55.1	77%	0.773	29%	0.285	S	S	*	.	S	Bend	trans	-100.9	-5.1	179.3	-61.9	-57.4	0	0	0	113.3	G35	G35-H38 PolarHBondContact O-CE1 2.78Å
39	K	57.6	Low	65.6	Low	180 Å²	180	59 Å²	59	78%	0.783	30%	0.302	S	S	*	.	S	Bend	trans	-124.9	131.5	172.6	-82.7	-172.9	174	-173.9	0	108.9
40	I	57.2	Low	64.4	Low	57 Å²	57	58.6 Å²	58.6	29%	0.292	30%	0.301	S	S	.	.			trans	-72.6	119.6	169.3	-82.4	162.9	0	0	0	107.8	R29 Y32 L190	R29-I40 VanDerWaalsContact CZ-CG2 3.48Å; Y32-I40 HydrophobicContact CD1-CD1 3.91Å; Y32-I40 HydrophobicContact CD1-CG1 4.11Å; Y32-I40 HydrophobicContact CD2-CD1 4.05Å; Y32-I40 HydrophobicContact CD2-CG1 3.66Å; Y32-I40 HydrophobicContact CE1-CD1 3.75Å; Y32-I40 HydrophobicContact CE1-CG1 4.37Å; Y32-I40 HydrophobicContact CE2-CD1 3.89Å; Y32-I40 HydrophobicContact CE2-CG1 3.93Å; Y32-I40 HydrophobicContact CG-CD1 4.04Å; Y32-I40 HydrophobicContact CG-CG1 3.74Å; I40-L190 HydrophobicContact CD1-CD2 4.49Å
41	G	52.3	Low	63.3	Low	8 Å²	8	58.8 Å²	58.8	8%	0.082	30%	0.302	C	S	.	.			trans	-85.5	152.8	163.5	0	0	0	0	0	110.1	E28 R29	E28-G41 VanDerWaalsContact OE2-C 3.28Å; R29-G41 PolarHBondContact NH2-O 2.82Å
42	E	53.9	Low	62.5	Low	76 Å²	76	63.6 Å²	63.6	36%	0.355	32%	0.32	S	S	.	.			trans	-112.3	128.8	163.9	-71.8	-171	-178.3	0	0	108.3	H44 E45 A47	E42-H44 VanDerWaalsContact C-N 3.27Å; E42-H44 PolarHBondContact O-N 3.03Å; E42-E45 HydrophobicContact CB-CG 4.41Å; E42-E45 PolarHBondContact O-N 2.86Å; E42-A47 PolarHBondContact O-N 2.74Å
43	T	48.5	Very low	61.7	Low	22 Å²	22	61.6 Å²	61.6	14%	0.135	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-60.4	-36.6	-179.8	44.3	0	0	0	0	111.9	T24 E45 G46	T24-T43 HydrophobicContact CG2-CG2 3.78Å; T43-E45 VanDerWaalsContact C-N 3.27Å; T43-E45 PolarHBondContact O-N 3.42Å; T43-G46 PolarHBondContact O-N 2.98Å
44	H	46.4	Very low	61	Low	146 Å²	146	65.9 Å²	65.9	68%	0.676	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-70.5	-18.7	-179.8	-55.4	-59.2	0	0	0	114.2	E42	E42-H44 VanDerWaalsContact C-N 3.27Å; E42-H44 PolarHBondContact O-N 3.03Å
45	E	41.4	Very low	60.6	Low	152 Å²	152	65.2 Å²	65.2	71%	0.71	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-98.7	4.8	177.9	-62.3	-163.7	152.6	0	0	113	E42 T43 A47	E42-E45 HydrophobicContact CB-CG 4.41Å; E42-E45 PolarHBondContact O-N 2.86Å; T43-E45 VanDerWaalsContact C-N 3.27Å; T43-E45 PolarHBondContact O-N 3.42Å; E45-A47 PolarHBondContact O-N 3.48Å
46	G	48	Very low	60.3	Low	28 Å²	28	63.3 Å²	63.3	29%	0.289	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	15.3	-176	0	0	0	0	0	113.8	T43	T43-G46 PolarHBondContact O-N 2.98Å
47	A	52.7	Low	60.2	Low	53 Å²	53	62.6 Å²	62.6	44%	0.438	31%	0.307	S	S	.	.			trans	-92.6	2.6	179.4	0	0	0	0	0	113.5	E42 E45 Q49	E42-A47 PolarHBondContact O-N 2.74Å; E45-A47 PolarHBondContact O-N 3.48Å; A47-Q49 PolarHBondContact O-N 2.97Å
48	S	58.4	Low	60.5	Low	6 Å²	6	67.7 Å²	67.7	4%	0.042	33%	0.331	C	S	.	.			trans	-61.7	127.4	179.4	170.9	0	0	0	0	110.9	E28 M50 D51	E28-S48 WeakPolarHBondContact OE1-CA 3.3Å; S48-M50 VanDerWaalsContact C-N 3.33Å; S48-M50 PolarHBondContact OG-N 2.81Å; S48-D51 PolarHBondContact OG-N 2.85Å; S48-D51 VanDerWaalsContact OG-N 3.13Å; S48-D51 PolarHBondContact OG-OD2 3.14Å
49	Q	59.9	Low	60.7	Low	82 Å²	82	64.5 Å²	64.5	38%	0.383	31%	0.312	S	S	.	.	S	Bend	trans	-78.5	-21.6	173.9	-70	-147.9	2.7	0	0	112.8	E28 A47	E28-Q49 PolarHBondContact OE1-N 3.42Å; A47-Q49 PolarHBondContact O-N 2.97Å
50	M	64.6	Low	61.1	Low	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-82.7	-36.2	-177.6	-63	-57.4	-77.4	0	0	111.5	T24 T27 E28 L31 S48 W52 A66 T68 D81 A359	T24-M50 HydrophobicContact CG2-CB 3.75Å; T24-M50 HydrophobicContact CG2-CG 4.46Å; T27-M50 HydrophobicContact CG2-CE 3.53Å; T27-M50 HydrophobicContact CG2-CG 4.09Å; T27-M50 HydrophobicContact CG2-SD 4.26Å; E28-M50 HydrophobicContact CG-CG 4.25Å; L31-M50 HydrophobicContact CD1-CG 4.36Å; L31-M50 HydrophobicContact CD1-SD 3.69Å; S48-M50 VanDerWaalsContact C-N 3.33Å; S48-M50 PolarHBondContact OG-N 2.81Å; M50-W52 PolarHBondContact O-N 2.8Å; M50-A66 HydrophobicContact CE-CB 3.58Å; M50-A66 HydrophobicContact SD-CB 4.47Å; M50-T68 HydrophobicContact CE-CG2 3.95Å; M50-D81 HydrophobicContact CE-CB 3.89Å; M50-A359 HydrophobicContact SD-CB 3.84Å
51	D	66	Low	61.7	Low	7 Å²	7	57 Å²	57	4%	0.037	29%	0.294	C	S	.	.			trans	-87.9	80	173.7	-58	-47.3	0	0	0	109.4	T24 S48 E56 Q57	T24-D51 WeakPolarHBondContact CG2-OD2 3.23Å; S48-D51 PolarHBondContact OG-N 2.85Å; S48-D51 VanDerWaalsContact OG-N 3.13Å; S48-D51 PolarHBondContact OG-OD2 3.14Å; D51-E56 WeakPolarHBondContact CA-OE2 3.38Å; D51-E56 HydrophobicContact CB-CB 3.75Å; D51-Q57 HydrophobicContact CB-CG 4.41Å; D51-Q57 VanDerWaalsContact O-CG 3.27Å; D51-Q57 WeakPolarHBondContact O-CG 3.41Å; D51-Q57 PolarHBondContact O-NE2 2.63Å
52	W	69.2	Low	62.6	Low	105 Å²	105	57.1 Å²	57.1	40%	0.398	29%	0.293	S	S	.	.			trans	-88.7	-18.8	-174.2	65.5	-85.2	0	0	0	112.9	M50 E56 M316	M50-W52 PolarHBondContact O-N 2.8Å; W52-E56 PolarHBondContact N-OE2 2.86Å; W52-M316 HydrophobicContact CH2-SD 4.07Å; W52-M316 HydrophobicContact CZ2-SD 3.72Å
53	M	69.4	Low	63.1	Low	9 Å²	9	53.9 Å²	53.9	4%	0.044	28%	0.278	C	S	.	.	S	Bend	trans	-76.4	138.8	175	-66.4	-169.6	166.2	0	0	110.2	Q55 E56 Q57 T64	M53-Q55 PolarHBondContact O-N 3.25Å; M53-E56 HydrophobicContact CB-CB 4.33Å; M53-E56 HydrophobicContact CB-CG 3.91Å; M53-E56 WeakPolarHBondContact CB-OE2 2.98Å; M53-E56 PolarHBondContact N-OE2 2.84Å; M53-E56 WeakPolarHBondContact O-CB 3.47Å; M53-E56 PolarHBondContact O-N 2.98Å; M53-Q57 PolarHBondContact O-N 3.49Å; M53-T64 HydrophobicContact CE-CG2 3.46Å; M53-T64 VanDerWaalsContact CE-CG2 3.46Å; M53-T64 HydrophobicContact SD-CG2 3.71Å
54	E	71.9	Confident	64.2	Low	114 Å²	114	53.7 Å²	53.7	53%	0.533	28%	0.277	S	S	.	.	H	α-helix	trans	-56.3	-36.7	175.4	-70.8	-178.4	172.3	0	0	111.4	E56 Q57 E58 R466	E54-E56 VanDerWaalsContact C-N 3.33Å; E54-E56 PolarHBondContact O-N 3.29Å; E54-Q57 PolarHBondContact O-N 2.65Å; E54-E58 WeakPolarHBondContact O-CB 3.45Å; E54-E58 VanDerWaalsContact O-CG 3.3Å; E54-E58 WeakPolarHBondContact O-CG 3.46Å; E54-E58 PolarHBondContact O-N 3.04Å; E54-R466 IonicContact OE2-CZ 3.47Å; E54-R466 IonicContact OE2-NH1 3.96Å; E54-R466 PolarHBondContact OE2-NH1 2.73Å
55	Q	75.7	Confident	65.4	Low	8 Å²	8	47.1 Å²	47.1	4%	0.037	25%	0.247	C	C	.	.	H	α-helix	trans	-65.3	-34.6	178.3	-63.4	86.6	-6.4	0	0	113.1	M53 R59 I63 D462	M53-Q55 PolarHBondContact O-N 3.25Å; Q55-R59 WeakPolarHBondContact O-CB 3.43Å; Q55-R59 WeakPolarHBondContact O-CG 3.15Å; Q55-R59 PolarHBondContact O-N 2.66Å; Q55-I63 HydrophobicContact CB-CD1 3.73Å; Q55-D462 VanDerWaalsContact CG-OD2 3.31Å; Q55-D462 WeakPolarHBondContact CG-OD2 3.35Å; Q55-D462 PolarHBondContact NE2-OD2 2.93Å
56	E	69.6	Low	66.8	Low	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-68.2	-44.7	177.3	-67.5	173.9	144.9	0	0	110	D51 W52 M53 E54 G60 I61 I63 T64	D51-E56 WeakPolarHBondContact CA-OE2 3.38Å; D51-E56 HydrophobicContact CB-CB 3.75Å; W52-E56 PolarHBondContact N-OE2 2.86Å; M53-E56 HydrophobicContact CB-CB 4.33Å; M53-E56 HydrophobicContact CB-CG 3.91Å; M53-E56 WeakPolarHBondContact CB-OE2 2.98Å; M53-E56 PolarHBondContact N-OE2 2.84Å; M53-E56 WeakPolarHBondContact O-CB 3.47Å; M53-E56 PolarHBondContact O-N 2.98Å; E54-E56 VanDerWaalsContact C-N 3.33Å; E54-E56 PolarHBondContact O-N 3.29Å; E56-G60 WeakPolarHBondContact O-CA 3.37Å; E56-G60 PolarHBondContact O-N 2.8Å; E56-I61 WeakPolarHBondContact CA-O 3.44Å; E56-I61 VanDerWaalsContact CB-O 3.23Å; E56-I61 WeakPolarHBondContact CB-O 3.23Å; E56-I61 WeakPolarHBondContact CG-O 3.14Å; E56-I61 PolarHBondContact O-N 3.38Å; E56-I63 HydrophobicContact CG-CB 3.73Å; E56-I63 HydrophobicContact CG-CD1 3.87Å; E56-I63 HydrophobicContact CG-CG1 3.77Å; E56-I63 WeakPolarHBondContact OE1-CA 3.24Å; E56-I63 PolarHBondContact OE1-N 3.18Å; E56-T64 PolarHBondContact OE1-N 3.34Å; E56-T64 PolarHBondContact OE1-OG1 3.23Å
57	Q	70.5	Confident	68.3	Low	79 Å²	79	39.5 Å²	39.5	37%	0.369	21%	0.208	S	C	.	.	H	α-helix	trans	-66.1	-43.5	178.1	-63.1	-179	0.2	0	0	112.6	D51 M53 E54 R59	D51-Q57 HydrophobicContact CB-CG 4.41Å; D51-Q57 VanDerWaalsContact O-CG 3.27Å; D51-Q57 WeakPolarHBondContact O-CG 3.41Å; D51-Q57 PolarHBondContact O-NE2 2.63Å; M53-Q57 PolarHBondContact O-N 3.49Å; E54-Q57 PolarHBondContact O-N 2.65Å; Q57-R59 VanDerWaalsContact C-N 3.34Å; Q57-R59 PolarHBondContact O-N 3.25Å
58	E	72.2	Confident	69.7	Low	122 Å²	122	37.2 Å²	37.2	57%	0.57	19%	0.188	S	C	*	.	H	α-helix	trans	-65.8	-36.1	-180	-77.1	175.3	-168.4	0	0	112.6	E54 R466	E54-E58 WeakPolarHBondContact O-CB 3.45Å; E54-E58 VanDerWaalsContact O-CG 3.3Å; E54-E58 WeakPolarHBondContact O-CG 3.46Å; E54-E58 PolarHBondContact O-N 3.04Å; E58-R466 IonicContact OE1-CZ 3.32Å; E58-R466 IonicContact OE1-NH1 3.97Å; E58-R466 PolarHBondContact OE1-NH1 2.93Å; E58-R466 IonicContact OE1-NH2 3.78Å; E58-R466 PolarHBondContact OE1-NH2 3.14Å; E58-R466 VanDerWaalsContact OE1-NH2 3.14Å; E58-R466 IonicContact OE2-CZ 3.47Å; E58-R466 IonicContact OE2-NH1 2.67Å; E58-R466 IonicContact OE2-NH2 2.84Å; E58-R466 PolarHBondContact OE2-NH2 2.84Å
59	R	70.1	Confident	70.9	Confident	100 Å²	100	37.6 Å²	37.6	38%	0.377	19%	0.19	S	C	.	.	H	α-helix	trans	-96	-15	-176.5	-62.2	-176.4	-170.6	-131.9	7.7	113.4	Q55 Q57 I61	Q55-R59 WeakPolarHBondContact O-CB 3.43Å; Q55-R59 WeakPolarHBondContact O-CG 3.15Å; Q55-R59 PolarHBondContact O-N 2.66Å; Q57-R59 VanDerWaalsContact C-N 3.34Å; Q57-R59 PolarHBondContact O-N 3.25Å; R59-I61 VanDerWaalsContact C-N 3.34Å; R59-I61 HydrophobicContact CB-CD1 4.31Å; R59-I61 HydrophobicContact CB-CG1 3.84Å
60	G	64.7	Low	72.1	Confident	55 Å²	55	33.7 Å²	33.7	57%	0.567	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.7	30.3	-176	0	0	0	0	0	113.7	E56	E56-G60 WeakPolarHBondContact O-CA 3.37Å; E56-G60 PolarHBondContact O-N 2.8Å
61	I	71.1	Confident	73.3	Confident	26 Å²	26	38.4 Å²	38.4	13%	0.133	19%	0.194	C	C	.	.	S	Bend	trans	-132.6	146.2	179.9	61.2	171.2	0	0	0	110.9	V19 E56 R59 I63 F88 L455	V19-I61 HydrophobicContact CG1-CG2 4.07Å; E56-I61 WeakPolarHBondContact CA-O 3.44Å; E56-I61 VanDerWaalsContact CB-O 3.23Å; E56-I61 WeakPolarHBondContact CB-O 3.23Å; E56-I61 WeakPolarHBondContact CG-O 3.14Å; E56-I61 PolarHBondContact O-N 3.38Å; R59-I61 VanDerWaalsContact C-N 3.34Å; R59-I61 HydrophobicContact CB-CD1 4.31Å; R59-I61 HydrophobicContact CB-CG1 3.84Å; I61-I63 HydrophobicContact CD1-CG1 4.4Å; I61-I63 HydrophobicContact CG1-CG1 4.28Å; I61-F88 HydrophobicContact CD1-CE2 4.47Å; I61-L455 HydrophobicContact CD1-CD2 3.69Å
62	T	69.7	Low	74.6	Confident	9 Å²	9	39.7 Å²	39.7	6%	0.055	20%	0.199	C	C	.	.			trans	-79.1	126.2	171	-38.3	0	0	0	0	109.9	K23 T24 P83	K23-T62 PolarHBondContact NZ-OG1 3.15Å; T24-T62 PolarHBondContact OG1-OG1 2.79Å; T62-P83 WeakPolarHBondContact O-CB 3.24Å
63	I	65.8	Low	75.6	Confident	9 Å²	9	41.2 Å²	41.2	5%	0.046	21%	0.208	C	C	.	.			trans	-106	-44	-178.6	-66.7	171.5	0	0	0	109.9	Q55 E56 I61 P83 F88 V459	Q55-I63 HydrophobicContact CB-CD1 3.73Å; E56-I63 HydrophobicContact CG-CB 3.73Å; E56-I63 HydrophobicContact CG-CD1 3.87Å; E56-I63 HydrophobicContact CG-CG1 3.77Å; E56-I63 WeakPolarHBondContact OE1-CA 3.24Å; E56-I63 PolarHBondContact OE1-N 3.18Å; I61-I63 HydrophobicContact CD1-CG1 4.4Å; I61-I63 HydrophobicContact CG1-CG1 4.28Å; I63-P83 WeakPolarHBondContact O-CG 3.39Å; I63-F88 HydrophobicContact CB-CE2 4.29Å; I63-F88 HydrophobicContact CB-CZ 4.38Å; I63-F88 HydrophobicContact CG1-CD2 4.48Å; I63-F88 HydrophobicContact CG1-CE2 3.86Å; I63-F88 HydrophobicContact CG1-CZ 4.08Å; I63-F88 HydrophobicContact CG2-CD1 4.13Å; I63-F88 HydrophobicContact CG2-CD2 4.49Å; I63-F88 HydrophobicContact CG2-CE1 3.75Å; I63-F88 HydrophobicContact CG2-CE2 4.14Å; I63-F88 HydrophobicContact CG2-CZ 3.77Å; I63-V459 HydrophobicContact CD1-CG1 4.07Å; I63-V459 HydrophobicContact CD1-CG2 3.96Å; I63-V459 HydrophobicContact CG2-CG1 4.11Å
64	T	70.7	Confident	76.6	Confident	17 Å²	17	43.3 Å²	43.3	10%	0.104	23%	0.232	C	C	.	.	S	Bend	trans	-114.9	146.5	-177.2	66.6	0	0	0	0	111.7	M53 E56 A66	M53-T64 HydrophobicContact CE-CG2 3.46Å; M53-T64 VanDerWaalsContact CE-CG2 3.46Å; M53-T64 HydrophobicContact SD-CG2 3.71Å; E56-T64 PolarHBondContact OE1-N 3.34Å; E56-T64 PolarHBondContact OE1-OG1 3.23Å; T64-A66 PolarHBondContact O-N 3.41Å
65	S	71.8	Confident	77.6	Confident	8 Å²	8	39.4 Å²	39.4	6%	0.056	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-73.7	128.7	178.3	62.2	0	0	0	0	112	D81 E91 K314	S65-D81 WeakPolarHBondContact CA-O 3.28Å; S65-D81 WeakPolarHBondContact CB-O 3.4Å; S65-E91 PolarHBondContact N-OE1 3.21Å; S65-E91 PolarHBondContact OG-OE1 2.91Å; S65-K314 PolarHBondContact O-NZ 3.47Å; S65-K314 PolarHBondContact OG-NZ 3.37Å
66	A	70.9	Confident	78.3	Confident	6 Å²	6	40.4 Å²	40.4	5%	0.05	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	119.3	178.3	0	0	0	0	0	109.7	M50 T64 I80 D81	M50-A66 HydrophobicContact CE-CB 3.58Å; M50-A66 HydrophobicContact SD-CB 4.47Å; T64-A66 PolarHBondContact O-N 3.41Å; A66-I80 WeakPolarHBondContact O-CA 3.1Å; A66-D81 HydrophobicContact CB-CB 4.5Å; A66-D81 PolarHBondContact N-O 3.41Å; A66-D81 PolarHBondContact O-N 2.85Å
67	A	79.1	Confident	79.3	Confident	15 Å²	15	40.4 Å²	40.4	12%	0.124	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	132.6	174.2	0	0	0	0	0	110.6	I79 F326 A359	A67-I79 CarbonylContact C-O 3.54Å; A67-I79 WeakPolarHBondContact CA-O 3.42Å; A67-F326 HydrophobicContact CB-CE1 4.41Å; A67-A359 PolarHBondContact O-N 2.91Å
68	T	81.6	Confident	80.3	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.025	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	149	175.6	-171.1	0	0	0	0	111.2	L31 M50 N78 I79	L31-T68 HydrophobicContact CD1-CG2 4.4Å; L31-T68 HydrophobicContact CD2-CG2 3.81Å; L31-T68 HydrophobicContact CG-CG2 4.48Å; M50-T68 HydrophobicContact CE-CG2 3.95Å; T68-N78 CarbonylContact O-C 3.6Å; T68-N78 WeakPolarHBondContact O-CA 3.41Å; T68-I79 HydrophobicContact CG2-CB 3.89Å; T68-I79 HydrophobicContact CG2-CD1 4.43Å; T68-I79 PolarHBondContact N-O 2.79Å; T68-I79 PolarHBondContact O-N 3.45Å
69	T	83.9	Confident	81.1	Confident	14 Å²	14	31 Å²	31	9%	0.086	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	134	172.8	-58.1	0	0	0	0	110.6	R76 V77 N78 Q356 H358	T69-R76 HydrophobicContact CG2-CG 3.68Å; T69-V77 WeakPolarHBondContact CA-O 3.08Å; T69-N78 WeakPolarHBondContact CB-OD1 3.46Å; T69-N78 WeakPolarHBondContact CG2-OD1 3.48Å; T69-N78 PolarHBondContact OG1-OD1 3.44Å; T69-Q356 PolarHBondContact OG1-NE2 3.31Å; T69-H358 PolarHBondContact N-ND1 2.97Å; T69-H358 PolarHBondContact O-CE1 3.02Å; T69-H358 PolarHBondContact O-ND1 3.36Å; T69-H358 VanDerWaalsContact O-ND1 3.11Å
70	A	86.3	Confident	81.9	Confident	1 Å²	1	26.3 Å²	26.3	1%	0.008	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	169.1	175.3	0	0	0	0	0	111.1	L31 T34 V77	L31-A70 HydrophobicContact CD2-CB 4.41Å; T34-A70 HydrophobicContact CG2-CB 3.86Å; A70-V77 PolarHBondContact N-O 3.06Å; A70-V77 PolarHBondContact O-N 3.38Å
71	Q	89.5	Confident	82.8	Confident	98 Å²	98	23.7 Å²	23.7	46%	0.458	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.5	176.5	-62.1	-178	4.2	0	0	109.4	E4 F5 T34 H75	E4-Q71 PolarHBondContact OE1-NE2 3.47Å; F5-Q71 HydrophobicContact CE2-CG 4.2Å; F5-Q71 HydrophobicContact CZ-CG 3.81Å; T34-Q71 VanDerWaalsContact CB-O 3.26Å; T34-Q71 WeakPolarHBondContact CB-O 3.41Å; T34-Q71 WeakPolarHBondContact CG2-O 3.47Å; Q71-H75 WeakPolarHBondContact CA-O 3.46Å
72	W	92.9	Very high	83.3	Confident	34 Å²	34	22.4 Å²	22.4	13%	0.129	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	127.8	178.5	-168.2	-116.7	0	0	0	109.8	Y33 T34 G74 H75 V77 Q268 L271 D272 I275	Y33-W72 WeakPolarHBondContact O-CZ3 3.45Å; T34-W72 HydrophobicContact CG2-CB 4.23Å; T34-W72 HydrophobicContact CG2-CD2 4.47Å; T34-W72 HydrophobicContact CG2-CE3 3.86Å; W72-G74 VanDerWaalsContact C-N 3.28Å; W72-G74 PolarHBondContact O-N 3.09Å; W72-H75 PolarHBondContact N-O 2.83Å; W72-H75 WeakPolarHBondContact O-CA 3.4Å; W72-H75 WeakPolarHBondContact O-CB 3.28Å; W72-H75 PolarHBondContact O-N 3.41Å; W72-V77 HydrophobicContact CB-CG2 4.29Å; W72-Q268 HydrophobicContact CH2-CB 4.32Å; W72-Q268 HydrophobicContact CH2-CG 3.99Å; W72-Q268 HydrophobicContact CZ2-CB 4.1Å; W72-Q268 HydrophobicContact CZ2-CG 4.27Å; W72-L271 HydrophobicContact CD2-CB 4.14Å; W72-L271 HydrophobicContact CD2-CD1 4.03Å; W72-L271 HydrophobicContact CE3-CD1 4.21Å; W72-L271 HydrophobicContact CG-CB 4.05Å; W72-L271 HydrophobicContact CG-CD1 4.42Å; W72-L271 HydrophobicContact CZ2-CB 4.42Å; W72-L271 HydrophobicContact CZ2-CD1 4.49Å; W72-D272 PolarHBondContact NE1-OD1 2.65Å; W72-I275 HydrophobicContact CB-CD1 4.16Å; W72-I275 VanDerWaalsContact CD1-CD1 3.42Å; W72-I275 HydrophobicContact CG-CD1 4.13Å; W72-I275 WeakPolarHBondContact O-CD1 3.27Å
73	K	90.9	Very high	83.6	Confident	137 Å²	137	22 Å²	22	60%	0.596	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	41.2	48.4	178.5	-66.3	-175.9	172.1	173	0	115	H75 D272 I275	K73-H75 VanDerWaalsContact C-N 3.26Å; K73-H75 PolarHBondContact O-N 2.78Å; K73-H75 PolarHBondContact O-ND1 2.87Å; K73-D272 WeakPolarHBondContact CD-OD1 3.3Å; K73-D272 WeakPolarHBondContact CE-OD1 3.45Å; K73-D272 IonicContact NZ-OD1 3.83Å; K73-D272 PolarHBondContact NZ-OD1 2.96Å; K73-D272 IonicContact NZ-OD2 3.44Å; K73-D272 PolarHBondContact NZ-OD2 3.32Å; K73-I275 HydrophobicContact CB-CD1 3.9Å
74	G	90	Very high	83.7	Confident	53 Å²	53	21.8 Å²	21.8	55%	0.546	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	8.9	179.2	0	0	0	0	0	115.5	F5 W72	F5-G74 WeakPolarHBondContact CD1-O 3.47Å; F5-G74 WeakPolarHBondContact CE1-O 3.39Å; W72-G74 VanDerWaalsContact C-N 3.28Å; W72-G74 PolarHBondContact O-N 3.09Å
75	H	92.9	Very high	83.7	Confident	32 Å²	32	23.4 Å²	23.4	15%	0.148	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	149.3	176.3	-63.7	68	0	0	0	110.8	N9 Q71 W72 K73 I275	N9-H75 CarbonylContact O-C 3.49Å; N9-H75 VanDerWaalsContact O-CA 3.23Å; N9-H75 WeakPolarHBondContact O-CA 3.44Å; N9-H75 WeakPolarHBondContact O-CB 3.42Å; Q71-H75 WeakPolarHBondContact CA-O 3.46Å; W72-H75 PolarHBondContact N-O 2.83Å; W72-H75 WeakPolarHBondContact O-CA 3.4Å; W72-H75 WeakPolarHBondContact O-CB 3.28Å; W72-H75 PolarHBondContact O-N 3.41Å; K73-H75 VanDerWaalsContact C-N 3.26Å; K73-H75 PolarHBondContact O-N 2.78Å; K73-H75 PolarHBondContact O-ND1 2.87Å; H75-I275 HydrophobicContact CB-CD1 3.94Å; H75-I275 HydrophobicContact CB-CG1 4.2Å
76	R	90.5	Very high	83.5	Confident	30 Å²	30	24.2 Å²	24.2	11%	0.113	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	126.7	169.4	179.1	177.8	176.5	176.6	-5.6	109.2	F5 N9 T10 R11 T69 N78 D372	F5-R76 HydrophobicContact CB-CB 4.06Å; F5-R76 HydrophobicContact CD1-CB 4.19Å; F5-R76 HydrophobicContact CD2-CB 3.83Å; F5-R76 HydrophobicContact CD2-CG 4.49Å; F5-R76 HydrophobicContact CE2-CB 4.36Å; F5-R76 HydrophobicContact CG-CB 3.74Å; N9-R76 PolarHBondContact O-N 3.35Å; T10-R76 CarbonylContact C-O 3.55Å; T10-R76 WeakPolarHBondContact CA-O 3.35Å; R11-R76 PolarHBondContact N-O 2.91Å; T69-R76 HydrophobicContact CG2-CG 3.68Å; R76-N78 PolarHBondContact NE-OD1 3.1Å; R76-N78 PolarHBondContact NH2-OD1 2.91Å; R76-D372 IonicContact CZ-OD1 2.67Å; R76-D372 IonicContact CZ-OD2 2.77Å; R76-D372 IonicContact NE-OD1 3.95Å; R76-D372 IonicContact NH1-OD1 3.89Å; R76-D372 PolarHBondContact NH1-OD1 2.93Å; R76-D372 IonicContact NH1-OD2 2.78Å; R76-D372 PolarHBondContact NH1-OD2 3.47Å; R76-D372 IonicContact NH2-OD1 3.05Å; R76-D372 PolarHBondContact NH2-OD1 2.86Å; R76-D372 IonicContact NH2-OD2 2.68Å
77	V	91	Very high	83.6	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	108.4	176.1	-170.7	0	0	0	0	108.5	R11 I13 T69 A70 W72 I79 V274	R11-V77 HydrophobicContact CB-CG1 4.48Å; R11-V77 CarbonylContact O-C 3.56Å; R11-V77 WeakPolarHBondContact O-CA 3.36Å; I13-V77 HydrophobicContact CD1-CG1 3.82Å; I13-V77 HydrophobicContact CG1-CG1 3.91Å; T69-V77 WeakPolarHBondContact CA-O 3.08Å; A70-V77 PolarHBondContact N-O 3.06Å; A70-V77 PolarHBondContact O-N 3.38Å; W72-V77 HydrophobicContact CB-CG2 4.29Å; V77-I79 HydrophobicContact CG1-CD1 4.27Å; V77-I79 HydrophobicContact CG1-CG1 3.78Å; V77-V274 HydrophobicContact CG1-CG1 4.34Å
78	N	89.8	Confident	83.5	Confident	2 Å²	2	23.9 Å²	23.9	1%	0.011	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125	169.2	-60.5	-37.6	0	0	0	107.7	R11 N12 I13 T68 T69 R76 I373	R11-N78 PolarHBondContact O-N 3.4Å; N12-N78 WeakPolarHBondContact CA-O 3.44Å; N12-N78 VanDerWaalsContact OD1-CB 3.28Å; N12-N78 WeakPolarHBondContact OD1-CB 3.37Å; N12-N78 PolarHBondContact OD1-ND2 3.21Å; I13-N78 PolarHBondContact N-O 3.4Å; T68-N78 CarbonylContact O-C 3.6Å; T68-N78 WeakPolarHBondContact O-CA 3.41Å; T69-N78 WeakPolarHBondContact CB-OD1 3.46Å; T69-N78 WeakPolarHBondContact CG2-OD1 3.48Å; T69-N78 PolarHBondContact OG1-OD1 3.44Å; R76-N78 PolarHBondContact NE-OD1 3.1Å; R76-N78 PolarHBondContact NH2-OD1 2.91Å; N78-I373 HydrophobicContact CB-CD1 4.38Å
79	I	89.6	Confident	82.9	Confident	1 Å²	1	24.1 Å²	24.1	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	132	-174.2	-52.2	168.9	0	0	0	108	I13 I15 T27 V30 A67 T68 V77	I13-I79 HydrophobicContact CD1-CG1 4.22Å; I13-I79 HydrophobicContact CG1-CG1 4.03Å; I13-I79 CarbonylContact O-C 3.49Å; I13-I79 VanDerWaalsContact O-CA 3.29Å; I13-I79 WeakPolarHBondContact O-CA 3.35Å; I15-I79 HydrophobicContact CD1-CG2 3.8Å; I15-I79 HydrophobicContact CG1-CG2 4.03Å; T27-I79 HydrophobicContact CG2-CG2 4.22Å; V30-I79 HydrophobicContact CB-CD1 4.31Å; V30-I79 HydrophobicContact CG1-CD1 3.32Å; A67-I79 CarbonylContact C-O 3.54Å; A67-I79 WeakPolarHBondContact CA-O 3.42Å; T68-I79 HydrophobicContact CG2-CB 3.89Å; T68-I79 HydrophobicContact CG2-CD1 4.43Å; T68-I79 PolarHBondContact N-O 2.79Å; T68-I79 PolarHBondContact O-N 3.45Å; V77-I79 HydrophobicContact CG1-CD1 4.27Å; V77-I79 HydrophobicContact CG1-CG1 3.78Å
80	I	87.2	Confident	82.6	Confident	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.3	165.6	-56.7	-177.3	0	0	0	107.9	I13 G14 I15 A66 T82 S95 V98 L99 F313 I373	I13-I80 PolarHBondContact O-N 3.31Å; G14-I80 WeakPolarHBondContact CA-O 3.46Å; I15-I80 PolarHBondContact N-O 2.96Å; A66-I80 WeakPolarHBondContact O-CA 3.1Å; I80-T82 HydrophobicContact CG2-CG2 4.25Å; I80-T82 PolarHBondContact O-N 3.19Å; I80-S95 WeakPolarHBondContact CG2-OG 3.45Å; I80-V98 HydrophobicContact CD1-CG2 3.7Å; I80-L99 HydrophobicContact CB-CD1 4.46Å; I80-L99 HydrophobicContact CB-CD2 4.1Å; I80-L99 HydrophobicContact CD1-CD2 3.65Å; I80-L99 HydrophobicContact CD1-CG 4.07Å; I80-L99 HydrophobicContact CG1-CD2 3.79Å; I80-F313 HydrophobicContact CD1-CE2 4.29Å; I80-F313 HydrophobicContact CD1-CZ 4.37Å; I80-I373 HydrophobicContact CD1-CD1 4.14Å; I80-I373 HydrophobicContact CG1-CD1 4.48Å
81	D	84	Confident	82.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	118	171.7	-162.5	26.5	0	0	0	108.7	K23 T24 T27 M50 S65 A66	K23-D81 WeakPolarHBondContact CD-OD1 3.48Å; K23-D81 VanDerWaalsContact CE-CG 3.46Å; K23-D81 WeakPolarHBondContact CE-OD1 3.23Å; K23-D81 WeakPolarHBondContact CG-OD1 3.43Å; T24-D81 PolarHBondContact OG1-OD2 3.34Å; T27-D81 HydrophobicContact CG2-CB 4.23Å; T27-D81 PolarHBondContact OG1-OD1 3.11Å; T27-D81 VanDerWaalsContact OG1-OD1 3.14Å; M50-D81 HydrophobicContact CE-CB 3.89Å; S65-D81 WeakPolarHBondContact CA-O 3.28Å; S65-D81 WeakPolarHBondContact CB-O 3.4Å; A66-D81 HydrophobicContact CB-CB 4.5Å; A66-D81 PolarHBondContact N-O 3.41Å; A66-D81 PolarHBondContact O-N 2.85Å
82	T	81.5	Confident	81.7	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-101.3	148.2	-173.2	68.2	0	0	0	0	112.2	I15 K23 I80 G84 S95	I15-T82 PolarHBondContact O-N 2.91Å; I15-T82 PolarHBondContact O-OG1 3.17Å; K23-T82 WeakPolarHBondContact CD-O 3.06Å; K23-T82 WeakPolarHBondContact CE-O 3.21Å; K23-T82 PolarHBondContact NZ-O 2.98Å; I80-T82 HydrophobicContact CG2-CG2 4.25Å; I80-T82 PolarHBondContact O-N 3.19Å; T82-G84 PolarHBondContact O-N 2.94Å; T82-S95 VanDerWaalsContact CG2-CB 3.47Å
83	P	76.6	Confident	81	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.006	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-60	141.2	176	-29.6	40.6	0	0	0	112.7	T62 I63 F88 E91 V92	T62-P83 WeakPolarHBondContact O-CB 3.24Å; I63-P83 WeakPolarHBondContact O-CG 3.39Å; P83-F88 HydrophobicContact CB-CB 3.58Å; P83-F88 HydrophobicContact CB-CG 4.46Å; P83-F88 HydrophobicContact CG-CB 3.93Å; P83-E91 HydrophobicContact CG-CB 3.71Å; P83-E91 HydrophobicContact CG-CG 3.76Å; P83-V92 WeakPolarHBondContact O-CG2 3.34Å
84	G	66.7	Low	80.5	Confident	4 Å²	4	13 Å²	13	4%	0.041	8%	0.077	C	C	.	.			trans	-94.3	-1.8	176.8	0	0	0	0	0	113.7	A17 V19 T82 Q115	A17-G84 VanDerWaalsContact O-CA 3.27Å; A17-G84 WeakPolarHBondContact O-CA 3.19Å; V19-G84 VanDerWaalsContact CG2-O 3.23Å; V19-G84 WeakPolarHBondContact CG2-O 3.36Å; T82-G84 PolarHBondContact O-N 2.94Å; G84-Q115 VanDerWaalsContact O-CG 3.32Å; G84-Q115 WeakPolarHBondContact O-CG 3.29Å
85	H	70.6	Confident	80.2	Confident	50 Å²	50	10.4 Å²	10.4	23%	0.231	5%	0.051	C	C	.	.	S	Bend	trans	-103.7	141.3	-173.2	-166.1	-75.6	0	0	0	111.4	V19 D87 F88 L455	V19-H85 HydrophobicContact CG2-CB 4.08Å; H85-D87 VanDerWaalsContact C-N 3.28Å; H85-D87 IonicContact CE1-OD1 3.43Å; H85-D87 WeakPolarHBondContact ND1-CB 3.48Å; H85-D87 PolarHBondContact ND1-N 2.76Å; H85-D87 PolarHBondContact O-N 2.72Å; H85-F88 HydrophobicContact CB-CD2 4.15Å; H85-F88 PolarHBondContact O-N 3.32Å; H85-L455 VanDerWaalsContact CE1-CD2 3.45Å; H85-L455 WeakPolarHBondContact CE1-CD2 3.41Å
86	V	68.3	Low	79.8	Confident	26 Å²	26	9 Å²	9	16%	0.158	4%	0.044	C	C	.	.	G	3₁₀ helix	trans	-57.7	-37.4	-175.2	67.5	0	0	0	0	114.1	F88 T89 Q115	V86-F88 PolarHBondContact O-N 2.9Å; V86-F88 VanDerWaalsContact O-N 3.13Å; V86-T89 HydrophobicContact CG2-CG2 4.23Å; V86-T89 WeakPolarHBondContact O-CB 3.47Å; V86-T89 WeakPolarHBondContact O-CG2 3.47Å; V86-T89 PolarHBondContact O-N 2.63Å; V86-T89 VanDerWaalsContact O-N 3.09Å; V86-T89 PolarHBondContact O-OG1 2.82Å; V86-Q115 VanDerWaalsContact CA-NE2 3.32Å
87	D	72.7	Confident	79.4	Confident	4 Å²	4	9.8 Å²	9.8	2%	0.021	5%	0.047	C	C	.	.	G	3₁₀ helix	trans	-61.5	-20.6	179.2	-80.5	27.4	0	0	0	113.9	H85 M452 G453 L455 H456 R658	H85-D87 VanDerWaalsContact C-N 3.28Å; H85-D87 IonicContact CE1-OD1 3.43Å; H85-D87 WeakPolarHBondContact ND1-CB 3.48Å; H85-D87 PolarHBondContact ND1-N 2.76Å; H85-D87 PolarHBondContact O-N 2.72Å; D87-M452 WeakPolarHBondContact O-CB 3.48Å; D87-G453 VanDerWaalsContact OD2-C 3.24Å; D87-G453 VanDerWaalsContact OD2-CA 3.24Å; D87-G453 WeakPolarHBondContact OD2-CA 3.27Å; D87-L455 HydrophobicContact CB-CB 4.45Å; D87-L455 WeakPolarHBondContact OD2-CA 3.48Å; D87-L455 WeakPolarHBondContact OD2-CB 3.42Å; D87-L455 PolarHBondContact OD2-N 3.13Å; D87-L455 VanDerWaalsContact OD2-N 3.08Å; D87-H456 HydrophobicContact CB-CB 3.96Å; D87-H456 PolarHBondContact OD2-N 3.26Å; D87-R658 IonicContact OD1-CZ 3.75Å; D87-R658 IonicContact OD1-NH1 2.74Å; D87-R658 PolarHBondContact OD1-NH1 3.18Å
88	F	76.7	Confident	79	Confident	9 Å²	9	9.8 Å²	9.8	4%	0.039	5%	0.048	C	C	.	.	G	3₁₀ helix	trans	-113.4	26	178.8	-52.8	-62.4	0	0	0	112	I61 I63 P83 H85 V86 I90 E91 V92 L455 V459	I61-F88 HydrophobicContact CD1-CE2 4.47Å; I63-F88 HydrophobicContact CB-CE2 4.29Å; I63-F88 HydrophobicContact CB-CZ 4.38Å; I63-F88 HydrophobicContact CG1-CD2 4.48Å; I63-F88 HydrophobicContact CG1-CE2 3.86Å; I63-F88 HydrophobicContact CG1-CZ 4.08Å; I63-F88 HydrophobicContact CG2-CD1 4.13Å; I63-F88 HydrophobicContact CG2-CD2 4.49Å; I63-F88 HydrophobicContact CG2-CE1 3.75Å; I63-F88 HydrophobicContact CG2-CE2 4.14Å; I63-F88 HydrophobicContact CG2-CZ 3.77Å; P83-F88 HydrophobicContact CB-CB 3.58Å; P83-F88 HydrophobicContact CB-CG 4.46Å; P83-F88 HydrophobicContact CG-CB 3.93Å; H85-F88 HydrophobicContact CB-CD2 4.15Å; H85-F88 PolarHBondContact O-N 3.32Å; V86-F88 PolarHBondContact O-N 2.9Å; V86-F88 VanDerWaalsContact O-N 3.13Å; F88-I90 PolarHBondContact O-N 2.8Å; F88-I90 VanDerWaalsContact O-N 3.15Å; F88-E91 WeakPolarHBondContact O-CB 3.3Å; F88-E91 PolarHBondContact O-N 3.22Å; F88-V92 PolarHBondContact O-N 3.47Å; F88-L455 HydrophobicContact CE2-CD2 4.02Å; F88-V459 HydrophobicContact CZ-CB 4.35Å; F88-V459 HydrophobicContact CZ-CG2 4.11Å
89	T	70.1	Confident	79	Confident	10 Å²	10	10.2 Å²	10.2	6%	0.061	5%	0.05	C	C	.	.	H	α-helix	trans	-54.9	-29.6	175.8	35.4	0	0	0	0	113.1	V86 E91 V92 Q93 T118	V86-T89 HydrophobicContact CG2-CG2 4.23Å; V86-T89 WeakPolarHBondContact O-CB 3.47Å; V86-T89 WeakPolarHBondContact O-CG2 3.47Å; V86-T89 PolarHBondContact O-N 2.63Å; V86-T89 VanDerWaalsContact O-N 3.09Å; V86-T89 PolarHBondContact O-OG1 2.82Å; T89-E91 VanDerWaalsContact C-N 3.28Å; T89-E91 PolarHBondContact O-N 2.88Å; T89-V92 WeakPolarHBondContact O-CB 3.28Å; T89-V92 PolarHBondContact O-N 3.24Å; T89-V92 VanDerWaalsContact O-N 3.16Å; T89-Q93 PolarHBondContact O-N 2.92Å; T89-T118 HydrophobicContact CG2-CG2 4.3Å
90	I	76.6	Confident	79.1	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.01	5%	0.052	C	C	.	.	H	α-helix	trans	-62.3	-38.3	176.4	-165	69.7	0	0	0	112.3	F88 V92 Q93 R94 F402 P403	F88-I90 PolarHBondContact O-N 2.8Å; F88-I90 VanDerWaalsContact O-N 3.15Å; I90-V92 VanDerWaalsContact C-N 3.26Å; I90-V92 PolarHBondContact O-N 3.43Å; I90-Q93 PolarHBondContact O-N 3.03Å; I90-R94 VanDerWaalsContact CG1-NH2 3.28Å; I90-R94 WeakPolarHBondContact O-CB 3.44Å; I90-R94 VanDerWaalsContact O-CG 3.22Å; I90-R94 WeakPolarHBondContact O-CG 3.49Å; I90-R94 PolarHBondContact O-N 3.38Å; I90-F402 HydrophobicContact CD1-CB 4.42Å; I90-F402 HydrophobicContact CD1-CD1 3.33Å; I90-F402 HydrophobicContact CD1-CE1 3.94Å; I90-F402 HydrophobicContact CD1-CG 4.29Å; I90-F402 HydrophobicContact CG1-CD1 4.01Å; I90-F402 HydrophobicContact CG1-CE1 4.34Å; I90-P403 HydrophobicContact CD1-CG 4.39Å
91	E	78	Confident	79.4	Confident	15 Å²	15	10.6 Å²	10.6	7%	0.07	5%	0.052	C	C	.	.	H	α-helix	trans	-69.7	-31.8	179.2	-162.4	76.4	160.7	0	0	110.3	S65 P83 F88 T89 R94 S95 K314	S65-E91 PolarHBondContact N-OE1 3.21Å; S65-E91 PolarHBondContact OG-OE1 2.91Å; P83-E91 HydrophobicContact CG-CB 3.71Å; P83-E91 HydrophobicContact CG-CG 3.76Å; F88-E91 WeakPolarHBondContact O-CB 3.3Å; F88-E91 PolarHBondContact O-N 3.22Å; T89-E91 VanDerWaalsContact C-N 3.28Å; T89-E91 PolarHBondContact O-N 2.88Å; E91-R94 IonicContact OE2-NH1 3.7Å; E91-S95 VanDerWaalsContact O-CB 3.29Å; E91-S95 WeakPolarHBondContact O-CB 3.39Å; E91-S95 PolarHBondContact O-N 2.96Å; E91-S95 VanDerWaalsContact O-N 3.09Å; E91-S95 PolarHBondContact O-OG 3.29Å; E91-K314 WeakPolarHBondContact OE1-CE 3.38Å; E91-K314 IonicContact OE1-NZ 2.61Å; E91-K314 PolarHBondContact OE1-NZ 3.26Å
92	V	78.7	Confident	79.9	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.012	5%	0.052	C	C	.	.	H	α-helix	trans	-67.2	-49	171.8	-174.3	0	0	0	0	110.8	P83 F88 T89 I90 R94 S95 L96 V119	P83-V92 WeakPolarHBondContact O-CG2 3.34Å; F88-V92 PolarHBondContact O-N 3.47Å; T89-V92 WeakPolarHBondContact O-CB 3.28Å; T89-V92 PolarHBondContact O-N 3.24Å; T89-V92 VanDerWaalsContact O-N 3.16Å; I90-V92 VanDerWaalsContact C-N 3.26Å; I90-V92 PolarHBondContact O-N 3.43Å; V92-R94 PolarHBondContact O-N 3.32Å; V92-S95 PolarHBondContact O-N 3.25Å; V92-S95 VanDerWaalsContact O-N 3.16Å; V92-L96 HydrophobicContact CG1-CD1 3.75Å; V92-L96 HydrophobicContact CG1-CG 4.12Å; V92-L96 WeakPolarHBondContact O-CB 3.3Å; V92-L96 WeakPolarHBondContact O-CG 3.38Å; V92-L96 PolarHBondContact O-N 2.95Å; V92-V119 HydrophobicContact CG1-CB 4.33Å; V92-V119 HydrophobicContact CG1-CG1 3.96Å
93	Q	79.2	Confident	80.6	Confident	26 Å²	26	10.6 Å²	10.6	12%	0.121	5%	0.052	C	C	.	.	H	α-helix	trans	-59.5	-47	178.1	-76.4	-175.7	-44.5	0	0	112.3	T89 I90 S95 L96 R97 Q122	T89-Q93 PolarHBondContact O-N 2.92Å; I90-Q93 PolarHBondContact O-N 3.03Å; Q93-S95 PolarHBondContact O-N 3.44Å; Q93-L96 PolarHBondContact O-N 2.84Å; Q93-R97 WeakPolarHBondContact O-CB 3.32Å; Q93-R97 PolarHBondContact O-N 2.83Å; Q93-R97 VanDerWaalsContact O-N 3.15Å; Q93-Q122 HydrophobicContact CG-CG 4.31Å
94	R	80.7	Confident	81.5	Confident	4 Å²	4	10.5 Å²	10.5	2%	0.015	5%	0.051	C	C	.	.	H	α-helix	trans	-57.5	-41.2	176.1	-70.5	168.5	-163.1	-175.6	10.6	111.7	I90 E91 V92 F313 T384 I400 E432 D433	I90-R94 VanDerWaalsContact CG1-NH2 3.28Å; I90-R94 WeakPolarHBondContact O-CB 3.44Å; I90-R94 VanDerWaalsContact O-CG 3.22Å; I90-R94 WeakPolarHBondContact O-CG 3.49Å; I90-R94 PolarHBondContact O-N 3.38Å; E91-R94 IonicContact OE2-NH1 3.7Å; V92-R94 PolarHBondContact O-N 3.32Å; R94-F313 WeakPolarHBondContact CD-O 3.18Å; R94-T384 HydrophobicContact CG-CG2 4.05Å; R94-I400 HydrophobicContact CG-CD1 4.21Å; R94-E432 PolarHBondContact NH1-O 3.37Å; R94-D433 IonicContact CZ-OD1 2.77Å; R94-D433 IonicContact NH2-OD1 2.84Å; R94-D433 PolarHBondContact NH2-OD1 2.86Å
95	S	83.2	Confident	82.9	Confident	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-70.1	-53	-179.7	-57.9	0	0	0	0	110.6	I80 T82 E91 V92 Q93 R97 V98 L99	I80-S95 WeakPolarHBondContact CG2-OG 3.45Å; T82-S95 VanDerWaalsContact CG2-CB 3.47Å; E91-S95 VanDerWaalsContact O-CB 3.29Å; E91-S95 WeakPolarHBondContact O-CB 3.39Å; E91-S95 PolarHBondContact O-N 2.96Å; E91-S95 VanDerWaalsContact O-N 3.09Å; E91-S95 PolarHBondContact O-OG 3.29Å; V92-S95 PolarHBondContact O-N 3.25Å; V92-S95 VanDerWaalsContact O-N 3.16Å; Q93-S95 PolarHBondContact O-N 3.44Å; S95-R97 PolarHBondContact O-N 2.78Å; S95-R97 VanDerWaalsContact O-N 3.13Å; S95-V98 WeakPolarHBondContact O-CG2 3.39Å; S95-V98 PolarHBondContact O-N 3.29Å; S95-L99 VanDerWaalsContact O-CD1 3.29Å; S95-L99 WeakPolarHBondContact O-CD1 3.47Å; S95-L99 WeakPolarHBondContact O-CG 3.42Å; S95-L99 PolarHBondContact O-N 3.02Å
96	L	83.6	Confident	84	Confident	2 Å²	2	8 Å²	8	1%	0.01	4%	0.038	C	C	.	.	H	α-helix	trans	-55.9	-35	-178.1	-72.6	173.8	0	0	0	113	M16 V92 Q93 V98 L99 A102 Q122 A123 Y126	M16-L96 HydrophobicContact SD-CD2 4.15Å; V92-L96 HydrophobicContact CG1-CD1 3.75Å; V92-L96 HydrophobicContact CG1-CG 4.12Å; V92-L96 WeakPolarHBondContact O-CB 3.3Å; V92-L96 WeakPolarHBondContact O-CG 3.38Å; V92-L96 PolarHBondContact O-N 2.95Å; Q93-L96 PolarHBondContact O-N 2.84Å; L96-V98 VanDerWaalsContact C-N 3.33Å; L96-V98 PolarHBondContact O-N 3.48Å; L96-L99 PolarHBondContact O-N 3.46Å; L96-A102 HydrophobicContact CD2-CB 4.42Å; L96-Q122 HydrophobicContact CD1-CB 3.77Å; L96-A123 HydrophobicContact CD1-CB 3.94Å; L96-A123 HydrophobicContact CD2-CB 3.96Å; L96-Y126 HydrophobicContact CB-CD2 4.14Å
97	R	81.7	Confident	85.2	Confident	46 Å²	46	7 Å²	7	17%	0.174	3%	0.032	C	C	.	.	H	α-helix	trans	-64.4	-31.8	178	-169.4	77.3	171.4	173.7	4.1	114.1	Q93 S95 L311 Y330 E398	Q93-R97 WeakPolarHBondContact O-CB 3.32Å; Q93-R97 PolarHBondContact O-N 2.83Å; Q93-R97 VanDerWaalsContact O-N 3.15Å; S95-R97 PolarHBondContact O-N 2.78Å; S95-R97 VanDerWaalsContact O-N 3.13Å; R97-L311 HydrophobicContact CG-CD2 4.25Å; R97-Y330 PolarHBondContact O-OH 2.87Å; R97-Y330 VanDerWaalsContact O-OH 3.11Å; R97-E398 IonicContact CZ-OE2 3.68Å; R97-E398 IonicContact NH1-OE2 2.95Å; R97-E398 PolarHBondContact NH1-OE2 2.84Å; R97-E398 VanDerWaalsContact NH1-OE2 3.15Å; R97-E398 PolarHBondContact NH2-O 3.08Å; R97-E398 IonicContact NH2-OE2 3.55Å; R97-E398 PolarHBondContact NH2-OE2 2.8Å
98	V	84.2	Confident	86.1	Confident	1 Å²	1	6.8 Å²	6.8	1%	0.006	3%	0.031	C	C	.	.	H	α-helix	trans	-97.9	-4.2	-177.2	-63.8	0	0	0	0	113.8	I80 S95 L96 L311 F313 R328	I80-V98 HydrophobicContact CD1-CG2 3.7Å; S95-V98 WeakPolarHBondContact O-CG2 3.39Å; S95-V98 PolarHBondContact O-N 3.29Å; L96-V98 VanDerWaalsContact C-N 3.33Å; L96-V98 PolarHBondContact O-N 3.48Å; V98-L311 HydrophobicContact CG1-CD2 4.27Å; V98-F313 HydrophobicContact CB-CD1 4.35Å; V98-F313 HydrophobicContact CB-CG 4.42Å; V98-F313 HydrophobicContact CG1-CB 3.58Å; V98-F313 HydrophobicContact CG1-CD1 3.76Å; V98-F313 HydrophobicContact CG1-CG 3.71Å; V98-F313 HydrophobicContact CG2-CD1 4.17Å; V98-F313 HydrophobicContact CG2-CD2 4.03Å; V98-F313 HydrophobicContact CG2-CE1 4.34Å; V98-F313 HydrophobicContact CG2-CE2 4.22Å; V98-F313 HydrophobicContact CG2-CG 4Å; V98-F313 HydrophobicContact CG2-CZ 4.36Å; V98-R328 HydrophobicContact CB-CB 3.92Å; V98-R328 HydrophobicContact CB-CG 4.19Å; V98-R328 HydrophobicContact CG1-CB 3.89Å; V98-R328 HydrophobicContact CG1-CG 4.47Å
99	L	88.3	Confident	86.7	Confident	10 Å²	10	10.2 Å²	10.2	5%	0.052	5%	0.047	C	C	.	.			trans	-93.4	144	-178.1	-69.5	167.7	0	0	0	110.3	I13 G14 I80 S95 L96	I13-L99 VanDerWaalsContact O-CD2 3.31Å; I13-L99 WeakPolarHBondContact O-CD2 3.36Å; G14-L99 VanDerWaalsContact N-CD1 3.32Å; I80-L99 HydrophobicContact CB-CD1 4.46Å; I80-L99 HydrophobicContact CB-CD2 4.1Å; I80-L99 HydrophobicContact CD1-CD2 3.65Å; I80-L99 HydrophobicContact CD1-CG 4.07Å; I80-L99 HydrophobicContact CG1-CD2 3.79Å; S95-L99 VanDerWaalsContact O-CD1 3.29Å; S95-L99 WeakPolarHBondContact O-CD1 3.47Å; S95-L99 WeakPolarHBondContact O-CG 3.42Å; S95-L99 PolarHBondContact O-N 3.02Å; L96-L99 PolarHBondContact O-N 3.46Å
100	D	92.2	Very high	87.6	Confident	10 Å²	10	11.6 Å²	11.6	5%	0.053	6%	0.058	C	C	.	.	S	Bend	trans	-84.5	-34.3	175	-57	-33.9	0	0	0	109.5	N12 P129 P279 P281 V284 R328	N12-D100 HydrophobicContact CB-CB 4.29Å; N12-D100 VanDerWaalsContact CB-OD2 3.32Å; N12-D100 WeakPolarHBondContact CB-OD2 3.26Å; N12-D100 PolarHBondContact ND2-OD2 2.91Å; N12-D100 PolarHBondContact O-N 3.34Å; D100-P129 WeakPolarHBondContact O-CD 3.45Å; D100-P279 VanDerWaalsContact C-CG 3.42Å; D100-P279 HydrophobicContact CB-CB 4.37Å; D100-P279 HydrophobicContact CB-CG 3.96Å; D100-P279 WeakPolarHBondContact O-CG 3.47Å; D100-P281 WeakPolarHBondContact OD2-CG 3.39Å; D100-V284 HydrophobicContact CB-CG2 3.73Å; D100-R328 VanDerWaalsContact CG-NH2 3.33Å; D100-R328 IonicContact OD1-CZ 2.74Å; D100-R328 IonicContact OD1-NH2 3.59Å; D100-R328 PolarHBondContact OD1-NH2 3.05Å; D100-R328 IonicContact OD2-CZ 2.97Å; D100-R328 IonicContact OD2-NH2 2.72Å; D100-R328 PolarHBondContact OD2-NH2 3.01Å
101	G	94.2	Very high	88.3	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	177.5	177.1	0	0	0	0	0	113.1	N12 I13 G14 P129	N12-G101 PolarHBondContact O-N 2.86Å; I13-G101 VanDerWaalsContact CA-O 3.25Å; I13-G101 WeakPolarHBondContact CA-O 3.44Å; G14-G101 PolarHBondContact N-O 2.8Å; G101-P129 CarbonylContact C-O 3.59Å; G101-P129 VanDerWaalsContact CA-O 3.24Å; G101-P129 WeakPolarHBondContact CA-O 3.43Å
102	A	94.8	Very high	88.9	Confident	0 Å²	0	10.8 Å²	10.8	0%	0	5%	0.054	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	156.1	177.7	0	0	0	0	0	114.1	G14 M16 L96 V128 P129 R130 I131	G14-A102 CarbonylContact O-C 3.52Å; G14-A102 VanDerWaalsContact O-CA 3.25Å; G14-A102 WeakPolarHBondContact O-CA 3.34Å; M16-A102 HydrophobicContact CE-CB 3.66Å; M16-A102 HydrophobicContact SD-CB 4.42Å; L96-A102 HydrophobicContact CD2-CB 4.42Å; A102-V128 HydrophobicContact CB-CG1 4.08Å; A102-P129 PolarHBondContact N-O 3.46Å; A102-R130 HydrophobicContact CB-CG 3.94Å; A102-R130 VanDerWaalsContact O-CA 3.28Å; A102-R130 WeakPolarHBondContact O-CA 3.15Å; A102-I131 PolarHBondContact O-N 2.68Å
103	V	96	Very high	89.3	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	112.3	172.6	-176.2	0	0	0	0	107.8	I13 G14 I15 M16 V105 I131 F133 M270 V274 L278	I13-V103 HydrophobicContact CD1-CG2 4.13Å; G14-V103 PolarHBondContact O-N 2.9Å; I15-V103 WeakPolarHBondContact CA-O 3.38Å; I15-V103 HydrophobicContact CG1-CB 4.45Å; M16-V103 PolarHBondContact N-O 2.95Å; V103-V105 HydrophobicContact CG1-CG2 4.31Å; V103-I131 HydrophobicContact CB-CG1 4.31Å; V103-I131 HydrophobicContact CG1-CG1 4.21Å; V103-I131 HydrophobicContact CG2-CD1 3.99Å; V103-I131 HydrophobicContact CG2-CG1 3.91Å; V103-F133 HydrophobicContact CG1-CB 4.11Å; V103-M270 HydrophobicContact CG1-CG 4.31Å; V103-M270 HydrophobicContact CG1-SD 4.04Å; V103-M270 HydrophobicContact CG2-SD 4.02Å; V103-V274 HydrophobicContact CG2-CG2 3.99Å; V103-L278 HydrophobicContact CG2-CD1 4.28Å
104	T	95.3	Very high	89.4	Confident	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	113.5	173.5	-52.6	0	0	0	0	109	M16 L106 T116 W120 I131 V132 F133	M16-T104 WeakPolarHBondContact CE-OG1 3.31Å; M16-T104 CarbonylContact O-C 3.58Å; M16-T104 WeakPolarHBondContact O-CA 3.43Å; T104-L106 HydrophobicContact CG2-CD2 4.17Å; T104-T116 HydrophobicContact CG2-CG2 4.21Å; T104-W120 HydrophobicContact CG2-CE3 4.15Å; T104-W120 HydrophobicContact CG2-CZ3 4.22Å; T104-I131 PolarHBondContact N-O 2.81Å; T104-V132 CarbonylContact O-C 3.6Å; T104-V132 WeakPolarHBondContact O-CA 3.37Å; T104-F133 PolarHBondContact O-N 2.88Å
105	V	95	Very high	89.2	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.9	177.1	-176.6	0	0	0	0	109.7	I15 M16 A17 A21 V103 F133 N135	I15-V105 HydrophobicContact CG2-CG2 3.55Å; M16-V105 PolarHBondContact O-N 3.37Å; A17-V105 HydrophobicContact CB-CB 3.8Å; A17-V105 WeakPolarHBondContact CB-O 3.32Å; A21-V105 HydrophobicContact CB-CG1 4.33Å; A21-V105 WeakPolarHBondContact O-CG1 3.45Å; V103-V105 HydrophobicContact CG1-CG2 4.31Å; V105-F133 WeakPolarHBondContact CA-O 3.27Å; V105-F133 HydrophobicContact CG1-CD1 4.34Å; V105-F133 HydrophobicContact CG2-CD1 4.46Å; V105-N135 HydrophobicContact CG1-CB 3.69Å
106	L	94.5	Very high	89.4	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.1	175.6	-57.4	-179.1	0	0	0	110.6	T104 T116 V132 F133 N135 L151	T104-L106 HydrophobicContact CG2-CD2 4.17Å; L106-T116 HydrophobicContact CD2-CG2 3.5Å; L106-V132 HydrophobicContact CD1-CG1 3.65Å; L106-V132 HydrophobicContact CG-CG1 3.94Å; L106-F133 PolarHBondContact N-O 2.83Å; L106-N135 WeakPolarHBondContact O-CA 3.44Å; L106-N135 WeakPolarHBondContact O-CB 3.41Å; L106-N135 PolarHBondContact O-N 3.35Å; L106-L151 HydrophobicContact CD1-CD1 4.25Å; L106-L151 HydrophobicContact CD1-CD2 3.91Å; L106-L151 HydrophobicContact CD1-CG 4.11Å
107	D	92.6	Very high	89.6	Confident	6 Å²	6	14.5 Å²	14.5	3%	0.032	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	118.6	161.6	-174.7	-26.6	0	0	0	108.2	Q109 S110 G111 K139	D107-Q109 PolarHBondContact O-N 2.68Å; D107-Q109 VanDerWaalsContact OD1-CB 3.31Å; D107-Q109 WeakPolarHBondContact OD1-CB 3.09Å; D107-Q109 PolarHBondContact OD1-N 3.44Å; D107-S110 PolarHBondContact O-N 3.14Å; D107-G111 PolarHBondContact O-N 2.75Å; D107-K139 IonicContact OD1-NZ 3.59Å; D107-K139 IonicContact OD2-NZ 3.67Å; D107-K139 PolarHBondContact OD2-NZ 2.96Å
108	S	92.5	Very high	89.5	Confident	0 Å²	0	14.4 Å²	14.4	0%	0	8%	0.078	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-16.5	-179.5	-69.1	0	0	0	0	114.3	C134 N135 M137 D143 S147	S108-C134 WeakPolarHBondContact OG-CB 3.45Å; S108-C134 PolarHBondContact OG-O 3.27Å; S108-N135 VanDerWaalsContact CB-O 3.28Å; S108-N135 WeakPolarHBondContact CB-O 3.4Å; S108-N135 PolarHBondContact N-O 3.22Å; S108-N135 PolarHBondContact OG-O 3.33Å; S108-M137 VanDerWaalsContact CB-SD 3.52Å; S108-M137 PolarHBondContact OG-SD 2.97Å; S108-D143 CarbonylContact O-C 3.47Å; S108-D143 PolarHBondContact O-N 2.95Å; S108-S147 VanDerWaalsContact CA-OG 3.26Å; S108-S147 WeakPolarHBondContact CA-OG 3.38Å; S108-S147 PolarHBondContact O-OG 2.99Å
109	Q	89.9	Confident	89.5	Confident	81 Å²	81	14.4 Å²	14.4	38%	0.379	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-42.9	173.3	-176.6	-174.8	24.7	0	0	112.2	D107 I140	D107-Q109 PolarHBondContact O-N 2.68Å; D107-Q109 VanDerWaalsContact OD1-CB 3.31Å; D107-Q109 WeakPolarHBondContact OD1-CB 3.09Å; D107-Q109 PolarHBondContact OD1-N 3.44Å; Q109-I140 PolarHBondContact NE2-O 3.04Å
110	S	88.5	Confident	89.5	Confident	39 Å²	39	14.6 Å²	14.6	27%	0.273	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-23.7	-170.8	-62.4	0	0	0	0	113.2	D107	D107-S110 PolarHBondContact O-N 3.14Å
111	G	91.1	Very high	89.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	11%	0.108	C	C	.	.	B	Isolated β-bridge	trans	65.1	-137	-173	0	0	0	0	0	112.3	D107 E113 T150	D107-G111 PolarHBondContact O-N 2.75Å; G111-E113 PolarHBondContact O-N 3.1Å; G111-T150 WeakPolarHBondContact CA-OG1 3.24Å
112	V	90.9	Very high	88.6	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	11%	0.112	C	C	.	.	S	Bend	trans	-74.1	116.6	177.4	174.1	0	0	0	0	111.2	T116 E117 T150 L151 R154 L155	V112-T116 HydrophobicContact CG1-CG2 4.17Å; V112-E117 HydrophobicContact CG1-CG 3.81Å; V112-T150 PolarHBondContact N-OG1 2.99Å; V112-L151 HydrophobicContact CG2-CD2 3.73Å; V112-L151 HydrophobicContact CG2-CG 4.08Å; V112-R154 HydrophobicContact CB-CB 4.26Å; V112-R154 HydrophobicContact CG1-CB 3.9Å; V112-R154 PolarHBondContact O-NH1 3.39Å; V112-L155 HydrophobicContact CG1-CD1 4.02Å; V112-L155 HydrophobicContact CG1-CD2 3.76Å; V112-L155 HydrophobicContact CG1-CG 3.8Å; V112-L155 HydrophobicContact CG2-CD1 3.74Å; V112-L155 HydrophobicContact CG2-CG 4.04Å
113	E	87.3	Confident	88.3	Confident	35 Å²	35	23.7 Å²	23.7	16%	0.164	11%	0.112	C	C	.	.			trans	-101.1	165	176.9	-67.3	178.4	110.5	0	0	112.1	H18 G111 Q115 T116 E117	H18-E113 HydrophobicContact CB-CB 3.94Å; H18-E113 WeakPolarHBondContact CB-OE2 3.3Å; H18-E113 IonicContact CD2-OE1 3.07Å; H18-E113 PolarHBondContact CD2-OE1 3.14Å; H18-E113 IonicContact CD2-OE2 2.77Å; H18-E113 PolarHBondContact CD2-OE2 2.7Å; H18-E113 IonicContact CG-OE2 3.41Å; H18-E113 IonicContact NE2-OE1 3.95Å; G111-E113 PolarHBondContact O-N 3.1Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.98Å; E113-Q115 VanDerWaalsContact O-N 3.15Å; E113-T116 WeakPolarHBondContact O-CA 3.41Å; E113-T116 WeakPolarHBondContact O-CB 3.21Å; E113-T116 PolarHBondContact O-N 3.34Å; E113-E117 PolarHBondContact O-N 3.34Å; E113-E117 VanDerWaalsContact O-N 3.16Å
114	P	79.9	Confident	88	Confident	25 Å²	25	26.6 Å²	26.6	16%	0.162	13%	0.13	C	C	.	.	H	α-helix	trans	-56.3	-36	-173.7	-27.3	34.9	0	0	0	114.8	E117 T118 Q662 R664	P114-E117 WeakPolarHBondContact O-CB 3.37Å; P114-E117 PolarHBondContact O-N 2.78Å; P114-T118 PolarHBondContact O-N 3.45Å; P114-T118 PolarHBondContact O-OG1 3.24Å; P114-Q662 WeakPolarHBondContact CB-O 3.28Å; P114-Q662 HydrophobicContact CG-CB 4.27Å; P114-Q662 WeakPolarHBondContact CG-O 3.44Å; P114-R664 HydrophobicContact CB-CG 4.32Å
115	Q	78	Confident	87.4	Confident	13 Å²	13	32.8 Å²	32.8	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-75.4	-29.6	176.8	-154.4	59.7	25.2	0	0	112.5	H18 G84 V86 E113 E117 T118 V119	H18-Q115 WeakPolarHBondContact ND1-CB 3.25Å; G84-Q115 VanDerWaalsContact O-CG 3.32Å; G84-Q115 WeakPolarHBondContact O-CG 3.29Å; V86-Q115 VanDerWaalsContact CA-NE2 3.32Å; E113-Q115 VanDerWaalsContact C-N 3.28Å; E113-Q115 PolarHBondContact O-N 2.98Å; E113-Q115 VanDerWaalsContact O-N 3.15Å; Q115-E117 VanDerWaalsContact C-N 3.26Å; Q115-E117 PolarHBondContact O-N 3.38Å; Q115-T118 PolarHBondContact O-N 3.32Å; Q115-T118 VanDerWaalsContact O-N 3.15Å; Q115-V119 WeakPolarHBondContact O-CG2 3.5Å; Q115-V119 PolarHBondContact O-N 3.49Å
116	T	87.7	Confident	86.9	Confident	0 Å²	0	35 Å²	35	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-58.2	-43.4	170.7	-55	0	0	0	0	109.8	T104 L106 V112 E113 T118 V119 W120 L155	T104-T116 HydrophobicContact CG2-CG2 4.21Å; L106-T116 HydrophobicContact CD2-CG2 3.5Å; V112-T116 HydrophobicContact CG1-CG2 4.17Å; E113-T116 WeakPolarHBondContact O-CA 3.41Å; E113-T116 WeakPolarHBondContact O-CB 3.21Å; E113-T116 PolarHBondContact O-N 3.34Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 3.46Å; T116-V119 WeakPolarHBondContact O-CG2 3.44Å; T116-V119 PolarHBondContact O-N 2.91Å; T116-W120 WeakPolarHBondContact O-CB 3.44Å; T116-W120 PolarHBondContact O-N 2.74Å; T116-L155 HydrophobicContact CG2-CD1 4.41Å
117	E	86.1	Confident	86.6	Confident	38 Å²	38	44.6 Å²	44.6	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-58.2	-42.4	175.4	-60.2	168.3	-160.7	0	0	111.9	V112 E113 P114 Q115 R121 L155 R664	V112-E117 HydrophobicContact CG1-CG 3.81Å; E113-E117 PolarHBondContact O-N 3.34Å; E113-E117 VanDerWaalsContact O-N 3.16Å; P114-E117 WeakPolarHBondContact O-CB 3.37Å; P114-E117 PolarHBondContact O-N 2.78Å; Q115-E117 VanDerWaalsContact C-N 3.26Å; Q115-E117 PolarHBondContact O-N 3.38Å; E117-R121 WeakPolarHBondContact O-CB 3.16Å; E117-R121 PolarHBondContact O-N 3Å; E117-L155 HydrophobicContact CB-CD2 4.02Å; E117-L155 HydrophobicContact CG-CD2 3.71Å; E117-R664 IonicContact OE1-CZ 3.54Å; E117-R664 IonicContact OE1-NE 2.72Å; E117-R664 PolarHBondContact OE1-NE 2.95Å; E117-R664 IonicContact OE1-NH2 3.84Å; E117-R664 PolarHBondContact OE1-NH2 3.22Å; E117-R664 IonicContact OE2-CZ 2.99Å; E117-R664 IonicContact OE2-NE 3.21Å; E117-R664 PolarHBondContact OE2-NE 2.91Å; E117-R664 IonicContact OE2-NH2 3.92Å
118	T	80.3	Confident	86.6	Confident	45 Å²	45	44.6 Å²	44.6	28%	0.276	20%	0.204	S	C	.	.	H	α-helix	trans	-66.5	-52	-178.9	-57.1	0	0	0	0	111.6	T89 P114 Q115 T116 W120 R121 Q122	T89-T118 HydrophobicContact CG2-CG2 4.3Å; P114-T118 PolarHBondContact O-N 3.45Å; P114-T118 PolarHBondContact O-OG1 3.24Å; Q115-T118 PolarHBondContact O-N 3.32Å; Q115-T118 VanDerWaalsContact O-N 3.15Å; T116-T118 VanDerWaalsContact C-N 3.29Å; T116-T118 PolarHBondContact O-N 3.46Å; T118-W120 VanDerWaalsContact C-N 3.3Å; T118-W120 PolarHBondContact O-N 2.8Å; T118-R121 PolarHBondContact O-N 2.88Å; T118-Q122 WeakPolarHBondContact O-CG 3.42Å; T118-Q122 PolarHBondContact O-N 2.9Å; T118-Q122 VanDerWaalsContact O-N 3.13Å
119	V	83.7	Confident	86.7	Confident	1 Å²	1	45 Å²	45	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-69.1	-31.4	-179.9	-57.5	0	0	0	0	111.8	M16 V92 Q115 T116 Q122 A123	M16-V119 HydrophobicContact CB-CG2 4.32Å; M16-V119 HydrophobicContact CG-CG2 4.42Å; M16-V119 HydrophobicContact SD-CB 4.32Å; M16-V119 HydrophobicContact SD-CG2 4.18Å; V92-V119 HydrophobicContact CG1-CB 4.33Å; V92-V119 HydrophobicContact CG1-CG1 3.96Å; Q115-V119 WeakPolarHBondContact O-CG2 3.5Å; Q115-V119 PolarHBondContact O-N 3.49Å; T116-V119 WeakPolarHBondContact O-CG2 3.44Å; T116-V119 PolarHBondContact O-N 2.91Å; V119-Q122 PolarHBondContact O-N 2.89Å; V119-A123 WeakPolarHBondContact O-CB 3.3Å; V119-A123 PolarHBondContact O-N 3.02Å
120	W	89.4	Confident	87	Confident	13 Å²	13	41.2 Å²	41.2	5%	0.049	19%	0.189	C	C	.	.	H	α-helix	trans	-63.3	-45.9	173.4	-171.9	-90.4	0	0	0	111.4	T104 T116 T118 Q122 A123 T124 R130 V132 L155 A157 Y254	T104-W120 HydrophobicContact CG2-CE3 4.15Å; T104-W120 HydrophobicContact CG2-CZ3 4.22Å; T116-W120 WeakPolarHBondContact O-CB 3.44Å; T116-W120 PolarHBondContact O-N 2.74Å; T118-W120 VanDerWaalsContact C-N 3.3Å; T118-W120 PolarHBondContact O-N 2.8Å; W120-Q122 VanDerWaalsContact C-N 3.35Å; W120-Q122 PolarHBondContact O-N 2.67Å; W120-A123 PolarHBondContact O-N 2.85Å; W120-T124 PolarHBondContact O-N 3.32Å; W120-T124 PolarHBondContact O-OG1 2.66Å; W120-R130 PolarHBondContact O-NH1 2.93Å; W120-V132 HydrophobicContact CH2-CG2 4.23Å; W120-V132 HydrophobicContact CZ3-CG2 4.01Å; W120-L155 HydrophobicContact CB-CD1 4.2Å; W120-L155 HydrophobicContact CB-CD2 4.17Å; W120-L155 HydrophobicContact CD2-CD1 3.66Å; W120-L155 HydrophobicContact CE3-CD1 3.91Å; W120-L155 HydrophobicContact CG-CB 4.48Å; W120-L155 HydrophobicContact CG-CD1 3.78Å; W120-L155 HydrophobicContact CG-CD2 4.18Å; W120-L155 HydrophobicContact CG-CG 4.38Å; W120-A157 HydrophobicContact CH2-CB 4.12Å; W120-A157 HydrophobicContact CZ2-CB 3.47Å; W120-A157 VanDerWaalsContact CZ2-CB 3.47Å; W120-Y254 AromaticContact CH2-CD1 3.47Å; W120-Y254 HydrophobicContact CH2-CD1 3.47Å; W120-Y254 VanDerWaalsContact CH2-CD1 3.47Å; W120-Y254 HydrophobicContact CH2-CD2 4.12Å; W120-Y254 AromaticContact CH2-CE1 3.79Å; W120-Y254 HydrophobicContact CH2-CE1 3.79Å; W120-Y254 HydrophobicContact CH2-CE2 4.44Å; W120-Y254 AromaticContact CH2-CG 3.63Å; W120-Y254 HydrophobicContact CH2-CG 3.63Å; W120-Y254 AromaticContact CZ2-CD1 3.78Å; W120-Y254 HydrophobicContact CZ2-CD1 3.78Å; W120-Y254 AromaticContact CZ2-CD2 3.91Å; W120-Y254 HydrophobicContact CZ2-CD2 3.91Å; W120-Y254 AromaticContact CZ2-CE1 3.66Å; W120-Y254 HydrophobicContact CZ2-CE1 3.66Å; W120-Y254 AromaticContact CZ2-CE2 3.84Å; W120-Y254 HydrophobicContact CZ2-CE2 3.84Å; W120-Y254 AromaticContact CZ2-CG 3.88Å; W120-Y254 HydrophobicContact CZ2-CG 3.88Å; W120-Y254 AromaticContact CZ2-CZ 3.69Å
121	R	84.5	Confident	87.4	Confident	184 Å²	184	39.3 Å²	39.3	69%	0.694	18%	0.176	S	C	*	.	H	α-helix	trans	-60.8	-44.5	176.7	-172.4	178.7	-69.6	163	-0	111.5	E117 T118 A123 T124 E125	E117-R121 WeakPolarHBondContact O-CB 3.16Å; E117-R121 PolarHBondContact O-N 3Å; T118-R121 PolarHBondContact O-N 2.88Å; R121-A123 PolarHBondContact O-N 3.38Å; R121-T124 PolarHBondContact O-N 2.96Å; R121-E125 PolarHBondContact O-N 2.85Å
122	Q	82.9	Confident	87.7	Confident	18 Å²	18	39.3 Å²	39.3	8%	0.084	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-44.2	176.8	-69.8	174.9	-25.5	0	0	112.1	Q93 L96 T118 V119 W120 T124 E125 Y126	Q93-Q122 HydrophobicContact CG-CG 4.31Å; L96-Q122 HydrophobicContact CD1-CB 3.77Å; T118-Q122 WeakPolarHBondContact O-CG 3.42Å; T118-Q122 PolarHBondContact O-N 2.9Å; T118-Q122 VanDerWaalsContact O-N 3.13Å; V119-Q122 PolarHBondContact O-N 2.89Å; W120-Q122 VanDerWaalsContact C-N 3.35Å; W120-Q122 PolarHBondContact O-N 2.67Å; Q122-T124 VanDerWaalsContact C-N 3.32Å; Q122-T124 PolarHBondContact O-N 2.93Å; Q122-E125 PolarHBondContact O-N 3.29Å; Q122-Y126 WeakPolarHBondContact O-CD2 3.34Å; Q122-Y126 PolarHBondContact O-N 2.92Å
123	A	88	Confident	88	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70.2	-29.3	178	0	0	0	0	0	112.7	M16 L96 V119 W120 R121 R127 V128 R130	M16-A123 HydrophobicContact CE-CB 4.04Å; M16-A123 HydrophobicContact SD-CB 4.13Å; L96-A123 HydrophobicContact CD1-CB 3.94Å; L96-A123 HydrophobicContact CD2-CB 3.96Å; V119-A123 WeakPolarHBondContact O-CB 3.3Å; V119-A123 PolarHBondContact O-N 3.02Å; W120-A123 PolarHBondContact O-N 2.85Å; R121-A123 PolarHBondContact O-N 3.38Å; A123-R127 PolarHBondContact O-N 2.8Å; A123-V128 HydrophobicContact CB-CB 4.37Å; A123-V128 PolarHBondContact O-N 3.04Å; A123-R130 VanDerWaalsContact CB-NH1 3.26Å
124	T	89.4	Confident	88.5	Confident	61 Å²	61	37.7 Å²	37.7	37%	0.374	17%	0.168	S	C	.	.	H	α-helix	trans	-69.5	-40.7	172.8	-60	0	0	0	0	111.6	W120 R121 Q122 Y126 R127 R130	W120-T124 PolarHBondContact O-N 3.32Å; W120-T124 PolarHBondContact O-OG1 2.66Å; R121-T124 PolarHBondContact O-N 2.96Å; Q122-T124 VanDerWaalsContact C-N 3.32Å; Q122-T124 PolarHBondContact O-N 2.93Å; T124-Y126 VanDerWaalsContact C-N 3.3Å; T124-Y126 PolarHBondContact O-N 3.28Å; T124-R127 PolarHBondContact O-N 2.61Å; T124-R130 PolarHBondContact OG1-NH1 3.45Å; T124-R130 VanDerWaalsContact OG1-NH1 3.12Å; T124-R130 PolarHBondContact OG1-NH2 3.37Å
125	E	83.7	Confident	89.2	Confident	129 Å²	129	36.6 Å²	36.6	60%	0.603	16%	0.161	S	C	*	.	H	α-helix	trans	-58.5	-42.5	176.8	-174.5	178.2	176	0	0	111.8	R121 Q122 R127	R121-E125 PolarHBondContact O-N 2.85Å; Q122-E125 PolarHBondContact O-N 3.29Å; E125-R127 VanDerWaalsContact C-N 3.27Å; E125-R127 PolarHBondContact O-N 2.64Å
126	Y	84	Confident	89.9	Confident	46 Å²	46	37.6 Å²	37.6	18%	0.18	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	4.8	175.1	-62.9	-55.1	0	0	0	114.5	L96 Q122 T124 V128	L96-Y126 HydrophobicContact CB-CD2 4.14Å; Q122-Y126 WeakPolarHBondContact O-CD2 3.34Å; Q122-Y126 PolarHBondContact O-N 2.92Å; T124-Y126 VanDerWaalsContact C-N 3.3Å; T124-Y126 PolarHBondContact O-N 3.28Å; Y126-V128 VanDerWaalsContact C-N 3.27Å; Y126-V128 PolarHBondContact O-N 2.96Å
127	R	88.6	Confident	90.2	Very high	203 Å²	203	37.7 Å²	37.7	77%	0.766	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	49	45.5	-177.4	-59.9	-174.1	174.8	-159.3	-3.5	113.1	A123 T124 E125 P129 V251	A123-R127 PolarHBondContact O-N 2.8Å; T124-R127 PolarHBondContact O-N 2.61Å; E125-R127 VanDerWaalsContact C-N 3.27Å; E125-R127 PolarHBondContact O-N 2.64Å; R127-P129 VanDerWaalsContact O-CD 3.27Å; R127-P129 WeakPolarHBondContact O-CD 3.46Å; R127-V251 HydrophobicContact CB-CG2 4.49Å
128	V	91.4	Very high	90.4	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.03	17%	0.165	C	C	.	.			trans	-82.8	119.1	179.1	-179.1	0	0	0	0	109.4	A102 A123 Y126 R130	A102-V128 HydrophobicContact CB-CG1 4.08Å; A123-V128 HydrophobicContact CB-CB 4.37Å; A123-V128 PolarHBondContact O-N 3.04Å; Y126-V128 VanDerWaalsContact C-N 3.27Å; Y126-V128 PolarHBondContact O-N 2.96Å; V128-R130 WeakPolarHBondContact O-CG 3.5Å; V128-R130 PolarHBondContact O-NE 2.84Å
129	P	95.7	Very high	90.8	Very high	10 Å²	10	38.3 Å²	38.3	7%	0.065	17%	0.165	C	C	.	.			trans	-56.1	138.9	169.7	-30.6	40.1	0	0	0	112.4	D100 G101 A102 R127 T248 V251 P279	D100-P129 WeakPolarHBondContact O-CD 3.45Å; G101-P129 CarbonylContact C-O 3.59Å; G101-P129 VanDerWaalsContact CA-O 3.24Å; G101-P129 WeakPolarHBondContact CA-O 3.43Å; A102-P129 PolarHBondContact N-O 3.46Å; R127-P129 VanDerWaalsContact O-CD 3.27Å; R127-P129 WeakPolarHBondContact O-CD 3.46Å; P129-T248 HydrophobicContact CB-CG2 4.45Å; P129-T248 WeakPolarHBondContact CB-O 3.47Å; P129-V251 HydrophobicContact CG-CG2 4.08Å; P129-P279 HydrophobicContact CB-CG 4.12Å; P129-P279 HydrophobicContact CG-CG 4.02Å
130	R	95.8	Very high	91	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	144	-169.2	-76	162.3	-73.2	-178.1	6.8	113.1	M16 A102 W120 A123 T124 V128 Y254	M16-R130 HydrophobicContact CE-CG 3.49Å; M16-R130 VanDerWaalsContact CE-CG 3.49Å; A102-R130 HydrophobicContact CB-CG 3.94Å; A102-R130 VanDerWaalsContact O-CA 3.28Å; A102-R130 WeakPolarHBondContact O-CA 3.15Å; W120-R130 PolarHBondContact O-NH1 2.93Å; A123-R130 VanDerWaalsContact CB-NH1 3.26Å; T124-R130 PolarHBondContact OG1-NH1 3.45Å; T124-R130 VanDerWaalsContact OG1-NH1 3.12Å; T124-R130 PolarHBondContact OG1-NH2 3.37Å; V128-R130 WeakPolarHBondContact O-CG 3.5Å; V128-R130 PolarHBondContact O-NE 2.84Å; R130-Y254 HydrophobicContact CB-CD1 3.86Å; R130-Y254 HydrophobicContact CB-CE1 4.06Å; R130-Y254 PolarHBondContact NH2-OH 2.65Å
131	I	97.3	Very high	90.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	156.2	162.3	66	177	0	0	0	109.5	A102 V103 T104 P255 L257 M270 A273 V274 L278	A102-I131 PolarHBondContact O-N 2.68Å; V103-I131 HydrophobicContact CB-CG1 4.31Å; V103-I131 HydrophobicContact CG1-CG1 4.21Å; V103-I131 HydrophobicContact CG2-CD1 3.99Å; V103-I131 HydrophobicContact CG2-CG1 3.91Å; T104-I131 PolarHBondContact N-O 2.81Å; I131-P255 HydrophobicContact CG2-CB 4.25Å; I131-P255 HydrophobicContact CG2-CG 4.04Å; I131-L257 HydrophobicContact CB-CD1 4.12Å; I131-L257 HydrophobicContact CD1-CD1 4.17Å; I131-L257 HydrophobicContact CG1-CD1 4.49Å; I131-M270 HydrophobicContact CD1-CG 4.33Å; I131-M270 HydrophobicContact CD1-SD 4.46Å; I131-A273 HydrophobicContact CD1-CB 4.22Å; I131-V274 HydrophobicContact CD1-CG2 3.88Å; I131-L278 HydrophobicContact CD1-CD1 4.25Å; I131-L278 HydrophobicContact CG1-CD1 4.28Å; I131-L278 HydrophobicContact CG2-CD2 3.97Å; I131-L278 HydrophobicContact CG2-CG 4.13Å
132	V	97.6	Very high	91.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	133.8	178.5	-175.4	0	0	0	0	109.9	T104 L106 W120 L151 P255 V256 L257	T104-V132 CarbonylContact O-C 3.6Å; T104-V132 WeakPolarHBondContact O-CA 3.37Å; L106-V132 HydrophobicContact CD1-CG1 3.65Å; L106-V132 HydrophobicContact CG-CG1 3.94Å; W120-V132 HydrophobicContact CH2-CG2 4.23Å; W120-V132 HydrophobicContact CZ3-CG2 4.01Å; V132-L151 HydrophobicContact CB-CD1 4.45Å; V132-L151 HydrophobicContact CG1-CD1 4Å; V132-L151 HydrophobicContact CG1-CD2 4.46Å; V132-L151 HydrophobicContact CG2-CD1 4.27Å; V132-L151 HydrophobicContact CG2-CD2 4.39Å; V132-P255 PolarHBondContact N-O 2.88Å; V132-V256 HydrophobicContact CB-CB 4.43Å; V132-V256 HydrophobicContact CB-CG1 4.14Å; V132-V256 HydrophobicContact CB-CG2 4.17Å; V132-V256 HydrophobicContact CG1-CG1 4.17Å; V132-L257 WeakPolarHBondContact O-CD1 3.12Å; V132-L257 PolarHBondContact O-N 2.73Å
133	F	97.7	Very high	91.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	104.9	175.4	-178.7	-117.8	0	0	0	109.9	T26 V103 T104 V105 L106 N135 L257 V267 M270	T26-F133 HydrophobicContact CG2-CD1 4.31Å; T26-F133 HydrophobicContact CG2-CE1 4.3Å; V103-F133 HydrophobicContact CG1-CB 4.11Å; T104-F133 PolarHBondContact O-N 2.88Å; V105-F133 WeakPolarHBondContact CA-O 3.27Å; V105-F133 HydrophobicContact CG1-CD1 4.34Å; V105-F133 HydrophobicContact CG2-CD1 4.46Å; L106-F133 PolarHBondContact N-O 2.83Å; F133-N135 HydrophobicContact CD1-CB 3.91Å; F133-N135 HydrophobicContact CE1-CB 3.76Å; F133-N135 PolarHBondContact O-N 2.78Å; F133-L257 HydrophobicContact CD2-CB 4.12Å; F133-V267 HydrophobicContact CZ-CG2 4.35Å; F133-M270 HydrophobicContact CB-CG 4.34Å; F133-M270 HydrophobicContact CD2-CB 4.16Å; F133-M270 HydrophobicContact CD2-CG 4.17Å; F133-M270 HydrophobicContact CE2-CB 4.38Å; F133-M270 HydrophobicContact CG-CG 4.26Å
134	C	96.5	Very high	92	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	98.8	172.7	-63.5	0	0	0	0	109	S108 F144 L257 G259	S108-C134 WeakPolarHBondContact OG-CB 3.45Å; S108-C134 PolarHBondContact OG-O 3.27Å; C134-F144 HydrophobicContact CB-CD2 3.66Å; C134-F144 HydrophobicContact CB-CE2 3.88Å; C134-L257 WeakPolarHBondContact CB-O 3.33Å; C134-L257 PolarHBondContact N-O 3.33Å; C134-G259 PolarHBondContact O-N 3.45Å
135	N	95.3	Very high	92.2	Very high	3 Å²	3	40 Å²	40	2%	0.016	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	171.3	-174.7	-170	24.9	0	0	0	111.4	A21 V105 L106 S108 F133 M137 G259 A261	A21-N135 PolarHBondContact O-ND2 3.02Å; V105-N135 HydrophobicContact CG1-CB 3.69Å; L106-N135 WeakPolarHBondContact O-CA 3.44Å; L106-N135 WeakPolarHBondContact O-CB 3.41Å; L106-N135 PolarHBondContact O-N 3.35Å; S108-N135 VanDerWaalsContact CB-O 3.28Å; S108-N135 WeakPolarHBondContact CB-O 3.4Å; S108-N135 PolarHBondContact N-O 3.22Å; S108-N135 PolarHBondContact OG-O 3.33Å; F133-N135 HydrophobicContact CD1-CB 3.91Å; F133-N135 HydrophobicContact CE1-CB 3.76Å; F133-N135 PolarHBondContact O-N 2.78Å; N135-M137 VanDerWaalsContact C-N 3.29Å; N135-M137 PolarHBondContact O-N 3.37Å; N135-G259 CarbonylContact C-O 3.47Å; N135-G259 WeakPolarHBondContact CA-O 3.49Å; N135-A261 WeakPolarHBondContact OD1-CB 3.46Å; N135-A261 PolarHBondContact OD1-N 3.15Å
136	K	93.1	Very high	92.7	Very high	34 Å²	34	38.4 Å²	38.4	15%	0.148	18%	0.184	C	C	.	.			trans	61.2	34.6	-179.9	-55.2	-172.7	172.8	-174.5	0	113	D20 D138 K139 G259	D20-K136 WeakPolarHBondContact O-CE 3.45Å; D20-K136 PolarHBondContact O-NZ 3.27Å; D20-K136 IonicContact OD1-NZ 3.91Å; D20-K136 PolarHBondContact OD1-NZ 3.31Å; D20-K136 IonicContact OD2-NZ 3.43Å; D20-K136 PolarHBondContact OD2-NZ 3.29Å; K136-D138 WeakPolarHBondContact CA-OD1 3.35Å; K136-D138 PolarHBondContact O-N 3.49Å; K136-K139 HydrophobicContact CB-CB 4.17Å; K136-K139 HydrophobicContact CB-CD 4.43Å; K136-K139 HydrophobicContact CD-CD 4.2Å; K136-K139 VanDerWaalsContact O-CB 3.27Å; K136-K139 WeakPolarHBondContact O-CB 3.2Å; K136-K139 PolarHBondContact O-N 2.98Å; K136-G259 PolarHBondContact N-O 3.27Å
137	M	93.6	Very high	93.2	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.01	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.8	172.1	-75.8	-58	-52.1	0	0	114.2	S108 N135 A142 F144 P165 A168 E169 F172 C258 G259	S108-M137 VanDerWaalsContact CB-SD 3.52Å; S108-M137 PolarHBondContact OG-SD 2.97Å; N135-M137 VanDerWaalsContact C-N 3.29Å; N135-M137 PolarHBondContact O-N 3.37Å; M137-A142 HydrophobicContact CE-CB 4.34Å; M137-A142 HydrophobicContact SD-CB 4.42Å; M137-F144 HydrophobicContact CE-CB 4.16Å; M137-F144 HydrophobicContact SD-CB 3.96Å; M137-P165 HydrophobicContact CE-CB 3.73Å; M137-P165 HydrophobicContact CE-CG 3.76Å; M137-A168 HydrophobicContact CE-CB 4.36Å; M137-E169 PolarHBondContact O-N 3.25Å; M137-F172 HydrophobicContact CB-CD1 3.74Å; M137-F172 HydrophobicContact CB-CD2 4.14Å; M137-F172 HydrophobicContact CB-CE1 3.78Å; M137-F172 HydrophobicContact CB-CE2 4.18Å; M137-F172 HydrophobicContact CB-CG 3.93Å; M137-F172 HydrophobicContact CB-CZ 4.01Å; M137-F172 HydrophobicContact CG-CE2 4.49Å; M137-F172 HydrophobicContact CG-CZ 4.37Å; M137-C258 HydrophobicContact CG-CB 4.26Å; M137-G259 WeakPolarHBondContact CB-O 3.39Å; M137-G259 WeakPolarHBondContact CG-O 3.36Å; M137-G259 PolarHBondContact N-O 3.41Å; M137-G259 VanDerWaalsContact N-O 3.17Å
138	D	90.4	Very high	93.5	Very high	30 Å²	30	26.7 Å²	26.7	16%	0.16	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-5.9	175.5	62.4	-61	0	0	0	114.3	K136 E169 S260 K263	K136-D138 WeakPolarHBondContact CA-OD1 3.35Å; K136-D138 PolarHBondContact O-N 3.49Å; D138-E169 WeakPolarHBondContact CA-O 3.46Å; D138-S260 WeakPolarHBondContact OD1-CB 3.4Å; D138-S260 PolarHBondContact OD1-OG 3.02Å; D138-K263 HydrophobicContact CB-CG 3.61Å; D138-K263 WeakPolarHBondContact OD2-CG 3.39Å
139	K	88.1	Confident	93.7	Very high	66 Å²	66	28.5 Å²	28.5	29%	0.287	15%	0.153	S	C	.	.	S	Bend	trans	-86	147.5	-177.1	-170.2	179.3	178.9	-158.1	0	111	D107 K136 G141 A142 E169	D107-K139 IonicContact OD1-NZ 3.59Å; D107-K139 IonicContact OD2-NZ 3.67Å; D107-K139 PolarHBondContact OD2-NZ 2.96Å; K136-K139 HydrophobicContact CB-CB 4.17Å; K136-K139 HydrophobicContact CB-CD 4.43Å; K136-K139 HydrophobicContact CD-CD 4.2Å; K136-K139 VanDerWaalsContact O-CB 3.27Å; K136-K139 WeakPolarHBondContact O-CB 3.2Å; K136-K139 PolarHBondContact O-N 2.98Å; K139-G141 PolarHBondContact O-N 2.53Å; K139-A142 WeakPolarHBondContact O-CB 3.49Å; K139-A142 PolarHBondContact O-N 3.48Å; K139-E169 WeakPolarHBondContact O-CG 3.43Å
140	I	87.4	Confident	93.6	Very high	130 Å²	130	28.2 Å²	28.2	67%	0.667	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	130.8	173.6	-60.3	172.4	0	0	0	110.1	Q109	Q109-I140 PolarHBondContact NE2-O 3.04Å
141	G	88.4	Confident	93.5	Very high	35 Å²	35	28.2 Å²	28.2	36%	0.361	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.7	12.1	-175.7	0	0	0	0	0	114.2	K139 D143 E169	K139-G141 PolarHBondContact O-N 2.53Å; G141-D143 PolarHBondContact O-N 3.17Å; G141-E169 PolarHBondContact N-OE1 2.95Å
142	A	90.5	Very high	93.3	Very high	9 Å²	9	31.3 Å²	31.3	7%	0.074	17%	0.165	C	C	.	.			trans	-63.3	119.8	174.3	0	0	0	0	0	110.8	M137 K139	M137-A142 HydrophobicContact CE-CB 4.34Å; M137-A142 HydrophobicContact SD-CB 4.42Å; K139-A142 WeakPolarHBondContact O-CB 3.49Å; K139-A142 PolarHBondContact O-N 3.48Å
143	D	92.4	Very high	93	Very high	79 Å²	79	37.3 Å²	37.3	42%	0.422	20%	0.197	S	C	.	.			trans	-134.5	105.8	176.4	-175	-18.7	0	0	0	109.8	S108 G141 L145 Y146 S147	S108-D143 CarbonylContact O-C 3.47Å; S108-D143 PolarHBondContact O-N 2.95Å; G141-D143 PolarHBondContact O-N 3.17Å; D143-L145 PolarHBondContact OD1-N 2.85Å; D143-Y146 PolarHBondContact OD1-N 3.19Å; D143-S147 PolarHBondContact O-N 3.42Å; D143-S147 PolarHBondContact O-OG 3.03Å
144	F	95.2	Very high	92.5	Very high	5 Å²	5	42.6 Å²	42.6	2%	0.022	22%	0.217	C	C	.	.	H	α-helix	trans	-64.4	-43.3	-179.7	176.2	-108.4	0	0	0	112.4	C134 M137 S147 V148 P161 Q163 L164 P165 V256 C258	C134-F144 HydrophobicContact CB-CD2 3.66Å; C134-F144 HydrophobicContact CB-CE2 3.88Å; M137-F144 HydrophobicContact CE-CB 4.16Å; M137-F144 HydrophobicContact SD-CB 3.96Å; F144-S147 WeakPolarHBondContact O-CB 3.44Å; F144-S147 PolarHBondContact O-N 3.01Å; F144-V148 HydrophobicContact CD1-CG2 4.37Å; F144-V148 HydrophobicContact CE1-CG2 3.94Å; F144-V148 HydrophobicContact CE2-CG2 4.13Å; F144-V148 HydrophobicContact CZ-CG2 3.82Å; F144-V148 VanDerWaalsContact O-CG2 3.29Å; F144-V148 WeakPolarHBondContact O-CG2 3.15Å; F144-V148 PolarHBondContact O-N 3.47Å; F144-P161 HydrophobicContact CE1-CB 3.85Å; F144-P161 HydrophobicContact CE1-CG 3.88Å; F144-P161 HydrophobicContact CZ-CB 4.02Å; F144-P161 HydrophobicContact CZ-CG 4.19Å; F144-Q163 VanDerWaalsContact CE1-O 3.27Å; F144-Q163 WeakPolarHBondContact CE1-O 3.41Å; F144-Q163 WeakPolarHBondContact CZ-O 3.35Å; F144-L164 HydrophobicContact CD1-CD2 4.23Å; F144-L164 HydrophobicContact CE1-CD2 4Å; F144-P165 HydrophobicContact CB-CG 3.74Å; F144-P165 HydrophobicContact CD1-CG 4.32Å; F144-P165 HydrophobicContact CG-CG 4.13Å; F144-V256 HydrophobicContact CE2-CG1 3.75Å; F144-V256 HydrophobicContact CZ-CB 4.44Å; F144-V256 HydrophobicContact CZ-CG1 3.9Å; F144-C258 HydrophobicContact CD2-CB 3.53Å; F144-C258 HydrophobicContact CE2-CB 3.6Å; F144-C258 HydrophobicContact CG-CB 4.23Å; F144-C258 HydrophobicContact CZ-CB 4.35Å
145	L	94.5	Very high	92.2	Very high	54 Å²	54	43.8 Å²	43.8	28%	0.283	22%	0.224	S	C	.	.	H	α-helix	trans	-73.1	-34.1	-176.2	-65.5	-176.4	0	0	0	111.3	D143 V148 S149 L164 W210	D143-L145 PolarHBondContact OD1-N 2.85Å; L145-V148 PolarHBondContact O-N 3.43Å; L145-S149 PolarHBondContact O-N 3.13Å; L145-L164 HydrophobicContact CD2-CD2 4.21Å; L145-W210 HydrophobicContact CD1-CZ2 4.24Å; L145-W210 HydrophobicContact CD2-CD2 4.49Å; L145-W210 HydrophobicContact CD2-CH2 4.13Å; L145-W210 HydrophobicContact CD2-CZ2 3.45Å; L145-W210 VanDerWaalsContact CD2-CZ2 3.45Å; L145-W210 HydrophobicContact CG-CZ2 4.4Å
146	Y	93.9	Very high	91.9	Very high	96 Å²	96	51.4 Å²	51.4	38%	0.376	26%	0.259	S	S	.	.	H	α-helix	trans	-59.8	-47.4	167.9	174.3	-107.2	0	0	0	111.5	D143 V148 S149 T150	D143-Y146 PolarHBondContact OD1-N 3.19Å; Y146-V148 VanDerWaalsContact C-N 3.27Å; Y146-V148 PolarHBondContact O-N 3.4Å; Y146-S149 PolarHBondContact O-N 3.39Å; Y146-S149 VanDerWaalsContact O-N 3.08Å; Y146-S149 PolarHBondContact O-OG 3.33Å; Y146-T150 HydrophobicContact CD1-CG2 4.39Å; Y146-T150 HydrophobicContact CD2-CG2 4.35Å; Y146-T150 HydrophobicContact CE1-CG2 3.93Å; Y146-T150 HydrophobicContact CE2-CG2 3.89Å; Y146-T150 WeakPolarHBondContact O-CG2 3.42Å; Y146-T150 PolarHBondContact O-N 2.98Å
147	S	93.4	Very high	91.9	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.2	-41.3	178.3	-64.6	0	0	0	0	111.8	S108 D143 F144 T150 L151	S108-S147 VanDerWaalsContact CA-OG 3.26Å; S108-S147 WeakPolarHBondContact CA-OG 3.38Å; S108-S147 PolarHBondContact O-OG 2.99Å; D143-S147 PolarHBondContact O-N 3.42Å; D143-S147 PolarHBondContact O-OG 3.03Å; F144-S147 WeakPolarHBondContact O-CB 3.44Å; F144-S147 PolarHBondContact O-N 3.01Å; S147-T150 PolarHBondContact O-N 3.35Å; S147-T150 PolarHBondContact O-OG1 3.25Å; S147-L151 PolarHBondContact O-N 3.3Å
148	V	94.8	Very high	91.9	Very high	3 Å²	3	52.5 Å²	52.5	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-46.6	172.8	174.6	0	0	0	0	111.3	F144 L145 Y146 T150 L151 H152 P161 V256	F144-V148 HydrophobicContact CD1-CG2 4.37Å; F144-V148 HydrophobicContact CE1-CG2 3.94Å; F144-V148 HydrophobicContact CE2-CG2 4.13Å; F144-V148 HydrophobicContact CZ-CG2 3.82Å; F144-V148 VanDerWaalsContact O-CG2 3.29Å; F144-V148 WeakPolarHBondContact O-CG2 3.15Å; F144-V148 PolarHBondContact O-N 3.47Å; L145-V148 PolarHBondContact O-N 3.43Å; Y146-V148 VanDerWaalsContact C-N 3.27Å; Y146-V148 PolarHBondContact O-N 3.4Å; V148-T150 VanDerWaalsContact C-N 3.27Å; V148-T150 PolarHBondContact O-N 2.82Å; V148-L151 WeakPolarHBondContact O-CB 3.49Å; V148-L151 PolarHBondContact O-N 3.22Å; V148-L151 VanDerWaalsContact O-N 3.07Å; V148-H152 PolarHBondContact O-CD2 2.87Å; V148-H152 VanDerWaalsContact O-CD2 3.31Å; V148-P161 HydrophobicContact CG1-CG 4.15Å; V148-P161 HydrophobicContact CG2-CG 3.96Å; V148-V256 HydrophobicContact CG2-CB 4.44Å; V148-V256 HydrophobicContact CG2-CG1 3.93Å
149	S	95.1	Very high	92.1	Very high	43 Å²	43	51.1 Å²	51.1	30%	0.301	26%	0.259	S	S	.	.	H	α-helix	trans	-60.5	-38.5	179.8	84	0	0	0	0	111.8	L145 Y146 L151 H152 D153	L145-S149 PolarHBondContact O-N 3.13Å; Y146-S149 PolarHBondContact O-N 3.39Å; Y146-S149 VanDerWaalsContact O-N 3.08Å; Y146-S149 PolarHBondContact O-OG 3.33Å; S149-L151 VanDerWaalsContact C-N 3.27Å; S149-L151 PolarHBondContact O-N 3.17Å; S149-H152 PolarHBondContact O-N 3.13Å; S149-H152 VanDerWaalsContact O-N 3.15Å; S149-D153 PolarHBondContact O-N 3.17Å
150	T	94.3	Very high	92.5	Very high	4 Å²	4	49.5 Å²	49.5	3%	0.025	25%	0.253	C	S	.	.	H	α-helix	trans	-65.3	-26.4	177.4	66	0	0	0	0	113.9	G111 V112 Y146 S147 V148 R154	G111-T150 WeakPolarHBondContact CA-OG1 3.24Å; V112-T150 PolarHBondContact N-OG1 2.99Å; Y146-T150 HydrophobicContact CD1-CG2 4.39Å; Y146-T150 HydrophobicContact CD2-CG2 4.35Å; Y146-T150 HydrophobicContact CE1-CG2 3.93Å; Y146-T150 HydrophobicContact CE2-CG2 3.89Å; Y146-T150 WeakPolarHBondContact O-CG2 3.42Å; Y146-T150 PolarHBondContact O-N 2.98Å; S147-T150 PolarHBondContact O-N 3.35Å; S147-T150 PolarHBondContact O-OG1 3.25Å; V148-T150 VanDerWaalsContact C-N 3.27Å; V148-T150 PolarHBondContact O-N 2.82Å; T150-R154 WeakPolarHBondContact O-CB 3.42Å; T150-R154 PolarHBondContact O-N 2.88Å
151	L	94.1	Very high	93	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.1	-43.1	172.6	-69.9	163.5	0	0	0	111	L106 V112 V132 S147 V148 S149 L155 Q156 A157 A159 V256	L106-L151 HydrophobicContact CD1-CD1 4.25Å; L106-L151 HydrophobicContact CD1-CD2 3.91Å; L106-L151 HydrophobicContact CD1-CG 4.11Å; V112-L151 HydrophobicContact CG2-CD2 3.73Å; V112-L151 HydrophobicContact CG2-CG 4.08Å; V132-L151 HydrophobicContact CB-CD1 4.45Å; V132-L151 HydrophobicContact CG1-CD1 4Å; V132-L151 HydrophobicContact CG1-CD2 4.46Å; V132-L151 HydrophobicContact CG2-CD1 4.27Å; V132-L151 HydrophobicContact CG2-CD2 4.39Å; S147-L151 PolarHBondContact O-N 3.3Å; V148-L151 WeakPolarHBondContact O-CB 3.49Å; V148-L151 PolarHBondContact O-N 3.22Å; V148-L151 VanDerWaalsContact O-N 3.07Å; S149-L151 VanDerWaalsContact C-N 3.27Å; S149-L151 PolarHBondContact O-N 3.17Å; L151-L155 HydrophobicContact CD2-CD1 3.74Å; L151-L155 CarbonylContact O-C 3.55Å; L151-L155 WeakPolarHBondContact O-CA 3.5Å; L151-L155 VanDerWaalsContact O-CB 3.28Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 PolarHBondContact O-N 3.14Å; L151-L155 VanDerWaalsContact O-N 3.13Å; L151-Q156 PolarHBondContact O-N 3.04Å; L151-A157 PolarHBondContact O-N 2.92Å; L151-A159 HydrophobicContact CB-CB 3.97Å; L151-A159 HydrophobicContact CD1-CB 3.73Å; L151-A159 HydrophobicContact CG-CB 4.39Å; L151-V256 HydrophobicContact CD1-CG1 4.45Å; L151-V256 HydrophobicContact CD1-CG2 3.87Å
152	H	93.3	Very high	93.4	Very high	64 Å²	64	42 Å²	42	30%	0.296	21%	0.206	S	C	.	.	H	α-helix	trans	-69.7	-48.5	175.9	-61.5	-76.2	0	0	0	111.3	V148 S149 Q156 A157 A159	V148-H152 PolarHBondContact O-CD2 2.87Å; V148-H152 VanDerWaalsContact O-CD2 3.31Å; S149-H152 PolarHBondContact O-N 3.13Å; S149-H152 VanDerWaalsContact O-N 3.15Å; H152-Q156 WeakPolarHBondContact O-CA 3.33Å; H152-Q156 PolarHBondContact O-N 2.95Å; H152-A157 PolarHBondContact CE1-O 2.96Å; H152-A157 PolarHBondContact ND1-O 2.92Å; H152-A159 PolarHBondContact CE1-O 2.96Å; H152-A159 VanDerWaalsContact CE1-O 3.26Å; H152-A159 PolarHBondContact NE2-O 2.86Å
153	D	90.5	Very high	93.6	Very high	126 Å²	126	41.9 Å²	41.9	67%	0.674	20%	0.204	S	C	*	.	H	α-helix	trans	-68.6	-40.7	-172.5	-67	-24.7	0	0	0	112.9	S149	S149-D153 PolarHBondContact O-N 3.17Å
154	R	87.5	Confident	93.8	Very high	112 Å²	112	38.2 Å²	38.2	42%	0.423	18%	0.184	S	C	.	.	H	α-helix	trans	-98.2	-34.3	-173.7	-60.2	-168.1	-178.7	-177.7	1.4	113.8	V112 T150	V112-R154 HydrophobicContact CB-CB 4.26Å; V112-R154 HydrophobicContact CG1-CB 3.9Å; V112-R154 PolarHBondContact O-NH1 3.39Å; T150-R154 WeakPolarHBondContact O-CB 3.42Å; T150-R154 PolarHBondContact O-N 2.88Å
155	L	90.3	Very high	93.9	Very high	25 Å²	25	38.9 Å²	38.9	13%	0.131	19%	0.189	C	C	.	.	H	α-helix	trans	-106	-10.8	-176.2	-51.2	177.3	0	0	0	113.1	V112 T116 E117 W120 L151 A157	V112-L155 HydrophobicContact CG1-CD1 4.02Å; V112-L155 HydrophobicContact CG1-CD2 3.76Å; V112-L155 HydrophobicContact CG1-CG 3.8Å; V112-L155 HydrophobicContact CG2-CD1 3.74Å; V112-L155 HydrophobicContact CG2-CG 4.04Å; T116-L155 HydrophobicContact CG2-CD1 4.41Å; E117-L155 HydrophobicContact CB-CD2 4.02Å; E117-L155 HydrophobicContact CG-CD2 3.71Å; W120-L155 HydrophobicContact CB-CD1 4.2Å; W120-L155 HydrophobicContact CB-CD2 4.17Å; W120-L155 HydrophobicContact CD2-CD1 3.66Å; W120-L155 HydrophobicContact CE3-CD1 3.91Å; W120-L155 HydrophobicContact CG-CB 4.48Å; W120-L155 HydrophobicContact CG-CD1 3.78Å; W120-L155 HydrophobicContact CG-CD2 4.18Å; W120-L155 HydrophobicContact CG-CG 4.38Å; L151-L155 HydrophobicContact CD2-CD1 3.74Å; L151-L155 CarbonylContact O-C 3.55Å; L151-L155 WeakPolarHBondContact O-CA 3.5Å; L151-L155 VanDerWaalsContact O-CB 3.28Å; L151-L155 WeakPolarHBondContact O-CB 3.48Å; L151-L155 PolarHBondContact O-N 3.14Å; L151-L155 VanDerWaalsContact O-N 3.13Å; L155-A157 HydrophobicContact CB-CB 4.17Å; L155-A157 PolarHBondContact O-N 3.14Å
156	Q	90	Very high	93.9	Very high	162 Å²	162	36.7 Å²	36.7	76%	0.757	18%	0.178	S	C	*	.			trans	53.3	31.9	-171.4	-57.2	180	-27	0	0	111.8	L151 H152	L151-Q156 PolarHBondContact O-N 3.04Å; H152-Q156 WeakPolarHBondContact O-CA 3.33Å; H152-Q156 PolarHBondContact O-N 2.95Å
157	A	91.7	Very high	93.8	Very high	4 Å²	4	32.9 Å²	32.9	3%	0.033	17%	0.167	C	C	.	.			trans	-80.4	138.2	-179.1	0	0	0	0	0	110.3	W120 L151 H152 L155 A159 Y254	W120-A157 HydrophobicContact CH2-CB 4.12Å; W120-A157 HydrophobicContact CZ2-CB 3.47Å; W120-A157 VanDerWaalsContact CZ2-CB 3.47Å; L151-A157 PolarHBondContact O-N 2.92Å; H152-A157 PolarHBondContact CE1-O 2.96Å; H152-A157 PolarHBondContact ND1-O 2.92Å; L155-A157 HydrophobicContact CB-CB 4.17Å; L155-A157 PolarHBondContact O-N 3.14Å; A157-A159 HydrophobicContact CB-CB 4.16Å; A157-A159 PolarHBondContact O-N 2.75Å; A157-Y254 HydrophobicContact CB-CD2 4.09Å; A157-Y254 HydrophobicContact CB-CE2 4.37Å
158	N	93.6	Very high	93.5	Very high	56 Å²	56	34.6 Å²	34.6	30%	0.299	18%	0.181	S	C	.	.			trans	-78.6	67.7	168.7	-172.8	25.5	0	0	0	110	H160 D252 F253 Y254	N158-H160 PolarHBondContact OD1-CD2 3.24Å; N158-H160 VanDerWaalsContact OD1-CD2 3.3Å; N158-H160 PolarHBondContact OD1-NE2 3.39Å; N158-D252 VanDerWaalsContact CB-O 3.26Å; N158-D252 WeakPolarHBondContact CB-O 3.35Å; N158-D252 PolarHBondContact ND2-O 2.91Å; N158-F253 WeakPolarHBondContact O-CA 3.47Å; N158-Y254 PolarHBondContact O-N 3.38Å
159	A	94.8	Very high	93.3	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	111.8	-170.1	0	0	0	0	0	111.4	L151 H152 A157 Y254 V256	L151-A159 HydrophobicContact CB-CB 3.97Å; L151-A159 HydrophobicContact CD1-CB 3.73Å; L151-A159 HydrophobicContact CG-CB 4.39Å; H152-A159 PolarHBondContact CE1-O 2.96Å; H152-A159 VanDerWaalsContact CE1-O 3.26Å; H152-A159 PolarHBondContact NE2-O 2.86Å; A157-A159 HydrophobicContact CB-CB 4.16Å; A157-A159 PolarHBondContact O-N 2.75Å; A159-Y254 VanDerWaalsContact CA-O 3.27Å; A159-Y254 WeakPolarHBondContact CA-O 3.47Å; A159-V256 HydrophobicContact CB-CG2 3.77Å
160	H	96.4	Very high	92.9	Very high	33 Å²	33	42.6 Å²	42.6	15%	0.153	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.6	-177.3	-69.7	-103.3	0	0	0	112.4	N158 I162 L214 F253 Y254 V256	N158-H160 PolarHBondContact OD1-CD2 3.24Å; N158-H160 VanDerWaalsContact OD1-CD2 3.3Å; N158-H160 PolarHBondContact OD1-NE2 3.39Å; H160-I162 PolarHBondContact O-N 3.45Å; H160-L214 HydrophobicContact CB-CD1 4.42Å; H160-F253 HydrophobicContact CB-CE2 3.61Å; H160-F253 HydrophobicContact CB-CZ 3.68Å; H160-F253 AromaticContact CD2-CE2 3.73Å; H160-F253 AromaticContact CG-CE2 3.88Å; H160-Y254 PolarHBondContact N-O 3.26Å; H160-V256 PolarHBondContact O-N 3.22Å
161	P	97.2	Very high	92.7	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.006	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.8	126.9	171.8	-26	36.9	0	0	0	112.1	F144 V148 L164 L178 W210	F144-P161 HydrophobicContact CE1-CB 3.85Å; F144-P161 HydrophobicContact CE1-CG 3.88Å; F144-P161 HydrophobicContact CZ-CB 4.02Å; F144-P161 HydrophobicContact CZ-CG 4.19Å; V148-P161 HydrophobicContact CG1-CG 4.15Å; V148-P161 HydrophobicContact CG2-CG 3.96Å; P161-L164 HydrophobicContact CB-CD2 4.48Å; P161-L178 HydrophobicContact CB-CD1 4.18Å; P161-L178 WeakPolarHBondContact O-CD1 3.24Å; P161-W210 HydrophobicContact CB-CE3 4.37Å; P161-W210 HydrophobicContact CG-CD2 4.34Å; P161-W210 HydrophobicContact CG-CE3 3.68Å; P161-W210 HydrophobicContact CG-CH2 4.44Å; P161-W210 HydrophobicContact CG-CZ3 3.74Å
162	I	97	Very high	92.7	Very high	6 Å²	6	48.5 Å²	48.5	3%	0.031	25%	0.25	C	C	.	.	S	Bend	trans	-98.6	-5.9	160.3	59.5	162.5	0	0	0	111.4	H160 L178 V179 L214 I244 P255 V256 L257 Y277	H160-I162 PolarHBondContact O-N 3.45Å; I162-L178 WeakPolarHBondContact O-CB 3.32Å; I162-L178 PolarHBondContact O-N 3.04Å; I162-V179 HydrophobicContact CB-CG2 4.49Å; I162-L214 HydrophobicContact CG2-CD1 3.86Å; I162-L214 HydrophobicContact CG2-CD2 4.21Å; I162-I244 HydrophobicContact CG2-CD1 4.09Å; I162-P255 HydrophobicContact CD1-CB 3.95Å; I162-P255 HydrophobicContact CG1-CB 4.2Å; I162-P255 HydrophobicContact CG2-CB 4Å; I162-V256 WeakPolarHBondContact CG1-O 3.44Å; I162-V256 PolarHBondContact N-O 2.72Å; I162-L257 HydrophobicContact CD1-CD1 4.08Å; I162-L257 HydrophobicContact CD1-CD2 4.07Å; I162-L257 HydrophobicContact CD1-CG 3.84Å; I162-L257 HydrophobicContact CG1-CD1 4.44Å; I162-L257 HydrophobicContact CG1-CG 3.98Å; I162-Y277 HydrophobicContact CD1-CD2 4.21Å; I162-Y277 HydrophobicContact CD1-CE2 3.61Å
163	Q	96.3	Very high	92.6	Very high	7 Å²	7	48.4 Å²	48.4	3%	0.033	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	154.1	180	-71.6	174.2	-6.3	0	0	111.4	F144 I175 I176	F144-Q163 VanDerWaalsContact CE1-O 3.27Å; F144-Q163 WeakPolarHBondContact CE1-O 3.41Å; F144-Q163 WeakPolarHBondContact CZ-O 3.35Å; Q163-I175 HydrophobicContact CB-CG2 3.78Å; Q163-I175 HydrophobicContact CG-CG2 3.88Å; Q163-I176 CarbonylContact C-O 3.5Å; Q163-I176 WeakPolarHBondContact CA-O 3.25Å; Q163-I176 WeakPolarHBondContact CB-O 3.4Å
164	L	96.4	Very high	92.7	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.4	168.7	-67.1	175	0	0	0	111	F144 L145 P161 I175 I176 L178 Q206 A207 W210	F144-L164 HydrophobicContact CD1-CD2 4.23Å; F144-L164 HydrophobicContact CE1-CD2 4Å; L145-L164 HydrophobicContact CD2-CD2 4.21Å; P161-L164 HydrophobicContact CB-CD2 4.48Å; L164-I175 CarbonylContact O-C 3.58Å; L164-I175 WeakPolarHBondContact O-CA 3.38Å; L164-I176 HydrophobicContact CB-CB 4.26Å; L164-I176 HydrophobicContact CB-CD1 4.37Å; L164-I176 PolarHBondContact N-O 2.97Å; L164-I176 PolarHBondContact O-N 2.88Å; L164-L178 HydrophobicContact CD1-CD2 3.96Å; L164-L178 HydrophobicContact CG-CD1 4.13Å; L164-L178 HydrophobicContact CG-CD2 4.16Å; L164-L178 HydrophobicContact CG-CG 4.37Å; L164-Q206 HydrophobicContact CD1-CG 4.08Å; L164-A207 HydrophobicContact CD1-CB 4.45Å; L164-W210 HydrophobicContact CD1-CB 4.1Å; L164-W210 HydrophobicContact CD1-CG 4.23Å; L164-W210 HydrophobicContact CD2-CB 4.49Å; L164-W210 HydrophobicContact CD2-CG 4.12Å
165	P	95.9	Very high	93.1	Very high	19 Å²	19	37 Å²	37	12%	0.123	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	146.1	175.1	32.5	-36.2	0	0	0	112	M137 F144 F172	M137-P165 HydrophobicContact CE-CB 3.73Å; M137-P165 HydrophobicContact CE-CG 3.76Å; F144-P165 HydrophobicContact CB-CG 3.74Å; F144-P165 HydrophobicContact CD1-CG 4.32Å; F144-P165 HydrophobicContact CG-CG 4.13Å; P165-F172 HydrophobicContact CB-CD2 3.98Å; P165-F172 HydrophobicContact CB-CE2 3.63Å
166	I	94.5	Very high	93.4	Very high	8 Å²	8	35.9 Å²	35.9	4%	0.041	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	105.9	168.7	-59.9	175.2	0	0	0	107.4	F172 T173 G174 I176 A183 I185 P200 Y203	I166-F172 WeakPolarHBondContact O-CA 3.47Å; I166-T173 PolarHBondContact O-N 2.7Å; I166-G174 WeakPolarHBondContact CB-O 3.49Å; I166-G174 PolarHBondContact N-O 3.05Å; I166-I176 HydrophobicContact CD1-CD1 4.45Å; I166-I176 HydrophobicContact CD1-CG1 3.81Å; I166-I176 HydrophobicContact CG1-CD1 3.99Å; I166-I176 HydrophobicContact CG1-CG1 3.71Å; I166-A183 HydrophobicContact CD1-CB 3.71Å; I166-I185 HydrophobicContact CD1-CD1 3.5Å; I166-P200 HydrophobicContact CD1-CG 4.22Å; I166-Y203 HydrophobicContact CB-CE2 4.34Å; I166-Y203 HydrophobicContact CG1-CD2 4.46Å; I166-Y203 HydrophobicContact CG2-CD2 4.18Å; I166-Y203 HydrophobicContact CG2-CE2 3.65Å
167	G	92	Very high	93.7	Very high	15 Å²	15	29 Å²	29	16%	0.155	16%	0.164	C	C	.	.	S	Bend	trans	75.5	179.4	-169.8	0	0	0	0	0	113.2	D171 Y203	G167-D171 WeakPolarHBondContact CA-O 3.1Å; G167-Y203 PolarHBondContact N-OH 2.95Å
168	A	88.6	Confident	93.9	Very high	36 Å²	36	28.8 Å²	28.8	30%	0.298	16%	0.162	S	C	.	.			trans	-145.2	163.4	175.3	0	0	0	0	0	108.8	M137 D170 D171 F172	M137-A168 HydrophobicContact CE-CB 4.36Å; A168-D170 PolarHBondContact O-N 2.84Å; A168-D171 PolarHBondContact O-N 2.78Å; A168-F172 PolarHBondContact O-N 3.29Å
169	E	90.3	Very high	93.9	Very high	73 Å²	73	26.2 Å²	26.2	34%	0.341	15%	0.148	S	C	.	.	G	3₁₀ helix	trans	57.3	-132.3	179.4	-41	-172.7	166.5	0	0	111.3	M137 D138 K139 G141 D171 F172	M137-E169 PolarHBondContact O-N 3.25Å; D138-E169 WeakPolarHBondContact CA-O 3.46Å; K139-E169 WeakPolarHBondContact O-CG 3.43Å; G141-E169 PolarHBondContact N-OE1 2.95Å; E169-D171 PolarHBondContact O-N 2.98Å; E169-F172 WeakPolarHBondContact O-CB 3.21Å; E169-F172 PolarHBondContact O-N 3.43Å
170	D	86.8	Confident	93.8	Very high	142 Å²	142	29.4 Å²	29.4	76%	0.759	16%	0.162	S	C	*	.	G	3₁₀ helix	trans	-62.9	-24.2	176.5	-72.4	-33.2	0	0	0	113.1	A168 F172	A168-D170 PolarHBondContact O-N 2.84Å; D170-F172 VanDerWaalsContact C-N 3.32Å
171	D	90.3	Very high	93.7	Very high	126 Å²	126	29.1 Å²	29.1	67%	0.674	16%	0.161	S	C	*	.	G	3₁₀ helix	trans	-88.1	2.9	179.3	-67	-37.7	0	0	0	112.8	G167 A168 E169 T173	G167-D171 WeakPolarHBondContact CA-O 3.1Å; A168-D171 PolarHBondContact O-N 2.78Å; E169-D171 PolarHBondContact O-N 2.98Å; D171-T173 WeakPolarHBondContact O-CG2 3.49Å; D171-T173 PolarHBondContact O-N 3.49Å
172	F	92.6	Very high	93.5	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.009	18%	0.178	C	C	.	.			trans	-70.1	101.4	176.9	-180	-122.8	0	0	0	111.2	M137 P165 I166 A168 E169 D170 G174 I175 K265	M137-F172 HydrophobicContact CB-CD1 3.74Å; M137-F172 HydrophobicContact CB-CD2 4.14Å; M137-F172 HydrophobicContact CB-CE1 3.78Å; M137-F172 HydrophobicContact CB-CE2 4.18Å; M137-F172 HydrophobicContact CB-CG 3.93Å; M137-F172 HydrophobicContact CB-CZ 4.01Å; M137-F172 HydrophobicContact CG-CE2 4.49Å; M137-F172 HydrophobicContact CG-CZ 4.37Å; P165-F172 HydrophobicContact CB-CD2 3.98Å; P165-F172 HydrophobicContact CB-CE2 3.63Å; I166-F172 WeakPolarHBondContact O-CA 3.47Å; A168-F172 PolarHBondContact O-N 3.29Å; E169-F172 WeakPolarHBondContact O-CB 3.21Å; E169-F172 PolarHBondContact O-N 3.43Å; D170-F172 VanDerWaalsContact C-N 3.32Å; F172-G174 WeakPolarHBondContact CE2-O 3.49Å; F172-I175 HydrophobicContact CE2-CG1 4.13Å; F172-I175 HydrophobicContact CZ-CD1 4.16Å; F172-I175 HydrophobicContact CZ-CG1 3.83Å; F172-K265 HydrophobicContact CD1-CD 3.98Å; F172-K265 HydrophobicContact CE1-CB 3.76Å; F172-K265 HydrophobicContact CE1-CD 3.99Å; F172-K265 HydrophobicContact CE1-CG 4.48Å; F172-K265 HydrophobicContact CZ-CB 4.43Å; F172-K265 PolarHBondContact O-NZ 2.73Å
173	T	91.4	Very high	93.4	Very high	61 Å²	61	32.6 Å²	32.6	37%	0.374	18%	0.176	S	C	.	.			trans	-112.8	-22.3	-172.3	55.1	0	0	0	0	114.4	I166 D171 Y186	I166-T173 PolarHBondContact O-N 2.7Å; D171-T173 WeakPolarHBondContact O-CG2 3.49Å; D171-T173 PolarHBondContact O-N 3.49Å; T173-Y186 PolarHBondContact O-N 2.98Å
174	G	93.1	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.3	175.6	-169.3	0	0	0	0	0	114	I166 F172 E184	I166-G174 WeakPolarHBondContact CB-O 3.49Å; I166-G174 PolarHBondContact N-O 3.05Å; F172-G174 WeakPolarHBondContact CE2-O 3.49Å; G174-E184 CarbonylContact C-O 3.58Å; G174-E184 WeakPolarHBondContact CA-O 3.35Å
175	I	95.9	Very high	93.1	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	133.1	-179.3	-62.4	166.5	0	0	0	108.2	Q163 L164 F172 A183 E184 Y186 C258 L269	Q163-I175 HydrophobicContact CB-CG2 3.78Å; Q163-I175 HydrophobicContact CG-CG2 3.88Å; L164-I175 CarbonylContact O-C 3.58Å; L164-I175 WeakPolarHBondContact O-CA 3.38Å; F172-I175 HydrophobicContact CE2-CG1 4.13Å; F172-I175 HydrophobicContact CZ-CD1 4.16Å; F172-I175 HydrophobicContact CZ-CG1 3.83Å; I175-A183 CarbonylContact O-C 3.49Å; I175-E184 PolarHBondContact N-O 3Å; I175-E184 PolarHBondContact O-N 2.78Å; I175-Y186 HydrophobicContact CD1-CE2 4.1Å; I175-Y186 HydrophobicContact CG1-CE2 4.39Å; I175-C258 VanDerWaalsContact CD1-O 3.28Å; I175-C258 WeakPolarHBondContact CD1-O 3.31Å; I175-L269 HydrophobicContact CB-CD1 4.12Å; I175-L269 HydrophobicContact CD1-CD1 4.02Å; I175-L269 HydrophobicContact CG2-CD1 3.98Å
176	I	96.8	Very high	92.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.6	171.8	-59.9	163.9	0	0	0	107.7	Q163 L164 I166 L178 K182 A183 I199 Y203 A207	Q163-I176 CarbonylContact C-O 3.5Å; Q163-I176 WeakPolarHBondContact CA-O 3.25Å; Q163-I176 WeakPolarHBondContact CB-O 3.4Å; L164-I176 HydrophobicContact CB-CB 4.26Å; L164-I176 HydrophobicContact CB-CD1 4.37Å; L164-I176 PolarHBondContact N-O 2.97Å; L164-I176 PolarHBondContact O-N 2.88Å; I166-I176 HydrophobicContact CD1-CD1 4.45Å; I166-I176 HydrophobicContact CD1-CG1 3.81Å; I166-I176 HydrophobicContact CG1-CD1 3.99Å; I166-I176 HydrophobicContact CG1-CG1 3.71Å; I176-L178 HydrophobicContact CG2-CD2 4.25Å; I176-K182 CarbonylContact C-O 3.52Å; I176-K182 WeakPolarHBondContact CA-O 3.29Å; I176-A183 HydrophobicContact CG1-CB 4.37Å; I176-I199 HydrophobicContact CD1-CG2 3.84Å; I176-I199 HydrophobicContact CG1-CG2 4.3Å; I176-I199 HydrophobicContact CG2-CD1 3.68Å; I176-I199 HydrophobicContact CG2-CG1 3.94Å; I176-Y203 HydrophobicContact CD1-CG 4.12Å; I176-A207 HydrophobicContact CG2-CB 4.23Å
177	D	95.6	Very high	92.4	Very high	18 Å²	18	37.6 Å²	37.6	10%	0.096	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	111.4	168.6	-178	-27.2	0	0	0	108.4	V179 K180 M181 K182	D177-V179 VanDerWaalsContact C-N 3.26Å; D177-V179 PolarHBondContact O-N 3.3Å; D177-V179 WeakPolarHBondContact OD1-CA 3.46Å; D177-V179 VanDerWaalsContact OD1-CB 3.28Å; D177-V179 WeakPolarHBondContact OD1-CB 3.15Å; D177-V179 PolarHBondContact OD1-N 2.9Å; D177-K180 HydrophobicContact CB-CB 4.38Å; D177-K180 PolarHBondContact OD1-N 2.9Å; D177-K180 WeakPolarHBondContact OD2-CD 3.32Å; D177-K180 IonicContact OD2-NZ 2.65Å; D177-M181 WeakPolarHBondContact O-CA 3.3Å; D177-M181 PolarHBondContact O-N 2.78Å; D177-K182 PolarHBondContact N-O 3.49Å; D177-K182 PolarHBondContact O-N 2.87Å
178	L	95.3	Very high	92	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.1	-178.2	-64.8	175.9	0	0	0	113	P161 I162 L164 I176 M181 A207 W210 L214	P161-L178 HydrophobicContact CB-CD1 4.18Å; P161-L178 WeakPolarHBondContact O-CD1 3.24Å; I162-L178 WeakPolarHBondContact O-CB 3.32Å; I162-L178 PolarHBondContact O-N 3.04Å; L164-L178 HydrophobicContact CD1-CD2 3.96Å; L164-L178 HydrophobicContact CG-CD1 4.13Å; L164-L178 HydrophobicContact CG-CD2 4.16Å; L164-L178 HydrophobicContact CG-CG 4.37Å; I176-L178 HydrophobicContact CG2-CD2 4.25Å; L178-M181 HydrophobicContact CD2-SD 4.36Å; L178-A207 HydrophobicContact CD2-CB 4.06Å; L178-A207 WeakPolarHBondContact CD2-O 3.36Å; L178-W210 HydrophobicContact CD1-CB 3.85Å; L178-W210 HydrophobicContact CD2-CB 4.46Å; L178-L214 HydrophobicContact CB-CD2 4.04Å
179	V	94	Very high	91.5	Very high	2 Å²	2	43 Å²	43	1%	0.012	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-45	178.4	179.6	0	0	0	0	109.7	I162 D177 L214 E237 L240 K241 I244	I162-V179 HydrophobicContact CB-CG2 4.49Å; D177-V179 VanDerWaalsContact C-N 3.26Å; D177-V179 PolarHBondContact O-N 3.3Å; D177-V179 WeakPolarHBondContact OD1-CA 3.46Å; D177-V179 VanDerWaalsContact OD1-CB 3.28Å; D177-V179 WeakPolarHBondContact OD1-CB 3.15Å; D177-V179 PolarHBondContact OD1-N 2.9Å; V179-L214 HydrophobicContact CG2-CD2 4.27Å; V179-E237 HydrophobicContact CG1-CG 3.83Å; V179-L240 HydrophobicContact CG1-CD2 4.26Å; V179-L240 HydrophobicContact CG2-CD2 4.41Å; V179-K241 HydrophobicContact CG1-CG 3.71Å; V179-I244 HydrophobicContact CG2-CD1 3.86Å
180	K	93	Very high	90.9	Very high	66 Å²	66	43.7 Å²	43.7	29%	0.287	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-17.2	176.3	-66.3	178.1	-170.3	161.7	0	114.3	D177 K182 E237	D177-K180 HydrophobicContact CB-CB 4.38Å; D177-K180 PolarHBondContact OD1-N 2.9Å; D177-K180 WeakPolarHBondContact OD2-CD 3.32Å; D177-K180 IonicContact OD2-NZ 2.65Å; K180-K182 HydrophobicContact CB-CB 4.49Å; K180-K182 HydrophobicContact CB-CG 4.47Å; K180-E237 WeakPolarHBondContact CG-OE1 3.38Å
181	M	93.9	Very high	90.4	Very high	28 Å²	28	36.9 Å²	36.9	14%	0.138	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	51.9	-166.8	-71.9	-62.3	-82.6	0	0	113.5	D177 L178 I199 A207 E208 R211	D177-M181 WeakPolarHBondContact O-CA 3.3Å; D177-M181 PolarHBondContact O-N 2.78Å; L178-M181 HydrophobicContact CD2-SD 4.36Å; M181-I199 HydrophobicContact CB-CD1 4.3Å; M181-I199 HydrophobicContact CE-CD1 3.82Å; M181-I199 HydrophobicContact SD-CD1 4.06Å; M181-A207 HydrophobicContact CE-CB 4.02Å; M181-A207 HydrophobicContact SD-CB 4.45Å; M181-E208 HydrophobicContact CE-CG 4.06Å; M181-R211 VanDerWaalsContact CG-CD 3.41Å; M181-R211 HydrophobicContact SD-CB 4.05Å; M181-R211 WeakPolarHBondContact SD-CD 3.24Å; M181-R211 HydrophobicContact SD-CG 4.33Å
182	K	94.6	Very high	89.8	Confident	80 Å²	80	34.8 Å²	34.8	35%	0.348	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	155.5	175.6	-67.8	-170.9	176.5	175.9	0	111	I176 D177 K180 E196	I176-K182 CarbonylContact C-O 3.52Å; I176-K182 WeakPolarHBondContact CA-O 3.29Å; D177-K182 PolarHBondContact N-O 3.49Å; D177-K182 PolarHBondContact O-N 2.87Å; K180-K182 HydrophobicContact CB-CB 4.49Å; K180-K182 HydrophobicContact CB-CG 4.47Å; K182-E196 HydrophobicContact CB-CG 4.11Å; K182-E196 HydrophobicContact CD-CG 3.71Å; K182-E196 WeakPolarHBondContact CD-OE1 3.38Å; K182-E196 WeakPolarHBondContact CE-OE1 2.97Å; K182-E196 IonicContact NZ-OE1 3.15Å; K182-E196 PolarHBondContact NZ-OE1 2.99Å
183	A	94.6	Very high	89.3	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	137.9	174.5	0	0	0	0	0	110.7	I166 I175 I176 I185 E196 T197	I166-A183 HydrophobicContact CD1-CB 3.71Å; I175-A183 CarbonylContact O-C 3.49Å; I176-A183 HydrophobicContact CG1-CB 4.37Å; A183-I185 HydrophobicContact CB-CD1 4.43Å; A183-E196 CarbonylContact O-C 3.59Å; A183-E196 WeakPolarHBondContact O-CA 3.06Å; A183-T197 PolarHBondContact N-O 2.88Å; A183-T197 PolarHBondContact O-N 2.97Å
184	E	93.3	Very high	89.1	Confident	23 Å²	23	40.3 Å²	40.3	11%	0.107	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	111.2	169.6	-73.8	-166.5	-171.7	0	0	109.3	G174 I175 I194 L269	G174-E184 CarbonylContact C-O 3.58Å; G174-E184 WeakPolarHBondContact CA-O 3.35Å; I175-E184 PolarHBondContact N-O 3Å; I175-E184 PolarHBondContact O-N 2.78Å; E184-I194 HydrophobicContact CB-CG2 3.69Å; E184-I194 HydrophobicContact CG-CG2 3.93Å; E184-L269 WeakPolarHBondContact OE2-CD2 3.42Å
185	I	92.6	Very high	88.9	Confident	39 Å²	39	45.6 Å²	45.6	20%	0.2	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126.3	-179.6	-53.5	-58.5	0	0	0	109.7	I166 A183 Q195 T197	I166-I185 HydrophobicContact CD1-CD1 3.5Å; A183-I185 HydrophobicContact CB-CD1 4.43Å; I185-Q195 PolarHBondContact N-O 2.95Å; I185-Q195 PolarHBondContact O-N 2.7Å; I185-T197 HydrophobicContact CG1-CG2 4.34Å
186	Y	90.7	Very high	88.8	Confident	13 Å²	13	50.4 Å²	50.4	5%	0.051	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112.3	178.7	-68.3	-100.6	0	0	0	109.4	T173 I175 I194 K265 G266	T173-Y186 PolarHBondContact O-N 2.98Å; I175-Y186 HydrophobicContact CD1-CE2 4.1Å; I175-Y186 HydrophobicContact CG1-CE2 4.39Å; Y186-I194 HydrophobicContact CD1-CD1 4.38Å; Y186-I194 HydrophobicContact CD1-CG1 3.92Å; Y186-I194 HydrophobicContact CE1-CD1 3.65Å; Y186-I194 HydrophobicContact CE1-CG1 3.7Å; Y186-K265 HydrophobicContact CD1-CB 4.15Å; Y186-K265 HydrophobicContact CD1-CG 3.82Å; Y186-K265 HydrophobicContact CD2-CB 4.15Å; Y186-K265 HydrophobicContact CD2-CD 4.34Å; Y186-K265 HydrophobicContact CD2-CG 4.08Å; Y186-K265 HydrophobicContact CE1-CB 4.17Å; Y186-K265 HydrophobicContact CE1-CG 4.34Å; Y186-K265 HydrophobicContact CE2-CB 4.21Å; Y186-K265 HydrophobicContact CG-CB 4.15Å; Y186-K265 HydrophobicContact CG-CD 4.13Å; Y186-K265 HydrophobicContact CG-CG 3.68Å; Y186-G266 VanDerWaalsContact CZ-N 3.35Å; Y186-G266 WeakPolarHBondContact OH-CA 3.29Å; Y186-G266 PolarHBondContact OH-N 2.83Å
187	T	85.5	Confident	88.6	Confident	65 Å²	65	52.8 Å²	52.8	40%	0.399	27%	0.269	S	S	.	.			trans	-93.9	-5.4	-174.8	59.1	0	0	0	0	113.8	E193 Q195	T187-E193 PolarHBondContact N-O 3.03Å; T187-E193 VanDerWaalsContact OG1-CB 3.23Å; T187-E193 WeakPolarHBondContact OG1-CB 3.43Å; T187-E193 PolarHBondContact OG1-O 2.95Å; T187-Q195 HydrophobicContact CG2-CG 4Å
188	N	84	Confident	88.5	Confident	35 Å²	35	59 Å²	59	19%	0.187	30%	0.297	C	S	.	.	S	Bend	trans	-140.6	157.2	176.7	75.1	-16.4	0	0	0	113.2	L190 G191 T192 E193	N188-L190 PolarHBondContact O-N 3Å; N188-G191 PolarHBondContact O-N 2.65Å; N188-G191 PolarHBondContact OD1-N 2.91Å; N188-G191 VanDerWaalsContact OD1-N 3.1Å; N188-T192 PolarHBondContact ND2-OG1 2.9Å; N188-T192 PolarHBondContact OD1-N 3.35Å; N188-E193 PolarHBondContact OD1-N 3.47Å; N188-E193 VanDerWaalsContact OD1-N 3.12Å
189	D	76.1	Confident	88.4	Confident	130 Å²	130	59.5 Å²	59.5	70%	0.695	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-13.7	-179.1	-61.7	-31	0	0	0	113.7	N264	D189-N264 WeakPolarHBondContact O-CB 3.46Å; D189-N264 PolarHBondContact O-ND2 3.48Å
190	L	77.8	Confident	88.4	Confident	87 Å²	87	61.2 Å²	61.2	46%	0.455	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-10.1	178.4	-80.3	157	0	0	0	113	I40 N188 T192	I40-L190 HydrophobicContact CD1-CD2 4.49Å; N188-L190 PolarHBondContact O-N 3Å; L190-T192 VanDerWaalsContact C-N 3.28Å; L190-T192 HydrophobicContact CB-CG2 4.22Å; L190-T192 PolarHBondContact O-N 3.5Å
191	G	76.8	Confident	88.4	Confident	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	63.9	31.6	-178	0	0	0	0	0	113.9	N188 N264 Q268	N188-G191 PolarHBondContact O-N 2.65Å; N188-G191 PolarHBondContact OD1-N 2.91Å; N188-G191 VanDerWaalsContact OD1-N 3.1Å; G191-N264 WeakPolarHBondContact CA-O 3.07Å; G191-Q268 PolarHBondContact O-OE1 3.36Å; G191-Q268 VanDerWaalsContact O-OE1 3.1Å
192	T	77.6	Confident	88.4	Confident	81 Å²	81	68.6 Å²	68.6	50%	0.497	36%	0.362	S	S	.	.			trans	-105.8	-20.6	179	62.6	0	0	0	0	112.7	N188 L190	N188-T192 PolarHBondContact ND2-OG1 2.9Å; N188-T192 PolarHBondContact OD1-N 3.35Å; L190-T192 VanDerWaalsContact C-N 3.28Å; L190-T192 HydrophobicContact CB-CG2 4.22Å; L190-T192 PolarHBondContact O-N 3.5Å
193	E	81.7	Confident	88.4	Confident	122 Å²	122	66.9 Å²	66.9	57%	0.57	35%	0.354	S	S	*	.			trans	-111.2	92.6	177	-69.7	-172.2	172.2	0	0	110	T187 N188	T187-E193 PolarHBondContact N-O 3.03Å; T187-E193 VanDerWaalsContact OG1-CB 3.23Å; T187-E193 WeakPolarHBondContact OG1-CB 3.43Å; T187-E193 PolarHBondContact OG1-O 2.95Å; N188-E193 PolarHBondContact OD1-N 3.47Å; N188-E193 VanDerWaalsContact OD1-N 3.12Å
194	I	87.1	Confident	88.4	Confident	57 Å²	57	69.9 Å²	69.9	29%	0.292	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	128.2	174.5	-59	172.8	0	0	0	108.5	E184 Y186	E184-I194 HydrophobicContact CB-CG2 3.69Å; E184-I194 HydrophobicContact CG-CG2 3.93Å; Y186-I194 HydrophobicContact CD1-CD1 4.38Å; Y186-I194 HydrophobicContact CD1-CG1 3.92Å; Y186-I194 HydrophobicContact CE1-CD1 3.65Å; Y186-I194 HydrophobicContact CE1-CG1 3.7Å
195	Q	90	Very high	88.4	Confident	112 Å²	112	76.5 Å²	76.5	52%	0.523	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.3	170.9	-67.9	-173.7	6.2	0	0	109.6	I185 T187 T197	I185-Q195 PolarHBondContact N-O 2.95Å; I185-Q195 PolarHBondContact O-N 2.7Å; T187-Q195 HydrophobicContact CG2-CG 4Å; Q195-T197 HydrophobicContact CB-CG2 4.32Å
196	E	92.7	Very high	88.5	Confident	100 Å²	100	77.8 Å²	77.8	47%	0.467	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	120.4	169.3	-167.3	-175.5	96.8	0	0	108.8	K182 A183	K182-E196 HydrophobicContact CB-CG 4.11Å; K182-E196 HydrophobicContact CD-CG 3.71Å; K182-E196 WeakPolarHBondContact CD-OE1 3.38Å; K182-E196 WeakPolarHBondContact CE-OE1 2.97Å; K182-E196 IonicContact NZ-OE1 3.15Å; K182-E196 PolarHBondContact NZ-OE1 2.99Å; A183-E196 CarbonylContact O-C 3.59Å; A183-E196 WeakPolarHBondContact O-CA 3.06Å
197	T	93.5	Very high	88.7	Confident	51 Å²	51	77.2 Å²	77.2	31%	0.313	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	167.3	-178.3	67.5	0	0	0	0	110.9	A183 I185 Q195	A183-T197 PolarHBondContact N-O 2.88Å; A183-T197 PolarHBondContact O-N 2.97Å; I185-T197 HydrophobicContact CG1-CG2 4.34Å; Q195-T197 HydrophobicContact CB-CG2 4.32Å
198	E	93.9	Very high	89.2	Confident	148 Å²	148	79.1 Å²	79.1	69%	0.692	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-61.6	154	163.5	-63.8	-64	156	0	0	110.2
199	I	93.9	Very high	89.8	Confident	11 Å²	11	81.9 Å²	81.9	6%	0.056	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-65.1	132.1	178.5	-60.1	172.2	0	0	0	108.9	I176 M181 A201 A207	I176-I199 HydrophobicContact CD1-CG2 3.84Å; I176-I199 HydrophobicContact CG1-CG2 4.3Å; I176-I199 HydrophobicContact CG2-CD1 3.68Å; I176-I199 HydrophobicContact CG2-CG1 3.94Å; M181-I199 HydrophobicContact CB-CD1 4.3Å; M181-I199 HydrophobicContact CE-CD1 3.82Å; M181-I199 HydrophobicContact SD-CD1 4.06Å; I199-A201 PolarHBondContact O-N 3.17Å; I199-A207 HydrophobicContact CD1-CB 3.86Å; I199-A207 HydrophobicContact CG2-CB 4.38Å
200	P	93.5	Very high	90.7	Very high	37 Å²	37	77.5 Å²	77.5	24%	0.24	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-58.6	139.8	176	-21.3	31.1	0	0	0	111.2	I166 E202 Y203 Q204	I166-P200 HydrophobicContact CD1-CG 4.22Å; P200-E202 HydrophobicContact CB-CG 4.35Å; P200-E202 PolarHBondContact O-N 3.39Å; P200-Y203 HydrophobicContact CB-CD2 4.11Å; P200-Y203 HydrophobicContact CG-CD2 4.25Å; P200-Y203 PolarHBondContact O-N 3.25Å; P200-Q204 PolarHBondContact O-N 2.89Å
201	A	93.2	Very high	91.5	Very high	98 Å²	98	76.3 Å²	76.3	81%	0.81	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-26.1	-173.4	0	0	0	0	0	114.1	I199 Y203	I199-A201 PolarHBondContact O-N 3.17Å; A201-Y203 VanDerWaalsContact C-N 3.32Å
202	E	93.8	Very high	92.3	Very high	151 Å²	151	82.2 Å²	82.2	71%	0.706	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-24.5	176.8	73.2	-167.9	150.6	0	0	113.7	P200	P200-E202 HydrophobicContact CB-CG 4.35Å; P200-E202 PolarHBondContact O-N 3.39Å
203	Y	93.8	Very high	93	Very high	45 Å²	45	81.8 Å²	81.8	18%	0.176	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	-8	-179.6	-65.7	-72	0	0	0	113.4	I166 G167 I176 P200 A201 E205 Q206 A207	I166-Y203 HydrophobicContact CB-CE2 4.34Å; I166-Y203 HydrophobicContact CG1-CD2 4.46Å; I166-Y203 HydrophobicContact CG2-CD2 4.18Å; I166-Y203 HydrophobicContact CG2-CE2 3.65Å; G167-Y203 PolarHBondContact N-OH 2.95Å; I176-Y203 HydrophobicContact CD1-CG 4.12Å; P200-Y203 HydrophobicContact CB-CD2 4.11Å; P200-Y203 HydrophobicContact CG-CD2 4.25Å; P200-Y203 PolarHBondContact O-N 3.25Å; A201-Y203 VanDerWaalsContact C-N 3.32Å; Y203-E205 PolarHBondContact O-N 2.89Å; Y203-Q206 PolarHBondContact O-N 3.34Å; Y203-A207 WeakPolarHBondContact O-CB 3.48Å; Y203-A207 PolarHBondContact O-N 3.29Å
204	Q	93.9	Very high	93.7	Very high	63 Å²	63	76 Å²	76	29%	0.294	37%	0.373	S	S	.	.	H	α-helix	trans	-56.7	-49	-174.2	-174.7	67.8	28.8	0	0	112.6	P200 Q206 A207 E208	P200-Q204 PolarHBondContact O-N 2.89Å; Q204-Q206 VanDerWaalsContact C-N 3.34Å; Q204-Q206 PolarHBondContact O-N 3.43Å; Q204-A207 PolarHBondContact O-N 3.35Å; Q204-E208 PolarHBondContact NE2-OE1 3.31Å; Q204-E208 WeakPolarHBondContact O-CG 3.24Å; Q204-E208 PolarHBondContact O-N 3.11Å
205	E	95.2	Very high	94	Very high	162 Å²	162	74 Å²	74	76%	0.757	36%	0.364	S	S	*	.	H	α-helix	trans	-63.2	-41.5	-179.3	-172.8	175.5	-171.8	0	0	111.4	Y203 E208 E209	Y203-E205 PolarHBondContact O-N 2.89Å; E205-E208 PolarHBondContact O-N 2.87Å; E205-E209 PolarHBondContact O-N 2.84Å
206	Q	94.7	Very high	94.1	Very high	66 Å²	66	73.1 Å²	73.1	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-66.5	-39.8	176.7	-171.8	176	40.7	0	0	111.8	L164 Y203 Q204 E209 W210	L164-Q206 HydrophobicContact CD1-CG 4.08Å; Y203-Q206 PolarHBondContact O-N 3.34Å; Q204-Q206 VanDerWaalsContact C-N 3.34Å; Q204-Q206 PolarHBondContact O-N 3.43Å; Q206-E209 PolarHBondContact O-N 2.79Å; Q206-W210 VanDerWaalsContact O-CD1 3.26Å; Q206-W210 PolarHBondContact O-N 2.81Å
207	A	95.1	Very high	94.1	Very high	0 Å²	0	68.7 Å²	68.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.4	-39.5	177.1	0	0	0	0	0	111.9	L164 I176 L178 M181 I199 Y203 Q204 R211	L164-A207 HydrophobicContact CD1-CB 4.45Å; I176-A207 HydrophobicContact CG2-CB 4.23Å; L178-A207 HydrophobicContact CD2-CB 4.06Å; L178-A207 WeakPolarHBondContact CD2-O 3.36Å; M181-A207 HydrophobicContact CE-CB 4.02Å; M181-A207 HydrophobicContact SD-CB 4.45Å; I199-A207 HydrophobicContact CD1-CB 3.86Å; I199-A207 HydrophobicContact CG2-CB 4.38Å; Y203-A207 WeakPolarHBondContact O-CB 3.48Å; Y203-A207 PolarHBondContact O-N 3.29Å; Q204-A207 PolarHBondContact O-N 3.35Å; A207-R211 WeakPolarHBondContact O-CB 3.38Å; A207-R211 PolarHBondContact O-N 2.88Å
208	E	95.3	Very high	94.1	Very high	106 Å²	106	66.3 Å²	66.3	50%	0.495	33%	0.325	S	S	.	.	H	α-helix	trans	-64.3	-45.9	175.1	-73.4	170.4	-171.7	0	0	111.6	M181 Q204 E205 W210 R211 E212	M181-E208 HydrophobicContact CE-CG 4.06Å; Q204-E208 PolarHBondContact NE2-OE1 3.31Å; Q204-E208 WeakPolarHBondContact O-CG 3.24Å; Q204-E208 PolarHBondContact O-N 3.11Å; E205-E208 PolarHBondContact O-N 2.87Å; E208-W210 PolarHBondContact O-N 2.92Å; E208-R211 PolarHBondContact O-N 3.42Å; E208-E212 PolarHBondContact O-N 2.89Å
209	E	95.6	Very high	94	Very high	92 Å²	92	59.3 Å²	59.3	43%	0.43	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-48.4	177.1	-173.5	-165.5	157.8	0	0	112	E205 Q206 E212 K213	E205-E209 PolarHBondContact O-N 2.84Å; Q206-E209 PolarHBondContact O-N 2.79Å; E209-E212 PolarHBondContact O-N 3.16Å; E209-K213 WeakPolarHBondContact O-CG 3.41Å; E209-K213 PolarHBondContact O-N 3.08Å; E209-K213 VanDerWaalsContact O-N 3.11Å; E209-K213 IonicContact OE1-NZ 3.96Å; E209-K213 PolarHBondContact OE1-NZ 3.22Å
210	W	95.3	Very high	93.9	Very high	38 Å²	38	64.3 Å²	64.3	14%	0.144	32%	0.32	C	S	.	.	H	α-helix	trans	-73.6	-28.5	-179.7	-79.2	100.9	0	0	0	112.9	L145 P161 L164 L178 Q206 E208 K213 L214	L145-W210 HydrophobicContact CD1-CZ2 4.24Å; L145-W210 HydrophobicContact CD2-CD2 4.49Å; L145-W210 HydrophobicContact CD2-CH2 4.13Å; L145-W210 HydrophobicContact CD2-CZ2 3.45Å; L145-W210 VanDerWaalsContact CD2-CZ2 3.45Å; L145-W210 HydrophobicContact CG-CZ2 4.4Å; P161-W210 HydrophobicContact CB-CE3 4.37Å; P161-W210 HydrophobicContact CG-CD2 4.34Å; P161-W210 HydrophobicContact CG-CE3 3.68Å; P161-W210 HydrophobicContact CG-CH2 4.44Å; P161-W210 HydrophobicContact CG-CZ3 3.74Å; L164-W210 HydrophobicContact CD1-CB 4.1Å; L164-W210 HydrophobicContact CD1-CG 4.23Å; L164-W210 HydrophobicContact CD2-CB 4.49Å; L164-W210 HydrophobicContact CD2-CG 4.12Å; L178-W210 HydrophobicContact CD1-CB 3.85Å; L178-W210 HydrophobicContact CD2-CB 4.46Å; Q206-W210 VanDerWaalsContact O-CD1 3.26Å; Q206-W210 PolarHBondContact O-N 2.81Å; E208-W210 PolarHBondContact O-N 2.92Å; W210-K213 HydrophobicContact CD2-CD 4.28Å; W210-K213 HydrophobicContact CE3-CB 4.41Å; W210-K213 HydrophobicContact CE3-CD 3.93Å; W210-K213 HydrophobicContact CZ3-CD 4.1Å; W210-L214 VanDerWaalsContact O-CB 3.3Å; W210-L214 WeakPolarHBondContact O-CB 3.49Å; W210-L214 PolarHBondContact O-N 3.04Å
211	R	94.6	Very high	93.7	Very high	63 Å²	63	65.1 Å²	65.1	24%	0.238	32%	0.324	C	S	.	.	H	α-helix	trans	-64.6	-43.9	170.2	179.2	169.9	-177.1	-178.7	7	111	M181 A207 E208 L214 V215	M181-R211 VanDerWaalsContact CG-CD 3.41Å; M181-R211 HydrophobicContact SD-CB 4.05Å; M181-R211 WeakPolarHBondContact SD-CD 3.24Å; M181-R211 HydrophobicContact SD-CG 4.33Å; A207-R211 WeakPolarHBondContact O-CB 3.38Å; A207-R211 PolarHBondContact O-N 2.88Å; E208-R211 PolarHBondContact O-N 3.42Å; R211-L214 PolarHBondContact O-N 3.12Å; R211-V215 HydrophobicContact CG-CG2 4.24Å; R211-V215 WeakPolarHBondContact O-CB 3.36Å; R211-V215 VanDerWaalsContact O-CG2 3.26Å; R211-V215 WeakPolarHBondContact O-CG2 3.46Å; R211-V215 PolarHBondContact O-N 2.95Å
212	E	93.2	Very high	93.5	Very high	123 Å²	123	62.6 Å²	62.6	58%	0.575	30%	0.297	S	S	*	.	H	α-helix	trans	-59.7	-48	176.8	-170.8	175.3	-173	0	0	110.9	E208 E209 L214 V215 E216	E208-E212 PolarHBondContact O-N 2.89Å; E209-E212 PolarHBondContact O-N 3.16Å; E212-L214 VanDerWaalsContact C-N 3.33Å; E212-L214 PolarHBondContact O-N 2.86Å; E212-V215 PolarHBondContact O-N 3.12Å; E212-E216 WeakPolarHBondContact O-CB 3.45Å; E212-E216 PolarHBondContact O-N 3.24Å
213	K	94	Very high	93.3	Very high	72 Å²	72	62.9 Å²	62.9	31%	0.313	30%	0.298	S	S	.	.	H	α-helix	trans	-60	-38.9	175	-72.5	171.6	173	169.4	0	113.5	E209 W210 A217	E209-K213 WeakPolarHBondContact O-CG 3.41Å; E209-K213 PolarHBondContact O-N 3.08Å; E209-K213 VanDerWaalsContact O-N 3.11Å; E209-K213 IonicContact OE1-NZ 3.96Å; E209-K213 PolarHBondContact OE1-NZ 3.22Å; W210-K213 HydrophobicContact CD2-CD 4.28Å; W210-K213 HydrophobicContact CE3-CB 4.41Å; W210-K213 HydrophobicContact CE3-CD 3.93Å; W210-K213 HydrophobicContact CZ3-CD 4.1Å; K213-A217 VanDerWaalsContact O-CB 3.32Å; K213-A217 WeakPolarHBondContact O-CB 3.45Å; K213-A217 PolarHBondContact O-N 3.46Å
214	L	94.8	Very high	93.1	Very high	1 Å²	1	66.1 Å²	66.1	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-64.8	-47.5	176.1	170.1	63.5	0	0	0	110.7	H160 I162 L178 V179 W210 R211 E212 A217 V218 L240 I244 F253	H160-L214 HydrophobicContact CB-CD1 4.42Å; I162-L214 HydrophobicContact CG2-CD1 3.86Å; I162-L214 HydrophobicContact CG2-CD2 4.21Å; L178-L214 HydrophobicContact CB-CD2 4.04Å; V179-L214 HydrophobicContact CG2-CD2 4.27Å; W210-L214 VanDerWaalsContact O-CB 3.3Å; W210-L214 WeakPolarHBondContact O-CB 3.49Å; W210-L214 PolarHBondContact O-N 3.04Å; R211-L214 PolarHBondContact O-N 3.12Å; E212-L214 VanDerWaalsContact C-N 3.33Å; E212-L214 PolarHBondContact O-N 2.86Å; L214-A217 PolarHBondContact O-N 3.39Å; L214-V218 HydrophobicContact CD1-CG2 4.03Å; L214-V218 VanDerWaalsContact O-CG2 3.28Å; L214-V218 WeakPolarHBondContact O-CG2 3.36Å; L214-V218 PolarHBondContact O-N 2.77Å; L214-L240 HydrophobicContact CD2-CD2 4.47Å; L214-I244 HydrophobicContact CD1-CD1 4.37Å; L214-F253 HydrophobicContact CD1-CE2 4.42Å; L214-F253 HydrophobicContact CD1-CZ 3.68Å
215	V	93	Very high	92.9	Very high	16 Å²	16	63.7 Å²	63.7	10%	0.097	31%	0.307	C	S	.	.	H	α-helix	trans	-63.7	-44	-179.4	173.2	0	0	0	0	110.5	R211 E212 V218 A219 F229 I235 L240	R211-V215 HydrophobicContact CG-CG2 4.24Å; R211-V215 WeakPolarHBondContact O-CB 3.36Å; R211-V215 VanDerWaalsContact O-CG2 3.26Å; R211-V215 WeakPolarHBondContact O-CG2 3.46Å; R211-V215 PolarHBondContact O-N 2.95Å; E212-V215 PolarHBondContact O-N 3.12Å; V215-V218 PolarHBondContact O-N 2.84Å; V215-A219 WeakPolarHBondContact O-CB 3.3Å; V215-A219 PolarHBondContact O-N 2.91Å; V215-F229 HydrophobicContact CG1-CD2 3.65Å; V215-F229 HydrophobicContact CG1-CE2 4.03Å; V215-I235 HydrophobicContact CG1-CD1 3.51Å; V215-L240 HydrophobicContact CG2-CD1 4.18Å; V215-L240 HydrophobicContact CG2-CD2 4.16Å
216	E	93	Very high	92.7	Very high	93 Å²	93	59.4 Å²	59.4	44%	0.435	29%	0.289	S	S	.	.	H	α-helix	trans	-57.2	-50.9	174.6	-175.5	179	-166.5	0	0	111.3	E212 V218 A219 D220 F229	E212-E216 WeakPolarHBondContact O-CB 3.45Å; E212-E216 PolarHBondContact O-N 3.24Å; E216-V218 VanDerWaalsContact C-N 3.32Å; E216-V218 PolarHBondContact O-N 3.14Å; E216-A219 WeakPolarHBondContact O-CB 3.39Å; E216-A219 PolarHBondContact O-N 2.77Å; E216-D220 PolarHBondContact O-N 3.42Å; E216-F229 HydrophobicContact CB-CE1 4.03Å; E216-F229 HydrophobicContact CB-CE2 4.48Å; E216-F229 HydrophobicContact CB-CZ 3.81Å; E216-F229 HydrophobicContact CG-CE1 3.97Å; E216-F229 HydrophobicContact CG-CZ 4.19Å
217	A	93.2	Very high	92.5	Very high	7 Å²	7	61 Å²	61	6%	0.058	30%	0.297	C	S	.	.	H	α-helix	trans	-64.6	-33.2	-178.1	0	0	0	0	0	113.7	K213 L214 F253	K213-A217 VanDerWaalsContact O-CB 3.32Å; K213-A217 WeakPolarHBondContact O-CB 3.45Å; K213-A217 PolarHBondContact O-N 3.46Å; L214-A217 PolarHBondContact O-N 3.39Å; A217-F253 HydrophobicContact CB-CD2 4.49Å; A217-F253 HydrophobicContact CB-CE2 3.97Å
218	V	93	Very high	92.3	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-75.5	-40.6	174.6	175.6	0	0	0	0	110.5	L214 V215 E216 D220 T221 L225 L240 I244 F253	L214-V218 HydrophobicContact CD1-CG2 4.03Å; L214-V218 VanDerWaalsContact O-CG2 3.28Å; L214-V218 WeakPolarHBondContact O-CG2 3.36Å; L214-V218 PolarHBondContact O-N 2.77Å; V215-V218 PolarHBondContact O-N 2.84Å; E216-V218 VanDerWaalsContact C-N 3.32Å; E216-V218 PolarHBondContact O-N 3.14Å; V218-D220 VanDerWaalsContact C-N 3.28Å; V218-D220 PolarHBondContact O-N 2.89Å; V218-T221 PolarHBondContact O-N 3.35Å; V218-T221 PolarHBondContact O-OG1 2.98Å; V218-L225 HydrophobicContact CG1-CD1 3.88Å; V218-L240 HydrophobicContact CB-CD1 4.19Å; V218-L240 HydrophobicContact CG1-CD1 4.2Å; V218-L240 HydrophobicContact CG2-CD1 4.21Å; V218-I244 HydrophobicContact CG1-CG1 4.38Å; V218-I244 HydrophobicContact CG2-CG1 3.53Å; V218-F253 HydrophobicContact CG2-CE2 4.12Å; V218-F253 HydrophobicContact CG2-CZ 4.09Å
219	A	92.3	Very high	91.9	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-60.5	-37.3	177.9	0	0	0	0	0	111.9	V215 E216 T221 D222 L225 M226 F229	V215-A219 WeakPolarHBondContact O-CB 3.3Å; V215-A219 PolarHBondContact O-N 2.91Å; E216-A219 WeakPolarHBondContact O-CB 3.39Å; E216-A219 PolarHBondContact O-N 2.77Å; A219-T221 PolarHBondContact O-N 3.44Å; A219-D222 CarbonylContact O-C 3.56Å; A219-D222 PolarHBondContact O-N 3.47Å; A219-D222 VanDerWaalsContact O-N 3.08Å; A219-L225 HydrophobicContact CB-CB 4.28Å; A219-M226 WeakPolarHBondContact O-CB 3.27Å; A219-F229 HydrophobicContact CB-CB 4.05Å; A219-F229 HydrophobicContact CB-CG 4.36Å
220	D	91.1	Very high	91.7	Very high	115 Å²	115	63.7 Å²	63.7	62%	0.615	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-19.1	174.7	-85.2	-6.2	0	0	0	114.2	E216 V218	E216-D220 PolarHBondContact O-N 3.42Å; V218-D220 VanDerWaalsContact C-N 3.28Å; V218-D220 PolarHBondContact O-N 2.89Å
221	T	88.8	Confident	91.4	Very high	54 Å²	54	68.5 Å²	68.5	33%	0.331	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-9.1	179.6	67.8	0	0	0	0	114.1	V218 A219 A247	V218-T221 PolarHBondContact O-N 3.35Å; V218-T221 PolarHBondContact O-OG1 2.98Å; A219-T221 PolarHBondContact O-N 3.44Å; T221-A247 HydrophobicContact CG2-CB 4.06Å; T221-A247 WeakPolarHBondContact OG1-CB 3.18Å
222	D	89.5	Confident	91	Very high	45 Å²	45	68.9 Å²	68.9	24%	0.241	36%	0.359	C	S	.	.			trans	-139.6	116.1	-174.4	-174.4	-57	0	0	0	110.8	A219 D224 L225 M226	A219-D222 CarbonylContact O-C 3.56Å; A219-D222 PolarHBondContact O-N 3.47Å; A219-D222 VanDerWaalsContact O-N 3.08Å; D222-D224 VanDerWaalsContact C-N 3.27Å; D222-D224 PolarHBondContact O-N 3.02Å; D222-D224 WeakPolarHBondContact OD1-CB 3.2Å; D222-D224 PolarHBondContact OD1-N 3.22Å; D222-L225 HydrophobicContact CB-CB 4.07Å; D222-L225 HydrophobicContact CB-CD1 3.98Å; D222-L225 HydrophobicContact CB-CG 4.06Å; D222-L225 PolarHBondContact O-N 3.22Å; D222-L225 PolarHBondContact OD1-N 3.36Å; D222-L225 VanDerWaalsContact OD1-N 3.12Å; D222-M226 WeakPolarHBondContact O-CB 3.41Å; D222-M226 PolarHBondContact O-N 2.87Å
223	E	89	Confident	90.8	Very high	157 Å²	157	68 Å²	68	73%	0.734	36%	0.355	S	S	*	.	H	α-helix	trans	-59.3	-34.7	-175.4	-67.9	-174.6	173.4	0	0	113.4	M227	E223-M227 PolarHBondContact O-N 3.25Å; E223-M227 VanDerWaalsContact O-N 3.1Å
224	D	89.9	Confident	90.2	Very high	114 Å²	114	72.5 Å²	72.5	61%	0.61	38%	0.377	S	S	*	.	H	α-helix	trans	-73.5	-41.5	-179.1	-72.9	-28.6	0	0	0	110.6	D222 M227 K228	D222-D224 VanDerWaalsContact C-N 3.27Å; D222-D224 PolarHBondContact O-N 3.02Å; D222-D224 WeakPolarHBondContact OD1-CB 3.2Å; D222-D224 PolarHBondContact OD1-N 3.22Å; D224-M227 PolarHBondContact O-N 2.8Å; D224-K228 PolarHBondContact O-N 2.87Å
225	L	89.8	Confident	89.9	Confident	11 Å²	11	73.1 Å²	73.1	6%	0.058	38%	0.38	C	S	.	.	H	α-helix	trans	-67.1	-37.4	174	-64.5	-179.5	0	0	0	111.9	V218 A219 D222 K228 F229 I235 E239	V218-L225 HydrophobicContact CG1-CD1 3.88Å; A219-L225 HydrophobicContact CB-CB 4.28Å; D222-L225 HydrophobicContact CB-CB 4.07Å; D222-L225 HydrophobicContact CB-CD1 3.98Å; D222-L225 HydrophobicContact CB-CG 4.06Å; D222-L225 PolarHBondContact O-N 3.22Å; D222-L225 PolarHBondContact OD1-N 3.36Å; D222-L225 VanDerWaalsContact OD1-N 3.12Å; L225-K228 PolarHBondContact O-N 3.05Å; L225-F229 WeakPolarHBondContact O-CB 3.47Å; L225-F229 PolarHBondContact O-N 3.21Å; L225-I235 HydrophobicContact CB-CD1 4.43Å; L225-I235 HydrophobicContact CD2-CD1 4.29Å; L225-I235 HydrophobicContact CD2-CG1 4.29Å; L225-I235 HydrophobicContact CD2-CG2 3.92Å; L225-E239 HydrophobicContact CD2-CB 4.13Å
226	M	90.8	Very high	89.9	Confident	73 Å²	73	75.7 Å²	75.7	36%	0.36	40%	0.396	S	S	.	.	H	α-helix	trans	-60.1	-45	174.6	-170.3	164.4	51	0	0	112.1	A219 D222 F229 L230	A219-M226 WeakPolarHBondContact O-CB 3.27Å; D222-M226 WeakPolarHBondContact O-CB 3.41Å; D222-M226 PolarHBondContact O-N 2.87Å; M226-F229 PolarHBondContact O-N 2.88Å; M226-L230 HydrophobicContact CG-CD1 4.02Å; M226-L230 HydrophobicContact CG-CG 4.43Å; M226-L230 WeakPolarHBondContact O-CB 3.23Å; M226-L230 VanDerWaalsContact O-CG 3.28Å; M226-L230 WeakPolarHBondContact O-CG 3.5Å; M226-L230 PolarHBondContact O-N 2.95Å
227	M	91	Very high	89.8	Confident	100 Å²	100	75.3 Å²	75.3	49%	0.493	39%	0.394	S	S	.	.	H	α-helix	trans	-60.9	-47.9	176.7	-78.6	-171.2	-76.3	0	0	111.6	E223 D224 F229 L230 E231	E223-M227 PolarHBondContact O-N 3.25Å; E223-M227 VanDerWaalsContact O-N 3.1Å; D224-M227 PolarHBondContact O-N 2.8Å; M227-F229 VanDerWaalsContact C-N 3.34Å; M227-F229 PolarHBondContact O-N 3.44Å; M227-L230 PolarHBondContact O-N 3.43Å; M227-E231 WeakPolarHBondContact O-CB 3.5Å; M227-E231 WeakPolarHBondContact O-CG 3.49Å; M227-E231 PolarHBondContact O-N 3.17Å
228	K	90.4	Very high	89.8	Confident	54 Å²	54	82.9 Å²	82.9	24%	0.235	43%	0.428	C	S	.	.	H	α-helix	trans	-58.2	-45.4	177.1	-74.6	-173	167.9	-167	0	112.5	D224 L225 E231 G232 E233 I235 E239	D224-K228 PolarHBondContact O-N 2.87Å; L225-K228 PolarHBondContact O-N 3.05Å; K228-E231 PolarHBondContact O-N 2.95Å; K228-G232 PolarHBondContact O-N 3.42Å; K228-G232 VanDerWaalsContact O-N 3.11Å; K228-E233 HydrophobicContact CB-CB 4.1Å; K228-E233 HydrophobicContact CG-CB 4.31Å; K228-E233 PolarHBondContact O-N 2.93Å; K228-I235 HydrophobicContact CB-CG1 4.17Å; K228-E239 VanDerWaalsContact NZ-CD 3.29Å; K228-E239 IonicContact NZ-OE1 3.45Å; K228-E239 PolarHBondContact NZ-OE1 2.96Å; K228-E239 IonicContact NZ-OE2 2.93Å; K228-E239 PolarHBondContact NZ-OE2 3.18Å
229	F	88.5	Confident	89.8	Confident	64 Å²	64	85.7 Å²	85.7	28%	0.281	44%	0.442	S	S	.	.	H	α-helix	trans	-61.3	-46.4	179.1	-177.6	-109.2	0	0	0	111.9	V215 E216 A219 L225 M226 M227 E231 G232 I235	V215-F229 HydrophobicContact CG1-CD2 3.65Å; V215-F229 HydrophobicContact CG1-CE2 4.03Å; E216-F229 HydrophobicContact CB-CE1 4.03Å; E216-F229 HydrophobicContact CB-CE2 4.48Å; E216-F229 HydrophobicContact CB-CZ 3.81Å; E216-F229 HydrophobicContact CG-CE1 3.97Å; E216-F229 HydrophobicContact CG-CZ 4.19Å; A219-F229 HydrophobicContact CB-CB 4.05Å; A219-F229 HydrophobicContact CB-CG 4.36Å; L225-F229 WeakPolarHBondContact O-CB 3.47Å; L225-F229 PolarHBondContact O-N 3.21Å; M226-F229 PolarHBondContact O-N 2.88Å; M227-F229 VanDerWaalsContact C-N 3.34Å; M227-F229 PolarHBondContact O-N 3.44Å; F229-E231 VanDerWaalsContact C-N 3.31Å; F229-E231 PolarHBondContact O-N 3.12Å; F229-G232 PolarHBondContact O-N 3.26Å; F229-G232 VanDerWaalsContact O-N 3.11Å; F229-I235 HydrophobicContact CB-CD1 4.31Å
230	L	89.9	Confident	89.8	Confident	135 Å²	135	85.7 Å²	85.7	71%	0.707	44%	0.441	S	S	*	.	H	α-helix	trans	-66.1	-31.9	178.3	-69.9	173.3	0	0	0	113.2	M226 M227 G232	M226-L230 HydrophobicContact CG-CD1 4.02Å; M226-L230 HydrophobicContact CG-CG 4.43Å; M226-L230 WeakPolarHBondContact O-CB 3.23Å; M226-L230 VanDerWaalsContact O-CG 3.28Å; M226-L230 WeakPolarHBondContact O-CG 3.5Å; M226-L230 PolarHBondContact O-N 2.95Å; M227-L230 PolarHBondContact O-N 3.43Å; L230-G232 VanDerWaalsContact C-N 3.26Å
231	E	90.4	Very high	90	Very high	140 Å²	140	82.6 Å²	82.6	65%	0.654	42%	0.422	S	S	*	.	H	α-helix	trans	-80	-7.7	176	-69.4	-177.3	170.1	0	0	113	M227 K228 F229 E233	M227-E231 WeakPolarHBondContact O-CB 3.5Å; M227-E231 WeakPolarHBondContact O-CG 3.49Å; M227-E231 PolarHBondContact O-N 3.17Å; K228-E231 PolarHBondContact O-N 2.95Å; F229-E231 VanDerWaalsContact C-N 3.31Å; F229-E231 PolarHBondContact O-N 3.12Å; E231-E233 VanDerWaalsContact C-N 3.27Å; E231-E233 HydrophobicContact CB-CG 4.22Å
232	G	86.1	Confident	90.3	Very high	70 Å²	70	82.2 Å²	82.2	72%	0.722	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.3	22.3	-175.8	0	0	0	0	0	113.1	K228 F229 L230	K228-G232 PolarHBondContact O-N 3.42Å; K228-G232 VanDerWaalsContact O-N 3.11Å; F229-G232 PolarHBondContact O-N 3.26Å; F229-G232 VanDerWaalsContact O-N 3.11Å; L230-G232 VanDerWaalsContact C-N 3.26Å
233	E	87.6	Confident	90.5	Very high	104 Å²	104	80.1 Å²	80.1	49%	0.486	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-75.5	140.6	172.2	-64.7	-161.5	156.9	0	0	110.7	K228 E231 I235	K228-E233 HydrophobicContact CB-CB 4.1Å; K228-E233 HydrophobicContact CG-CB 4.31Å; K228-E233 PolarHBondContact O-N 2.93Å; E231-E233 VanDerWaalsContact C-N 3.27Å; E231-E233 HydrophobicContact CB-CG 4.22Å; E233-I235 PolarHBondContact O-N 2.77Å
234	E	82.9	Confident	90.9	Very high	167 Å²	167	72.6 Å²	72.6	78%	0.78	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-72.8	120.5	179.5	-166.6	175.6	-173.9	0	0	110.3
235	I	88.4	Confident	91.2	Very high	14 Å²	14	69.4 Å²	69.4	7%	0.072	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-80.4	123.1	174.2	-66.5	165.6	0	0	0	108.7	V215 L225 K228 F229 E233 E239 L240	V215-I235 HydrophobicContact CG1-CD1 3.51Å; L225-I235 HydrophobicContact CB-CD1 4.43Å; L225-I235 HydrophobicContact CD2-CD1 4.29Å; L225-I235 HydrophobicContact CD2-CG1 4.29Å; L225-I235 HydrophobicContact CD2-CG2 3.92Å; K228-I235 HydrophobicContact CB-CG1 4.17Å; F229-I235 HydrophobicContact CB-CD1 4.31Å; E233-I235 PolarHBondContact O-N 2.77Å; I235-E239 HydrophobicContact CG2-CB 3.91Å; I235-L240 HydrophobicContact CG2-CB 4.02Å
236	T	92	Very high	91.5	Very high	71 Å²	71	73 Å²	73	44%	0.436	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-71.3	159.9	-177.7	63.2	0	0	0	0	112.1	E238 E239 L240	T236-E238 VanDerWaalsContact C-N 3.28Å; T236-E238 PolarHBondContact O-N 2.93Å; T236-E239 PolarHBondContact N-OE2 2.84Å; T236-E239 PolarHBondContact O-N 2.86Å; T236-E239 WeakPolarHBondContact OG1-CB 3.14Å; T236-E239 WeakPolarHBondContact OG1-CG 3.35Å; T236-E239 PolarHBondContact OG1-N 2.88Å; T236-E239 PolarHBondContact OG1-OE2 2.81Å; T236-L240 WeakPolarHBondContact O-CB 3.21Å; T236-L240 PolarHBondContact O-N 3.43Å
237	E	91.8	Very high	91.7	Very high	85 Å²	85	69.8 Å²	69.8	40%	0.397	36%	0.362	S	S	.	.	H	α-helix	trans	-55.8	-42.9	177.3	-169.3	-168.4	148.1	0	0	111.9	V179 K180 L240 K241	V179-E237 HydrophobicContact CG1-CG 3.83Å; K180-E237 WeakPolarHBondContact CG-OE1 3.38Å; E237-L240 PolarHBondContact O-N 2.83Å; E237-K241 WeakPolarHBondContact O-CB 3.28Å; E237-K241 WeakPolarHBondContact O-CG 3.43Å; E237-K241 PolarHBondContact O-N 2.77Å; E237-K241 IonicContact OE1-NZ 3.62Å
238	E	92.5	Very high	91.9	Very high	165 Å²	165	65 Å²	65	77%	0.771	34%	0.339	S	S	*	.	H	α-helix	trans	-65.5	-42.6	179.8	-68.5	-170.2	162.1	0	0	112	T236 K241 A242	T236-E238 VanDerWaalsContact C-N 3.28Å; T236-E238 PolarHBondContact O-N 2.93Å; E238-K241 PolarHBondContact O-N 3.13Å; E238-A242 WeakPolarHBondContact O-CB 3.24Å; E238-A242 PolarHBondContact O-N 3.01Å
239	E	92.9	Very high	92.1	Very high	61 Å²	61	64.5 Å²	64.5	29%	0.285	34%	0.338	S	S	.	.	H	α-helix	trans	-65.5	-43.6	177.1	-73.3	169.7	147.1	0	0	111.4	L225 K228 I235 T236 A242 G243	L225-E239 HydrophobicContact CD2-CB 4.13Å; K228-E239 VanDerWaalsContact NZ-CD 3.29Å; K228-E239 IonicContact NZ-OE1 3.45Å; K228-E239 PolarHBondContact NZ-OE1 2.96Å; K228-E239 IonicContact NZ-OE2 2.93Å; K228-E239 PolarHBondContact NZ-OE2 3.18Å; I235-E239 HydrophobicContact CG2-CB 3.91Å; T236-E239 PolarHBondContact N-OE2 2.84Å; T236-E239 PolarHBondContact O-N 2.86Å; T236-E239 WeakPolarHBondContact OG1-CB 3.14Å; T236-E239 WeakPolarHBondContact OG1-CG 3.35Å; T236-E239 PolarHBondContact OG1-N 2.88Å; T236-E239 PolarHBondContact OG1-OE2 2.81Å; E239-A242 PolarHBondContact O-N 2.88Å; E239-G243 PolarHBondContact O-N 2.81Å
240	L	93.7	Very high	92.3	Very high	1 Å²	1	64 Å²	64	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-43.9	177	-175	58.9	0	0	0	111	V179 L214 V215 V218 I235 T236 E237 A242 G243 I244	V179-L240 HydrophobicContact CG1-CD2 4.26Å; V179-L240 HydrophobicContact CG2-CD2 4.41Å; L214-L240 HydrophobicContact CD2-CD2 4.47Å; V215-L240 HydrophobicContact CG2-CD1 4.18Å; V215-L240 HydrophobicContact CG2-CD2 4.16Å; V218-L240 HydrophobicContact CB-CD1 4.19Å; V218-L240 HydrophobicContact CG1-CD1 4.2Å; V218-L240 HydrophobicContact CG2-CD1 4.21Å; I235-L240 HydrophobicContact CG2-CB 4.02Å; T236-L240 WeakPolarHBondContact O-CB 3.21Å; T236-L240 PolarHBondContact O-N 3.43Å; E237-L240 PolarHBondContact O-N 2.83Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.03Å; L240-G243 PolarHBondContact O-N 3.4Å; L240-I244 HydrophobicContact CD1-CD1 4.3Å; L240-I244 HydrophobicContact CD1-CG1 4.42Å; L240-I244 HydrophobicContact CG-CD1 4Å; L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 2.81Å; L240-I244 PolarHBondContact O-N 2.71Å
241	K	94.9	Very high	92.5	Very high	49 Å²	49	58.7 Å²	58.7	21%	0.213	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-43	175	-78.6	-166.5	174.6	-157.9	0	112.3	V179 E237 E238 R245 D276 Y277	V179-K241 HydrophobicContact CG1-CG 3.71Å; E237-K241 WeakPolarHBondContact O-CB 3.28Å; E237-K241 WeakPolarHBondContact O-CG 3.43Å; E237-K241 PolarHBondContact O-N 2.77Å; E237-K241 IonicContact OE1-NZ 3.62Å; E238-K241 PolarHBondContact O-N 3.13Å; K241-R245 WeakPolarHBondContact O-CB 3.41Å; K241-R245 PolarHBondContact O-N 2.74Å; K241-D276 IonicContact NZ-OD2 2.86Å; K241-D276 PolarHBondContact NZ-OD2 3.46Å; K241-Y277 HydrophobicContact CB-CE1 4.38Å; K241-Y277 HydrophobicContact CG-CE1 4.36Å
242	A	94.2	Very high	92.6	Very high	46 Å²	46	56.8 Å²	56.8	38%	0.38	31%	0.313	S	S	.	.	H	α-helix	trans	-64	-43.5	177.3	0	0	0	0	0	111.6	E238 E239 L240 R245 N246	E238-A242 WeakPolarHBondContact O-CB 3.24Å; E238-A242 PolarHBondContact O-N 3.01Å; E239-A242 PolarHBondContact O-N 2.88Å; L240-A242 VanDerWaalsContact C-N 3.35Å; L240-A242 PolarHBondContact O-N 3.03Å; A242-R245 PolarHBondContact O-N 2.79Å; A242-N246 WeakPolarHBondContact O-CB 2.85Å; A242-N246 PolarHBondContact O-N 3.31Å; A242-N246 PolarHBondContact O-ND2 2.68Å
243	G	94.8	Very high	93	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-50.5	175	0	0	0	0	0	112.2	E239 L240 R245 N246 A247	E239-G243 PolarHBondContact O-N 2.81Å; L240-G243 PolarHBondContact O-N 3.4Å; G243-R245 VanDerWaalsContact C-N 3.29Å; G243-R245 PolarHBondContact O-N 2.83Å; G243-N246 PolarHBondContact O-N 3.03Å; G243-A247 WeakPolarHBondContact O-CB 3.49Å; G243-A247 PolarHBondContact O-N 3.21Å
244	I	96.2	Very high	93.4	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.8	-45.5	176	-66.6	165	0	0	0	110.4	I162 V179 L214 V218 L240 T248 F253 P255 Y277	I162-I244 HydrophobicContact CG2-CD1 4.09Å; V179-I244 HydrophobicContact CG2-CD1 3.86Å; L214-I244 HydrophobicContact CD1-CD1 4.37Å; V218-I244 HydrophobicContact CG1-CG1 4.38Å; V218-I244 HydrophobicContact CG2-CG1 3.53Å; L240-I244 HydrophobicContact CD1-CD1 4.3Å; L240-I244 HydrophobicContact CD1-CG1 4.42Å; L240-I244 HydrophobicContact CG-CD1 4Å; L240-I244 VanDerWaalsContact O-CG1 3.24Å; L240-I244 WeakPolarHBondContact O-CG1 2.81Å; L240-I244 PolarHBondContact O-N 2.71Å; I244-T248 VanDerWaalsContact O-CB 3.29Å; I244-T248 WeakPolarHBondContact O-CB 3.5Å; I244-T248 PolarHBondContact O-N 2.95Å; I244-T248 PolarHBondContact O-OG1 2.82Å; I244-F253 HydrophobicContact CG2-CD1 4.38Å; I244-F253 HydrophobicContact CG2-CE1 4.05Å; I244-P255 HydrophobicContact CG2-CB 4.38Å; I244-P255 HydrophobicContact CG2-CG 3.71Å; I244-Y277 HydrophobicContact CB-CD1 3.98Å; I244-Y277 HydrophobicContact CB-CE1 3.73Å; I244-Y277 HydrophobicContact CD1-CE1 4.36Å; I244-Y277 HydrophobicContact CG2-CD1 3.47Å; I244-Y277 VanDerWaalsContact CG2-CD1 3.47Å; I244-Y277 HydrophobicContact CG2-CD2 4.33Å; I244-Y277 HydrophobicContact CG2-CE1 3.52Å; I244-Y277 HydrophobicContact CG2-CE2 4.39Å; I244-Y277 HydrophobicContact CG2-CG 3.9Å
245	R	96.6	Very high	94.1	Very high	47 Å²	47	41.2 Å²	41.2	18%	0.177	22%	0.221	C	C	.	.	H	α-helix	trans	-59.7	-53	178.2	-178.6	178.6	-175.7	72.5	7.6	110.9	K241 A242 G243 A247 T248 L249 I275 D276 Y277 L278 D283	K241-R245 WeakPolarHBondContact O-CB 3.41Å; K241-R245 PolarHBondContact O-N 2.74Å; A242-R245 PolarHBondContact O-N 2.79Å; G243-R245 VanDerWaalsContact C-N 3.29Å; G243-R245 PolarHBondContact O-N 2.83Å; R245-A247 VanDerWaalsContact C-N 3.33Å; R245-A247 PolarHBondContact O-N 2.8Å; R245-T248 PolarHBondContact O-N 2.98Å; R245-L249 HydrophobicContact CG-CD1 3.89Å; R245-L249 HydrophobicContact CG-CG 4.24Å; R245-L249 VanDerWaalsContact O-CG 3.24Å; R245-L249 WeakPolarHBondContact O-CG 3.43Å; R245-L249 PolarHBondContact O-N 3.33Å; R245-I275 PolarHBondContact NH1-O 3.31Å; R245-D276 WeakPolarHBondContact CD-O 3.17Å; R245-D276 VanDerWaalsContact NH1-C 3.33Å; R245-D276 PolarHBondContact NH1-O 2.99Å; R245-Y277 HydrophobicContact CB-CD1 4.23Å; R245-L278 PolarHBondContact NH1-O 3.11Å; R245-L278 PolarHBondContact NH2-O 3.41Å; R245-L278 VanDerWaalsContact NH2-O 3.14Å; R245-D283 IonicContact CZ-OD2 2.74Å; R245-D283 IonicContact NH2-OD2 3.74Å; R245-D283 PolarHBondContact NH2-OD2 3.24Å
246	N	95.1	Very high	94.6	Very high	87 Å²	87	40.6 Å²	40.6	47%	0.465	22%	0.218	S	C	.	.	H	α-helix	trans	-58.4	-45.7	-177.9	-69.6	-16.8	0	0	0	111.5	A242 G243 T248 L249 A250	A242-N246 WeakPolarHBondContact O-CB 2.85Å; A242-N246 PolarHBondContact O-N 3.31Å; A242-N246 PolarHBondContact O-ND2 2.68Å; G243-N246 PolarHBondContact O-N 3.03Å; N246-T248 VanDerWaalsContact C-N 3.35Å; N246-T248 PolarHBondContact O-N 3.11Å; N246-L249 PolarHBondContact O-N 3.38Å; N246-A250 WeakPolarHBondContact O-CB 2.9Å; N246-A250 PolarHBondContact O-N 2.95Å
247	A	94.9	Very high	94.9	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.033	20%	0.197	C	C	.	.	H	α-helix	trans	-65.6	-36.9	178.3	0	0	0	0	0	112.7	T221 G243 R245 A250 V251 D252 F253	T221-A247 HydrophobicContact CG2-CB 4.06Å; T221-A247 WeakPolarHBondContact OG1-CB 3.18Å; G243-A247 WeakPolarHBondContact O-CB 3.49Å; G243-A247 PolarHBondContact O-N 3.21Å; R245-A247 VanDerWaalsContact C-N 3.33Å; R245-A247 PolarHBondContact O-N 2.8Å; A247-A250 PolarHBondContact O-N 2.64Å; A247-V251 PolarHBondContact O-N 3.04Å; A247-D252 PolarHBondContact O-N 3.48Å; A247-D252 VanDerWaalsContact O-N 3.14Å; A247-F253 HydrophobicContact CB-CB 3.47Å; A247-F253 VanDerWaalsContact CB-CB 3.47Å; A247-F253 HydrophobicContact CB-CG 4.21Å; A247-F253 PolarHBondContact O-N 3.22Å
248	T	96.4	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-44.6	175	-56	0	0	0	0	111.1	P129 I244 R245 N246 A250 V251 F253 P255 L278	P129-T248 HydrophobicContact CB-CG2 4.45Å; P129-T248 WeakPolarHBondContact CB-O 3.47Å; I244-T248 VanDerWaalsContact O-CB 3.29Å; I244-T248 WeakPolarHBondContact O-CB 3.5Å; I244-T248 PolarHBondContact O-N 2.95Å; I244-T248 PolarHBondContact O-OG1 2.82Å; R245-T248 PolarHBondContact O-N 2.98Å; N246-T248 VanDerWaalsContact C-N 3.35Å; N246-T248 PolarHBondContact O-N 3.11Å; T248-A250 VanDerWaalsContact C-N 3.3Å; T248-A250 PolarHBondContact O-N 2.77Å; T248-V251 PolarHBondContact O-N 2.85Å; T248-V251 VanDerWaalsContact O-N 3.12Å; T248-F253 WeakPolarHBondContact CA-O 3.4Å; T248-P255 HydrophobicContact CG2-CG 4.35Å; T248-P255 WeakPolarHBondContact OG1-CD 3.1Å; T248-P255 VanDerWaalsContact OG1-CG 3.23Å; T248-P255 WeakPolarHBondContact OG1-CG 3.27Å; T248-L278 HydrophobicContact CG2-CD2 4.45Å
249	L	94.9	Very high	95.1	Very high	43 Å²	43	25.3 Å²	25.3	23%	0.225	14%	0.142	C	C	.	.	H	α-helix	trans	-64.6	-34.4	177.5	-67	177.4	0	0	0	112.4	R245 N246 V251 P279 D283	R245-L249 HydrophobicContact CG-CD1 3.89Å; R245-L249 HydrophobicContact CG-CG 4.24Å; R245-L249 VanDerWaalsContact O-CG 3.24Å; R245-L249 WeakPolarHBondContact O-CG 3.43Å; R245-L249 PolarHBondContact O-N 3.33Å; N246-L249 PolarHBondContact O-N 3.38Å; L249-V251 PolarHBondContact O-N 3.46Å; L249-P279 HydrophobicContact CD2-CB 3.47Å; L249-P279 VanDerWaalsContact CD2-CB 3.47Å; L249-P279 HydrophobicContact CD2-CG 4.04Å; L249-D283 HydrophobicContact CD1-CB 4.28Å; L249-D283 HydrophobicContact CD2-CB 4.24Å
250	A	93.1	Very high	95.2	Very high	54 Å²	54	22.4 Å²	22.4	45%	0.446	13%	0.128	S	C	.	.	H	α-helix	trans	-73.6	-12.2	175.4	0	0	0	0	0	113.5	N246 A247 T248 D252	N246-A250 WeakPolarHBondContact O-CB 2.9Å; N246-A250 PolarHBondContact O-N 2.95Å; A247-A250 PolarHBondContact O-N 2.64Å; T248-A250 VanDerWaalsContact C-N 3.3Å; T248-A250 PolarHBondContact O-N 2.77Å; A250-D252 HydrophobicContact CB-CB 4.43Å; A250-D252 WeakPolarHBondContact CB-OD2 3.35Å; A250-D252 PolarHBondContact O-N 3.35Å
251	V	93.2	Very high	95.1	Very high	24 Å²	24	22.3 Å²	22.3	15%	0.145	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	21.8	-177.2	-163.8	0	0	0	0	112.4	R127 P129 A247 T248 L249 Y254	R127-V251 HydrophobicContact CB-CG2 4.49Å; P129-V251 HydrophobicContact CG-CG2 4.08Å; A247-V251 PolarHBondContact O-N 3.04Å; T248-V251 PolarHBondContact O-N 2.85Å; T248-V251 VanDerWaalsContact O-N 3.12Å; L249-V251 PolarHBondContact O-N 3.46Å; V251-Y254 HydrophobicContact CG1-CE1 4.22Å; V251-Y254 WeakPolarHBondContact CG1-OH 3.39Å; V251-Y254 PolarHBondContact O-OH 2.89Å
252	D	91.9	Very high	94.7	Very high	99 Å²	99	24.7 Å²	24.7	53%	0.529	14%	0.138	S	C	.	.	S	Bend	trans	-99.9	-13.5	-179.6	-67.3	-32.7	0	0	0	112.9	N158 A247 A250	N158-D252 VanDerWaalsContact CB-O 3.26Å; N158-D252 WeakPolarHBondContact CB-O 3.35Å; N158-D252 PolarHBondContact ND2-O 2.91Å; A247-D252 PolarHBondContact O-N 3.48Å; A247-D252 VanDerWaalsContact O-N 3.14Å; A250-D252 HydrophobicContact CB-CB 4.43Å; A250-D252 WeakPolarHBondContact CB-OD2 3.35Å; A250-D252 PolarHBondContact O-N 3.35Å
253	F	95	Very high	94.4	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.138	C	C	.	.			trans	-141.8	144.3	179.6	-178.3	-90.4	0	0	0	110.9	N158 H160 L214 A217 V218 I244 A247 T248 P255	N158-F253 WeakPolarHBondContact O-CA 3.47Å; H160-F253 HydrophobicContact CB-CE2 3.61Å; H160-F253 HydrophobicContact CB-CZ 3.68Å; H160-F253 AromaticContact CD2-CE2 3.73Å; H160-F253 AromaticContact CG-CE2 3.88Å; L214-F253 HydrophobicContact CD1-CE2 4.42Å; L214-F253 HydrophobicContact CD1-CZ 3.68Å; A217-F253 HydrophobicContact CB-CD2 4.49Å; A217-F253 HydrophobicContact CB-CE2 3.97Å; V218-F253 HydrophobicContact CG2-CE2 4.12Å; V218-F253 HydrophobicContact CG2-CZ 4.09Å; I244-F253 HydrophobicContact CG2-CD1 4.38Å; I244-F253 HydrophobicContact CG2-CE1 4.05Å; A247-F253 HydrophobicContact CB-CB 3.47Å; A247-F253 VanDerWaalsContact CB-CB 3.47Å; A247-F253 HydrophobicContact CB-CG 4.21Å; A247-F253 PolarHBondContact O-N 3.22Å; T248-F253 WeakPolarHBondContact CA-O 3.4Å; F253-P255 HydrophobicContact CD1-CG 4Å; F253-P255 HydrophobicContact CE1-CB 4.2Å; F253-P255 HydrophobicContact CE1-CG 3.85Å
254	Y	96.7	Very high	94.1	Very high	15 Å²	15	27.2 Å²	27.2	6%	0.059	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	102.7	-178.2	-57	-84.1	0	0	0	110.9	W120 R130 A157 N158 A159 H160 V251 V256	W120-Y254 AromaticContact CH2-CD1 3.47Å; W120-Y254 HydrophobicContact CH2-CD1 3.47Å; W120-Y254 VanDerWaalsContact CH2-CD1 3.47Å; W120-Y254 HydrophobicContact CH2-CD2 4.12Å; W120-Y254 AromaticContact CH2-CE1 3.79Å; W120-Y254 HydrophobicContact CH2-CE1 3.79Å; W120-Y254 HydrophobicContact CH2-CE2 4.44Å; W120-Y254 AromaticContact CH2-CG 3.63Å; W120-Y254 HydrophobicContact CH2-CG 3.63Å; W120-Y254 AromaticContact CZ2-CD1 3.78Å; W120-Y254 HydrophobicContact CZ2-CD1 3.78Å; W120-Y254 AromaticContact CZ2-CD2 3.91Å; W120-Y254 HydrophobicContact CZ2-CD2 3.91Å; W120-Y254 AromaticContact CZ2-CE1 3.66Å; W120-Y254 HydrophobicContact CZ2-CE1 3.66Å; W120-Y254 AromaticContact CZ2-CE2 3.84Å; W120-Y254 HydrophobicContact CZ2-CE2 3.84Å; W120-Y254 AromaticContact CZ2-CG 3.88Å; W120-Y254 HydrophobicContact CZ2-CG 3.88Å; W120-Y254 AromaticContact CZ2-CZ 3.69Å; R130-Y254 HydrophobicContact CB-CD1 3.86Å; R130-Y254 HydrophobicContact CB-CE1 4.06Å; R130-Y254 PolarHBondContact NH2-OH 2.65Å; A157-Y254 HydrophobicContact CB-CD2 4.09Å; A157-Y254 HydrophobicContact CB-CE2 4.37Å; N158-Y254 PolarHBondContact O-N 3.38Å; A159-Y254 VanDerWaalsContact CA-O 3.27Å; A159-Y254 WeakPolarHBondContact CA-O 3.47Å; H160-Y254 PolarHBondContact N-O 3.26Å; V251-Y254 HydrophobicContact CG1-CE1 4.22Å; V251-Y254 WeakPolarHBondContact CG1-OH 3.39Å; V251-Y254 PolarHBondContact O-OH 2.89Å; Y254-V256 PolarHBondContact O-N 2.89Å
255	P	97.7	Very high	94	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	127.8	178.4	-18.5	29	0	0	0	111.3	I131 V132 I162 I244 T248 F253	I131-P255 HydrophobicContact CG2-CB 4.25Å; I131-P255 HydrophobicContact CG2-CG 4.04Å; V132-P255 PolarHBondContact N-O 2.88Å; I162-P255 HydrophobicContact CD1-CB 3.95Å; I162-P255 HydrophobicContact CG1-CB 4.2Å; I162-P255 HydrophobicContact CG2-CB 4Å; I244-P255 HydrophobicContact CG2-CB 4.38Å; I244-P255 HydrophobicContact CG2-CG 3.71Å; T248-P255 HydrophobicContact CG2-CG 4.35Å; T248-P255 WeakPolarHBondContact OG1-CD 3.1Å; T248-P255 VanDerWaalsContact OG1-CG 3.23Å; T248-P255 WeakPolarHBondContact OG1-CG 3.27Å; F253-P255 HydrophobicContact CD1-CG 4Å; F253-P255 HydrophobicContact CE1-CB 4.2Å; F253-P255 HydrophobicContact CE1-CG 3.85Å
256	V	97.8	Very high	93.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	126.6	178.5	-167.7	0	0	0	0	111	V132 F144 V148 L151 A159 H160 I162 Y254	V132-V256 HydrophobicContact CB-CB 4.43Å; V132-V256 HydrophobicContact CB-CG1 4.14Å; V132-V256 HydrophobicContact CB-CG2 4.17Å; V132-V256 HydrophobicContact CG1-CG1 4.17Å; F144-V256 HydrophobicContact CE2-CG1 3.75Å; F144-V256 HydrophobicContact CZ-CB 4.44Å; F144-V256 HydrophobicContact CZ-CG1 3.9Å; V148-V256 HydrophobicContact CG2-CB 4.44Å; V148-V256 HydrophobicContact CG2-CG1 3.93Å; L151-V256 HydrophobicContact CD1-CG1 4.45Å; L151-V256 HydrophobicContact CD1-CG2 3.87Å; A159-V256 HydrophobicContact CB-CG2 3.77Å; H160-V256 PolarHBondContact O-N 3.22Å; I162-V256 WeakPolarHBondContact CG1-O 3.44Å; I162-V256 PolarHBondContact N-O 2.72Å; Y254-V256 PolarHBondContact O-N 2.89Å
257	L	97.7	Very high	93.7	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	159.4	178.9	-62.4	101.2	0	0	0	110.8	I131 V132 F133 C134 I162 M270 A273	I131-L257 HydrophobicContact CB-CD1 4.12Å; I131-L257 HydrophobicContact CD1-CD1 4.17Å; I131-L257 HydrophobicContact CG1-CD1 4.49Å; V132-L257 WeakPolarHBondContact O-CD1 3.12Å; V132-L257 PolarHBondContact O-N 2.73Å; F133-L257 HydrophobicContact CD2-CB 4.12Å; C134-L257 WeakPolarHBondContact CB-O 3.33Å; C134-L257 PolarHBondContact N-O 3.33Å; I162-L257 HydrophobicContact CD1-CD1 4.08Å; I162-L257 HydrophobicContact CD1-CD2 4.07Å; I162-L257 HydrophobicContact CD1-CG 3.84Å; I162-L257 HydrophobicContact CG1-CD1 4.44Å; I162-L257 HydrophobicContact CG1-CG 3.98Å; L257-M270 HydrophobicContact CD2-CB 4.48Å; L257-A273 HydrophobicContact CD1-CB 4.14Å; L257-A273 HydrophobicContact CD2-CB 3.59Å; L257-A273 HydrophobicContact CG-CB 4.48Å
258	C	95.6	Very high	93.5	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152.3	176.8	63.3	0	0	0	0	111.9	M137 F144 I175	M137-C258 HydrophobicContact CG-CB 4.26Å; F144-C258 HydrophobicContact CD2-CB 3.53Å; F144-C258 HydrophobicContact CE2-CB 3.6Å; F144-C258 HydrophobicContact CG-CB 4.23Å; F144-C258 HydrophobicContact CZ-CB 4.35Å; I175-C258 VanDerWaalsContact CD1-O 3.28Å; I175-C258 WeakPolarHBondContact CD1-O 3.31Å
259	G	94.8	Very high	93.4	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.			trans	176.1	-175.7	174	0	0	0	0	0	114.7	C134 N135 K136 M137 K265	C134-G259 PolarHBondContact O-N 3.45Å; N135-G259 CarbonylContact C-O 3.47Å; N135-G259 WeakPolarHBondContact CA-O 3.49Å; K136-G259 PolarHBondContact N-O 3.27Å; M137-G259 WeakPolarHBondContact CB-O 3.39Å; M137-G259 WeakPolarHBondContact CG-O 3.36Å; M137-G259 PolarHBondContact N-O 3.41Å; M137-G259 VanDerWaalsContact N-O 3.17Å; G259-K265 WeakPolarHBondContact CA-O 3.29Å
260	S	94.2	Very high	93.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-133.6	107.5	170.7	172.8	0	0	0	0	109	D138 F262 K263 N264 K265	D138-S260 WeakPolarHBondContact OD1-CB 3.4Å; D138-S260 PolarHBondContact OD1-OG 3.02Å; S260-F262 PolarHBondContact O-N 3.42Å; S260-F262 PolarHBondContact OG-N 3.13Å; S260-K263 PolarHBondContact O-N 3.02Å; S260-K263 WeakPolarHBondContact OG-CB 3.47Å; S260-K263 PolarHBondContact OG-N 3.33Å; S260-N264 PolarHBondContact O-N 3.37Å; S260-N264 VanDerWaalsContact O-N 3.09Å; S260-K265 CarbonylContact C-O 3.53Å; S260-K265 PolarHBondContact N-O 3.44Å; S260-K265 PolarHBondContact O-N 2.86Å
261	A	91.4	Very high	93.5	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-31.3	172.8	0	0	0	0	0	111.6	T25 T26 R29 N135 V267	T25-A261 HydrophobicContact CG2-CB 4.19Å; T26-A261 WeakPolarHBondContact OG1-CB 3.39Å; R29-A261 VanDerWaalsContact CD-O 3.24Å; R29-A261 WeakPolarHBondContact CD-O 3.36Å; R29-A261 HydrophobicContact CG-CB 4.1Å; R29-A261 WeakPolarHBondContact CG-O 3.25Å; N135-A261 WeakPolarHBondContact OD1-CB 3.46Å; N135-A261 PolarHBondContact OD1-N 3.15Å; A261-V267 HydrophobicContact CB-CG2 4.18Å
262	F	87	Confident	93.6	Very high	99 Å²	99	19.5 Å²	19.5	43%	0.434	9%	0.092	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-46.3	178.5	-178	-112.8	0	0	0	112	S260 N264	S260-F262 PolarHBondContact O-N 3.42Å; S260-F262 PolarHBondContact OG-N 3.13Å; F262-N264 VanDerWaalsContact C-N 3.26Å; F262-N264 PolarHBondContact O-N 2.91Å
263	K	87.3	Confident	93.8	Very high	84 Å²	84	15 Å²	15	37%	0.365	7%	0.069	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	10.7	179	-63.7	-69	-171.9	169.5	0	114.1	D138 S260 K265	D138-K263 HydrophobicContact CB-CG 3.61Å; D138-K263 WeakPolarHBondContact OD2-CG 3.39Å; S260-K263 PolarHBondContact O-N 3.02Å; S260-K263 WeakPolarHBondContact OG-CB 3.47Å; S260-K263 PolarHBondContact OG-N 3.33Å; K263-K265 VanDerWaalsContact C-N 3.34Å; K263-K265 WeakPolarHBondContact O-CG 3.43Å; K263-K265 PolarHBondContact O-N 3.4Å
264	N	89.4	Confident	93.9	Very high	15 Å²	15	15 Å²	15	8%	0.08	7%	0.069	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	36.4	175.1	-61.4	-51.9	0	0	0	113.2	R29 Y33 D189 G191 S260 F262	R29-N264 WeakPolarHBondContact CD-OD1 3.48Å; R29-N264 PolarHBondContact NH1-OD1 2.93Å; Y33-N264 VanDerWaalsContact OH-CA 3.23Å; Y33-N264 WeakPolarHBondContact OH-CA 3.42Å; Y33-N264 WeakPolarHBondContact OH-CB 3.23Å; Y33-N264 PolarHBondContact OH-O 2.67Å; Y33-N264 VanDerWaalsContact OH-O 3.06Å; D189-N264 WeakPolarHBondContact O-CB 3.46Å; D189-N264 PolarHBondContact O-ND2 3.48Å; G191-N264 WeakPolarHBondContact CA-O 3.07Å; S260-N264 PolarHBondContact O-N 3.37Å; S260-N264 VanDerWaalsContact O-N 3.09Å; F262-N264 VanDerWaalsContact C-N 3.26Å; F262-N264 PolarHBondContact O-N 2.91Å
265	K	92.6	Very high	93.8	Very high	26 Å²	26	14.8 Å²	14.8	11%	0.113	7%	0.069	C	C	.	.	B	Isolated β-bridge	trans	-121.8	132	-178.8	-58.5	-179.3	-172.8	175.9	0	111.1	F172 Y186 G259 S260 K263 V267	F172-K265 HydrophobicContact CD1-CD 3.98Å; F172-K265 HydrophobicContact CE1-CB 3.76Å; F172-K265 HydrophobicContact CE1-CD 3.99Å; F172-K265 HydrophobicContact CE1-CG 4.48Å; F172-K265 HydrophobicContact CZ-CB 4.43Å; F172-K265 PolarHBondContact O-NZ 2.73Å; Y186-K265 HydrophobicContact CD1-CB 4.15Å; Y186-K265 HydrophobicContact CD1-CG 3.82Å; Y186-K265 HydrophobicContact CD2-CB 4.15Å; Y186-K265 HydrophobicContact CD2-CD 4.34Å; Y186-K265 HydrophobicContact CD2-CG 4.08Å; Y186-K265 HydrophobicContact CE1-CB 4.17Å; Y186-K265 HydrophobicContact CE1-CG 4.34Å; Y186-K265 HydrophobicContact CE2-CB 4.21Å; Y186-K265 HydrophobicContact CG-CB 4.15Å; Y186-K265 HydrophobicContact CG-CD 4.13Å; Y186-K265 HydrophobicContact CG-CG 3.68Å; G259-K265 WeakPolarHBondContact CA-O 3.29Å; S260-K265 CarbonylContact C-O 3.53Å; S260-K265 PolarHBondContact N-O 3.44Å; S260-K265 PolarHBondContact O-N 2.86Å; K263-K265 VanDerWaalsContact C-N 3.34Å; K263-K265 WeakPolarHBondContact O-CG 3.43Å; K263-K265 PolarHBondContact O-N 3.4Å; K265-V267 VanDerWaalsContact C-N 3.34Å; K265-V267 PolarHBondContact O-N 2.67Å
266	G	92.7	Very high	93.7	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.01	8%	0.083	C	C	.	.	S	Bend	trans	85.3	-17	174	0	0	0	0	0	116.6	Y186 Q268 L269 M270	Y186-G266 VanDerWaalsContact CZ-N 3.35Å; Y186-G266 WeakPolarHBondContact OH-CA 3.29Å; Y186-G266 PolarHBondContact OH-N 2.83Å; G266-Q268 VanDerWaalsContact C-N 3.31Å; G266-Q268 PolarHBondContact O-N 3.18Å; G266-L269 WeakPolarHBondContact O-CB 3.25Å; G266-L269 PolarHBondContact O-N 3.31Å; G266-M270 PolarHBondContact O-N 2.99Å
267	V	92.8	Very high	93.7	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.6	-34.9	-178.7	-179.8	0	0	0	0	112.5	R29 V30 Y33 F133 A261 K265 M270 L271	R29-V267 HydrophobicContact CB-CB 4.26Å; R29-V267 HydrophobicContact CB-CG1 3.8Å; R29-V267 HydrophobicContact CB-CG2 3.95Å; R29-V267 HydrophobicContact CG-CG2 4.19Å; V30-V267 HydrophobicContact CG2-CG1 3.8Å; Y33-V267 HydrophobicContact CD2-CB 4.1Å; Y33-V267 HydrophobicContact CD2-CG1 3.95Å; Y33-V267 HydrophobicContact CE2-CB 3.83Å; Y33-V267 HydrophobicContact CE2-CG1 4.14Å; Y33-V267 HydrophobicContact CE2-CG2 4.5Å; F133-V267 HydrophobicContact CZ-CG2 4.35Å; A261-V267 HydrophobicContact CB-CG2 4.18Å; K265-V267 VanDerWaalsContact C-N 3.34Å; K265-V267 PolarHBondContact O-N 2.67Å; V267-M270 HydrophobicContact CG1-CE 4.17Å; V267-M270 PolarHBondContact O-N 2.84Å; V267-L271 PolarHBondContact O-N 3.42Å
268	Q	92.3	Very high	93.7	Very high	35 Å²	35	17.9 Å²	17.9	16%	0.164	9%	0.085	C	C	.	.	H	α-helix	trans	-66.4	-39.4	175.9	-68.3	168.1	-54.7	0	0	111.6	Y33 W72 G191 G266 M270 L271 D272	Y33-Q268 HydrophobicContact CD1-CG 3.88Å; Y33-Q268 HydrophobicContact CD2-CG 4.04Å; Y33-Q268 HydrophobicContact CE1-CG 4.21Å; Y33-Q268 HydrophobicContact CE2-CG 4.39Å; Y33-Q268 HydrophobicContact CG-CG 3.77Å; W72-Q268 HydrophobicContact CH2-CB 4.32Å; W72-Q268 HydrophobicContact CH2-CG 3.99Å; W72-Q268 HydrophobicContact CZ2-CB 4.1Å; W72-Q268 HydrophobicContact CZ2-CG 4.27Å; G191-Q268 PolarHBondContact O-OE1 3.36Å; G191-Q268 VanDerWaalsContact O-OE1 3.1Å; G266-Q268 VanDerWaalsContact C-N 3.31Å; G266-Q268 PolarHBondContact O-N 3.18Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; Q268-L271 WeakPolarHBondContact O-CB 3.23Å; Q268-L271 PolarHBondContact O-N 3.12Å; Q268-D272 PolarHBondContact O-N 3.26Å
269	L	93.6	Very high	93.7	Very high	8 Å²	8	18 Å²	18	4%	0.042	9%	0.085	C	C	.	.	H	α-helix	trans	-66.7	-36.2	173.8	-70.1	176.3	0	0	0	112.2	I175 E184 G266 L271 D272 A273	I175-L269 HydrophobicContact CB-CD1 4.12Å; I175-L269 HydrophobicContact CD1-CD1 4.02Å; I175-L269 HydrophobicContact CG2-CD1 3.98Å; E184-L269 WeakPolarHBondContact OE2-CD2 3.42Å; G266-L269 WeakPolarHBondContact O-CB 3.25Å; G266-L269 PolarHBondContact O-N 3.31Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L269-D272 WeakPolarHBondContact O-CB 3.28Å; L269-D272 PolarHBondContact O-N 3.46Å; L269-A273 PolarHBondContact O-N 3.44Å
270	M	95.6	Very high	93.6	Very high	1 Å²	1	18 Å²	18	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-62	-41.9	171	-175.7	-79.7	-65.4	0	0	111.5	T26 V30 V103 I131 F133 L257 G266 V267 Q268 D272 A273 V274	T26-M270 HydrophobicContact CG2-CE 3.88Å; V30-M270 HydrophobicContact CG2-CE 3.62Å; V103-M270 HydrophobicContact CG1-CG 4.31Å; V103-M270 HydrophobicContact CG1-SD 4.04Å; V103-M270 HydrophobicContact CG2-SD 4.02Å; I131-M270 HydrophobicContact CD1-CG 4.33Å; I131-M270 HydrophobicContact CD1-SD 4.46Å; F133-M270 HydrophobicContact CB-CG 4.34Å; F133-M270 HydrophobicContact CD2-CB 4.16Å; F133-M270 HydrophobicContact CD2-CG 4.17Å; F133-M270 HydrophobicContact CE2-CB 4.38Å; F133-M270 HydrophobicContact CG-CG 4.26Å; L257-M270 HydrophobicContact CD2-CB 4.48Å; G266-M270 PolarHBondContact O-N 2.99Å; V267-M270 HydrophobicContact CG1-CE 4.17Å; V267-M270 PolarHBondContact O-N 2.84Å; Q268-M270 VanDerWaalsContact C-N 3.34Å; M270-D272 VanDerWaalsContact C-N 3.31Å; M270-D272 PolarHBondContact O-N 2.89Å; M270-A273 PolarHBondContact O-N 2.75Å; M270-V274 WeakPolarHBondContact O-CG2 3.35Å; M270-V274 PolarHBondContact O-N 3.11Å; M270-V274 HydrophobicContact SD-CG2 3.75Å
271	L	94.3	Very high	93.5	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-33.5	174.1	-76.5	169.7	0	0	0	113.5	V30 T34 W72 V267 Q268 L269 V274 I275	V30-L271 HydrophobicContact CB-CD1 4.44Å; V30-L271 HydrophobicContact CB-CD2 4.37Å; V30-L271 HydrophobicContact CG1-CD1 4.15Å; V30-L271 HydrophobicContact CG1-CD2 3.62Å; V30-L271 HydrophobicContact CG1-CG 4.34Å; V30-L271 HydrophobicContact CG2-CD1 4.25Å; V30-L271 HydrophobicContact CG2-CD2 3.95Å; V30-L271 HydrophobicContact CG2-CG 4.09Å; T34-L271 HydrophobicContact CG2-CD1 4.06Å; W72-L271 HydrophobicContact CD2-CB 4.14Å; W72-L271 HydrophobicContact CD2-CD1 4.03Å; W72-L271 HydrophobicContact CE3-CD1 4.21Å; W72-L271 HydrophobicContact CG-CB 4.05Å; W72-L271 HydrophobicContact CG-CD1 4.42Å; W72-L271 HydrophobicContact CZ2-CB 4.42Å; W72-L271 HydrophobicContact CZ2-CD1 4.49Å; V267-L271 PolarHBondContact O-N 3.42Å; Q268-L271 WeakPolarHBondContact O-CB 3.23Å; Q268-L271 PolarHBondContact O-N 3.12Å; L269-L271 VanDerWaalsContact C-N 3.33Å; L271-V274 WeakPolarHBondContact O-CB 3.49Å; L271-V274 PolarHBondContact O-N 2.68Å; L271-I275 PolarHBondContact O-N 3.38Å
272	D	95.1	Very high	93.5	Very high	26 Å²	26	21.2 Å²	21.2	14%	0.139	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-46.2	172.2	-71.3	-13.9	0	0	0	111	W72 K73 Q268 L269 M270 V274 I275 D276	W72-D272 PolarHBondContact NE1-OD1 2.65Å; K73-D272 WeakPolarHBondContact CD-OD1 3.3Å; K73-D272 WeakPolarHBondContact CE-OD1 3.45Å; K73-D272 IonicContact NZ-OD1 3.83Å; K73-D272 PolarHBondContact NZ-OD1 2.96Å; K73-D272 IonicContact NZ-OD2 3.44Å; K73-D272 PolarHBondContact NZ-OD2 3.32Å; Q268-D272 PolarHBondContact O-N 3.26Å; L269-D272 WeakPolarHBondContact O-CB 3.28Å; L269-D272 PolarHBondContact O-N 3.46Å; M270-D272 VanDerWaalsContact C-N 3.31Å; M270-D272 PolarHBondContact O-N 2.89Å; D272-V274 VanDerWaalsContact C-N 3.29Å; D272-V274 PolarHBondContact O-N 3.03Å; D272-I275 PolarHBondContact O-N 3.36Å; D272-D276 WeakPolarHBondContact O-CB 3.27Å; D272-D276 PolarHBondContact O-N 3.44Å
273	A	96.4	Very high	93.7	Very high	4 Å²	4	19.9 Å²	19.9	3%	0.033	10%	0.103	C	C	.	.	H	α-helix	trans	-62.5	-32.5	175.5	0	0	0	0	0	113.3	I131 L257 L269 M270 I275 D276 Y277	I131-A273 HydrophobicContact CD1-CB 4.22Å; L257-A273 HydrophobicContact CD1-CB 4.14Å; L257-A273 HydrophobicContact CD2-CB 3.59Å; L257-A273 HydrophobicContact CG-CB 4.48Å; L269-A273 PolarHBondContact O-N 3.44Å; M270-A273 PolarHBondContact O-N 2.75Å; A273-I275 VanDerWaalsContact C-N 3.31Å; A273-I275 PolarHBondContact O-N 2.93Å; A273-D276 PolarHBondContact O-N 3.47Å; A273-Y277 HydrophobicContact CB-CD2 3.81Å; A273-Y277 HydrophobicContact CB-CE2 4.1Å; A273-Y277 WeakPolarHBondContact O-CB 3.42Å; A273-Y277 PolarHBondContact O-N 3.14Å
274	V	96.5	Very high	93.8	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.1	-41.8	170.7	164.3	0	0	0	0	111	R11 I13 V77 V103 I131 M270 L271 D272 L278	R11-V274 HydrophobicContact CB-CG1 4.23Å; R11-V274 HydrophobicContact CG-CG1 4.24Å; R11-V274 PolarHBondContact NE-O 3.08Å; I13-V274 HydrophobicContact CD1-CG1 4Å; I13-V274 HydrophobicContact CD1-CG2 3.96Å; I13-V274 HydrophobicContact CG2-CG1 4.03Å; V77-V274 HydrophobicContact CG1-CG1 4.34Å; V103-V274 HydrophobicContact CG2-CG2 3.99Å; I131-V274 HydrophobicContact CD1-CG2 3.88Å; M270-V274 WeakPolarHBondContact O-CG2 3.35Å; M270-V274 PolarHBondContact O-N 3.11Å; M270-V274 HydrophobicContact SD-CG2 3.75Å; L271-V274 WeakPolarHBondContact O-CB 3.49Å; L271-V274 PolarHBondContact O-N 2.68Å; D272-V274 VanDerWaalsContact C-N 3.29Å; D272-V274 PolarHBondContact O-N 3.03Å; V274-L278 HydrophobicContact CB-CD1 4.28Å; V274-L278 HydrophobicContact CG1-CD1 4.25Å; V274-L278 HydrophobicContact CG2-CD1 3.93Å; V274-L278 VanDerWaalsContact O-CB 3.32Å; V274-L278 WeakPolarHBondContact O-CB 3.26Å; V274-L278 PolarHBondContact O-N 3.05Å
275	I	95.9	Very high	93.7	Very high	12 Å²	12	23.3 Å²	23.3	6%	0.062	13%	0.133	C	C	.	.	H	α-helix	trans	-71.1	-47.6	178.3	-66.9	178.8	0	0	0	110.3	R11 W72 K73 H75 R245 L271 D272 A273	R11-I275 PolarHBondContact NE-O 3.16Å; R11-I275 PolarHBondContact NH2-O 3.07Å; W72-I275 HydrophobicContact CB-CD1 4.16Å; W72-I275 VanDerWaalsContact CD1-CD1 3.42Å; W72-I275 HydrophobicContact CG-CD1 4.13Å; W72-I275 WeakPolarHBondContact O-CD1 3.27Å; K73-I275 HydrophobicContact CB-CD1 3.9Å; H75-I275 HydrophobicContact CB-CD1 3.94Å; H75-I275 HydrophobicContact CB-CG1 4.2Å; R245-I275 PolarHBondContact NH1-O 3.31Å; L271-I275 PolarHBondContact O-N 3.38Å; D272-I275 PolarHBondContact O-N 3.36Å; A273-I275 VanDerWaalsContact C-N 3.31Å; A273-I275 PolarHBondContact O-N 2.93Å
276	D	95.4	Very high	93.4	Very high	56 Å²	56	23.6 Å²	23.6	30%	0.299	14%	0.141	S	C	.	.	H	α-helix	trans	-70.8	-39.3	-171.1	-74.8	1.8	0	0	0	112.3	K241 R245 D272 A273	K241-D276 IonicContact NZ-OD2 2.86Å; K241-D276 PolarHBondContact NZ-OD2 3.46Å; R245-D276 WeakPolarHBondContact CD-O 3.17Å; R245-D276 VanDerWaalsContact NH1-C 3.33Å; R245-D276 PolarHBondContact NH1-O 2.99Å; D272-D276 WeakPolarHBondContact O-CB 3.27Å; D272-D276 PolarHBondContact O-N 3.44Å; A273-D276 PolarHBondContact O-N 3.47Å
277	Y	97.1	Very high	93.2	Very high	9 Å²	9	24.8 Å²	24.8	4%	0.035	15%	0.147	C	C	.	.	H	α-helix	trans	-117.6	-24	-168.4	-51.1	-53.2	0	0	0	115.3	I162 K241 I244 R245 A273	I162-Y277 HydrophobicContact CD1-CD2 4.21Å; I162-Y277 HydrophobicContact CD1-CE2 3.61Å; K241-Y277 HydrophobicContact CB-CE1 4.38Å; K241-Y277 HydrophobicContact CG-CE1 4.36Å; I244-Y277 HydrophobicContact CB-CD1 3.98Å; I244-Y277 HydrophobicContact CB-CE1 3.73Å; I244-Y277 HydrophobicContact CD1-CE1 4.36Å; I244-Y277 HydrophobicContact CG2-CD1 3.47Å; I244-Y277 VanDerWaalsContact CG2-CD1 3.47Å; I244-Y277 HydrophobicContact CG2-CD2 4.33Å; I244-Y277 HydrophobicContact CG2-CE1 3.52Å; I244-Y277 HydrophobicContact CG2-CE2 4.39Å; I244-Y277 HydrophobicContact CG2-CG 3.9Å; R245-Y277 HydrophobicContact CB-CD1 4.23Å; A273-Y277 HydrophobicContact CB-CD2 3.81Å; A273-Y277 HydrophobicContact CB-CE2 4.1Å; A273-Y277 WeakPolarHBondContact O-CB 3.42Å; A273-Y277 PolarHBondContact O-N 3.14Å
278	L	96.8	Very high	93.1	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.168	C	C	.	.	S	Bend	trans	-84.4	154.3	178.1	-67.6	179.8	0	0	0	112.5	R11 I13 V103 I131 R245 T248 V274	R11-L278 PolarHBondContact NE-O 3.41Å; R11-L278 VanDerWaalsContact NE-O 3.1Å; I13-L278 HydrophobicContact CB-CD1 4.47Å; I13-L278 HydrophobicContact CG2-CD1 3.59Å; V103-L278 HydrophobicContact CG2-CD1 4.28Å; I131-L278 HydrophobicContact CD1-CD1 4.25Å; I131-L278 HydrophobicContact CG1-CD1 4.28Å; I131-L278 HydrophobicContact CG2-CD2 3.97Å; I131-L278 HydrophobicContact CG2-CG 4.13Å; R245-L278 PolarHBondContact NH1-O 3.11Å; R245-L278 PolarHBondContact NH2-O 3.41Å; R245-L278 VanDerWaalsContact NH2-O 3.14Å; T248-L278 HydrophobicContact CG2-CD2 4.45Å; V274-L278 HydrophobicContact CB-CD1 4.28Å; V274-L278 HydrophobicContact CG1-CD1 4.25Å; V274-L278 HydrophobicContact CG2-CD1 3.93Å; V274-L278 VanDerWaalsContact O-CB 3.32Å; V274-L278 WeakPolarHBondContact O-CB 3.26Å; V274-L278 PolarHBondContact O-N 3.05Å
279	P	95.5	Very high	93	Very high	1 Å²	1	28.1 Å²	28.1	1%	0.006	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-69.7	145.3	-174.3	21.8	-31.5	0	0	0	113.9	R11 D100 P129 L249 D283 V284	R11-P279 WeakPolarHBondContact CD-O 3.23Å; D100-P279 VanDerWaalsContact C-CG 3.42Å; D100-P279 HydrophobicContact CB-CB 4.37Å; D100-P279 HydrophobicContact CB-CG 3.96Å; D100-P279 WeakPolarHBondContact O-CG 3.47Å; P129-P279 HydrophobicContact CB-CG 4.12Å; P129-P279 HydrophobicContact CG-CG 4.02Å; L249-P279 HydrophobicContact CD2-CB 3.47Å; L249-P279 VanDerWaalsContact CD2-CB 3.47Å; L249-P279 HydrophobicContact CD2-CG 4.04Å; P279-D283 HydrophobicContact CB-CB 3.96Å; P279-V284 HydrophobicContact CB-CG2 3.88Å; P279-V284 HydrophobicContact CG-CG2 4.26Å
280	A	94	Very high	92.8	Very high	1 Å²	1	32 Å²	32	1%	0.008	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-78.2	160	153	0	0	0	0	0	110.7	T10 T282 D283	T10-A280 WeakPolarHBondContact O-CA 3.47Å; A280-T282 PolarHBondContact O-N 3.39Å; A280-D283 WeakPolarHBondContact CB-OD2 3.35Å; A280-D283 PolarHBondContact N-OD2 3.26Å; A280-D283 WeakPolarHBondContact O-CB 3.1Å; A280-D283 PolarHBondContact O-N 3.36Å
281	P	91.6	Very high	92.5	Very high	7 Å²	7	33.9 Å²	33.9	5%	0.045	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-24.6	170.5	-26.5	30.8	0	0	0	114.8	L7 T10 D100 A302	L7-P281 HydrophobicContact CD2-CB 4.08Å; L7-P281 HydrophobicContact CD2-CG 4.2Å; L7-P281 WeakPolarHBondContact O-CD 3.26Å; T10-P281 HydrophobicContact CG2-CG 4.22Å; T10-P281 VanDerWaalsContact O-CD 3.3Å; T10-P281 WeakPolarHBondContact O-CD 3.34Å; D100-P281 WeakPolarHBondContact OD2-CG 3.39Å; P281-A302 HydrophobicContact CB-CB 4.39Å; P281-A302 WeakPolarHBondContact O-CB 3.27Å
282	T	91.3	Very high	92.1	Very high	60 Å²	60	36.3 Å²	36.3	37%	0.368	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-19.4	177	46.3	0	0	0	0	113.8	L7 A280	L7-T282 HydrophobicContact CB-CG2 3.69Å; L7-T282 HydrophobicContact CD1-CG2 4.11Å; A280-T282 PolarHBondContact O-N 3.39Å
283	D	92.1	Very high	91.6	Very high	71 Å²	71	43.5 Å²	43.5	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.3	-179.1	-55.5	-30.5	0	0	0	111.7	R245 L249 P279 A280	R245-D283 IonicContact CZ-OD2 2.74Å; R245-D283 IonicContact NH2-OD2 3.74Å; R245-D283 PolarHBondContact NH2-OD2 3.24Å; L249-D283 HydrophobicContact CD1-CB 4.28Å; L249-D283 HydrophobicContact CD2-CB 4.24Å; P279-D283 HydrophobicContact CB-CB 3.96Å; A280-D283 WeakPolarHBondContact CB-OD2 3.35Å; A280-D283 PolarHBondContact N-OD2 3.26Å; A280-D283 WeakPolarHBondContact O-CB 3.1Å; A280-D283 PolarHBondContact O-N 3.36Å
284	V	87.9	Confident	91.2	Very high	54 Å²	54	46.9 Å²	46.9	33%	0.327	25%	0.253	S	S	.	.	S	Bend	trans	-87.2	139.9	177.8	-172.4	0	0	0	0	109.4	D100 P279	D100-V284 HydrophobicContact CB-CG2 3.73Å; P279-V284 HydrophobicContact CB-CG2 3.88Å; P279-V284 HydrophobicContact CG-CG2 4.26Å
285	P	87.3	Confident	90.6	Very high	117 Å²	117	53 Å²	53	76%	0.76	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-52.5	144.8	173.3	-27	34.9	0	0	0	112.6	I287	P285-I287 PolarHBondContact O-N 2.97Å
286	A	87.6	Confident	90.2	Very high	33 Å²	33	58.8 Å²	58.8	27%	0.273	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-55.6	136.6	175.6	0	0	0	0	0	110.5	K288 E299 P301	A286-K288 PolarHBondContact O-N 3.01Å; A286-E299 HydrophobicContact CB-CB 4.2Å; A286-P301 HydrophobicContact CB-CB 4.44Å
287	I	88.1	Confident	90	Very high	26 Å²	26	61.4 Å²	61.4	13%	0.133	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	133.5	-179.1	-168.7	164.4	0	0	0	109.9	P285 E299 R300 Y330 L397	P285-I287 PolarHBondContact O-N 2.97Å; I287-E299 WeakPolarHBondContact O-CA 3.47Å; I287-R300 HydrophobicContact CG2-CB 3.74Å; I287-R300 PolarHBondContact N-O 3.39Å; I287-R300 PolarHBondContact O-N 2.87Å; I287-Y330 HydrophobicContact CB-CD1 4.01Å; I287-Y330 HydrophobicContact CB-CE1 4.35Å; I287-Y330 HydrophobicContact CB-CG 4.21Å; I287-Y330 HydrophobicContact CD1-CD1 4.07Å; I287-Y330 HydrophobicContact CD1-CD2 3.83Å; I287-Y330 HydrophobicContact CD1-CE1 3.77Å; I287-Y330 HydrophobicContact CD1-CE2 3.51Å; I287-Y330 HydrophobicContact CD1-CG 4.1Å; I287-Y330 VanDerWaalsContact CD1-CZ 3.47Å; I287-Y330 HydrophobicContact CG2-CD1 3.93Å; I287-Y330 HydrophobicContact CG2-CD2 4.19Å; I287-Y330 HydrophobicContact CG2-CG 3.65Å; I287-L397 HydrophobicContact CD1-CB 4.34Å; I287-L397 HydrophobicContact CD1-CD1 4.15Å; I287-L397 HydrophobicContact CD1-CD2 4.23Å; I287-L397 HydrophobicContact CD1-CG 4.45Å; I287-L397 HydrophobicContact CG1-CD2 4.11Å; I287-L397 HydrophobicContact CG2-CD2 3.75Å
288	K	89.8	Confident	89.6	Confident	104 Å²	104	63 Å²	63	45%	0.452	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	147.9	177	-67.6	171.7	165.9	-128.2	0	110.8	A286 E297 E299	A286-K288 PolarHBondContact O-N 3.01Å; K288-E297 VanDerWaalsContact CD-OE1 3.3Å; K288-E297 WeakPolarHBondContact CD-OE1 3.28Å; K288-E297 WeakPolarHBondContact CE-OE1 3.15Å; K288-E297 IonicContact NZ-OE1 3.54Å; K288-E297 PolarHBondContact NZ-OE1 3.3Å; K288-E299 HydrophobicContact CG-CG 4.31Å
289	G	90.3	Very high	89.3	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	178.9	172.8	0	0	0	0	0	111.5	E297 T298 I396	G289-E297 CarbonylContact O-C 3.4Å; G289-E297 WeakPolarHBondContact O-CA 3.47Å; G289-T298 PolarHBondContact N-O 2.94Å; G289-T298 PolarHBondContact O-N 3.4Å; G289-T298 VanDerWaalsContact O-O 3.05Å; G289-T298 PolarHBondContact O-OG1 2.83Å; G289-I396 CarbonylContact C-O 3.52Å; G289-I396 WeakPolarHBondContact CA-O 3.22Å
290	F	91.1	Very high	89.1	Confident	90 Å²	90	69.7 Å²	69.7	40%	0.395	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	142.1	-177.4	-56.5	-87.7	0	0	0	110.5	P292 E296 E297 V395 I396	F290-P292 WeakPolarHBondContact O-CD 3.35Å; F290-E296 WeakPolarHBondContact CA-O 3.36Å; F290-E297 HydrophobicContact CD1-CB 4.45Å; F290-E297 HydrophobicContact CE1-CB 4.29Å; F290-E297 HydrophobicContact CE1-CG 4.45Å; F290-V395 CarbonylContact O-C 3.55Å; F290-V395 WeakPolarHBondContact O-CA 3.06Å; F290-I396 PolarHBondContact N-O 3.47Å; F290-I396 PolarHBondContact O-N 3.27Å
291	D	88.6	Confident	89	Confident	40 Å²	40	72.8 Å²	72.8	21%	0.214	38%	0.384	C	S	.	.			trans	-72.4	120.5	167.8	-175.5	-47.7	0	0	0	108.8	K293 T294 D295 E296 T298	D291-K293 PolarHBondContact O-N 3.23Å; D291-K293 WeakPolarHBondContact OD1-CB 3.13Å; D291-K293 PolarHBondContact OD1-N 2.98Å; D291-T294 WeakPolarHBondContact CB-OG1 3.27Å; D291-T294 PolarHBondContact O-N 3.24Å; D291-D295 WeakPolarHBondContact O-CA 3.49Å; D291-D295 PolarHBondContact O-N 3.1Å; D291-E296 PolarHBondContact N-O 2.87Å; D291-T298 HydrophobicContact CB-CG2 4.44Å
292	P	85.6	Confident	89	Confident	52 Å²	52	73.9 Å²	73.9	34%	0.338	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.1	-175.6	26.4	-35.7	0	0	0	114.9	F290 P394 I396	F290-P292 WeakPolarHBondContact O-CD 3.35Å; P292-P394 HydrophobicContact CG-CB 3.65Å; P292-I396 HydrophobicContact CB-CD1 3.83Å; P292-I396 HydrophobicContact CB-CG1 4.18Å
293	K	84.8	Confident	89	Confident	177 Å²	177	74.2 Å²	74.2	77%	0.77	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.7	-30.2	178.4	-63.5	177.3	-177.6	168.9	0	113.2	D291	D291-K293 PolarHBondContact O-N 3.23Å; D291-K293 WeakPolarHBondContact OD1-CB 3.13Å; D291-K293 PolarHBondContact OD1-N 2.98Å
294	T	87.1	Confident	88.9	Confident	74 Å²	74	72.7 Å²	72.7	45%	0.454	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-13.1	-173.9	63.2	0	0	0	0	113.3	D291 E296	D291-T294 WeakPolarHBondContact CB-OG1 3.27Å; D291-T294 PolarHBondContact O-N 3.24Å; T294-E296 PolarHBondContact O-N 3.1Å; T294-E296 VanDerWaalsContact O-N 3.15Å; T294-E296 WeakPolarHBondContact OG1-CB 3.48Å; T294-E296 PolarHBondContact OG1-N 2.88Å
295	D	84.1	Confident	89.1	Confident	130 Å²	130	75.2 Å²	75.2	70%	0.695	41%	0.405	S	S	*	.			trans	55.4	18.7	-170.2	-67.5	-30.9	0	0	0	113.4	D291	D291-D295 WeakPolarHBondContact O-CA 3.49Å; D291-D295 PolarHBondContact O-N 3.1Å
296	E	88.7	Confident	89.4	Confident	133 Å²	133	70.4 Å²	70.4	62%	0.621	38%	0.376	S	S	*	.			trans	-78.4	138.2	174.9	-68.8	-179.8	162.5	0	0	110.4	F290 D291 T294	F290-E296 WeakPolarHBondContact CA-O 3.36Å; D291-E296 PolarHBondContact N-O 2.87Å; T294-E296 PolarHBondContact O-N 3.1Å; T294-E296 VanDerWaalsContact O-N 3.15Å; T294-E296 WeakPolarHBondContact OG1-CB 3.48Å; T294-E296 PolarHBondContact OG1-N 2.88Å
297	E	89.7	Confident	89.7	Confident	110 Å²	110	71.6 Å²	71.6	51%	0.514	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	133.3	174.7	-167.8	178.6	174.8	0	0	110.1	K288 G289 F290	K288-E297 VanDerWaalsContact CD-OE1 3.3Å; K288-E297 WeakPolarHBondContact CD-OE1 3.28Å; K288-E297 WeakPolarHBondContact CE-OE1 3.15Å; K288-E297 IonicContact NZ-OE1 3.54Å; K288-E297 PolarHBondContact NZ-OE1 3.3Å; G289-E297 CarbonylContact O-C 3.4Å; G289-E297 WeakPolarHBondContact O-CA 3.47Å; F290-E297 HydrophobicContact CD1-CB 4.45Å; F290-E297 HydrophobicContact CE1-CB 4.29Å; F290-E297 HydrophobicContact CE1-CG 4.45Å
298	T	89.9	Confident	90.1	Very high	42 Å²	42	70.9 Å²	70.9	26%	0.258	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	152.8	179.8	67.5	0	0	0	0	109.5	G289 D291 V395	G289-T298 PolarHBondContact N-O 2.94Å; G289-T298 PolarHBondContact O-N 3.4Å; G289-T298 VanDerWaalsContact O-O 3.05Å; G289-T298 PolarHBondContact O-OG1 2.83Å; D291-T298 HydrophobicContact CB-CG2 4.44Å; T298-V395 WeakPolarHBondContact OG1-CG2 3.45Å
299	E	91.2	Very high	90.3	Very high	120 Å²	120	66 Å²	66	56%	0.561	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.7	147.9	177.9	-66.5	-177.6	174.7	0	0	111.1	A286 I287 K288	A286-E299 HydrophobicContact CB-CB 4.2Å; I287-E299 WeakPolarHBondContact O-CA 3.47Å; K288-E299 HydrophobicContact CG-CG 4.31Å
300	R	91.1	Very high	90.5	Very high	23 Å²	23	66 Å²	66	9%	0.087	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	97.3	177.5	-63.2	-63.2	179.9	162.1	3.3	110	I287 P307 S309 A393 V395 L397	I287-R300 HydrophobicContact CG2-CB 3.74Å; I287-R300 PolarHBondContact N-O 3.39Å; I287-R300 PolarHBondContact O-N 2.87Å; R300-P307 VanDerWaalsContact NH1-CB 3.31Å; R300-S309 WeakPolarHBondContact CB-OG 3.15Å; R300-S309 WeakPolarHBondContact CG-OG 3.5Å; R300-A393 PolarHBondContact NH2-O 3Å; R300-V395 HydrophobicContact CG-CG1 4.44Å; R300-L397 HydrophobicContact CG-CD2 4.46Å
301	P	91.1	Very high	90.6	Very high	66 Å²	66	61.7 Å²	61.7	43%	0.429	34%	0.336	S	S	.	.			trans	-70.2	150.8	178.3	29.6	-34.5	0	0	0	111	A286 D303 A306 S331	A286-P301 HydrophobicContact CB-CB 4.44Å; P301-D303 PolarHBondContact O-N 2.81Å; P301-A306 HydrophobicContact CG-CB 4.48Å; P301-S331 WeakPolarHBondContact O-CB 3.37Å
302	A	91.2	Very high	90.7	Very high	30 Å²	30	59.8 Å²	59.8	25%	0.248	33%	0.326	C	S	.	.	S	Bend	trans	-69.8	79.3	173.7	0	0	0	0	0	111.3	L7 P281 Y330	L7-A302 VanDerWaalsContact CD1-O 3.24Å; L7-A302 WeakPolarHBondContact CD1-O 3.12Å; P281-A302 HydrophobicContact CB-CB 4.39Å; P281-A302 WeakPolarHBondContact O-CB 3.27Å; A302-Y330 WeakPolarHBondContact CA-O 3.48Å
303	D	91.6	Very high	90.7	Very high	67 Å²	67	57.4 Å²	57.4	36%	0.358	31%	0.311	S	S	.	.			trans	-140.4	136.9	178.5	-179.5	3.8	0	0	0	109.9	P301 S305 A306 G332	P301-D303 PolarHBondContact O-N 2.81Å; D303-S305 PolarHBondContact O-N 2.94Å; D303-S305 WeakPolarHBondContact OD1-CB 3.42Å; D303-S305 PolarHBondContact OD1-N 2.79Å; D303-S305 PolarHBondContact OD1-OG 3.18Å; D303-A306 HydrophobicContact CB-CB 4.14Å; D303-A306 PolarHBondContact O-N 2.83Å; D303-G332 PolarHBondContact O-N 3.01Å
304	D	91	Very high	90.8	Very high	39 Å²	39	49.6 Å²	49.6	21%	0.209	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.9	174.2	-73.5	-17	0	0	0	113.7	R3 A306 V333 S370	R3-D304 WeakPolarHBondContact CD-OD2 3.34Å; R3-D304 IonicContact CZ-OD1 3.07Å; R3-D304 IonicContact CZ-OD2 2.69Å; R3-D304 IonicContact NE-OD1 3.16Å; R3-D304 IonicContact NE-OD2 3.94Å; R3-D304 PolarHBondContact NE-OD2 2.78Å; R3-D304 IonicContact NH1-OD1 3.08Å; R3-D304 PolarHBondContact NH1-OD1 3.29Å; R3-D304 VanDerWaalsContact NH1-OD1 3.15Å; R3-D304 IonicContact NH1-OD2 3.55Å; R3-D304 PolarHBondContact NH1-OD2 3.21Å; R3-D304 IonicContact NH2-OD1 3.38Å; R3-D304 PolarHBondContact NH2-OD1 2.74Å; R3-D304 IonicContact NH2-OD2 2.74Å; D304-A306 VanDerWaalsContact C-N 3.34Å; D304-V333 HydrophobicContact CB-CG2 3.8Å; D304-S370 PolarHBondContact N-OG 3.19Å; D304-S370 PolarHBondContact OD1-N 2.96Å; D304-S370 VanDerWaalsContact OD1-N 3.14Å; D304-S370 PolarHBondContact OD1-OG 2.75Å
305	S	91.7	Very high	90.8	Very high	106 Å²	106	46.3 Å²	46.3	74%	0.741	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-19.4	-177.6	-39.7	0	0	0	0	111.8	D303	D303-S305 PolarHBondContact O-N 2.94Å; D303-S305 WeakPolarHBondContact OD1-CB 3.42Å; D303-S305 PolarHBondContact OD1-N 2.79Å; D303-S305 PolarHBondContact OD1-OG 3.18Å
306	A	92.5	Very high	90.7	Very high	17 Å²	17	41.1 Å²	41.1	14%	0.14	23%	0.228	C	C	.	.	S	Bend	trans	-69.7	158.8	176.3	0	0	0	0	0	111.1	P301 D303 D304 G332	P301-A306 HydrophobicContact CG-CB 4.48Å; D303-A306 HydrophobicContact CB-CB 4.14Å; D303-A306 PolarHBondContact O-N 2.83Å; D304-A306 VanDerWaalsContact C-N 3.34Å; A306-G332 WeakPolarHBondContact O-CA 3.35Å; A306-G332 PolarHBondContact O-N 3.3Å
307	P	94.2	Very high	90.3	Very high	58 Å²	58	37 Å²	37	38%	0.377	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-63.8	147.8	177.2	-13.8	26.1	0	0	0	111	R300 S309 S331 D390 A393	R300-P307 VanDerWaalsContact NH1-CB 3.31Å; P307-S309 PolarHBondContact O-N 2.85Å; P307-S331 PolarHBondContact O-OG 3.05Å; P307-D390 HydrophobicContact CB-CB 4.29Å; P307-A393 HydrophobicContact CB-CB 3.76Å; P307-A393 HydrophobicContact CG-CB 4.05Å
308	F	95.8	Very high	89.7	Confident	11 Å²	11	32.3 Å²	32.3	5%	0.048	19%	0.191	C	C	.	.	P	Polyproline II helix	trans	-60.4	129.7	-176.1	175.3	-108.8	0	0	0	112	S310 V329 S331 L334 V340 L388 C389 D390	F308-S310 WeakPolarHBondContact CZ-OG 3.4Å; F308-V329 HydrophobicContact CD2-CG1 4.04Å; F308-V329 HydrophobicContact CE2-CB 4.46Å; F308-V329 HydrophobicContact CE2-CG1 3.78Å; F308-V329 HydrophobicContact CE2-CG2 3.95Å; F308-S331 CarbonylContact C-O 3.57Å; F308-S331 VanDerWaalsContact CA-O 3.28Å; F308-S331 WeakPolarHBondContact CA-O 3.31Å; F308-L334 HydrophobicContact CD1-CD1 4.24Å; F308-L334 HydrophobicContact CD2-CB 4.07Å; F308-L334 HydrophobicContact CD2-CD1 4.47Å; F308-L334 HydrophobicContact CE1-CD1 3.89Å; F308-L334 HydrophobicContact CE2-CB 3.61Å; F308-L334 HydrophobicContact CE2-CD1 4.12Å; F308-L334 HydrophobicContact CE2-CD2 4.25Å; F308-L334 HydrophobicContact CE2-CG 4.22Å; F308-L334 HydrophobicContact CZ-CB 4.04Å; F308-L334 HydrophobicContact CZ-CD1 3.8Å; F308-L334 HydrophobicContact CZ-CD2 3.87Å; F308-L334 HydrophobicContact CZ-CG 4.12Å; F308-V340 HydrophobicContact CD1-CG1 3.89Å; F308-V340 HydrophobicContact CE1-CB 4.31Å; F308-V340 HydrophobicContact CE1-CG1 3.62Å; F308-L388 HydrophobicContact CE1-CB 4.14Å; F308-L388 WeakPolarHBondContact CE1-O 3.32Å; F308-C389 CarbonylContact O-C 3.54Å; F308-C389 WeakPolarHBondContact O-CA 3.42Å; F308-C389 WeakPolarHBondContact O-CB 3.38Å; F308-D390 HydrophobicContact CB-CB 4.34Å; F308-D390 PolarHBondContact O-N 3.15Å
309	S	95.4	Very high	88.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	137.7	168.1	74.1	0	0	0	0	110.6	R300 P307 Y330 S331 L388	R300-S309 WeakPolarHBondContact CB-OG 3.15Å; R300-S309 WeakPolarHBondContact CG-OG 3.5Å; P307-S309 PolarHBondContact O-N 2.85Å; S309-Y330 PolarHBondContact O-N 3.05Å; S309-S331 WeakPolarHBondContact CB-OG 3.31Å; S309-S331 PolarHBondContact N-O 3Å; S309-S331 PolarHBondContact N-OG 2.61Å; S309-S331 PolarHBondContact O-N 2.93Å; S309-S331 PolarHBondContact OG-OG 3.02Å; S309-L388 CarbonylContact C-O 3.55Å
310	S	94.7	Very high	88.1	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	155.7	-180	64.9	0	0	0	0	111.5	F308 R328 T387 L388	F308-S310 WeakPolarHBondContact CZ-OG 3.4Å; S310-R328 CarbonylContact C-O 3.58Å; S310-R328 WeakPolarHBondContact CA-O 3.29Å; S310-R328 WeakPolarHBondContact CB-O 3.19Å; S310-T387 WeakPolarHBondContact O-CA 3.45Å; S310-L388 PolarHBondContact N-O 2.98Å; S310-L388 PolarHBondContact O-N 2.74Å; S310-L388 WeakPolarHBondContact OG-CB 3.3Å; S310-L388 PolarHBondContact OG-O 2.88Å; S310-L388 VanDerWaalsContact OG-O 3.08Å
311	L	92.2	Very high	87.6	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.2	176.1	-175.1	68.1	0	0	0	109.6	R97 V98 F327 R328 Y330 G385 L397	R97-L311 HydrophobicContact CG-CD2 4.25Å; V98-L311 HydrophobicContact CG1-CD2 4.27Å; L311-F327 CarbonylContact O-C 3.56Å; L311-F327 WeakPolarHBondContact O-CA 3.36Å; L311-F327 WeakPolarHBondContact O-CB 3.15Å; L311-R328 PolarHBondContact N-O 2.78Å; L311-R328 PolarHBondContact O-N 3.34Å; L311-Y330 HydrophobicContact CB-CE2 3.82Å; L311-G385 WeakPolarHBondContact CD1-O 3.47Å; L311-L397 HydrophobicContact CB-CD1 4.27Å
312	A	91.2	Very high	87.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.2	168.3	0	0	0	0	0	109	T325 F326 T382 G385 D386	A312-T325 HydrophobicContact CB-CG2 3.62Å; A312-F326 CarbonylContact C-O 3.59Å; A312-F326 VanDerWaalsContact CA-O 3.32Å; A312-F326 WeakPolarHBondContact CA-O 3.49Å; A312-T382 HydrophobicContact CB-CG2 3.65Å; A312-G385 PolarHBondContact O-N 3.03Å; A312-D386 WeakPolarHBondContact CB-O 3.35Å; A312-D386 PolarHBondContact N-O 3.43Å
313	F	86.3	Confident	87.1	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.009	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-11.5	-173.2	69.2	-88.7	0	0	0	113.8	I80 R94 V98 F326 I373 T384	I80-F313 HydrophobicContact CD1-CE2 4.29Å; I80-F313 HydrophobicContact CD1-CZ 4.37Å; R94-F313 WeakPolarHBondContact CD-O 3.18Å; V98-F313 HydrophobicContact CB-CD1 4.35Å; V98-F313 HydrophobicContact CB-CG 4.42Å; V98-F313 HydrophobicContact CG1-CB 3.58Å; V98-F313 HydrophobicContact CG1-CD1 3.76Å; V98-F313 HydrophobicContact CG1-CG 3.71Å; V98-F313 HydrophobicContact CG2-CD1 4.17Å; V98-F313 HydrophobicContact CG2-CD2 4.03Å; V98-F313 HydrophobicContact CG2-CE1 4.34Å; V98-F313 HydrophobicContact CG2-CE2 4.22Å; V98-F313 HydrophobicContact CG2-CG 4Å; V98-F313 HydrophobicContact CG2-CZ 4.36Å; F313-F326 HydrophobicContact CD1-CB 4.29Å; F313-F326 HydrophobicContact CE1-CB 3.71Å; F313-F326 HydrophobicContact CE2-CB 4.12Å; F313-F326 HydrophobicContact CZ-CB 3.62Å; F313-F326 HydrophobicContact CZ-CD1 4.38Å; F313-F326 HydrophobicContact CZ-CG 4.39Å; F313-F326 PolarHBondContact N-O 2.9Å; F313-I373 HydrophobicContact CE1-CG2 3.95Å; F313-I373 HydrophobicContact CZ-CG2 3.9Å; F313-T384 VanDerWaalsContact O-CG2 3.27Å; F313-T384 WeakPolarHBondContact O-CG2 3.44Å
314	K	85.5	Confident	87	Confident	13 Å²	13	34.4 Å²	34.4	6%	0.057	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	134.4	177.3	171.7	172.5	-177.9	156.5	0	110.9	S65 E91 T325 F326	S65-K314 PolarHBondContact O-NZ 3.47Å; S65-K314 PolarHBondContact OG-NZ 3.37Å; E91-K314 WeakPolarHBondContact OE1-CE 3.38Å; E91-K314 IonicContact OE1-NZ 2.61Å; E91-K314 PolarHBondContact OE1-NZ 3.26Å; K314-T325 CarbonylContact O-C 3.6Å; K314-F326 HydrophobicContact CB-CB 4.02Å; K314-F326 HydrophobicContact CB-CD2 4.21Å; K314-F326 HydrophobicContact CB-CG 4.35Å; K314-F326 HydrophobicContact CD-CD2 4.25Å; K314-F326 HydrophobicContact CD-CE2 4.5Å; K314-F326 HydrophobicContact CG-CD2 3.97Å; K314-F326 PolarHBondContact O-N 3.47Å
315	V	87.4	Confident	87	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.03	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	137.8	170	179.4	0	0	0	0	108.2	R323 L324 T325	V315-R323 HydrophobicContact CG1-CG 3.92Å; V315-L324 WeakPolarHBondContact CA-O 3.36Å; V315-T325 HydrophobicContact CG2-CG2 4.33Å
316	M	83	Confident	86.9	Confident	20 Å²	20	28.1 Å²	28.1	10%	0.099	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	138.5	178.2	-175.1	179	74	0	0	109.6	W52 L324 F326	W52-M316 HydrophobicContact CH2-SD 4.07Å; W52-M316 HydrophobicContact CZ2-SD 3.72Å; M316-L324 HydrophobicContact CE-CD1 3.83Å; M316-L324 PolarHBondContact N-O 3.27Å; M316-L324 PolarHBondContact O-N 3.48Å; M316-F326 HydrophobicContact CB-CE2 4.37Å; M316-F326 HydrophobicContact CE-CE2 4.29Å
317	T	79.5	Confident	86.8	Confident	47 Å²	47	27.3 Å²	27.3	29%	0.288	15%	0.152	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	108.1	171.3	-52.1	0	0	0	0	109.5	E432	T317-E432 WeakPolarHBondContact CA-OE1 3.28Å; T317-E432 WeakPolarHBondContact CB-OE1 3.44Å; T317-E432 PolarHBondContact N-OE1 3.33Å; T317-E432 PolarHBondContact OG1-OE1 3.15Å
318	D	76.9	Confident	86.7	Confident	11 Å²	11	24.7 Å²	24.7	6%	0.059	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	135.5	173.4	-177.5	-99.5	0	0	0	111.7	F320 V321 G322 L324 R362	D318-F320 VanDerWaalsContact C-N 3.26Å; D318-F320 PolarHBondContact O-N 3.1Å; D318-F320 WeakPolarHBondContact OD1-CA 3.03Å; D318-F320 WeakPolarHBondContact OD1-CB 3.48Å; D318-F320 PolarHBondContact OD1-N 3Å; D318-V321 HydrophobicContact CB-CG2 3.68Å; D318-V321 WeakPolarHBondContact OD1-CG2 3.47Å; D318-V321 PolarHBondContact OD1-N 3.28Å; D318-G322 WeakPolarHBondContact CA-O 3.41Å; D318-G322 WeakPolarHBondContact CB-O 3.03Å; D318-G322 PolarHBondContact N-O 3.44Å; D318-G322 VanDerWaalsContact O-CA 3.24Å; D318-G322 WeakPolarHBondContact O-CA 3.46Å; D318-G322 PolarHBondContact O-N 2.83Å; D318-L324 HydrophobicContact CB-CD1 3.78Å; D318-L324 HydrophobicContact CB-CG 4.15Å; D318-R362 VanDerWaalsContact CG-NH1 3.28Å; D318-R362 IonicContact OD1-CZ 2.64Å; D318-R362 IonicContact OD1-NH1 3.82Å; D318-R362 PolarHBondContact OD1-NH1 2.92Å; D318-R362 IonicContact OD1-NH2 3.71Å; D318-R362 PolarHBondContact OD1-NH2 3.3Å; D318-R362 IonicContact OD2-CZ 3.12Å; D318-R362 VanDerWaalsContact OD2-CZ 3.22Å; D318-R362 IonicContact OD2-NH1 3.42Å; D318-R362 PolarHBondContact OD2-NH1 3.44Å; D318-R362 IonicContact OD2-NH2 3.78Å; D318-R362 PolarHBondContact OD2-NH2 3.16Å
319	P	72.3	Confident	86.5	Confident	116 Å²	116	24.2 Å²	24.2	75%	0.753	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-27.6	179.2	-25.8	34.4	0	0	0	115.2
320	F	76.6	Confident	86.4	Confident	171 Å²	171	25.7 Å²	25.7	75%	0.75	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-38.8	-172.4	-54.3	-83.4	0	0	0	113.1	D318	D318-F320 VanDerWaalsContact C-N 3.26Å; D318-F320 PolarHBondContact O-N 3.1Å; D318-F320 WeakPolarHBondContact OD1-CA 3.03Å; D318-F320 WeakPolarHBondContact OD1-CB 3.48Å; D318-F320 PolarHBondContact OD1-N 3Å
321	V	79.7	Confident	86.3	Confident	32 Å²	32	25.7 Å²	25.7	19%	0.194	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-6.4	-176.8	-60.9	0	0	0	0	113.8	D318 L324 L355 V377	D318-V321 HydrophobicContact CB-CG2 3.68Å; D318-V321 WeakPolarHBondContact OD1-CG2 3.47Å; D318-V321 PolarHBondContact OD1-N 3.28Å; V321-L324 HydrophobicContact CG2-CD1 4.01Å; V321-L324 HydrophobicContact CG2-CD2 3.71Å; V321-L324 HydrophobicContact CG2-CG 3.86Å; V321-L355 HydrophobicContact CG2-CD1 4.39Å; V321-V377 HydrophobicContact CB-CG1 4.12Å; V321-V377 WeakPolarHBondContact O-CG1 3.5Å
322	G	83.9	Confident	86.4	Confident	29 Å²	29	25.7 Å²	25.7	30%	0.299	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	80.3	-146.1	-176.5	0	0	0	0	0	111.6	D318 L324	D318-G322 WeakPolarHBondContact CA-O 3.41Å; D318-G322 WeakPolarHBondContact CB-O 3.03Å; D318-G322 PolarHBondContact N-O 3.44Å; D318-G322 VanDerWaalsContact O-CA 3.24Å; D318-G322 WeakPolarHBondContact O-CA 3.46Å; D318-G322 PolarHBondContact O-N 2.83Å; G322-L324 PolarHBondContact O-N 3.12Å
323	R	87.4	Confident	86.5	Confident	45 Å²	45	27.8 Å²	27.8	17%	0.17	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	122.6	-175.6	-172.4	170.5	174.5	-176.3	4.5	111.7	V315 G378 L379 K380 T382 E431	V315-R323 HydrophobicContact CG1-CG 3.92Å; R323-G378 PolarHBondContact O-N 3.44Å; R323-L379 VanDerWaalsContact CD-O 3.3Å; R323-L379 WeakPolarHBondContact CD-O 3.4Å; R323-L379 PolarHBondContact NE-O 2.9Å; R323-K380 PolarHBondContact NH1-O 2.82Å; R323-T382 PolarHBondContact NH2-O 3.17Å; R323-E431 IonicContact CZ-OE2 2.86Å; R323-E431 IonicContact NH1-OE2 3.13Å
324	L	88.9	Confident	86.9	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	133.6	171.3	-70.9	176.9	0	0	0	109.5	V315 M316 D318 V321 G322 F326 L355 A375 A376 V377	V315-L324 WeakPolarHBondContact CA-O 3.36Å; M316-L324 HydrophobicContact CE-CD1 3.83Å; M316-L324 PolarHBondContact N-O 3.27Å; M316-L324 PolarHBondContact O-N 3.48Å; D318-L324 HydrophobicContact CB-CD1 3.78Å; D318-L324 HydrophobicContact CB-CG 4.15Å; V321-L324 HydrophobicContact CG2-CD1 4.01Å; V321-L324 HydrophobicContact CG2-CD2 3.71Å; V321-L324 HydrophobicContact CG2-CG 3.86Å; G322-L324 PolarHBondContact O-N 3.12Å; L324-F326 HydrophobicContact CB-CE2 4.39Å; L324-L355 HydrophobicContact CD2-CD1 3.91Å; L324-A375 HydrophobicContact CD2-CB 4.37Å; L324-A376 WeakPolarHBondContact CA-O 3.45Å; L324-V377 HydrophobicContact CD2-CB 4.45Å; L324-V377 HydrophobicContact CD2-CG2 3.73Å
325	T	91	Very high	87.3	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	110.7	172.5	-56.1	0	0	0	0	108.1	A312 K314 V315 F327 A375 A376 L379 T382	A312-T325 HydrophobicContact CB-CG2 3.62Å; K314-T325 CarbonylContact O-C 3.6Å; V315-T325 HydrophobicContact CG2-CG2 4.33Å; T325-F327 WeakPolarHBondContact O-CD1 3.45Å; T325-A375 CarbonylContact O-C 3.58Å; T325-A375 VanDerWaalsContact O-CA 3.3Å; T325-A375 WeakPolarHBondContact O-CA 3.38Å; T325-A376 PolarHBondContact N-O 2.8Å; T325-A376 PolarHBondContact O-N 3.12Å; T325-L379 HydrophobicContact CG2-CD1 4.11Å; T325-T382 HydrophobicContact CG2-CG2 3.82Å
326	F	89.7	Confident	87.6	Confident	13 Å²	13	33 Å²	33	6%	0.057	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	134.4	173.2	-69.2	-104.3	0	0	0	109.7	A67 A312 F313 K314 M316 L324 M357 A374 A375	A67-F326 HydrophobicContact CB-CE1 4.41Å; A312-F326 CarbonylContact C-O 3.59Å; A312-F326 VanDerWaalsContact CA-O 3.32Å; A312-F326 WeakPolarHBondContact CA-O 3.49Å; F313-F326 HydrophobicContact CD1-CB 4.29Å; F313-F326 HydrophobicContact CE1-CB 3.71Å; F313-F326 HydrophobicContact CE2-CB 4.12Å; F313-F326 HydrophobicContact CZ-CB 3.62Å; F313-F326 HydrophobicContact CZ-CD1 4.38Å; F313-F326 HydrophobicContact CZ-CG 4.39Å; F313-F326 PolarHBondContact N-O 2.9Å; K314-F326 HydrophobicContact CB-CB 4.02Å; K314-F326 HydrophobicContact CB-CD2 4.21Å; K314-F326 HydrophobicContact CB-CG 4.35Å; K314-F326 HydrophobicContact CD-CD2 4.25Å; K314-F326 HydrophobicContact CD-CE2 4.5Å; K314-F326 HydrophobicContact CG-CD2 3.97Å; K314-F326 PolarHBondContact O-N 3.47Å; M316-F326 HydrophobicContact CB-CE2 4.37Å; M316-F326 HydrophobicContact CE-CE2 4.29Å; L324-F326 HydrophobicContact CB-CE2 4.39Å; F326-M357 HydrophobicContact CE1-CB 4.12Å; F326-M357 HydrophobicContact CE1-CG 3.58Å; F326-M357 HydrophobicContact CZ-CE 4.46Å; F326-M357 HydrophobicContact CZ-CG 3.88Å; F326-A374 WeakPolarHBondContact CA-O 3.22Å; F326-A375 HydrophobicContact CD1-CB 4.13Å; F326-A375 HydrophobicContact CD2-CB 4.41Å; F326-A375 HydrophobicContact CE1-CB 4.25Å; F326-A375 HydrophobicContact CG-CB 4.22Å; F326-A375 HydrophobicContact CZ-CB 4.43Å
327	F	91.5	Very high	87.9	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	149	-179.9	62.1	-88.7	0	0	0	112	L311 T325 V329 L334 I354 V368 A374 A376	L311-F327 CarbonylContact O-C 3.56Å; L311-F327 WeakPolarHBondContact O-CA 3.36Å; L311-F327 WeakPolarHBondContact O-CB 3.15Å; T325-F327 WeakPolarHBondContact O-CD1 3.45Å; F327-V329 HydrophobicContact CD2-CG2 3.77Å; F327-V329 HydrophobicContact CE2-CG2 3.61Å; F327-L334 HydrophobicContact CE1-CD2 4.41Å; F327-L334 HydrophobicContact CE2-CD2 3.71Å; F327-L334 HydrophobicContact CZ-CD2 3.56Å; F327-I354 HydrophobicContact CZ-CG2 4.32Å; F327-V368 HydrophobicContact CE2-CG1 4.27Å; F327-V368 HydrophobicContact CZ-CG2 4.31Å; F327-A374 HydrophobicContact CE1-CB 4.28Å; F327-A374 HydrophobicContact CE2-CB 4.24Å; F327-A374 HydrophobicContact CZ-CB 3.83Å; F327-A374 PolarHBondContact N-O 3.03Å; F327-A374 PolarHBondContact O-N 2.87Å; F327-A374 VanDerWaalsContact O-N 3.14Å; F327-A376 HydrophobicContact CD1-CB 4.12Å; F327-A376 HydrophobicContact CE1-CB 3.68Å
328	R	91.1	Very high	88.6	Confident	3 Å²	3	33.2 Å²	33.2	1%	0.011	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	121.4	171.9	167.2	57.3	173.3	-161.3	-6.4	108.8	N12 V98 D100 S310 L311 Y330 G371	N12-R328 PolarHBondContact ND2-NH1 3.35Å; N12-R328 PolarHBondContact ND2-NH2 2.99Å; N12-R328 PolarHBondContact OD1-NH1 2.8Å; V98-R328 HydrophobicContact CB-CB 3.92Å; V98-R328 HydrophobicContact CB-CG 4.19Å; V98-R328 HydrophobicContact CG1-CB 3.89Å; V98-R328 HydrophobicContact CG1-CG 4.47Å; D100-R328 VanDerWaalsContact CG-NH2 3.33Å; D100-R328 IonicContact OD1-CZ 2.74Å; D100-R328 IonicContact OD1-NH2 3.59Å; D100-R328 PolarHBondContact OD1-NH2 3.05Å; D100-R328 IonicContact OD2-CZ 2.97Å; D100-R328 IonicContact OD2-NH2 2.72Å; D100-R328 PolarHBondContact OD2-NH2 3.01Å; S310-R328 CarbonylContact C-O 3.58Å; S310-R328 WeakPolarHBondContact CA-O 3.29Å; S310-R328 WeakPolarHBondContact CB-O 3.19Å; L311-R328 PolarHBondContact N-O 2.78Å; L311-R328 PolarHBondContact O-N 3.34Å; R328-Y330 HydrophobicContact CB-CE2 4.27Å; R328-Y330 HydrophobicContact CG-CD1 4.49Å; R328-Y330 HydrophobicContact CG-CD2 4.16Å; R328-Y330 HydrophobicContact CG-CE1 4.08Å; R328-Y330 HydrophobicContact CG-CE2 3.71Å; R328-G371 PolarHBondContact NH1-O 3.46Å
329	V	92.5	Very high	89.4	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	119.6	174.3	-173	0	0	0	0	109.3	F308 F327 S331 V368 Y369 G371 D372	F308-V329 HydrophobicContact CD2-CG1 4.04Å; F308-V329 HydrophobicContact CE2-CB 4.46Å; F308-V329 HydrophobicContact CE2-CG1 3.78Å; F308-V329 HydrophobicContact CE2-CG2 3.95Å; F327-V329 HydrophobicContact CD2-CG2 3.77Å; F327-V329 HydrophobicContact CE2-CG2 3.61Å; V329-S331 WeakPolarHBondContact CG1-O 3.37Å; V329-V368 HydrophobicContact CG2-CB 4.35Å; V329-V368 HydrophobicContact CG2-CG1 3.57Å; V329-Y369 WeakPolarHBondContact CB-O 3.44Å; V329-G371 PolarHBondContact O-N 2.94Å; V329-D372 PolarHBondContact N-O 3.3Å
330	Y	92.5	Very high	90.5	Very high	32 Å²	32	32.6 Å²	32.6	13%	0.125	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-42.5	176.4	-72.6	-80.3	0	0	0	111.3	R97 I287 A302 S309 L311 R328 L397	R97-Y330 PolarHBondContact O-OH 2.87Å; R97-Y330 VanDerWaalsContact O-OH 3.11Å; I287-Y330 HydrophobicContact CB-CD1 4.01Å; I287-Y330 HydrophobicContact CB-CE1 4.35Å; I287-Y330 HydrophobicContact CB-CG 4.21Å; I287-Y330 HydrophobicContact CD1-CD1 4.07Å; I287-Y330 HydrophobicContact CD1-CD2 3.83Å; I287-Y330 HydrophobicContact CD1-CE1 3.77Å; I287-Y330 HydrophobicContact CD1-CE2 3.51Å; I287-Y330 HydrophobicContact CD1-CG 4.1Å; I287-Y330 VanDerWaalsContact CD1-CZ 3.47Å; I287-Y330 HydrophobicContact CG2-CD1 3.93Å; I287-Y330 HydrophobicContact CG2-CD2 4.19Å; I287-Y330 HydrophobicContact CG2-CG 3.65Å; A302-Y330 WeakPolarHBondContact CA-O 3.48Å; S309-Y330 PolarHBondContact O-N 3.05Å; L311-Y330 HydrophobicContact CB-CE2 3.82Å; R328-Y330 HydrophobicContact CB-CE2 4.27Å; R328-Y330 HydrophobicContact CG-CD1 4.49Å; R328-Y330 HydrophobicContact CG-CD2 4.16Å; R328-Y330 HydrophobicContact CG-CE1 4.08Å; R328-Y330 HydrophobicContact CG-CE2 3.71Å; Y330-L397 HydrophobicContact CD2-CD1 3.95Å; Y330-L397 HydrophobicContact CE2-CD1 4.34Å
331	S	94.2	Very high	91.4	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	154.3	179.4	70.5	0	0	0	0	111.9	P301 P307 F308 S309 V329	P301-S331 WeakPolarHBondContact O-CB 3.37Å; P307-S331 PolarHBondContact O-OG 3.05Å; F308-S331 CarbonylContact C-O 3.57Å; F308-S331 VanDerWaalsContact CA-O 3.28Å; F308-S331 WeakPolarHBondContact CA-O 3.31Å; S309-S331 WeakPolarHBondContact CB-OG 3.31Å; S309-S331 PolarHBondContact N-O 3Å; S309-S331 PolarHBondContact N-OG 2.61Å; S309-S331 PolarHBondContact O-N 2.93Å; S309-S331 PolarHBondContact OG-OG 3.02Å; V329-S331 WeakPolarHBondContact CG1-O 3.37Å
332	G	93.8	Very high	92.1	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.01	14%	0.14	C	C	.	.	S	Bend	trans	71.7	-162.9	177.1	0	0	0	0	0	114.6	D303 A306 S370	D303-G332 PolarHBondContact O-N 3.01Å; A306-G332 WeakPolarHBondContact O-CA 3.35Å; A306-G332 PolarHBondContact O-N 3.3Å; G332-S370 PolarHBondContact O-N 3.06Å
333	V	93.7	Very high	92.6	Very high	44 Å²	44	23.4 Å²	23.4	27%	0.267	13%	0.129	S	C	.	.			trans	-132.9	137.1	-173.4	179.8	0	0	0	0	110	D304 T367 V368 Y369	D304-V333 HydrophobicContact CB-CG2 3.8Å; V333-T367 HydrophobicContact CG1-CG2 3.26Å; V333-V368 WeakPolarHBondContact CA-O 3.45Å; V333-Y369 HydrophobicContact CG1-CD1 4.16Å; V333-Y369 HydrophobicContact CG1-CE1 4.2Å; V333-Y369 HydrophobicContact CG2-CD1 3.74Å; V333-Y369 HydrophobicContact CG2-CE1 4.23Å
334	L	94.4	Very high	92.7	Very high	3 Å²	3	23.5 Å²	23.5	2%	0.016	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.8	174.7	-169.5	64.9	0	0	0	111	F308 F327 S338 V340 I351 I354 T367 V368	F308-L334 HydrophobicContact CD1-CD1 4.24Å; F308-L334 HydrophobicContact CD2-CB 4.07Å; F308-L334 HydrophobicContact CD2-CD1 4.47Å; F308-L334 HydrophobicContact CE1-CD1 3.89Å; F308-L334 HydrophobicContact CE2-CB 3.61Å; F308-L334 HydrophobicContact CE2-CD1 4.12Å; F308-L334 HydrophobicContact CE2-CD2 4.25Å; F308-L334 HydrophobicContact CE2-CG 4.22Å; F308-L334 HydrophobicContact CZ-CB 4.04Å; F308-L334 HydrophobicContact CZ-CD1 3.8Å; F308-L334 HydrophobicContact CZ-CD2 3.87Å; F308-L334 HydrophobicContact CZ-CG 4.12Å; F327-L334 HydrophobicContact CE1-CD2 4.41Å; F327-L334 HydrophobicContact CE2-CD2 3.71Å; F327-L334 HydrophobicContact CZ-CD2 3.56Å; L334-S338 WeakPolarHBondContact CD1-OG 3.26Å; L334-V340 HydrophobicContact CD1-CG1 3.48Å; L334-V340 VanDerWaalsContact CD1-CG1 3.48Å; L334-I351 HydrophobicContact CD1-CG1 3.98Å; L334-I351 HydrophobicContact CD2-CD1 4.46Å; L334-I351 HydrophobicContact CD2-CG1 4.13Å; L334-I351 HydrophobicContact CD2-CG2 4.28Å; L334-I351 HydrophobicContact CG-CG1 4.37Å; L334-I354 HydrophobicContact CD2-CD1 4.08Å; L334-I354 HydrophobicContact CG-CD1 4.12Å; L334-T367 CarbonylContact O-C 3.57Å; L334-T367 WeakPolarHBondContact O-CA 3.12Å; L334-V368 HydrophobicContact CB-CB 4.37Å; L334-V368 PolarHBondContact N-O 2.99Å; L334-V368 PolarHBondContact O-N 3.16Å
335	N	93.7	Very high	92.8	Very high	78 Å²	78	27.8 Å²	27.8	42%	0.417	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	144.3	175.3	-65.8	-60.1	0	0	0	110.9	S338 E366 T367	N335-S338 VanDerWaalsContact O-CB 3.23Å; N335-S338 WeakPolarHBondContact O-CB 3.31Å; N335-S338 PolarHBondContact O-N 2.87Å; N335-S338 PolarHBondContact O-OG 3.49Å; N335-E366 CarbonylContact C-O 3.56Å; N335-E366 WeakPolarHBondContact CA-O 3.37Å; N335-T367 VanDerWaalsContact OD1-CG2 3.31Å; N335-T367 WeakPolarHBondContact OD1-CG2 3.45Å; N335-T367 PolarHBondContact OD1-OG1 3.46Å
336	S	92.5	Very high	92.9	Very high	49 Å²	49	30.6 Å²	30.6	34%	0.343	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	140	168.8	172.3	0	0	0	0	110.4	S338 G352 E366	S336-S338 VanDerWaalsContact C-N 3.31Å; S336-S338 PolarHBondContact O-N 3.28Å; S336-G352 PolarHBondContact OG-O 3.48Å; S336-E366 PolarHBondContact N-O 2.83Å
337	G	90.6	Very high	93.1	Very high	37 Å²	37	34.5 Å²	34.5	38%	0.381	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.3	-5.2	-175.6	0	0	0	0	0	115.2	I351 G352	G337-I351 CarbonylContact C-O 3.53Å; G337-I351 WeakPolarHBondContact CA-O 3.47Å; G337-I351 PolarHBondContact N-O 3.01Å; G337-G352 PolarHBondContact N-O 3.48Å
338	S	92.8	Very high	93.2	Very high	34 Å²	34	41.6 Å²	41.6	24%	0.238	23%	0.229	C	C	.	.			trans	-76.7	171.1	178.8	67.6	0	0	0	0	113.6	L334 N335 S336 I351	L334-S338 WeakPolarHBondContact CD1-OG 3.26Å; N335-S338 VanDerWaalsContact O-CB 3.23Å; N335-S338 WeakPolarHBondContact O-CB 3.31Å; N335-S338 PolarHBondContact O-N 2.87Å; N335-S338 PolarHBondContact O-OG 3.49Å; S336-S338 VanDerWaalsContact C-N 3.31Å; S336-S338 PolarHBondContact O-N 3.28Å; S338-I351 PolarHBondContact O-N 3.47Å
339	Y	93.9	Very high	93.4	Very high	111 Å²	111	42 Å²	42	44%	0.435	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.3	171.2	-67.4	-92.5	0	0	0	109.5	R348 E349 R350 E391	Y339-R348 HydrophobicContact CD1-CG 4.35Å; Y339-E349 WeakPolarHBondContact CA-O 3.48Å; Y339-R350 HydrophobicContact CD1-CB 3.95Å; Y339-R350 HydrophobicContact CD1-CG 4.18Å; Y339-R350 HydrophobicContact CE1-CB 3.77Å; Y339-R350 HydrophobicContact CE1-CG 3.8Å; Y339-E391 VanDerWaalsContact CB-OE1 3.25Å; Y339-E391 WeakPolarHBondContact CB-OE1 3.45Å
340	V	95.3	Very high	93.4	Very high	3 Å²	3	49.3 Å²	49.3	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	158.8	176.9	-62.3	0	0	0	0	109.6	F308 L334 E349 I351 L388	F308-V340 HydrophobicContact CD1-CG1 3.89Å; F308-V340 HydrophobicContact CE1-CB 4.31Å; F308-V340 HydrophobicContact CE1-CG1 3.62Å; L334-V340 HydrophobicContact CD1-CG1 3.48Å; L334-V340 VanDerWaalsContact CD1-CG1 3.48Å; V340-E349 HydrophobicContact CG2-CB 3.94Å; V340-E349 PolarHBondContact N-O 3.16Å; V340-E349 PolarHBondContact O-N 3.21Å; V340-I351 HydrophobicContact CG1-CD1 4.48Å; V340-I351 HydrophobicContact CG1-CG1 4.03Å; V340-I351 HydrophobicContact CG2-CD1 3.72Å; V340-I351 HydrophobicContact CG2-CG1 4.04Å; V340-L388 HydrophobicContact CG2-CB 4.25Å; V340-L388 HydrophobicContact CG2-CD2 4.12Å
341	L	95.7	Very high	93.4	Very high	31 Å²	31	47.8 Å²	47.8	16%	0.162	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.9	171.7	179.2	65.5	0	0	0	109.2	A343 L388 C389 E391 P394	L341-A343 PolarHBondContact O-N 2.98Å; L341-A343 VanDerWaalsContact O-N 3.16Å; L341-L388 CarbonylContact O-C 3.55Å; L341-L388 WeakPolarHBondContact O-CA 3.41Å; L341-C389 PolarHBondContact N-O 3.41Å; L341-C389 PolarHBondContact O-N 3.23Å; L341-E391 HydrophobicContact CB-CG 4.16Å; L341-P394 HydrophobicContact CD2-CB 3.88Å; L341-P394 HydrophobicContact CD2-CG 3.91Å
342	N	95.7	Very high	93.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	95.1	158	-177.3	-20.8	0	0	0	107.6	S344 K345 G346 K347 E349 D386 T387 L388	N342-S344 VanDerWaalsContact C-N 3.32Å; N342-S344 PolarHBondContact OD1-N 3.32Å; N342-K345 PolarHBondContact O-N 3.4Å; N342-K345 PolarHBondContact OD1-N 3.23Å; N342-G346 WeakPolarHBondContact O-CA 3.41Å; N342-G346 PolarHBondContact O-N 3.36Å; N342-K347 WeakPolarHBondContact CB-O 3.29Å; N342-K347 PolarHBondContact N-O 3.17Å; N342-K347 PolarHBondContact O-N 2.86Å; N342-K347 VanDerWaalsContact O-N 3.1Å; N342-E349 HydrophobicContact CB-CG 4.37Å; N342-D386 PolarHBondContact ND2-OD2 2.99Å; N342-T387 CarbonylContact C-O 3.51Å; N342-T387 VanDerWaalsContact CA-O 3.32Å; N342-T387 WeakPolarHBondContact CA-O 3.26Å; N342-L388 HydrophobicContact CB-CD2 4.01Å
343	A	93	Very high	93.2	Very high	8 Å²	8	54.4 Å²	54.4	7%	0.066	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-33.6	-174.6	0	0	0	0	0	112	L341 K345 G346 T387 V395 I396	L341-A343 PolarHBondContact O-N 2.98Å; L341-A343 VanDerWaalsContact O-N 3.16Å; A343-K345 PolarHBondContact O-N 3.32Å; A343-G346 PolarHBondContact O-N 2.87Å; A343-T387 PolarHBondContact N-O 2.69Å; A343-V395 WeakPolarHBondContact CB-O 3.35Å; A343-I396 HydrophobicContact CB-CG1 3.86Å
344	S	91	Very high	93.1	Very high	47 Å²	47	52.3 Å²	52.3	33%	0.329	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.9	177.7	-53.1	0	0	0	0	112.5	N342 T387	N342-S344 VanDerWaalsContact C-N 3.32Å; N342-S344 PolarHBondContact OD1-N 3.32Å; S344-T387 PolarHBondContact OG-N 2.94Å
345	K	91.2	Very high	92.8	Very high	89 Å²	89	52.6 Å²	52.6	39%	0.387	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	0.3	-178.6	-63.8	-179.7	-174.6	165.9	0	114.3	N342 A343 K347 D381 T383 D386	N342-K345 PolarHBondContact O-N 3.4Å; N342-K345 PolarHBondContact OD1-N 3.23Å; A343-K345 PolarHBondContact O-N 3.32Å; K345-K347 PolarHBondContact O-N 3.41Å; K345-D381 VanDerWaalsContact CD-O 3.27Å; K345-D381 WeakPolarHBondContact CD-O 2.98Å; K345-D381 PolarHBondContact NZ-O 3.27Å; K345-T383 PolarHBondContact NZ-OG1 3.39Å; K345-D386 WeakPolarHBondContact CE-OD1 3.38Å; K345-D386 WeakPolarHBondContact CE-OD2 3.5Å; K345-D386 IonicContact NZ-OD1 3.14Å; K345-D386 IonicContact NZ-OD2 2.84Å; K345-D386 PolarHBondContact NZ-OD2 3.41Å
346	G	91.5	Very high	92.4	Very high	60 Å²	60	49.9 Å²	49.9	62%	0.619	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.1	27.2	-175.1	0	0	0	0	0	114.1	N342 A343	N342-G346 WeakPolarHBondContact O-CA 3.41Å; N342-G346 PolarHBondContact O-N 3.36Å; A343-G346 PolarHBondContact O-N 2.87Å
347	K	93.6	Very high	91.6	Very high	95 Å²	95	48.4 Å²	48.4	41%	0.413	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139.2	-175.3	-75.3	-162.2	179.9	-175.4	0	112.4	N342 K345 D381	N342-K347 WeakPolarHBondContact CB-O 3.29Å; N342-K347 PolarHBondContact N-O 3.17Å; N342-K347 PolarHBondContact O-N 2.86Å; N342-K347 VanDerWaalsContact O-N 3.1Å; K345-K347 PolarHBondContact O-N 3.41Å; K347-D381 HydrophobicContact CB-CB 4.43Å; K347-D381 HydrophobicContact CD-CB 3.75Å; K347-D381 WeakPolarHBondContact CD-OD1 3.32Å; K347-D381 VanDerWaalsContact CD-OD2 3.22Å; K347-D381 WeakPolarHBondContact CD-OD2 3.47Å; K347-D381 VanDerWaalsContact NZ-CG 3.3Å; K347-D381 IonicContact NZ-OD1 3.53Å; K347-D381 PolarHBondContact NZ-OD1 2.87Å; K347-D381 IonicContact NZ-OD2 3.64Å; K347-D381 PolarHBondContact NZ-OD2 2.98Å
348	R	94.4	Very high	90.7	Very high	149 Å²	149	47.5 Å²	47.5	56%	0.562	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.5	126	176.4	-167.8	-175.4	-171	170.5	17.7	110.2	Y339 E391	Y339-R348 HydrophobicContact CD1-CG 4.35Å; R348-E391 IonicContact CZ-OE1 2.93Å; R348-E391 IonicContact CZ-OE2 3.87Å; R348-E391 IonicContact NE-OE1 3.15Å; R348-E391 PolarHBondContact NE-OE1 2.92Å; R348-E391 IonicContact NE-OE2 2.8Å; R348-E391 VanDerWaalsContact NH2-CD 3.32Å; R348-E391 IonicContact NH2-OE1 2.73Å; R348-E391 PolarHBondContact NH2-OE1 3.38Å; R348-E391 IonicContact NH2-OE2 3.37Å; R348-E391 PolarHBondContact NH2-OE2 2.58Å
349	E	94.6	Very high	89.3	Confident	12 Å²	12	46.6 Å²	46.6	6%	0.056	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	149.1	-179.4	-79.1	-75.6	-167.3	0	0	111	Y339 V340 N342 L379 K380 D381 T382	Y339-E349 WeakPolarHBondContact CA-O 3.48Å; V340-E349 HydrophobicContact CG2-CB 3.94Å; V340-E349 PolarHBondContact N-O 3.16Å; V340-E349 PolarHBondContact O-N 3.21Å; N342-E349 HydrophobicContact CB-CG 4.37Å; E349-L379 HydrophobicContact CB-CD2 4.27Å; E349-K380 PolarHBondContact OE1-N 2.97Å; E349-K380 PolarHBondContact OE2-N 2.96Å; E349-D381 WeakPolarHBondContact OE1-CA 3.47Å; E349-D381 WeakPolarHBondContact OE1-CB 3.27Å; E349-D381 PolarHBondContact OE1-N 3.34Å; E349-T382 PolarHBondContact OE1-N 3.15Å; E349-T382 PolarHBondContact OE1-OG1 2.78Å
350	R	93.5	Very high	87.8	Confident	152 Å²	152	45.4 Å²	45.4	57%	0.574	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	120.3	177.4	-174.8	179.4	178.3	-172.5	-2.7	109.7	Y339 G352	Y339-R350 HydrophobicContact CD1-CB 3.95Å; Y339-R350 HydrophobicContact CD1-CG 4.18Å; Y339-R350 HydrophobicContact CE1-CB 3.77Å; Y339-R350 HydrophobicContact CE1-CG 3.8Å; R350-G352 PolarHBondContact O-N 2.66Å; R350-G352 VanDerWaalsContact O-N 3.14Å
351	I	93.1	Very high	86.5	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.			trans	-78.9	100.6	173.4	-54.6	-50.2	0	0	0	108.3	L334 G337 S338 V340 I354 A376 L379	L334-I351 HydrophobicContact CD1-CG1 3.98Å; L334-I351 HydrophobicContact CD2-CD1 4.46Å; L334-I351 HydrophobicContact CD2-CG1 4.13Å; L334-I351 HydrophobicContact CD2-CG2 4.28Å; L334-I351 HydrophobicContact CG-CG1 4.37Å; G337-I351 CarbonylContact C-O 3.53Å; G337-I351 WeakPolarHBondContact CA-O 3.47Å; G337-I351 PolarHBondContact N-O 3.01Å; S338-I351 PolarHBondContact O-N 3.47Å; V340-I351 HydrophobicContact CG1-CD1 4.48Å; V340-I351 HydrophobicContact CG1-CG1 4.03Å; V340-I351 HydrophobicContact CG2-CD1 3.72Å; V340-I351 HydrophobicContact CG2-CG1 4.04Å; I351-I354 HydrophobicContact CG2-CD1 3.87Å; I351-I354 HydrophobicContact CG2-CG1 3.55Å; I351-A376 HydrophobicContact CD1-CB 4.34Å; I351-L379 HydrophobicContact CD1-CD1 4.37Å; I351-L379 HydrophobicContact CD1-CD2 3.7Å
352	G	90.3	Very high	85.5	Confident	34 Å²	34	51.8 Å²	51.8	35%	0.351	26%	0.261	S	S	.	.			trans	-70.8	-80.5	176.3	0	0	0	0	0	111	S336 G337 R350	S336-G352 PolarHBondContact OG-O 3.48Å; G337-G352 PolarHBondContact N-O 3.48Å; R350-G352 PolarHBondContact O-N 2.66Å; R350-G352 VanDerWaalsContact O-N 3.14Å
353	R	92	Very high	85	Confident	107 Å²	107	57.2 Å²	57.2	40%	0.404	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	148.9	178.6	-64.1	-179.7	-68.6	174.9	-0.4	109.9	E364 V377	R353-E364 VanDerWaalsContact CD-OE1 3.23Å; R353-E364 WeakPolarHBondContact CD-OE1 3.2Å; R353-E364 VanDerWaalsContact CG-OE1 3.26Å; R353-E364 WeakPolarHBondContact CG-OE1 3.4Å; R353-V377 HydrophobicContact CB-CB 4.36Å; R353-V377 HydrophobicContact CB-CG2 4.13Å; R353-V377 PolarHBondContact O-N 3.25Å
354	I	92.3	Very high	84.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.6	175.5	-53.4	177.1	0	0	0	108.2	F327 L334 I351 E364 I365 V368 A374 A375	F327-I354 HydrophobicContact CZ-CG2 4.32Å; L334-I354 HydrophobicContact CD2-CD1 4.08Å; L334-I354 HydrophobicContact CG-CD1 4.12Å; I351-I354 HydrophobicContact CG2-CD1 3.87Å; I351-I354 HydrophobicContact CG2-CG1 3.55Å; I354-E364 WeakPolarHBondContact O-CA 3.36Å; I354-I365 HydrophobicContact CB-CG1 4.1Å; I354-I365 HydrophobicContact CG2-CD1 3.88Å; I354-I365 HydrophobicContact CG2-CG1 3.69Å; I354-I365 PolarHBondContact O-N 2.93Å; I354-V368 HydrophobicContact CD1-CG2 3.94Å; I354-V368 HydrophobicContact CG2-CG2 3.44Å; I354-V368 VanDerWaalsContact CG2-CG2 3.44Å; I354-A374 HydrophobicContact CG2-CB 3.83Å; I354-A375 WeakPolarHBondContact CA-O 3.37Å
355	L	89.2	Confident	84.8	Confident	9 Å²	9	61.4 Å²	61.4	5%	0.047	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	132	178.1	-57.4	178.1	0	0	0	109.6	V321 L324 M357 K363 E364 A375 V377	V321-L355 HydrophobicContact CG2-CD1 4.39Å; L324-L355 HydrophobicContact CD2-CD1 3.91Å; L355-M357 HydrophobicContact CB-SD 4.28Å; L355-K363 WeakPolarHBondContact CA-O 3.46Å; L355-E364 HydrophobicContact CD2-CB 4.07Å; L355-E364 HydrophobicContact CD2-CG 4.35Å; L355-A375 PolarHBondContact N-O 3.13Å; L355-A375 PolarHBondContact O-N 3.49Å; L355-V377 HydrophobicContact CD1-CG2 3.73Å; L355-V377 HydrophobicContact CG-CG2 3.92Å
356	Q	84.2	Confident	84.8	Confident	21 Å²	21	64.9 Å²	64.9	10%	0.098	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	121	159.7	-169.6	173.7	20.4	0	0	108.2	T69 K363 I365	T69-Q356 PolarHBondContact OG1-NE2 3.31Å; Q356-K363 HydrophobicContact CB-CB 4.45Å; Q356-K363 PolarHBondContact N-O 3.41Å; Q356-K363 PolarHBondContact O-N 3.09Å; Q356-I365 HydrophobicContact CB-CD1 4.08Å; Q356-I365 HydrophobicContact CB-CG1 4.44Å; Q356-I365 HydrophobicContact CB-CG2 4.08Å
357	M	76.7	Confident	84.8	Confident	17 Å²	17	63.7 Å²	63.7	8%	0.084	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	139.8	-178.7	-61.7	-61.4	-67.7	0	0	110.5	F326 L355 R362 A375	F326-M357 HydrophobicContact CE1-CB 4.12Å; F326-M357 HydrophobicContact CE1-CG 3.58Å; F326-M357 HydrophobicContact CZ-CE 4.46Å; F326-M357 HydrophobicContact CZ-CG 3.88Å; L355-M357 HydrophobicContact CB-SD 4.28Å; M357-R362 HydrophobicContact CE-CG 4.15Å; M357-R362 HydrophobicContact SD-CG 3.94Å; M357-A375 HydrophobicContact CG-CB 4.23Å
358	H	70.5	Confident	84.7	Confident	19 Å²	19	59.2 Å²	59.2	9%	0.088	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	86.4	170.1	-74.8	-64.1	0	0	0	107.6	K36 T69 N360 T361	K36-H358 WeakPolarHBondContact CE-CE1 3.15Å; K36-H358 WeakPolarHBondContact CE-ND1 3.29Å; K36-H358 WeakPolarHBondContact CE-NE2 3.45Å; K36-H358 PolarHBondContact NZ-CE1 2.79Å; K36-H358 PolarHBondContact NZ-NE2 2.94Å; T69-H358 PolarHBondContact N-ND1 2.97Å; T69-H358 PolarHBondContact O-CE1 3.02Å; T69-H358 PolarHBondContact O-ND1 3.36Å; T69-H358 VanDerWaalsContact O-ND1 3.11Å; H358-N360 PolarHBondContact O-N 2.86Å; H358-T361 VanDerWaalsContact CB-OG1 3.3Å; H358-T361 WeakPolarHBondContact CB-OG1 3.35Å; H358-T361 PolarHBondContact N-O 2.82Å; H358-T361 PolarHBondContact O-N 2.91Å; H358-T361 PolarHBondContact O-OG1 3.32Å
359	A	63.9	Low	84.6	Confident	14 Å²	14	54.2 Å²	54.2	12%	0.116	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.2	-103.9	-170.1	0	0	0	0	0	110.8	M50 A67	M50-A359 HydrophobicContact SD-CB 3.84Å; A67-A359 PolarHBondContact O-N 2.91Å
360	N	62.5	Low	84.3	Confident	86 Å²	86	53.7 Å²	53.7	46%	0.46	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-14	178.7	64.4	-0.5	0	0	0	115	H358	H358-N360 PolarHBondContact O-N 2.86Å
361	T	67.5	Low	84	Confident	79 Å²	79	46.4 Å²	46.4	49%	0.485	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.8	-179.6	56.9	0	0	0	0	111.8	H358	H358-T361 VanDerWaalsContact CB-OG1 3.3Å; H358-T361 WeakPolarHBondContact CB-OG1 3.35Å; H358-T361 PolarHBondContact N-O 2.82Å; H358-T361 PolarHBondContact O-N 2.91Å; H358-T361 PolarHBondContact O-OG1 3.32Å
362	R	75.7	Confident	83.7	Confident	90 Å²	90	47.1 Å²	47.1	34%	0.34	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	122.3	-171	-55.1	165.9	-154.4	-168.4	-4.2	108.8	D318 M357	D318-R362 VanDerWaalsContact CG-NH1 3.28Å; D318-R362 IonicContact OD1-CZ 2.64Å; D318-R362 IonicContact OD1-NH1 3.82Å; D318-R362 PolarHBondContact OD1-NH1 2.92Å; D318-R362 IonicContact OD1-NH2 3.71Å; D318-R362 PolarHBondContact OD1-NH2 3.3Å; D318-R362 IonicContact OD2-CZ 3.12Å; D318-R362 VanDerWaalsContact OD2-CZ 3.22Å; D318-R362 IonicContact OD2-NH1 3.42Å; D318-R362 PolarHBondContact OD2-NH1 3.44Å; D318-R362 IonicContact OD2-NH2 3.78Å; D318-R362 PolarHBondContact OD2-NH2 3.16Å; M357-R362 HydrophobicContact CE-CG 4.15Å; M357-R362 HydrophobicContact SD-CG 3.94Å
363	K	84.1	Confident	83.6	Confident	113 Å²	113	46.1 Å²	46.1	49%	0.491	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	116.6	171	-176.3	-177.2	175.7	-170	0	108.3	L355 Q356 I365	L355-K363 WeakPolarHBondContact CA-O 3.46Å; Q356-K363 HydrophobicContact CB-CB 4.45Å; Q356-K363 PolarHBondContact N-O 3.41Å; Q356-K363 PolarHBondContact O-N 3.09Å; K363-I365 HydrophobicContact CD-CG2 4.45Å; K363-I365 HydrophobicContact CG-CG2 4.3Å
364	E	89.6	Confident	83.5	Confident	114 Å²	114	41.1 Å²	41.1	53%	0.533	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	131.7	171.8	-169.4	164.7	178.6	0	0	109.3	R353 I354 L355	R353-E364 VanDerWaalsContact CD-OE1 3.23Å; R353-E364 WeakPolarHBondContact CD-OE1 3.2Å; R353-E364 VanDerWaalsContact CG-OE1 3.26Å; R353-E364 WeakPolarHBondContact CG-OE1 3.4Å; I354-E364 WeakPolarHBondContact O-CA 3.36Å; L355-E364 HydrophobicContact CD2-CB 4.07Å; L355-E364 HydrophobicContact CD2-CG 4.35Å
365	I	90.3	Very high	83.4	Confident	29 Å²	29	41.1 Å²	41.1	15%	0.149	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	145.8	-178.7	56.1	167.8	0	0	0	110.1	I354 Q356 K363 V368 A374	I354-I365 HydrophobicContact CB-CG1 4.1Å; I354-I365 HydrophobicContact CG2-CD1 3.88Å; I354-I365 HydrophobicContact CG2-CG1 3.69Å; I354-I365 PolarHBondContact O-N 2.93Å; Q356-I365 HydrophobicContact CB-CD1 4.08Å; Q356-I365 HydrophobicContact CB-CG1 4.44Å; Q356-I365 HydrophobicContact CB-CG2 4.08Å; K363-I365 HydrophobicContact CD-CG2 4.45Å; K363-I365 HydrophobicContact CG-CG2 4.3Å; I365-V368 HydrophobicContact CD1-CG2 3.67Å; I365-A374 HydrophobicContact CD1-CB 4.38Å
366	E	91.3	Very high	83.6	Confident	163 Å²	163	40.7 Å²	40.7	76%	0.762	20%	0.198	S	C	*	.	S	Bend	trans	-83.7	-33.1	-178.3	-65.9	-174.1	170.1	0	0	112.6	N335 S336	N335-E366 CarbonylContact C-O 3.56Å; N335-E366 WeakPolarHBondContact CA-O 3.37Å; S336-E366 PolarHBondContact N-O 2.83Å
367	T	91.6	Very high	83.9	Confident	35 Å²	35	40.4 Å²	40.4	22%	0.215	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	139.2	-171.4	-55.4	0	0	0	0	111	V333 L334 N335 Y369	V333-T367 HydrophobicContact CG1-CG2 3.26Å; L334-T367 CarbonylContact O-C 3.57Å; L334-T367 WeakPolarHBondContact O-CA 3.12Å; N335-T367 VanDerWaalsContact OD1-CG2 3.31Å; N335-T367 WeakPolarHBondContact OD1-CG2 3.45Å; N335-T367 PolarHBondContact OD1-OG1 3.46Å; T367-Y369 HydrophobicContact CG2-CD1 4.49Å; T367-Y369 HydrophobicContact CG2-CD2 4.39Å; T367-Y369 HydrophobicContact CG2-CE1 3.97Å; T367-Y369 HydrophobicContact CG2-CE2 3.87Å
368	V	90.8	Very high	84.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.6	172.7	-172	0	0	0	0	108.1	F327 V329 V333 L334 I354 I365 D372 A374	F327-V368 HydrophobicContact CE2-CG1 4.27Å; F327-V368 HydrophobicContact CZ-CG2 4.31Å; V329-V368 HydrophobicContact CG2-CB 4.35Å; V329-V368 HydrophobicContact CG2-CG1 3.57Å; V333-V368 WeakPolarHBondContact CA-O 3.45Å; L334-V368 HydrophobicContact CB-CB 4.37Å; L334-V368 PolarHBondContact N-O 2.99Å; L334-V368 PolarHBondContact O-N 3.16Å; I354-V368 HydrophobicContact CD1-CG2 3.94Å; I354-V368 HydrophobicContact CG2-CG2 3.44Å; I354-V368 VanDerWaalsContact CG2-CG2 3.44Å; I365-V368 HydrophobicContact CD1-CG2 3.67Å; V368-D372 HydrophobicContact CG1-CB 3.54Å; V368-A374 HydrophobicContact CG1-CB 4.11Å; V368-A374 HydrophobicContact CG2-CB 3.73Å
369	Y	91.8	Very high	85.4	Confident	45 Å²	45	40.7 Å²	40.7	18%	0.176	21%	0.21	C	C	.	.			trans	-100.3	172.5	-177.1	-63	-85.7	0	0	0	111.6	A2 R3 V329 V333 T367 D372	A2-Y369 HydrophobicContact CB-CE1 4.28Å; A2-Y369 PolarHBondContact O-OH 3.22Å; R3-Y369 HydrophobicContact CG-CD1 3.92Å; R3-Y369 HydrophobicContact CG-CD2 4Å; R3-Y369 HydrophobicContact CG-CE1 4.16Å; R3-Y369 HydrophobicContact CG-CE2 4.21Å; R3-Y369 HydrophobicContact CG-CG 3.86Å; R3-Y369 VanDerWaalsContact NE-CB 3.27Å; V329-Y369 WeakPolarHBondContact CB-O 3.44Å; V333-Y369 HydrophobicContact CG1-CD1 4.16Å; V333-Y369 HydrophobicContact CG1-CE1 4.2Å; V333-Y369 HydrophobicContact CG2-CD1 3.74Å; V333-Y369 HydrophobicContact CG2-CE1 4.23Å; T367-Y369 HydrophobicContact CG2-CD1 4.49Å; T367-Y369 HydrophobicContact CG2-CD2 4.39Å; T367-Y369 HydrophobicContact CG2-CE1 3.97Å; T367-Y369 HydrophobicContact CG2-CE2 3.87Å; Y369-D372 WeakPolarHBondContact O-CB 3.47Å; Y369-D372 PolarHBondContact O-N 3.26Å
370	S	89.9	Confident	86.4	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	145.5	170.6	53.4	0	0	0	0	110.8	R3 L7 D304 G332 D372	R3-S370 PolarHBondContact NH2-O 3.3Å; R3-S370 PolarHBondContact NH2-OG 2.92Å; L7-S370 VanDerWaalsContact CD2-O 3.23Å; L7-S370 WeakPolarHBondContact CD2-O 3.39Å; D304-S370 PolarHBondContact N-OG 3.19Å; D304-S370 PolarHBondContact OD1-N 2.96Å; D304-S370 VanDerWaalsContact OD1-N 3.14Å; D304-S370 PolarHBondContact OD1-OG 2.75Å; G332-S370 PolarHBondContact O-N 3.06Å; S370-D372 PolarHBondContact O-N 3.05Å
371	G	86.5	Confident	87.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	7.8	-178.9	0	0	0	0	0	115.7	N12 R328 V329	N12-G371 PolarHBondContact ND2-O 2.74Å; N12-G371 PolarHBondContact OD1-O 3.49Å; R328-G371 PolarHBondContact NH1-O 3.46Å; V329-G371 PolarHBondContact O-N 2.94Å
372	D	86.9	Confident	88.9	Confident	14 Å²	14	42.4 Å²	42.4	8%	0.075	21%	0.206	C	C	.	.			trans	-99.6	156.8	173.7	-80	-12.3	0	0	0	112.8	R76 V329 V368 Y369 S370	R76-D372 IonicContact CZ-OD1 2.67Å; R76-D372 IonicContact CZ-OD2 2.77Å; R76-D372 IonicContact NE-OD1 3.95Å; R76-D372 IonicContact NH1-OD1 3.89Å; R76-D372 PolarHBondContact NH1-OD1 2.93Å; R76-D372 IonicContact NH1-OD2 2.78Å; R76-D372 PolarHBondContact NH1-OD2 3.47Å; R76-D372 IonicContact NH2-OD1 3.05Å; R76-D372 PolarHBondContact NH2-OD1 2.86Å; R76-D372 IonicContact NH2-OD2 2.68Å; V329-D372 PolarHBondContact N-O 3.3Å; V368-D372 HydrophobicContact CG1-CB 3.54Å; Y369-D372 WeakPolarHBondContact O-CB 3.47Å; Y369-D372 PolarHBondContact O-N 3.26Å; S370-D372 PolarHBondContact O-N 3.05Å
373	I	87.5	Confident	89.5	Confident	14 Å²	14	39.8 Å²	39.8	7%	0.072	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	129.1	172.7	-61.1	168.6	0	0	0	108	N78 I80 F313	N78-I373 HydrophobicContact CB-CD1 4.38Å; I80-I373 HydrophobicContact CD1-CD1 4.14Å; I80-I373 HydrophobicContact CG1-CD1 4.48Å; F313-I373 HydrophobicContact CE1-CG2 3.95Å; F313-I373 HydrophobicContact CZ-CG2 3.9Å
374	A	89.8	Confident	89.6	Confident	2 Å²	2	34.8 Å²	34.8	2%	0.017	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	174.1	-179.9	0	0	0	0	0	111.1	F326 F327 I354 I365 V368	F326-A374 WeakPolarHBondContact CA-O 3.22Å; F327-A374 HydrophobicContact CE1-CB 4.28Å; F327-A374 HydrophobicContact CE2-CB 4.24Å; F327-A374 HydrophobicContact CZ-CB 3.83Å; F327-A374 PolarHBondContact N-O 3.03Å; F327-A374 PolarHBondContact O-N 2.87Å; F327-A374 VanDerWaalsContact O-N 3.14Å; I354-A374 HydrophobicContact CG2-CB 3.83Å; I365-A374 HydrophobicContact CD1-CB 4.38Å; V368-A374 HydrophobicContact CG1-CB 4.11Å; V368-A374 HydrophobicContact CG2-CB 3.73Å
375	A	90.7	Very high	89.5	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	132.7	174.8	0	0	0	0	0	111.6	L324 T325 F326 I354 L355 M357	L324-A375 HydrophobicContact CD2-CB 4.37Å; T325-A375 CarbonylContact O-C 3.58Å; T325-A375 VanDerWaalsContact O-CA 3.3Å; T325-A375 WeakPolarHBondContact O-CA 3.38Å; F326-A375 HydrophobicContact CD1-CB 4.13Å; F326-A375 HydrophobicContact CD2-CB 4.41Å; F326-A375 HydrophobicContact CE1-CB 4.25Å; F326-A375 HydrophobicContact CG-CB 4.22Å; F326-A375 HydrophobicContact CZ-CB 4.43Å; I354-A375 WeakPolarHBondContact CA-O 3.37Å; L355-A375 PolarHBondContact N-O 3.13Å; L355-A375 PolarHBondContact O-N 3.49Å; M357-A375 HydrophobicContact CG-CB 4.23Å
376	A	92.8	Very high	89.5	Confident	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	138.3	174.2	0	0	0	0	0	109.8	L324 T325 F327 I351 L379	L324-A376 WeakPolarHBondContact CA-O 3.45Å; T325-A376 PolarHBondContact N-O 2.8Å; T325-A376 PolarHBondContact O-N 3.12Å; F327-A376 HydrophobicContact CD1-CB 4.12Å; F327-A376 HydrophobicContact CE1-CB 3.68Å; I351-A376 HydrophobicContact CD1-CB 4.34Å; A376-L379 HydrophobicContact CB-CD1 3.86Å; A376-L379 HydrophobicContact CB-CD2 4.38Å; A376-L379 HydrophobicContact CB-CG 4.01Å
377	V	91.8	Very high	89.7	Confident	14 Å²	14	21.2 Å²	21.2	9%	0.085	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	124.5	178.4	-173.9	0	0	0	0	110.4	V321 L324 R353 L355	V321-V377 HydrophobicContact CB-CG1 4.12Å; V321-V377 WeakPolarHBondContact O-CG1 3.5Å; L324-V377 HydrophobicContact CD2-CB 4.45Å; L324-V377 HydrophobicContact CD2-CG2 3.73Å; R353-V377 HydrophobicContact CB-CB 4.36Å; R353-V377 HydrophobicContact CB-CG2 4.13Å; R353-V377 PolarHBondContact O-N 3.25Å; L355-V377 HydrophobicContact CD1-CG2 3.73Å; L355-V377 HydrophobicContact CG-CG2 3.92Å
378	G	86.1	Confident	89.9	Confident	41 Å²	41	19.5 Å²	19.5	42%	0.423	11%	0.107	S	C	.	.			trans	87.1	21.6	162.8	0	0	0	0	0	116.7	R323	R323-G378 PolarHBondContact O-N 3.44Å
379	L	91.2	Very high	90.1	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.005	11%	0.107	C	C	.	.			trans	-65.7	135.3	169.8	-53.7	-173.3	0	0	0	109.8	R323 T325 E349 I351 A376 T382 L388	R323-L379 VanDerWaalsContact CD-O 3.3Å; R323-L379 WeakPolarHBondContact CD-O 3.4Å; R323-L379 PolarHBondContact NE-O 2.9Å; T325-L379 HydrophobicContact CG2-CD1 4.11Å; E349-L379 HydrophobicContact CB-CD2 4.27Å; I351-L379 HydrophobicContact CD1-CD1 4.37Å; I351-L379 HydrophobicContact CD1-CD2 3.7Å; A376-L379 HydrophobicContact CB-CD1 3.86Å; A376-L379 HydrophobicContact CB-CD2 4.38Å; A376-L379 HydrophobicContact CB-CG 4.01Å; L379-T382 HydrophobicContact CD1-CG2 4.17Å; L379-L388 HydrophobicContact CD1-CD1 3.8Å
380	K	86.4	Confident	90.2	Very high	163 Å²	163	20.1 Å²	20.1	71%	0.709	11%	0.114	S	C	*	.	S	Bend	trans	-99.1	-38	-169.3	-69.4	-175.7	179.6	-179.1	0	113	R323 E349	R323-K380 PolarHBondContact NH1-O 2.82Å; E349-K380 PolarHBondContact OE1-N 2.97Å; E349-K380 PolarHBondContact OE2-N 2.96Å
381	D	89.7	Confident	90.2	Very high	53 Å²	53	23.7 Å²	23.7	28%	0.283	13%	0.13	S	C	.	.	S	Bend	trans	-108.7	-11.2	-173.5	-66.5	-71.7	0	0	0	111.7	K345 K347 E349	K345-D381 VanDerWaalsContact CD-O 3.27Å; K345-D381 WeakPolarHBondContact CD-O 2.98Å; K345-D381 PolarHBondContact NZ-O 3.27Å; K347-D381 HydrophobicContact CB-CB 4.43Å; K347-D381 HydrophobicContact CD-CB 3.75Å; K347-D381 WeakPolarHBondContact CD-OD1 3.32Å; K347-D381 VanDerWaalsContact CD-OD2 3.22Å; K347-D381 WeakPolarHBondContact CD-OD2 3.47Å; K347-D381 VanDerWaalsContact NZ-CG 3.3Å; K347-D381 IonicContact NZ-OD1 3.53Å; K347-D381 PolarHBondContact NZ-OD1 2.87Å; K347-D381 IonicContact NZ-OD2 3.64Å; K347-D381 PolarHBondContact NZ-OD2 2.98Å; E349-D381 WeakPolarHBondContact OE1-CA 3.47Å; E349-D381 WeakPolarHBondContact OE1-CB 3.27Å; E349-D381 PolarHBondContact OE1-N 3.34Å
382	T	91.5	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.			trans	-79.4	118.2	179.1	-48.7	0	0	0	0	113.4	A312 R323 T325 E349 L379 D386 L388	A312-T382 HydrophobicContact CB-CG2 3.65Å; R323-T382 PolarHBondContact NH2-O 3.17Å; T325-T382 HydrophobicContact CG2-CG2 3.82Å; E349-T382 PolarHBondContact OE1-N 3.15Å; E349-T382 PolarHBondContact OE1-OG1 2.78Å; L379-T382 HydrophobicContact CD1-CG2 4.17Å; T382-D386 WeakPolarHBondContact CA-OD2 3.21Å; T382-D386 HydrophobicContact CG2-CB 3.92Å; T382-L388 HydrophobicContact CG2-CD1 4.24Å; T382-L388 HydrophobicContact CG2-CD2 3.83Å; T382-L388 HydrophobicContact CG2-CG 4.15Å
383	T	88.8	Confident	90.7	Very high	35 Å²	35	33.4 Å²	33.4	22%	0.215	18%	0.176	C	C	.	.			trans	-111.6	174.3	174.2	53.2	0	0	0	0	111.8	K345 G385 D386	K345-T383 PolarHBondContact NZ-OG1 3.39Å; T383-G385 PolarHBondContact O-N 3.15Å; T383-D386 PolarHBondContact N-OD2 3.47Å; T383-D386 WeakPolarHBondContact O-CB 3.07Å; T383-D386 PolarHBondContact O-N 3.28Å; T383-D386 PolarHBondContact OG1-OD2 3.25Å
384	T	87	Confident	90.9	Very high	7 Å²	7	33.5 Å²	33.5	4%	0.043	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	132.6	171.7	-58.8	0	0	0	0	110.7	R94 F313 I400 F402 P434	R94-T384 HydrophobicContact CG-CG2 4.05Å; F313-T384 VanDerWaalsContact O-CG2 3.27Å; F313-T384 WeakPolarHBondContact O-CG2 3.44Å; T384-I400 HydrophobicContact CG2-CD1 4.4Å; T384-F402 HydrophobicContact CG2-CE1 4.21Å; T384-F402 HydrophobicContact CG2-CZ 4.06Å; T384-P434 HydrophobicContact CG2-CG 4.42Å
385	G	86.5	Confident	91.1	Very high	8 Å²	8	33.4 Å²	33.4	8%	0.082	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.3	-9.7	-175.7	0	0	0	0	0	115	L311 A312 T383	L311-G385 WeakPolarHBondContact CD1-O 3.47Å; A312-G385 PolarHBondContact O-N 3.03Å; T383-G385 PolarHBondContact O-N 3.15Å
386	D	91.7	Very high	91.2	Very high	13 Å²	13	36 Å²	36	7%	0.07	19%	0.19	C	C	.	.			trans	-75.1	142.4	-179	-75.8	-10.9	0	0	0	112	A312 N342 K345 T382 T383	A312-D386 WeakPolarHBondContact CB-O 3.35Å; A312-D386 PolarHBondContact N-O 3.43Å; N342-D386 PolarHBondContact ND2-OD2 2.99Å; K345-D386 WeakPolarHBondContact CE-OD1 3.38Å; K345-D386 WeakPolarHBondContact CE-OD2 3.5Å; K345-D386 IonicContact NZ-OD1 3.14Å; K345-D386 IonicContact NZ-OD2 2.84Å; K345-D386 PolarHBondContact NZ-OD2 3.41Å; T382-D386 WeakPolarHBondContact CA-OD2 3.21Å; T382-D386 HydrophobicContact CG2-CB 3.92Å; T383-D386 PolarHBondContact N-OD2 3.47Å; T383-D386 WeakPolarHBondContact O-CB 3.07Å; T383-D386 PolarHBondContact O-N 3.28Å; T383-D386 PolarHBondContact OG1-OD2 3.25Å
387	T	94.3	Very high	91.1	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.7	174	-60.9	0	0	0	0	111.2	S310 N342 A343 S344 C389 V395 L397	S310-T387 WeakPolarHBondContact O-CA 3.45Å; N342-T387 CarbonylContact C-O 3.51Å; N342-T387 VanDerWaalsContact CA-O 3.32Å; N342-T387 WeakPolarHBondContact CA-O 3.26Å; A343-T387 PolarHBondContact N-O 2.69Å; S344-T387 PolarHBondContact OG-N 2.94Å; T387-C389 HydrophobicContact CG2-CB 4.47Å; T387-V395 HydrophobicContact CG2-CG1 4.44Å; T387-V395 WeakPolarHBondContact CG2-O 3.49Å; T387-L397 HydrophobicContact CG2-CB 4.29Å; T387-L397 HydrophobicContact CG2-CD1 3.94Å; T387-L397 HydrophobicContact CG2-CG 3.69Å; T387-L397 WeakPolarHBondContact OG1-CB 3.42Å; T387-L397 PolarHBondContact OG1-N 2.84Å
388	L	95.1	Very high	90.4	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	124.1	169.1	-54.5	173.8	0	0	0	109.7	F308 S309 S310 V340 L341 N342 L379 T382	F308-L388 HydrophobicContact CE1-CB 4.14Å; F308-L388 WeakPolarHBondContact CE1-O 3.32Å; S309-L388 CarbonylContact C-O 3.55Å; S310-L388 PolarHBondContact N-O 2.98Å; S310-L388 PolarHBondContact O-N 2.74Å; S310-L388 WeakPolarHBondContact OG-CB 3.3Å; S310-L388 PolarHBondContact OG-O 2.88Å; S310-L388 VanDerWaalsContact OG-O 3.08Å; V340-L388 HydrophobicContact CG2-CB 4.25Å; V340-L388 HydrophobicContact CG2-CD2 4.12Å; L341-L388 CarbonylContact O-C 3.55Å; L341-L388 WeakPolarHBondContact O-CA 3.41Å; N342-L388 HydrophobicContact CB-CD2 4.01Å; L379-L388 HydrophobicContact CD1-CD1 3.8Å; T382-L388 HydrophobicContact CG2-CD1 4.24Å; T382-L388 HydrophobicContact CG2-CD2 3.83Å; T382-L388 HydrophobicContact CG2-CG 4.15Å
389	C	95.5	Very high	89.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	173.9	-175.7	64.5	0	0	0	0	113.4	F308 L341 T387 V395	F308-C389 CarbonylContact O-C 3.54Å; F308-C389 WeakPolarHBondContact O-CA 3.42Å; F308-C389 WeakPolarHBondContact O-CB 3.38Å; L341-C389 PolarHBondContact N-O 3.41Å; L341-C389 PolarHBondContact O-N 3.23Å; T387-C389 HydrophobicContact CG2-CB 4.47Å; C389-V395 HydrophobicContact CB-CG1 3.9Å
390	D	94	Very high	88.7	Confident	58 Å²	58	42.6 Å²	42.6	31%	0.31	22%	0.219	S	C	.	.			trans	-65.1	131.9	172.4	-168.1	-61.5	0	0	0	111.2	P307 F308 K392 A393	P307-D390 HydrophobicContact CB-CB 4.29Å; F308-D390 HydrophobicContact CB-CB 4.34Å; F308-D390 PolarHBondContact O-N 3.15Å; D390-K392 PolarHBondContact O-N 3.4Å; D390-K392 VanDerWaalsContact O-N 3.12Å; D390-K392 WeakPolarHBondContact OD1-CA 3.38Å; D390-K392 VanDerWaalsContact OD1-CB 3.3Å; D390-K392 WeakPolarHBondContact OD1-CB 3.5Å; D390-K392 PolarHBondContact OD1-N 3.33Å; D390-A393 CarbonylContact O-C 3.59Å; D390-A393 VanDerWaalsContact O-C 3.22Å; D390-A393 PolarHBondContact O-N 3.24Å
391	E	91	Very high	87.9	Confident	75 Å²	75	42.6 Å²	42.6	35%	0.35	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-28	179.5	-68.8	174.1	-163.9	0	0	113.9	Y339 L341 R348	Y339-E391 VanDerWaalsContact CB-OE1 3.25Å; Y339-E391 WeakPolarHBondContact CB-OE1 3.45Å; L341-E391 HydrophobicContact CB-CG 4.16Å; R348-E391 IonicContact CZ-OE1 2.93Å; R348-E391 IonicContact CZ-OE2 3.87Å; R348-E391 IonicContact NE-OE1 3.15Å; R348-E391 PolarHBondContact NE-OE1 2.92Å; R348-E391 IonicContact NE-OE2 2.8Å; R348-E391 VanDerWaalsContact NH2-CD 3.32Å; R348-E391 IonicContact NH2-OE1 2.73Å; R348-E391 PolarHBondContact NH2-OE1 3.38Å; R348-E391 IonicContact NH2-OE2 3.37Å; R348-E391 PolarHBondContact NH2-OE2 2.58Å
392	K	91	Very high	87	Confident	194 Å²	194	43 Å²	43	84%	0.843	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.3	-179	-59.8	176.9	-177.1	171.5	0	112.9	D390	D390-K392 PolarHBondContact O-N 3.4Å; D390-K392 VanDerWaalsContact O-N 3.12Å; D390-K392 WeakPolarHBondContact OD1-CA 3.38Å; D390-K392 VanDerWaalsContact OD1-CB 3.3Å; D390-K392 WeakPolarHBondContact OD1-CB 3.5Å; D390-K392 PolarHBondContact OD1-N 3.33Å
393	A	92.1	Very high	86	Confident	24 Å²	24	45.1 Å²	45.1	20%	0.198	23%	0.234	C	C	.	.	S	Bend	trans	-134.6	69	177.2	0	0	0	0	0	110.1	R300 P307 D390	R300-A393 PolarHBondContact NH2-O 3Å; P307-A393 HydrophobicContact CB-CB 3.76Å; P307-A393 HydrophobicContact CG-CB 4.05Å; D390-A393 CarbonylContact O-C 3.59Å; D390-A393 VanDerWaalsContact O-C 3.22Å; D390-A393 PolarHBondContact O-N 3.24Å
394	P	92.7	Very high	85.1	Confident	16 Å²	16	47.5 Å²	47.5	10%	0.104	25%	0.246	C	C	.	.			trans	-57.3	141.6	178.4	-22.5	34.8	0	0	0	111.9	P292 L341	P292-P394 HydrophobicContact CG-CB 3.65Å; L341-P394 HydrophobicContact CD2-CB 3.88Å; L341-P394 HydrophobicContact CD2-CG 3.91Å
395	V	93.8	Very high	84.8	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.253	C	S	.	.			trans	-152.2	140.7	171.6	59	0	0	0	0	108.2	F290 T298 R300 A343 T387 C389 L397	F290-V395 CarbonylContact O-C 3.55Å; F290-V395 WeakPolarHBondContact O-CA 3.06Å; T298-V395 WeakPolarHBondContact OG1-CG2 3.45Å; R300-V395 HydrophobicContact CG-CG1 4.44Å; A343-V395 WeakPolarHBondContact CB-O 3.35Å; T387-V395 HydrophobicContact CG2-CG1 4.44Å; T387-V395 WeakPolarHBondContact CG2-O 3.49Å; C389-V395 HydrophobicContact CB-CG1 3.9Å; V395-L397 HydrophobicContact CG2-CD2 4.21Å
396	I	92.9	Very high	84.1	Confident	54 Å²	54	50 Å²	50	28%	0.277	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	112.4	166.8	-63.7	179.6	0	0	0	106.8	G289 F290 P292 A343	G289-I396 CarbonylContact C-O 3.52Å; G289-I396 WeakPolarHBondContact CA-O 3.22Å; F290-I396 PolarHBondContact N-O 3.47Å; F290-I396 PolarHBondContact O-N 3.27Å; P292-I396 HydrophobicContact CB-CD1 3.83Å; P292-I396 HydrophobicContact CB-CG1 4.18Å; A343-I396 HydrophobicContact CB-CG1 3.86Å
397	L	90.2	Very high	83.6	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	151.2	171.9	-56.6	173.1	0	0	0	108.7	I287 R300 L311 Y330 T387 V395 S399	I287-L397 HydrophobicContact CD1-CB 4.34Å; I287-L397 HydrophobicContact CD1-CD1 4.15Å; I287-L397 HydrophobicContact CD1-CD2 4.23Å; I287-L397 HydrophobicContact CD1-CG 4.45Å; I287-L397 HydrophobicContact CG1-CD2 4.11Å; I287-L397 HydrophobicContact CG2-CD2 3.75Å; R300-L397 HydrophobicContact CG-CD2 4.46Å; L311-L397 HydrophobicContact CB-CD1 4.27Å; Y330-L397 HydrophobicContact CD2-CD1 3.95Å; Y330-L397 HydrophobicContact CE2-CD1 4.34Å; T387-L397 HydrophobicContact CG2-CB 4.29Å; T387-L397 HydrophobicContact CG2-CD1 3.94Å; T387-L397 HydrophobicContact CG2-CG 3.69Å; T387-L397 WeakPolarHBondContact OG1-CB 3.42Å; T387-L397 PolarHBondContact OG1-N 2.84Å; V395-L397 HydrophobicContact CG2-CD2 4.21Å; L397-S399 PolarHBondContact O-N 3.33Å
398	E	77.1	Confident	83.1	Confident	105 Å²	105	54.8 Å²	54.8	49%	0.491	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-58.4	124.5	-176.6	-176.4	-173.6	-125.9	0	0	111.2	R97	R97-E398 IonicContact CZ-OE2 3.68Å; R97-E398 IonicContact NH1-OE2 2.95Å; R97-E398 PolarHBondContact NH1-OE2 2.84Å; R97-E398 VanDerWaalsContact NH1-OE2 3.15Å; R97-E398 PolarHBondContact NH2-O 3.08Å; R97-E398 IonicContact NH2-OE2 3.55Å; R97-E398 PolarHBondContact NH2-OE2 2.8Å
399	S	69.3	Low	82.7	Confident	82 Å²	82	55.9 Å²	55.9	57%	0.573	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-74.7	154.3	-169.5	59.9	0	0	0	0	113	L397	L397-S399 PolarHBondContact O-N 3.33Å
400	I	71.1	Confident	82.4	Confident	7 Å²	7	56.1 Å²	56.1	4%	0.036	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-76.9	123.1	173.8	-53.8	174.2	0	0	0	108.2	R94 T384 F402	R94-I400 HydrophobicContact CG-CD1 4.21Å; T384-I400 HydrophobicContact CG2-CD1 4.4Å; I400-F402 HydrophobicContact CB-CE1 4.46Å; I400-F402 HydrophobicContact CB-CE2 4.29Å; I400-F402 HydrophobicContact CB-CZ 3.98Å; I400-F402 HydrophobicContact CG2-CE1 4.08Å; I400-F402 HydrophobicContact CG2-CZ 4.1Å; I400-F402 WeakPolarHBondContact O-CD2 3.37Å; I400-F402 VanDerWaalsContact O-CE2 3.23Å; I400-F402 WeakPolarHBondContact O-CE2 3.45Å
401	E	69.7	Low	82.3	Confident	163 Å²	163	53.4 Å²	53.4	76%	0.762	28%	0.276	S	S	*	.	P	Polyproline II helix	trans	-76.3	128.9	167.1	-72.2	-170.8	169.6	0	0	109.5
402	F	72	Confident	82.2	Confident	62 Å²	62	54.4 Å²	54.4	27%	0.272	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-100.1	126	178.1	-61	-83.7	0	0	0	108.6	I90 T384 I400 P434	I90-F402 HydrophobicContact CD1-CB 4.42Å; I90-F402 HydrophobicContact CD1-CD1 3.33Å; I90-F402 HydrophobicContact CD1-CE1 3.94Å; I90-F402 HydrophobicContact CD1-CG 4.29Å; I90-F402 HydrophobicContact CG1-CD1 4.01Å; I90-F402 HydrophobicContact CG1-CE1 4.34Å; T384-F402 HydrophobicContact CG2-CE1 4.21Å; T384-F402 HydrophobicContact CG2-CZ 4.06Å; I400-F402 HydrophobicContact CB-CE1 4.46Å; I400-F402 HydrophobicContact CB-CE2 4.29Å; I400-F402 HydrophobicContact CB-CZ 3.98Å; I400-F402 HydrophobicContact CG2-CE1 4.08Å; I400-F402 HydrophobicContact CG2-CZ 4.1Å; I400-F402 WeakPolarHBondContact O-CD2 3.37Å; I400-F402 VanDerWaalsContact O-CE2 3.23Å; I400-F402 WeakPolarHBondContact O-CE2 3.45Å; F402-P434 HydrophobicContact CD1-CB 3.68Å; F402-P434 HydrophobicContact CD1-CG 3.84Å; F402-P434 HydrophobicContact CD2-CB 4.26Å; F402-P434 HydrophobicContact CE1-CB 3.77Å; F402-P434 HydrophobicContact CE1-CG 3.4Å; F402-P434 VanDerWaalsContact CE1-CG 3.4Å; F402-P434 HydrophobicContact CE2-CB 4.26Å; F402-P434 HydrophobicContact CE2-CG 4.33Å; F402-P434 HydrophobicContact CG-CB 3.99Å; F402-P434 HydrophobicContact CZ-CB 4.04Å; F402-P434 HydrophobicContact CZ-CG 3.68Å
403	P	69.9	Low	82.2	Confident	44 Å²	44	47 Å²	47	29%	0.286	25%	0.252	S	S	.	.	P	Polyproline II helix	trans	-62.1	149.6	173.9	26.7	-33.7	0	0	0	110.6	I90 M452	I90-P403 HydrophobicContact CD1-CG 4.39Å; P403-M452 HydrophobicContact CB-CE 3.95Å; P403-M452 HydrophobicContact CB-SD 4.4Å; P403-M452 HydrophobicContact CG-CE 3.62Å; P403-M452 HydrophobicContact CG-SD 3.99Å
404	D	71.1	Confident	82	Confident	85 Å²	85	51.2 Å²	51.2	46%	0.455	27%	0.266	S	S	.	.	P	Polyproline II helix	trans	-69.8	144.5	173.8	-74.1	-49.4	0	0	0	111.1	R437	D404-R437 IonicContact OD1-CZ 3.44Å; D404-R437 IonicContact OD1-NH1 3.57Å; D404-R437 PolarHBondContact OD1-NH1 2.92Å; D404-R437 IonicContact OD1-NH2 2.67Å; D404-R437 PolarHBondContact OD1-NH2 2.97Å
405	P	79	Confident	81.8	Confident	29 Å²	29	52.8 Å²	52.8	19%	0.188	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-56.4	146	172.4	-21.4	30.9	0	0	0	112.2	R437 A450 G451	P405-R437 HydrophobicContact CG-CB 4.31Å; P405-R437 HydrophobicContact CG-CG 3.9Å; P405-A450 HydrophobicContact CB-CB 3.56Å; P405-A450 HydrophobicContact CG-CB 3.85Å; P405-G451 CarbonylContact C-O 3.57Å; P405-G451 WeakPolarHBondContact CA-O 3.33Å
406	V	73	Confident	81.4	Confident	38 Å²	38	61.6 Å²	61.6	23%	0.23	32%	0.316	C	S	.	.			trans	-111.9	-9	-179.2	-61.7	0	0	0	0	113.7	G451 M452 A654 F667	V406-G451 PolarHBondContact N-O 2.99Å; V406-M452 WeakPolarHBondContact CG2-O 3.41Å; V406-A654 HydrophobicContact CG2-CB 4.28Å; V406-F667 HydrophobicContact CB-CE1 4.43Å; V406-F667 WeakPolarHBondContact O-CZ 3.23Å
407	I	80	Confident	81	Confident	18 Å²	18	62.1 Å²	62.1	9%	0.092	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	143.8	178	-173.3	166	0	0	0	110.4	A450 G451 E454 L457	I407-A450 CarbonylContact O-C 3.46Å; I407-A450 WeakPolarHBondContact O-CA 3.4Å; I407-G451 WeakPolarHBondContact CG2-O 3.32Å; I407-G451 PolarHBondContact N-O 3.45Å; I407-G451 PolarHBondContact O-N 3.3Å; I407-E454 HydrophobicContact CD1-CB 4.28Å; I407-L457 HydrophobicContact CB-CD1 4.4Å; I407-L457 HydrophobicContact CG1-CD1 4.19Å; I407-L457 HydrophobicContact CG2-CD1 3.57Å; I407-L457 HydrophobicContact CG2-CG 4.21Å
408	E	84.8	Confident	80.8	Confident	96 Å²	96	63.1 Å²	63.1	45%	0.449	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	138.7	177.1	-66.2	179.9	179.7	0	0	110	V448 I449 A450 P477	E408-V448 HydrophobicContact CB-CG1 3.92Å; E408-V448 HydrophobicContact CG-CG1 4.35Å; E408-I449 WeakPolarHBondContact CA-O 3.07Å; E408-A450 HydrophobicContact CG-CB 3.82Å; E408-P477 HydrophobicContact CB-CG 4.19Å
409	V	87.4	Confident	81.3	Confident	23 Å²	23	63.4 Å²	63.4	14%	0.139	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.2	171.8	-58.7	0	0	0	0	110.1	V448 I449 L457 V474	V409-V448 WeakPolarHBondContact O-CA 3.45Å; V409-I449 HydrophobicContact CG2-CD1 3.73Å; V409-I449 HydrophobicContact CG2-CG1 3.36Å; V409-I449 PolarHBondContact N-O 2.94Å; V409-I449 PolarHBondContact O-N 3.36Å; V409-L457 HydrophobicContact CB-CD1 4.36Å; V409-L457 HydrophobicContact CG1-CD1 3.84Å; V409-L457 HydrophobicContact CG2-CD1 3.77Å; V409-V474 HydrophobicContact CB-CG1 3.88Å; V409-V474 HydrophobicContact CG1-CG1 4.35Å; V409-V474 HydrophobicContact CG2-CG1 3.78Å
410	A	88.8	Confident	82	Confident	4 Å²	4	65.8 Å²	65.8	3%	0.033	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	139.1	169.7	0	0	0	0	0	109.8	V474 G475	A410-V474 WeakPolarHBondContact O-CA 3.2Å; A410-G475 PolarHBondContact N-O 3.2Å; A410-G475 PolarHBondContact O-N 2.77Å
411	V	91.1	Very high	82.8	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.006	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	127.6	173.1	-98.9	0	0	0	0	110.5	T447 I449 V461 A472 N473 V474	V411-T447 HydrophobicContact CG2-CG2 4.37Å; V411-T447 PolarHBondContact N-O 3.44Å; V411-I449 HydrophobicContact CG1-CD1 3.91Å; V411-I449 HydrophobicContact CG2-CB 4.14Å; V411-I449 HydrophobicContact CG2-CD1 3.8Å; V411-I449 HydrophobicContact CG2-CG1 3.81Å; V411-I449 HydrophobicContact CG2-CG2 3.39Å; V411-V461 HydrophobicContact CG1-CG2 4.22Å; V411-A472 HydrophobicContact CG1-CB 4.33Å; V411-N473 WeakPolarHBondContact CA-O 3.38Å; V411-V474 HydrophobicContact CG1-CG2 3.95Å
412	E	89.6	Confident	83.9	Confident	96 Å²	96	62.9 Å²	62.9	45%	0.449	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.9	178.4	-65.7	-170	150	0	0	111	A472 N473	E412-A472 CarbonylContact O-C 3.59Å; E412-A472 VanDerWaalsContact O-CA 3.23Å; E412-A472 WeakPolarHBondContact O-CA 3.42Å; E412-A472 WeakPolarHBondContact O-CB 3.38Å; E412-N473 PolarHBondContact N-O 2.98Å; E412-N473 PolarHBondContact O-N 3.47Å
413	P	90.7	Very high	84.7	Confident	39 Å²	39	61.9 Å²	61.9	25%	0.253	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.3	177	30.2	-32.8	0	0	0	109.9	S415 D418 Q419 M422	P413-S415 PolarHBondContact O-N 3.36Å; P413-D418 HydrophobicContact CB-CB 3.99Å; P413-Q419 HydrophobicContact CB-CB 4.31Å; P413-Q419 HydrophobicContact CG-CB 3.9Å; P413-Q419 HydrophobicContact CG-CG 4.2Å; P413-M422 HydrophobicContact CB-CE 4.48Å; P413-M422 HydrophobicContact CB-SD 4.07Å; P413-M422 HydrophobicContact CG-CE 4.24Å; P413-M422 HydrophobicContact CG-SD 4.42Å
414	K	88.5	Confident	85.5	Confident	112 Å²	112	63.3 Å²	63.3	49%	0.487	34%	0.341	S	S	.	.	S	Bend	trans	-66.5	-24.7	178	-72	-168.1	-167.6	155.6	0	113.2	D471 N473	K414-D471 HydrophobicContact CB-CB 4.46Å; K414-D471 HydrophobicContact CD-CB 3.85Å; K414-D471 HydrophobicContact CG-CB 4.26Å; K414-D471 PolarHBondContact N-O 3.37Å; K414-D471 VanDerWaalsContact N-O 3.08Å; K414-D471 IonicContact NZ-OD1 3.51Å; K414-N473 WeakPolarHBondContact CE-OD1 3.37Å
415	S	87.9	Confident	86.5	Confident	49 Å²	49	59.3 Å²	59.3	34%	0.343	32%	0.319	S	S	.	.	S	Bend	trans	-140.1	158.2	178.6	85.1	0	0	0	0	111.8	P413 A417 D418 Q419	P413-S415 PolarHBondContact O-N 3.36Å; S415-A417 PolarHBondContact O-N 3.05Å; S415-A417 PolarHBondContact OG-N 3.42Å; S415-D418 WeakPolarHBondContact CB-OD2 3.45Å; S415-D418 PolarHBondContact N-OD2 3.44Å; S415-D418 WeakPolarHBondContact O-CB 3.44Å; S415-D418 PolarHBondContact O-N 2.75Å; S415-D418 VanDerWaalsContact OG-CG 3.23Å; S415-D418 PolarHBondContact OG-N 2.88Å; S415-D418 PolarHBondContact OG-OD2 3.21Å; S415-Q419 PolarHBondContact O-N 3.38Å
416	K	84.6	Confident	87.1	Confident	185 Å²	185	58.1 Å²	58.1	80%	0.804	31%	0.311	S	S	*	.	H	α-helix	trans	-59.1	-30.7	174.3	-77.2	-170.4	174.6	-173	0	113.4	D418 Q419	K416-D418 PolarHBondContact O-N 3.27Å; K416-Q419 WeakPolarHBondContact O-CB 3.15Å; K416-Q419 PolarHBondContact O-N 3Å
417	A	84.7	Confident	87.8	Confident	65 Å²	65	62.1 Å²	62.1	54%	0.537	33%	0.327	S	S	.	.	H	α-helix	trans	-70.6	-23.8	177.4	0	0	0	0	0	112.3	S415	S415-A417 PolarHBondContact O-N 3.05Å; S415-A417 PolarHBondContact OG-N 3.42Å
418	D	87.2	Confident	88.1	Confident	22 Å²	22	65 Å²	65	12%	0.118	34%	0.339	C	S	.	.	H	α-helix	trans	-83.4	-21.9	177.4	-59.7	-44.1	0	0	0	111.7	P413 S415 K416 D420 K421 M422 V470	P413-D418 HydrophobicContact CB-CB 3.99Å; S415-D418 WeakPolarHBondContact CB-OD2 3.45Å; S415-D418 PolarHBondContact N-OD2 3.44Å; S415-D418 WeakPolarHBondContact O-CB 3.44Å; S415-D418 PolarHBondContact O-N 2.75Å; S415-D418 VanDerWaalsContact OG-CG 3.23Å; S415-D418 PolarHBondContact OG-N 2.88Å; S415-D418 PolarHBondContact OG-OD2 3.21Å; K416-D418 PolarHBondContact O-N 3.27Å; D418-D420 PolarHBondContact O-N 3.44Å; D418-K421 PolarHBondContact O-N 2.91Å; D418-M422 WeakPolarHBondContact O-CB 3.48Å; D418-M422 PolarHBondContact O-N 3.32Å; D418-V470 HydrophobicContact CB-CG1 4.28Å
419	Q	86.2	Confident	88.3	Confident	112 Å²	112	60.4 Å²	60.4	52%	0.523	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-50.6	-179.7	-171.7	173.5	0.9	0	0	112.7	P413 S415 K416 K421 M422 G423	P413-Q419 HydrophobicContact CB-CB 4.31Å; P413-Q419 HydrophobicContact CG-CB 3.9Å; P413-Q419 HydrophobicContact CG-CG 4.2Å; S415-Q419 PolarHBondContact O-N 3.38Å; K416-Q419 WeakPolarHBondContact O-CB 3.15Å; K416-Q419 PolarHBondContact O-N 3Å; Q419-K421 VanDerWaalsContact C-N 3.35Å; Q419-K421 PolarHBondContact O-N 3.49Å; Q419-M422 PolarHBondContact O-N 2.93Å; Q419-G423 PolarHBondContact O-N 3.22Å
420	D	85.1	Confident	88.3	Confident	132 Å²	132	60.8 Å²	60.8	71%	0.706	32%	0.323	S	S	*	.	H	α-helix	trans	-66.4	-38.9	179.4	-67.5	-23.8	0	0	0	111.7	D418 V424	D418-D420 PolarHBondContact O-N 3.44Å; D420-V424 PolarHBondContact O-N 3.37Å
421	K	88.3	Confident	88	Confident	103 Å²	103	63.8 Å²	63.8	45%	0.448	34%	0.337	S	S	.	.	H	α-helix	trans	-69.7	-36.7	178.6	-65.2	179.5	-174.5	168.2	0	112	D418 Q419 V424 A425 V470	D418-K421 PolarHBondContact O-N 2.91Å; Q419-K421 VanDerWaalsContact C-N 3.35Å; Q419-K421 PolarHBondContact O-N 3.49Å; K421-V424 PolarHBondContact O-N 2.95Å; K421-A425 WeakPolarHBondContact O-CB 3.33Å; K421-A425 PolarHBondContact O-N 3.43Å; K421-V470 HydrophobicContact CB-CG2 3.46Å; K421-V470 VanDerWaalsContact CB-CG2 3.46Å; K421-V470 HydrophobicContact CD-CG2 4.31Å
422	M	91.4	Very high	87.6	Confident	6 Å²	6	64.3 Å²	64.3	3%	0.03	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-47.2	177.9	-172.2	178.9	79	0	0	109.9	P413 D418 Q419 V424 A425 L426 T447 M464 V470 A472	P413-M422 HydrophobicContact CB-CE 4.48Å; P413-M422 HydrophobicContact CB-SD 4.07Å; P413-M422 HydrophobicContact CG-CE 4.24Å; P413-M422 HydrophobicContact CG-SD 4.42Å; D418-M422 WeakPolarHBondContact O-CB 3.48Å; D418-M422 PolarHBondContact O-N 3.32Å; Q419-M422 PolarHBondContact O-N 2.93Å; M422-V424 VanDerWaalsContact C-N 3.33Å; M422-V424 PolarHBondContact O-N 2.74Å; M422-A425 PolarHBondContact O-N 2.96Å; M422-L426 HydrophobicContact CE-CD1 4.45Å; M422-L426 HydrophobicContact CG-CD1 3.77Å; M422-L426 HydrophobicContact CG-CG 4.16Å; M422-L426 WeakPolarHBondContact O-CB 3.47Å; M422-L426 VanDerWaalsContact O-CG 3.26Å; M422-L426 WeakPolarHBondContact O-CG 3.23Å; M422-L426 PolarHBondContact O-N 3.05Å; M422-T447 HydrophobicContact CE-CG2 4.39Å; M422-M464 HydrophobicContact CG-CE 4.43Å; M422-M464 HydrophobicContact CG-SD 3.79Å; M422-V470 HydrophobicContact CB-CG1 3.8Å; M422-V470 HydrophobicContact CG-CG1 4.19Å; M422-A472 HydrophobicContact SD-CB 4.37Å
423	G	88.8	Confident	87.4	Confident	40 Å²	40	60.6 Å²	60.6	41%	0.412	32%	0.322	S	S	.	.	H	α-helix	trans	-56.5	-45.6	175.9	0	0	0	0	0	112.9	Q419 Q427	Q419-G423 PolarHBondContact O-N 3.22Å; G423-Q427 WeakPolarHBondContact O-CB 3.36Å; G423-Q427 PolarHBondContact O-N 3.07Å
424	V	88.4	Confident	87	Confident	75 Å²	75	60.5 Å²	60.5	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-67	-39.9	177.9	177.3	0	0	0	0	112.2	D420 K421 M422 K428	D420-V424 PolarHBondContact O-N 3.37Å; K421-V424 PolarHBondContact O-N 2.95Å; M422-V424 VanDerWaalsContact C-N 3.33Å; M422-V424 PolarHBondContact O-N 2.74Å; V424-K428 HydrophobicContact CG1-CD 4.41Å; V424-K428 WeakPolarHBondContact O-CG 3.19Å; V424-K428 PolarHBondContact O-N 2.95Å; V424-K428 VanDerWaalsContact O-N 3.16Å
425	A	90.3	Very high	86.7	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.3	-49.4	179.1	0	0	0	0	0	111.2	K421 M422 Q427 K428 L429 M464 F468	K421-A425 WeakPolarHBondContact O-CB 3.33Å; K421-A425 PolarHBondContact O-N 3.43Å; M422-A425 PolarHBondContact O-N 2.96Å; A425-Q427 VanDerWaalsContact C-N 3.33Å; A425-Q427 PolarHBondContact O-N 3.08Å; A425-K428 PolarHBondContact O-N 2.89Å; A425-L429 WeakPolarHBondContact O-CG 3.44Å; A425-L429 PolarHBondContact O-N 3.22Å; A425-M464 HydrophobicContact CB-CG 3.94Å; A425-M464 HydrophobicContact CB-SD 4.4Å; A425-F468 HydrophobicContact CB-CB 3.7Å; A425-F468 HydrophobicContact CB-CD1 3.86Å; A425-F468 HydrophobicContact CB-CD2 3.91Å; A425-F468 HydrophobicContact CB-CE1 4.49Å; A425-F468 HydrophobicContact CB-CG 3.52Å
426	L	91.7	Very high	86.8	Confident	5 Å²	5	53.1 Å²	53.1	3%	0.026	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-42	178.4	-71.7	177.8	0	0	0	111.9	M422 K428 L429 A430 F436 V438 T447 I449 M464	M422-L426 HydrophobicContact CE-CD1 4.45Å; M422-L426 HydrophobicContact CG-CD1 3.77Å; M422-L426 HydrophobicContact CG-CG 4.16Å; M422-L426 WeakPolarHBondContact O-CB 3.47Å; M422-L426 VanDerWaalsContact O-CG 3.26Å; M422-L426 WeakPolarHBondContact O-CG 3.23Å; M422-L426 PolarHBondContact O-N 3.05Å; L426-K428 PolarHBondContact O-N 3.08Å; L426-L429 PolarHBondContact O-N 3.16Å; L426-A430 WeakPolarHBondContact O-CB 3.05Å; L426-A430 PolarHBondContact O-N 3.13Å; L426-F436 HydrophobicContact CD2-CE1 3.94Å; L426-F436 HydrophobicContact CD2-CZ 3.76Å; L426-V438 HydrophobicContact CB-CG1 4.1Å; L426-V438 HydrophobicContact CB-CG2 3.98Å; L426-V438 HydrophobicContact CD1-CG1 3.91Å; L426-V438 HydrophobicContact CD2-CG2 4.47Å; L426-T447 HydrophobicContact CD1-CG2 3.79Å; L426-I449 HydrophobicContact CD1-CG2 4.2Å; L426-I449 HydrophobicContact CD2-CG2 3.85Å; L426-M464 HydrophobicContact CD2-SD 4.01Å; L426-M464 HydrophobicContact CG-SD 4.13Å
427	Q	88.7	Confident	87	Confident	121 Å²	121	49.3 Å²	49.3	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-62.2	-43	175.7	-174.2	176.4	8.8	0	0	112.1	G423 A425 A430 E431	G423-Q427 WeakPolarHBondContact O-CB 3.36Å; G423-Q427 PolarHBondContact O-N 3.07Å; A425-Q427 VanDerWaalsContact C-N 3.33Å; A425-Q427 PolarHBondContact O-N 3.08Å; Q427-A430 PolarHBondContact O-N 3.18Å; Q427-E431 WeakPolarHBondContact O-CG 3.32Å; Q427-E431 PolarHBondContact O-N 3.09Å
428	K	85.5	Confident	87.3	Confident	78 Å²	78	48.7 Å²	48.7	34%	0.339	25%	0.253	S	S	.	.	H	α-helix	trans	-65.8	-40	177	-76	177.9	173	-170.7	0	112.4	V424 A425 L426 A430 E431 E432 F468	V424-K428 HydrophobicContact CG1-CD 4.41Å; V424-K428 WeakPolarHBondContact O-CG 3.19Å; V424-K428 PolarHBondContact O-N 2.95Å; V424-K428 VanDerWaalsContact O-N 3.16Å; A425-K428 PolarHBondContact O-N 2.89Å; L426-K428 PolarHBondContact O-N 3.08Å; K428-A430 VanDerWaalsContact C-N 3.35Å; K428-E431 PolarHBondContact O-N 3.13Å; K428-E432 WeakPolarHBondContact O-CG 3.33Å; K428-E432 PolarHBondContact O-N 3.24Å; K428-E432 VanDerWaalsContact O-N 3.13Å; K428-F468 HydrophobicContact CB-CE1 4.34Å; K428-F468 HydrophobicContact CB-CZ 4.14Å; K428-F468 HydrophobicContact CD-CE1 3.59Å; K428-F468 HydrophobicContact CD-CZ 4.13Å
429	L	88.4	Confident	87.4	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64.5	-40.1	175.6	-69.3	171.7	0	0	0	111.3	A425 L426 E431 E432 D433 F436 L460 R463 M464 F468	A425-L429 WeakPolarHBondContact O-CG 3.44Å; A425-L429 PolarHBondContact O-N 3.22Å; L426-L429 PolarHBondContact O-N 3.16Å; L429-E431 VanDerWaalsContact C-N 3.34Å; L429-E431 PolarHBondContact O-N 3.06Å; L429-E432 PolarHBondContact O-N 2.78Å; L429-D433 PolarHBondContact O-N 3.47Å; L429-F436 HydrophobicContact CB-CD1 4.19Å; L429-F436 HydrophobicContact CB-CE1 4.08Å; L429-L460 HydrophobicContact CB-CD2 4.48Å; L429-L460 HydrophobicContact CD2-CD2 4.11Å; L429-R463 HydrophobicContact CD2-CB 4.44Å; L429-M464 HydrophobicContact CD1-CB 4.13Å; L429-F468 HydrophobicContact CD2-CE2 4.2Å; L429-F468 HydrophobicContact CG-CE2 4.28Å
430	A	88.1	Confident	87.5	Confident	30 Å²	30	53 Å²	53	25%	0.248	28%	0.28	C	S	.	.	H	α-helix	trans	-67.7	-31.4	175.1	0	0	0	0	0	113.1	L426 Q427 K428 D433 F436 V438	L426-A430 WeakPolarHBondContact O-CB 3.05Å; L426-A430 PolarHBondContact O-N 3.13Å; Q427-A430 PolarHBondContact O-N 3.18Å; K428-A430 VanDerWaalsContact C-N 3.35Å; A430-D433 CarbonylContact O-C 3.51Å; A430-D433 VanDerWaalsContact O-C 3.26Å; A430-F436 HydrophobicContact CB-CD1 4.07Å; A430-V438 HydrophobicContact CB-CG2 4.36Å
431	E	82.7	Confident	87.3	Confident	67 Å²	67	48.8 Å²	48.8	31%	0.313	26%	0.257	S	S	.	.	H	α-helix	trans	-68.3	-33.8	172.4	-77.1	179.7	-166.5	0	0	112.7	R323 Q427 K428 L429	R323-E431 IonicContact CZ-OE2 2.86Å; R323-E431 IonicContact NH1-OE2 3.13Å; Q427-E431 WeakPolarHBondContact O-CG 3.32Å; Q427-E431 PolarHBondContact O-N 3.09Å; K428-E431 PolarHBondContact O-N 3.13Å; L429-E431 VanDerWaalsContact C-N 3.34Å; L429-E431 PolarHBondContact O-N 3.06Å
432	E	82.9	Confident	86.9	Confident	12 Å²	12	50.8 Å²	50.8	6%	0.056	28%	0.278	C	S	.	.	H	α-helix	trans	-75.8	-40.8	175.2	-69	-179.6	-176.8	0	0	111.6	R94 T317 K428 L429 R463	R94-E432 PolarHBondContact NH1-O 3.37Å; T317-E432 WeakPolarHBondContact CA-OE1 3.28Å; T317-E432 WeakPolarHBondContact CB-OE1 3.44Å; T317-E432 PolarHBondContact N-OE1 3.33Å; T317-E432 PolarHBondContact OG1-OE1 3.15Å; K428-E432 WeakPolarHBondContact O-CG 3.33Å; K428-E432 PolarHBondContact O-N 3.24Å; K428-E432 VanDerWaalsContact O-N 3.13Å; L429-E432 PolarHBondContact O-N 2.78Å; E432-R463 IonicContact OE2-CZ 3.82Å; E432-R463 IonicContact OE2-NH1 3.42Å; E432-R463 PolarHBondContact OE2-NH1 3.32Å; E432-R463 VanDerWaalsContact OE2-NH1 3.13Å; E432-R463 IonicContact OE2-NH2 3.32Å; E432-R463 PolarHBondContact OE2-NH2 2.93Å
433	D	85.1	Confident	86	Confident	18 Å²	18	55.8 Å²	55.8	10%	0.096	30%	0.301	C	S	.	.			trans	-123.2	94.2	179.1	-165.7	-8.3	0	0	0	113.4	R94 L429 A430 S435 F436 H456	R94-D433 IonicContact CZ-OD1 2.77Å; R94-D433 IonicContact NH2-OD1 2.84Å; R94-D433 PolarHBondContact NH2-OD1 2.86Å; L429-D433 PolarHBondContact O-N 3.47Å; A430-D433 CarbonylContact O-C 3.51Å; A430-D433 VanDerWaalsContact O-C 3.26Å; D433-S435 VanDerWaalsContact CG-OG 3.22Å; D433-S435 PolarHBondContact O-N 3.38Å; D433-S435 VanDerWaalsContact O-N 3.09Å; D433-S435 WeakPolarHBondContact OD1-CB 3.4Å; D433-S435 PolarHBondContact OD1-N 3.16Å; D433-S435 PolarHBondContact OD1-OG 2.85Å; D433-S435 PolarHBondContact OD2-OG 3.45Å; D433-F436 HydrophobicContact CB-CB 4.21Å; D433-F436 WeakPolarHBondContact O-CA 3.26Å; D433-F436 VanDerWaalsContact O-CB 3.27Å; D433-F436 WeakPolarHBondContact O-CB 3.33Å; D433-F436 PolarHBondContact O-N 3.49Å; D433-H456 IonicContact OD2-CE1 3.13Å; D433-H456 PolarHBondContact OD2-CE1 3.48Å; D433-H456 IonicContact OD2-NE2 2.77Å; D433-H456 PolarHBondContact OD2-NE2 3.47Å; D433-H456 VanDerWaalsContact OD2-NE2 3.08Å
434	P	82.2	Confident	85.6	Confident	38 Å²	38	55.9 Å²	55.9	25%	0.247	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-16.6	172.4	-4.6	-10.7	0	0	0	117	T384 F402 F436	T384-P434 HydrophobicContact CG2-CG 4.42Å; F402-P434 HydrophobicContact CD1-CB 3.68Å; F402-P434 HydrophobicContact CD1-CG 3.84Å; F402-P434 HydrophobicContact CD2-CB 4.26Å; F402-P434 HydrophobicContact CE1-CB 3.77Å; F402-P434 HydrophobicContact CE1-CG 3.4Å; F402-P434 VanDerWaalsContact CE1-CG 3.4Å; F402-P434 HydrophobicContact CE2-CB 4.26Å; F402-P434 HydrophobicContact CE2-CG 4.33Å; F402-P434 HydrophobicContact CG-CB 3.99Å; F402-P434 HydrophobicContact CZ-CB 4.04Å; F402-P434 HydrophobicContact CZ-CG 3.68Å; P434-F436 VanDerWaalsContact C-N 3.25Å
435	S	82.6	Confident	85.3	Confident	1 Å²	1	54.9 Å²	54.9	1%	0.007	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-10.9	171.9	73	0	0	0	0	112.7	D433 H456	D433-S435 VanDerWaalsContact CG-OG 3.22Å; D433-S435 PolarHBondContact O-N 3.38Å; D433-S435 VanDerWaalsContact O-N 3.09Å; D433-S435 WeakPolarHBondContact OD1-CB 3.4Å; D433-S435 PolarHBondContact OD1-N 3.16Å; D433-S435 PolarHBondContact OD1-OG 2.85Å; D433-S435 PolarHBondContact OD2-OG 3.45Å; S435-H456 PolarHBondContact OG-CE1 2.88Å
436	F	89.4	Confident	85.1	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.018	30%	0.302	C	S	.	.			trans	-90.8	116.4	171.4	-179.5	-117.9	0	0	0	110.1	L426 L429 A430 D433 P434 V438 I449 A450 L457 L460	L426-F436 HydrophobicContact CD2-CE1 3.94Å; L426-F436 HydrophobicContact CD2-CZ 3.76Å; L429-F436 HydrophobicContact CB-CD1 4.19Å; L429-F436 HydrophobicContact CB-CE1 4.08Å; A430-F436 HydrophobicContact CB-CD1 4.07Å; D433-F436 HydrophobicContact CB-CB 4.21Å; D433-F436 WeakPolarHBondContact O-CA 3.26Å; D433-F436 VanDerWaalsContact O-CB 3.27Å; D433-F436 WeakPolarHBondContact O-CB 3.33Å; D433-F436 PolarHBondContact O-N 3.49Å; P434-F436 VanDerWaalsContact C-N 3.25Å; F436-V438 HydrophobicContact CD1-CG2 3.91Å; F436-V438 HydrophobicContact CE1-CG2 3.38Å; F436-V438 HydrophobicContact CZ-CG2 3.92Å; F436-I449 HydrophobicContact CE2-CB 3.57Å; F436-I449 HydrophobicContact CE2-CD1 4.05Å; F436-I449 HydrophobicContact CE2-CG1 4.15Å; F436-I449 HydrophobicContact CE2-CG2 4.12Å; F436-I449 HydrophobicContact CZ-CB 3.69Å; F436-I449 HydrophobicContact CZ-CD1 4.17Å; F436-I449 HydrophobicContact CZ-CG1 4.44Å; F436-I449 HydrophobicContact CZ-CG2 3.69Å; F436-A450 WeakPolarHBondContact CA-O 3.18Å; F436-A450 VanDerWaalsContact CD2-O 3.23Å; F436-A450 WeakPolarHBondContact CD2-O 3.38Å; F436-L457 HydrophobicContact CD2-CD2 4.09Å; F436-L457 HydrophobicContact CE2-CD2 3.8Å; F436-L460 HydrophobicContact CB-CD1 3.84Å; F436-L460 HydrophobicContact CD1-CD1 4.01Å; F436-L460 HydrophobicContact CD2-CD1 3.1Å; F436-L460 HydrophobicContact CE1-CD1 4.31Å; F436-L460 HydrophobicContact CE2-CB 4.47Å; F436-L460 HydrophobicContact CE2-CD1 3.43Å; F436-L460 VanDerWaalsContact CE2-CD1 3.43Å; F436-L460 HydrophobicContact CG-CD1 3.4Å; F436-L460 HydrophobicContact CZ-CD1 4.03Å
437	R	89.3	Confident	85	Confident	105 Å²	105	57 Å²	57	40%	0.396	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	144.4	177.1	-62.6	-169.1	-177.8	163.8	10	110.7	D404 P405 I449 A450	D404-R437 IonicContact OD1-CZ 3.44Å; D404-R437 IonicContact OD1-NH1 3.57Å; D404-R437 PolarHBondContact OD1-NH1 2.92Å; D404-R437 IonicContact OD1-NH2 2.67Å; D404-R437 PolarHBondContact OD1-NH2 2.97Å; P405-R437 HydrophobicContact CG-CB 4.31Å; P405-R437 HydrophobicContact CG-CG 3.9Å; R437-I449 CarbonylContact O-C 3.58Å; R437-I449 WeakPolarHBondContact O-CA 3.12Å; R437-A450 HydrophobicContact CB-CB 4.24Å; R437-A450 PolarHBondContact N-O 2.7Å; R437-A450 PolarHBondContact O-N 2.9Å
438	V	91.3	Very high	85.1	Confident	52 Å²	52	52 Å²	52	32%	0.315	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	117.5	178.8	-175.6	0	0	0	0	106.7	L426 A430 F436 T447 I449	L426-V438 HydrophobicContact CB-CG1 4.1Å; L426-V438 HydrophobicContact CB-CG2 3.98Å; L426-V438 HydrophobicContact CD1-CG1 3.91Å; L426-V438 HydrophobicContact CD2-CG2 4.47Å; A430-V438 HydrophobicContact CB-CG2 4.36Å; F436-V438 HydrophobicContact CD1-CG2 3.91Å; F436-V438 HydrophobicContact CE1-CG2 3.38Å; F436-V438 HydrophobicContact CZ-CG2 3.92Å; V438-T447 HydrophobicContact CG1-CG2 3.92Å; V438-I449 HydrophobicContact CG1-CG2 4.32Å; V438-I449 HydrophobicContact CG2-CG2 4.24Å
439	E	89.3	Confident	85.4	Confident	134 Å²	134	48.3 Å²	48.3	63%	0.626	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.5	150.3	177.6	-67.5	-169.4	174.6	0	0	110	V448	E439-V448 PolarHBondContact N-O 3.09Å; E439-V448 PolarHBondContact O-N 2.88Å; E439-V448 VanDerWaalsContact O-O 3.12Å
440	T	87.7	Confident	85.4	Confident	92 Å²	92	48.7 Å²	48.7	56%	0.564	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	117	167.6	-55.6	0	0	0	0	107	V442 E446	T440-V442 PolarHBondContact O-N 3.15Å; T440-V442 VanDerWaalsContact O-N 3.15Å; T440-E446 CarbonylContact C-O 3.53Å; T440-E446 WeakPolarHBondContact CA-O 3.33Å
441	N	82.1	Confident	85.4	Confident	42 Å²	42	47.2 Å²	47.2	23%	0.225	26%	0.263	C	S	.	.			trans	-62.7	119.9	176.3	-178	-41.3	0	0	0	108.3	E443 T444 G445 E446 V448	N441-E443 PolarHBondContact O-N 3.38Å; N441-E443 WeakPolarHBondContact OD1-CB 3.34Å; N441-E443 PolarHBondContact OD1-N 3.3Å; N441-T444 WeakPolarHBondContact CB-OG1 3.23Å; N441-T444 VanDerWaalsContact CG-OG1 3.3Å; N441-T444 PolarHBondContact OD1-N 3.39Å; N441-T444 VanDerWaalsContact OD1-N 3.1Å; N441-G445 WeakPolarHBondContact O-CA 3.45Å; N441-G445 PolarHBondContact O-N 3.15Å; N441-E446 PolarHBondContact N-O 3.31Å; N441-V448 HydrophobicContact CB-CG2 4.33Å
442	V	78.7	Confident	85.3	Confident	146 Å²	146	44.7 Å²	44.7	89%	0.885	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-24.7	-172.4	-144.1	0	0	0	0	112.1	T440	T440-V442 PolarHBondContact O-N 3.15Å; T440-V442 VanDerWaalsContact O-N 3.15Å
443	E	72.8	Confident	85.1	Confident	111 Å²	111	44.1 Å²	44.1	52%	0.519	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-44	-177.9	-57.4	-164.4	146.6	0	0	112.1	N441 S480 R482	N441-E443 PolarHBondContact O-N 3.38Å; N441-E443 WeakPolarHBondContact OD1-CB 3.34Å; N441-E443 PolarHBondContact OD1-N 3.3Å; E443-S480 WeakPolarHBondContact OE2-CB 3.35Å; E443-S480 PolarHBondContact OE2-OG 3.37Å; E443-R482 IonicContact OE1-CZ 2.68Å; E443-R482 IonicContact OE1-NH1 3.55Å; E443-R482 IonicContact OE1-NH2 3.68Å; E443-R482 PolarHBondContact OE1-NH2 3.07Å; E443-R482 IonicContact OE2-NH2 3.76Å; E443-R482 PolarHBondContact OE2-NH2 2.96Å
444	T	80.3	Confident	84.7	Confident	41 Å²	41	48 Å²	48	25%	0.252	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-21.1	-176.6	70	0	0	0	0	112.7	N441 E446 Q478	N441-T444 WeakPolarHBondContact CB-OG1 3.23Å; N441-T444 VanDerWaalsContact CG-OG1 3.3Å; N441-T444 PolarHBondContact OD1-N 3.39Å; N441-T444 VanDerWaalsContact OD1-N 3.1Å; T444-E446 PolarHBondContact O-N 3.29Å; T444-E446 PolarHBondContact OG1-N 2.93Å; T444-Q478 HydrophobicContact CG2-CB 3.78Å
445	G	81.4	Confident	84.6	Confident	54 Å²	54	48 Å²	48	56%	0.557	26%	0.264	S	S	*	.			trans	74.1	2.1	-174.4	0	0	0	0	0	114.1	N441	N441-G445 WeakPolarHBondContact O-CA 3.45Å; N441-G445 PolarHBondContact O-N 3.15Å
446	E	86.2	Confident	84.6	Confident	20 Å²	20	48 Å²	48	9%	0.093	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-73.2	147.7	178.2	-66.7	-178.6	150.2	0	0	111.2	T440 N441 T444 Q478	T440-E446 CarbonylContact C-O 3.53Å; T440-E446 WeakPolarHBondContact CA-O 3.33Å; N441-E446 PolarHBondContact N-O 3.31Å; T444-E446 PolarHBondContact O-N 3.29Å; T444-E446 PolarHBondContact OG1-N 2.93Å; E446-Q478 VanDerWaalsContact OE1-CG 3.23Å; E446-Q478 WeakPolarHBondContact OE1-CG 3.44Å; E446-Q478 PolarHBondContact OE1-NE2 2.88Å; E446-Q478 VanDerWaalsContact OE2-CB 3.31Å; E446-Q478 WeakPolarHBondContact OE2-CB 3.41Å; E446-Q478 WeakPolarHBondContact OE2-CG 3.46Å; E446-Q478 PolarHBondContact OE2-N 2.63Å; E446-Q478 VanDerWaalsContact OE2-N 3.07Å
447	T	90.5	Very high	84.6	Confident	29 Å²	29	48 Å²	48	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	116.6	167.3	-55.5	0	0	0	0	108.3	V411 M422 L426 V438	V411-T447 HydrophobicContact CG2-CG2 4.37Å; V411-T447 PolarHBondContact N-O 3.44Å; M422-T447 HydrophobicContact CE-CG2 4.39Å; L426-T447 HydrophobicContact CD1-CG2 3.79Å; V438-T447 HydrophobicContact CG1-CG2 3.92Å
448	V	90.4	Very high	84.4	Confident	16 Å²	16	46.5 Å²	46.5	10%	0.097	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	130.4	176.2	-177.7	0	0	0	0	108	E408 V409 E439 N441 P477	E408-V448 HydrophobicContact CB-CG1 3.92Å; E408-V448 HydrophobicContact CG-CG1 4.35Å; V409-V448 WeakPolarHBondContact O-CA 3.45Å; E439-V448 PolarHBondContact N-O 3.09Å; E439-V448 PolarHBondContact O-N 2.88Å; E439-V448 VanDerWaalsContact O-O 3.12Å; N441-V448 HydrophobicContact CB-CG2 4.33Å; V448-P477 HydrophobicContact CG1-CG 4.36Å; V448-P477 HydrophobicContact CG2-CB 4.5Å
449	I	92.3	Very high	84.3	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.3	172.5	65.9	177.6	0	0	0	109.2	E408 V409 V411 L426 F436 R437 V438 L457 V461	E408-I449 WeakPolarHBondContact CA-O 3.07Å; V409-I449 HydrophobicContact CG2-CD1 3.73Å; V409-I449 HydrophobicContact CG2-CG1 3.36Å; V409-I449 PolarHBondContact N-O 2.94Å; V409-I449 PolarHBondContact O-N 3.36Å; V411-I449 HydrophobicContact CG1-CD1 3.91Å; V411-I449 HydrophobicContact CG2-CB 4.14Å; V411-I449 HydrophobicContact CG2-CD1 3.8Å; V411-I449 HydrophobicContact CG2-CG1 3.81Å; V411-I449 HydrophobicContact CG2-CG2 3.39Å; L426-I449 HydrophobicContact CD1-CG2 4.2Å; L426-I449 HydrophobicContact CD2-CG2 3.85Å; F436-I449 HydrophobicContact CE2-CB 3.57Å; F436-I449 HydrophobicContact CE2-CD1 4.05Å; F436-I449 HydrophobicContact CE2-CG1 4.15Å; F436-I449 HydrophobicContact CE2-CG2 4.12Å; F436-I449 HydrophobicContact CZ-CB 3.69Å; F436-I449 HydrophobicContact CZ-CD1 4.17Å; F436-I449 HydrophobicContact CZ-CG1 4.44Å; F436-I449 HydrophobicContact CZ-CG2 3.69Å; R437-I449 CarbonylContact O-C 3.58Å; R437-I449 WeakPolarHBondContact O-CA 3.12Å; V438-I449 HydrophobicContact CG1-CG2 4.32Å; V438-I449 HydrophobicContact CG2-CG2 4.24Å; I449-L457 HydrophobicContact CD1-CD2 4.12Å; I449-L457 HydrophobicContact CG1-CD2 4.03Å; I449-V461 HydrophobicContact CD1-CG2 3.87Å
450	A	89	Confident	84.3	Confident	9 Å²	9	38 Å²	38	7%	0.074	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.7	-178	0	0	0	0	0	110.3	P405 I407 E408 F436 R437	P405-A450 HydrophobicContact CB-CB 3.56Å; P405-A450 HydrophobicContact CG-CB 3.85Å; I407-A450 CarbonylContact O-C 3.46Å; I407-A450 WeakPolarHBondContact O-CA 3.4Å; E408-A450 HydrophobicContact CG-CB 3.82Å; F436-A450 WeakPolarHBondContact CA-O 3.18Å; F436-A450 VanDerWaalsContact CD2-O 3.23Å; F436-A450 WeakPolarHBondContact CD2-O 3.38Å; R437-A450 HydrophobicContact CB-CB 4.24Å; R437-A450 PolarHBondContact N-O 2.7Å; R437-A450 PolarHBondContact O-N 2.9Å
451	G	87.3	Confident	84.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	-173.3	-179.7	0	0	0	0	0	113.7	P405 V406 I407	P405-G451 CarbonylContact C-O 3.57Å; P405-G451 WeakPolarHBondContact CA-O 3.33Å; V406-G451 PolarHBondContact N-O 2.99Å; I407-G451 WeakPolarHBondContact CG2-O 3.32Å; I407-G451 PolarHBondContact N-O 3.45Å; I407-G451 PolarHBondContact O-N 3.3Å
452	M	81.3	Confident	84.7	Confident	13 Å²	13	34.2 Å²	34.2	6%	0.064	20%	0.198	C	C	.	.	S	Bend	trans	-82.9	-8.9	-175.6	-62.5	-59.1	-66.4	0	0	114.2	D87 P403 V406 H456 R658	D87-M452 WeakPolarHBondContact O-CB 3.48Å; P403-M452 HydrophobicContact CB-CE 3.95Å; P403-M452 HydrophobicContact CB-SD 4.4Å; P403-M452 HydrophobicContact CG-CE 3.62Å; P403-M452 HydrophobicContact CG-SD 3.99Å; V406-M452 WeakPolarHBondContact CG2-O 3.41Å; M452-H456 PolarHBondContact N-ND1 3.13Å; M452-H456 VanDerWaalsContact N-ND1 3.13Å; M452-R658 PolarHBondContact O-NH1 3.07Å; M452-R658 PolarHBondContact O-NH2 3.42Å
453	G	77.2	Confident	85.1	Confident	1 Å²	1	28.3 Å²	28.3	1%	0.01	16%	0.16	C	C	.	.	S	Bend	trans	172.6	174.1	179.4	0	0	0	0	0	112.4	D87 H456 L457	D87-G453 VanDerWaalsContact OD2-C 3.24Å; D87-G453 VanDerWaalsContact OD2-CA 3.24Å; D87-G453 WeakPolarHBondContact OD2-CA 3.27Å; G453-H456 WeakPolarHBondContact O-CB 3.47Å; G453-H456 PolarHBondContact O-N 3.18Å; G453-L457 PolarHBondContact O-N 3.19Å; G453-L457 VanDerWaalsContact O-N 3.11Å
454	E	76.8	Confident	85.9	Confident	99 Å²	99	23 Å²	23	46%	0.463	14%	0.135	S	C	.	.	H	α-helix	trans	-65.2	-41.7	-177.5	-172.4	173.7	176.6	0	0	111.4	I407 H456 L457 D458 T655	I407-E454 HydrophobicContact CD1-CB 4.28Å; E454-H456 VanDerWaalsContact C-N 3.3Å; E454-H456 PolarHBondContact O-N 3.26Å; E454-L457 PolarHBondContact O-N 2.93Å; E454-D458 WeakPolarHBondContact O-CB 3.28Å; E454-D458 PolarHBondContact O-N 3.38Å; E454-T655 PolarHBondContact OE2-OG1 2.97Å
455	L	80.6	Confident	86.3	Confident	37 Å²	37	27.8 Å²	27.8	19%	0.194	15%	0.149	C	C	.	.	H	α-helix	trans	-64.2	-39.4	176.3	-175.1	80.2	0	0	0	110.9	I61 H85 D87 F88 D458 V459	I61-L455 HydrophobicContact CD1-CD2 3.69Å; H85-L455 VanDerWaalsContact CE1-CD2 3.45Å; H85-L455 WeakPolarHBondContact CE1-CD2 3.41Å; D87-L455 HydrophobicContact CB-CB 4.45Å; D87-L455 WeakPolarHBondContact OD2-CA 3.48Å; D87-L455 WeakPolarHBondContact OD2-CB 3.42Å; D87-L455 PolarHBondContact OD2-N 3.13Å; D87-L455 VanDerWaalsContact OD2-N 3.08Å; F88-L455 HydrophobicContact CE2-CD2 4.02Å; L455-D458 PolarHBondContact O-N 3.25Å; L455-V459 WeakPolarHBondContact O-CB 3.45Å; L455-V459 VanDerWaalsContact O-CG2 3.31Å; L455-V459 WeakPolarHBondContact O-CG2 3.23Å; L455-V459 PolarHBondContact O-N 2.93Å
456	H	83.9	Confident	86.6	Confident	2 Å²	2	29.3 Å²	29.3	1%	0.009	14%	0.138	C	C	.	.	H	α-helix	trans	-56.7	-55.1	175	-171.6	179.9	0	0	0	110.8	D87 D433 S435 M452 G453 E454 D458 V459 L460	D87-H456 HydrophobicContact CB-CB 3.96Å; D87-H456 PolarHBondContact OD2-N 3.26Å; D433-H456 IonicContact OD2-CE1 3.13Å; D433-H456 PolarHBondContact OD2-CE1 3.48Å; D433-H456 IonicContact OD2-NE2 2.77Å; D433-H456 PolarHBondContact OD2-NE2 3.47Å; D433-H456 VanDerWaalsContact OD2-NE2 3.08Å; S435-H456 PolarHBondContact OG-CE1 2.88Å; M452-H456 PolarHBondContact N-ND1 3.13Å; M452-H456 VanDerWaalsContact N-ND1 3.13Å; G453-H456 WeakPolarHBondContact O-CB 3.47Å; G453-H456 PolarHBondContact O-N 3.18Å; E454-H456 VanDerWaalsContact C-N 3.3Å; E454-H456 PolarHBondContact O-N 3.26Å; H456-D458 PolarHBondContact O-N 3.47Å; H456-V459 PolarHBondContact O-N 2.98Å; H456-L460 VanDerWaalsContact NE2-CD1 3.34Å; H456-L460 WeakPolarHBondContact NE2-CD1 3.34Å; H456-L460 WeakPolarHBondContact O-CG 3.46Å; H456-L460 PolarHBondContact O-N 2.96Å
457	L	88.5	Confident	86.5	Confident	4 Å²	4	32.2 Å²	32.2	2%	0.021	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-40.4	-178	-69.4	177.9	0	0	0	112.1	I407 V409 F436 I449 G453 E454 V459 L460 V461	I407-L457 HydrophobicContact CB-CD1 4.4Å; I407-L457 HydrophobicContact CG1-CD1 4.19Å; I407-L457 HydrophobicContact CG2-CD1 3.57Å; I407-L457 HydrophobicContact CG2-CG 4.21Å; V409-L457 HydrophobicContact CB-CD1 4.36Å; V409-L457 HydrophobicContact CG1-CD1 3.84Å; V409-L457 HydrophobicContact CG2-CD1 3.77Å; F436-L457 HydrophobicContact CD2-CD2 4.09Å; F436-L457 HydrophobicContact CE2-CD2 3.8Å; I449-L457 HydrophobicContact CD1-CD2 4.12Å; I449-L457 HydrophobicContact CG1-CD2 4.03Å; G453-L457 PolarHBondContact O-N 3.19Å; G453-L457 VanDerWaalsContact O-N 3.11Å; E454-L457 PolarHBondContact O-N 2.93Å; L457-V459 VanDerWaalsContact C-N 3.33Å; L457-V459 PolarHBondContact O-N 2.8Å; L457-L460 PolarHBondContact O-N 3.33Å; L457-V461 WeakPolarHBondContact O-CG2 3.45Å; L457-V461 PolarHBondContact O-N 3.11Å
458	D	86	Confident	86.3	Confident	73 Å²	73	33 Å²	33	39%	0.39	15%	0.152	S	C	.	.	H	α-helix	trans	-59	-43.7	175.7	-87.4	-1.4	0	0	0	112.4	E454 L455 H456 D462	E454-D458 WeakPolarHBondContact O-CB 3.28Å; E454-D458 PolarHBondContact O-N 3.38Å; L455-D458 PolarHBondContact O-N 3.25Å; H456-D458 PolarHBondContact O-N 3.47Å; D458-D462 WeakPolarHBondContact O-CB 3.24Å; D458-D462 PolarHBondContact O-N 2.64Å
459	V	87.5	Confident	86.2	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	18%	0.182	C	C	.	.	H	α-helix	trans	-64.3	-43.9	176.7	167.4	0	0	0	0	110.3	I63 F88 L455 H456 L457 D462 R463	I63-V459 HydrophobicContact CD1-CG1 4.07Å; I63-V459 HydrophobicContact CD1-CG2 3.96Å; I63-V459 HydrophobicContact CG2-CG1 4.11Å; F88-V459 HydrophobicContact CZ-CB 4.35Å; F88-V459 HydrophobicContact CZ-CG2 4.11Å; L455-V459 WeakPolarHBondContact O-CB 3.45Å; L455-V459 VanDerWaalsContact O-CG2 3.31Å; L455-V459 WeakPolarHBondContact O-CG2 3.23Å; L455-V459 PolarHBondContact O-N 2.93Å; H456-V459 PolarHBondContact O-N 2.98Å; L457-V459 VanDerWaalsContact C-N 3.33Å; L457-V459 PolarHBondContact O-N 2.8Å; V459-D462 PolarHBondContact O-N 3.34Å; V459-R463 HydrophobicContact CG1-CG 4.32Å; V459-R463 WeakPolarHBondContact O-CB 3.16Å; V459-R463 VanDerWaalsContact O-CG 3.29Å; V459-R463 WeakPolarHBondContact O-CG 3.39Å; V459-R463 PolarHBondContact O-N 2.67Å
460	L	89.9	Confident	86	Confident	6 Å²	6	40 Å²	40	3%	0.031	18%	0.182	C	C	.	.	H	α-helix	trans	-66.1	-39.2	179.3	-69.8	178.8	0	0	0	112.8	L429 F436 H456 L457 R463 M464	L429-L460 HydrophobicContact CB-CD2 4.48Å; L429-L460 HydrophobicContact CD2-CD2 4.11Å; F436-L460 HydrophobicContact CB-CD1 3.84Å; F436-L460 HydrophobicContact CD1-CD1 4.01Å; F436-L460 HydrophobicContact CD2-CD1 3.1Å; F436-L460 HydrophobicContact CE1-CD1 4.31Å; F436-L460 HydrophobicContact CE2-CB 4.47Å; F436-L460 HydrophobicContact CE2-CD1 3.43Å; F436-L460 VanDerWaalsContact CE2-CD1 3.43Å; F436-L460 HydrophobicContact CG-CD1 3.4Å; F436-L460 HydrophobicContact CZ-CD1 4.03Å; H456-L460 VanDerWaalsContact NE2-CD1 3.34Å; H456-L460 WeakPolarHBondContact NE2-CD1 3.34Å; H456-L460 WeakPolarHBondContact O-CG 3.46Å; H456-L460 PolarHBondContact O-N 2.96Å; L457-L460 PolarHBondContact O-N 3.33Å; L460-R463 PolarHBondContact O-N 2.84Å; L460-M464 WeakPolarHBondContact O-CB 3.36Å; L460-M464 PolarHBondContact O-N 2.93Å
461	V	89.2	Confident	85.9	Confident	24 Å²	24	42.4 Å²	42.4	15%	0.145	19%	0.193	C	C	.	.	H	α-helix	trans	-65.8	-42.1	174.6	172.2	0	0	0	0	110.9	V411 I449 L457 M464 R465 V474	V411-V461 HydrophobicContact CG1-CG2 4.22Å; I449-V461 HydrophobicContact CD1-CG2 3.87Å; L457-V461 WeakPolarHBondContact O-CG2 3.45Å; L457-V461 PolarHBondContact O-N 3.11Å; V461-M464 WeakPolarHBondContact O-CB 3.36Å; V461-M464 PolarHBondContact O-N 3.08Å; V461-R465 PolarHBondContact O-N 2.98Å; V461-V474 HydrophobicContact CB-CG2 4.34Å; V461-V474 HydrophobicContact CG1-CG2 3.72Å; V461-V474 HydrophobicContact CG2-CG2 3.86Å
462	D	89	Confident	86	Confident	30 Å²	30	43.1 Å²	43.1	16%	0.16	20%	0.199	C	C	.	.	H	α-helix	trans	-65.7	-41.4	175.7	-177.2	72	0	0	0	111.9	Q55 D458 V459 M464 R465 R466	Q55-D462 VanDerWaalsContact CG-OD2 3.31Å; Q55-D462 WeakPolarHBondContact CG-OD2 3.35Å; Q55-D462 PolarHBondContact NE2-OD2 2.93Å; D458-D462 WeakPolarHBondContact O-CB 3.24Å; D458-D462 PolarHBondContact O-N 2.64Å; V459-D462 PolarHBondContact O-N 3.34Å; D462-M464 PolarHBondContact O-N 2.74Å; D462-R465 CarbonylContact O-C 3.5Å; D462-R465 WeakPolarHBondContact O-CA 3.38Å; D462-R465 WeakPolarHBondContact O-CB 3.2Å; D462-R465 PolarHBondContact O-N 2.74Å; D462-R465 VanDerWaalsContact O-N 3.1Å; D462-R466 WeakPolarHBondContact O-CG 3.15Å; D462-R466 PolarHBondContact O-N 3.3Å; D462-R466 IonicContact OD1-CZ 2.63Å; D462-R466 IonicContact OD1-NE 2.64Å; D462-R466 PolarHBondContact OD1-NE 3.45Å; D462-R466 IonicContact OD1-NH2 2.88Å; D462-R466 WeakPolarHBondContact OD2-CD 3.39Å; D462-R466 IonicContact OD2-CZ 3.22Å; D462-R466 IonicContact OD2-NE 2.96Å; D462-R466 PolarHBondContact OD2-NE 3.04Å; D462-R466 IonicContact OD2-NH2 2.97Å
463	R	87.3	Confident	86.3	Confident	22 Å²	22	46.4 Å²	46.4	8%	0.083	22%	0.217	C	C	.	.	H	α-helix	trans	-59.4	-45.7	172.4	-75.1	-174.8	67.9	-154.5	-8.9	111.4	L429 E432 V459 L460 R465 R466 E467	L429-R463 HydrophobicContact CD2-CB 4.44Å; E432-R463 IonicContact OE2-CZ 3.82Å; E432-R463 IonicContact OE2-NH1 3.42Å; E432-R463 PolarHBondContact OE2-NH1 3.32Å; E432-R463 VanDerWaalsContact OE2-NH1 3.13Å; E432-R463 IonicContact OE2-NH2 3.32Å; E432-R463 PolarHBondContact OE2-NH2 2.93Å; V459-R463 HydrophobicContact CG1-CG 4.32Å; V459-R463 WeakPolarHBondContact O-CB 3.16Å; V459-R463 VanDerWaalsContact O-CG 3.29Å; V459-R463 WeakPolarHBondContact O-CG 3.39Å; V459-R463 PolarHBondContact O-N 2.67Å; L460-R463 PolarHBondContact O-N 2.84Å; R463-R465 PolarHBondContact O-N 3.18Å; R463-R466 PolarHBondContact O-N 2.93Å; R463-E467 WeakPolarHBondContact CG-OE1 3.43Å; R463-E467 IonicContact CZ-OE1 3.6Å; R463-E467 IonicContact CZ-OE2 3.53Å; R463-E467 IonicContact NE-OE1 3.36Å; R463-E467 PolarHBondContact NE-OE1 2.97Å; R463-E467 IonicContact NE-OE2 3.96Å; R463-E467 IonicContact NH2-OE1 2.61Å; R463-E467 PolarHBondContact NH2-OE1 3.39Å; R463-E467 IonicContact NH2-OE2 3.31Å; R463-E467 PolarHBondContact NH2-OE2 3.1Å; R463-E467 VanDerWaalsContact O-CB 3.24Å; R463-E467 WeakPolarHBondContact O-CB 3.45Å; R463-E467 PolarHBondContact O-N 3.46Å
464	M	89.4	Confident	86.8	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-54.9	-42	173.8	-179.2	175.1	69.5	0	0	111.5	M422 A425 L426 L429 L460 V461 D462 F468 K469 V470 A472	M422-M464 HydrophobicContact CG-CE 4.43Å; M422-M464 HydrophobicContact CG-SD 3.79Å; A425-M464 HydrophobicContact CB-CG 3.94Å; A425-M464 HydrophobicContact CB-SD 4.4Å; L426-M464 HydrophobicContact CD2-SD 4.01Å; L426-M464 HydrophobicContact CG-SD 4.13Å; L429-M464 HydrophobicContact CD1-CB 4.13Å; L460-M464 WeakPolarHBondContact O-CB 3.36Å; L460-M464 PolarHBondContact O-N 2.93Å; V461-M464 WeakPolarHBondContact O-CB 3.36Å; V461-M464 PolarHBondContact O-N 3.08Å; D462-M464 PolarHBondContact O-N 2.74Å; M464-F468 CarbonylContact O-C 3.59Å; M464-F468 WeakPolarHBondContact O-CB 3.19Å; M464-F468 PolarHBondContact O-N 2.91Å; M464-K469 PolarHBondContact O-N 2.88Å; M464-V470 HydrophobicContact CE-CG1 4.26Å; M464-V470 HydrophobicContact CG-CB 3.8Å; M464-V470 HydrophobicContact CG-CG1 4.04Å; M464-V470 PolarHBondContact O-N 2.89Å; M464-V470 HydrophobicContact SD-CB 4.4Å; M464-V470 HydrophobicContact SD-CG1 3.98Å; M464-A472 HydrophobicContact CE-CB 3.42Å; M464-A472 VanDerWaalsContact CE-CB 3.42Å
465	R	89.1	Confident	87.2	Confident	140 Å²	140	46.8 Å²	46.8	53%	0.528	23%	0.233	S	C	.	.	H	α-helix	trans	-68.6	-48.2	177.9	-166.9	-178	-174.9	-154.4	-5.9	113.2	V461 D462 R463 K469 V470 D471	V461-R465 PolarHBondContact O-N 2.98Å; D462-R465 CarbonylContact O-C 3.5Å; D462-R465 WeakPolarHBondContact O-CA 3.38Å; D462-R465 WeakPolarHBondContact O-CB 3.2Å; D462-R465 PolarHBondContact O-N 2.74Å; D462-R465 VanDerWaalsContact O-N 3.1Å; R463-R465 PolarHBondContact O-N 3.18Å; R465-K469 WeakPolarHBondContact O-CA 3.48Å; R465-K469 PolarHBondContact O-N 2.85Å; R465-V470 VanDerWaalsContact CA-O 3.29Å; R465-V470 WeakPolarHBondContact CA-O 3.34Å; R465-D471 IonicContact CZ-OD1 3.49Å; R465-D471 IonicContact NE-OD1 3.67Å; R465-D471 PolarHBondContact NE-OD1 2.91Å; R465-D471 IonicContact NH2-OD1 3.12Å
466	R	86.7	Confident	87.1	Confident	86 Å²	86	48.3 Å²	48.3	33%	0.325	25%	0.251	S	S	.	.	H	α-helix	trans	-78.5	-49	-175.2	-64.6	-169	-165.9	-158	6.5	112.8	E54 E58 D462 R463	E54-R466 IonicContact OE2-CZ 3.47Å; E54-R466 IonicContact OE2-NH1 3.96Å; E54-R466 PolarHBondContact OE2-NH1 2.73Å; E58-R466 IonicContact OE1-CZ 3.32Å; E58-R466 IonicContact OE1-NH1 3.97Å; E58-R466 PolarHBondContact OE1-NH1 2.93Å; E58-R466 IonicContact OE1-NH2 3.78Å; E58-R466 PolarHBondContact OE1-NH2 3.14Å; E58-R466 VanDerWaalsContact OE1-NH2 3.14Å; E58-R466 IonicContact OE2-CZ 3.47Å; E58-R466 IonicContact OE2-NH1 2.67Å; E58-R466 IonicContact OE2-NH2 2.84Å; E58-R466 PolarHBondContact OE2-NH2 2.84Å; D462-R466 WeakPolarHBondContact O-CG 3.15Å; D462-R466 PolarHBondContact O-N 3.3Å; D462-R466 IonicContact OD1-CZ 2.63Å; D462-R466 IonicContact OD1-NE 2.64Å; D462-R466 PolarHBondContact OD1-NE 3.45Å; D462-R466 IonicContact OD1-NH2 2.88Å; D462-R466 WeakPolarHBondContact OD2-CD 3.39Å; D462-R466 IonicContact OD2-CZ 3.22Å; D462-R466 IonicContact OD2-NE 2.96Å; D462-R466 PolarHBondContact OD2-NE 3.04Å; D462-R466 IonicContact OD2-NH2 2.97Å; R463-R466 PolarHBondContact O-N 2.93Å
467	E	84.5	Confident	86.8	Confident	81 Å²	81	48.7 Å²	48.7	38%	0.379	25%	0.254	S	S	.	.	H	α-helix	trans	-79.1	-41.2	-173.3	-61.6	175	-159.6	0	0	111.7	R463	R463-E467 WeakPolarHBondContact CG-OE1 3.43Å; R463-E467 IonicContact CZ-OE1 3.6Å; R463-E467 IonicContact CZ-OE2 3.53Å; R463-E467 IonicContact NE-OE1 3.36Å; R463-E467 PolarHBondContact NE-OE1 2.97Å; R463-E467 IonicContact NE-OE2 3.96Å; R463-E467 IonicContact NH2-OE1 2.61Å; R463-E467 PolarHBondContact NH2-OE1 3.39Å; R463-E467 IonicContact NH2-OE2 3.31Å; R463-E467 PolarHBondContact NH2-OE2 3.1Å; R463-E467 VanDerWaalsContact O-CB 3.24Å; R463-E467 WeakPolarHBondContact O-CB 3.45Å; R463-E467 PolarHBondContact O-N 3.46Å
468	F	86.6	Confident	86.3	Confident	45 Å²	45	53.4 Å²	53.4	20%	0.197	28%	0.275	C	S	.	.	H	α-helix	trans	-103	-6.3	-174.8	-57.7	-88.5	0	0	0	113.6	A425 K428 L429 M464 V470	A425-F468 HydrophobicContact CB-CB 3.7Å; A425-F468 HydrophobicContact CB-CD1 3.86Å; A425-F468 HydrophobicContact CB-CD2 3.91Å; A425-F468 HydrophobicContact CB-CE1 4.49Å; A425-F468 HydrophobicContact CB-CG 3.52Å; K428-F468 HydrophobicContact CB-CE1 4.34Å; K428-F468 HydrophobicContact CB-CZ 4.14Å; K428-F468 HydrophobicContact CD-CE1 3.59Å; K428-F468 HydrophobicContact CD-CZ 4.13Å; L429-F468 HydrophobicContact CD2-CE2 4.2Å; L429-F468 HydrophobicContact CG-CE2 4.28Å; M464-F468 CarbonylContact O-C 3.59Å; M464-F468 WeakPolarHBondContact O-CB 3.19Å; M464-F468 PolarHBondContact O-N 2.91Å; F468-V470 VanDerWaalsContact C-N 3.29Å; F468-V470 HydrophobicContact CB-CG2 4.09Å; F468-V470 PolarHBondContact O-N 3.29Å
469	K	87.8	Confident	86.1	Confident	166 Å²	166	50.5 Å²	50.5	72%	0.722	26%	0.261	S	S	*	.			trans	56.4	43.8	-178.9	-55.6	-178.6	-179.2	-178.7	0	112	M464 R465	M464-K469 PolarHBondContact O-N 2.88Å; R465-K469 WeakPolarHBondContact O-CA 3.48Å; R465-K469 PolarHBondContact O-N 2.85Å
470	V	88.6	Confident	85.9	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.267	C	S	.	.			trans	-113.7	111.2	178.3	175.8	0	0	0	0	108.6	D418 K421 M422 M464 R465 F468	D418-V470 HydrophobicContact CB-CG1 4.28Å; K421-V470 HydrophobicContact CB-CG2 3.46Å; K421-V470 VanDerWaalsContact CB-CG2 3.46Å; K421-V470 HydrophobicContact CD-CG2 4.31Å; M422-V470 HydrophobicContact CB-CG1 3.8Å; M422-V470 HydrophobicContact CG-CG1 4.19Å; M464-V470 HydrophobicContact CE-CG1 4.26Å; M464-V470 HydrophobicContact CG-CB 3.8Å; M464-V470 HydrophobicContact CG-CG1 4.04Å; M464-V470 PolarHBondContact O-N 2.89Å; M464-V470 HydrophobicContact SD-CB 4.4Å; M464-V470 HydrophobicContact SD-CG1 3.98Å; R465-V470 VanDerWaalsContact CA-O 3.29Å; R465-V470 WeakPolarHBondContact CA-O 3.34Å; F468-V470 VanDerWaalsContact C-N 3.29Å; F468-V470 HydrophobicContact CB-CG2 4.09Å; F468-V470 PolarHBondContact O-N 3.29Å
471	D	87	Confident	85.9	Confident	58 Å²	58	52.6 Å²	52.6	31%	0.31	27%	0.271	S	S	.	.			trans	-85.5	118.9	170.9	-85	-65.7	0	0	0	109.9	K414 R465	K414-D471 HydrophobicContact CB-CB 4.46Å; K414-D471 HydrophobicContact CD-CB 3.85Å; K414-D471 HydrophobicContact CG-CB 4.26Å; K414-D471 PolarHBondContact N-O 3.37Å; K414-D471 VanDerWaalsContact N-O 3.08Å; K414-D471 IonicContact NZ-OD1 3.51Å; R465-D471 IonicContact CZ-OD1 3.49Å; R465-D471 IonicContact NE-OD1 3.67Å; R465-D471 PolarHBondContact NE-OD1 2.91Å; R465-D471 IonicContact NH2-OD1 3.12Å
472	A	88.6	Confident	85.9	Confident	16 Å²	16	53.4 Å²	53.4	13%	0.132	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	155.8	173.3	0	0	0	0	0	111.1	V411 E412 M422 M464	V411-A472 HydrophobicContact CG1-CB 4.33Å; E412-A472 CarbonylContact O-C 3.59Å; E412-A472 VanDerWaalsContact O-CA 3.23Å; E412-A472 WeakPolarHBondContact O-CA 3.42Å; E412-A472 WeakPolarHBondContact O-CB 3.38Å; M422-A472 HydrophobicContact SD-CB 4.37Å; M464-A472 HydrophobicContact CE-CB 3.42Å; M464-A472 VanDerWaalsContact CE-CB 3.42Å
473	N	88.4	Confident	86	Confident	81 Å²	81	52 Å²	52	43%	0.433	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	140.3	165.9	-62.2	-36.2	0	0	0	108.4	V411 E412 K414	V411-N473 WeakPolarHBondContact CA-O 3.38Å; E412-N473 PolarHBondContact N-O 2.98Å; E412-N473 PolarHBondContact O-N 3.47Å; K414-N473 WeakPolarHBondContact CE-OD1 3.37Å
474	V	87.1	Confident	86.2	Confident	71 Å²	71	51 Å²	51	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	135.2	176.1	-171.7	0	0	0	0	108.3	V409 A410 V411 V461	V409-V474 HydrophobicContact CB-CG1 3.88Å; V409-V474 HydrophobicContact CG1-CG1 4.35Å; V409-V474 HydrophobicContact CG2-CG1 3.78Å; A410-V474 WeakPolarHBondContact O-CA 3.2Å; V411-V474 HydrophobicContact CG1-CG2 3.95Å; V461-V474 HydrophobicContact CB-CG2 4.34Å; V461-V474 HydrophobicContact CG1-CG2 3.72Å; V461-V474 HydrophobicContact CG2-CG2 3.86Å
475	G	84.9	Confident	86.4	Confident	37 Å²	37	51 Å²	51	38%	0.381	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	173.1	179.2	0	0	0	0	0	112.6	A410	A410-G475 PolarHBondContact N-O 3.2Å; A410-G475 PolarHBondContact O-N 2.77Å
476	A	79.6	Confident	86.4	Confident	69 Å²	69	49.1 Å²	49.1	57%	0.57	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-68	137.1	171.1	0	0	0	0	0	109.7	F651	A476-F651 HydrophobicContact CB-CD2 4.25Å; A476-F651 HydrophobicContact CB-CE2 4.47Å; A476-F651 HydrophobicContact CB-CG 4.4Å
477	P	78.3	Confident	86.7	Confident	11 Å²	11	47.4 Å²	47.4	7%	0.071	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-53.8	142.6	172.7	-23.8	33	0	0	0	111.9	E408 V448 F651	E408-P477 HydrophobicContact CB-CG 4.19Å; V448-P477 HydrophobicContact CG1-CG 4.36Å; V448-P477 HydrophobicContact CG2-CB 4.5Å; P477-F651 HydrophobicContact CB-CE1 4.01Å; P477-F651 HydrophobicContact CB-CZ 4.25Å; P477-F651 HydrophobicContact CG-CD1 4.47Å; P477-F651 HydrophobicContact CG-CE1 3.84Å; P477-F651 VanDerWaalsContact O-CZ 3.28Å; P477-F651 WeakPolarHBondContact O-CZ 3.26Å
478	Q	77.3	Confident	87.1	Confident	102 Å²	102	46.6 Å²	46.6	48%	0.477	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-66.5	137.3	171	-77	-178.3	30.3	0	0	111.3	T444 E446	T444-Q478 HydrophobicContact CG2-CB 3.78Å; E446-Q478 VanDerWaalsContact OE1-CG 3.23Å; E446-Q478 WeakPolarHBondContact OE1-CG 3.44Å; E446-Q478 PolarHBondContact OE1-NE2 2.88Å; E446-Q478 VanDerWaalsContact OE2-CB 3.31Å; E446-Q478 WeakPolarHBondContact OE2-CB 3.41Å; E446-Q478 WeakPolarHBondContact OE2-CG 3.46Å; E446-Q478 PolarHBondContact OE2-N 2.63Å; E446-Q478 VanDerWaalsContact OE2-N 3.07Å
479	V	81.7	Confident	87.5	Confident	13 Å²	13	45.3 Å²	45.3	8%	0.079	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-85.2	126.4	175.3	179.8	0	0	0	0	108.7	Y481 P602 A648 F651	V479-Y481 VanDerWaalsContact C-N 3.29Å; V479-Y481 HydrophobicContact CB-CD2 4.14Å; V479-Y481 HydrophobicContact CB-CE2 3.66Å; V479-Y481 HydrophobicContact CG1-CD1 4.27Å; V479-Y481 HydrophobicContact CG1-CD2 4.23Å; V479-Y481 HydrophobicContact CG1-CE1 3.97Å; V479-Y481 HydrophobicContact CG1-CE2 3.96Å; V479-Y481 HydrophobicContact CG1-CG 4.38Å; V479-Y481 VanDerWaalsContact O-CD2 3.27Å; V479-Y481 WeakPolarHBondContact O-CD2 3.16Å; V479-Y481 PolarHBondContact O-N 3.48Å; V479-P602 VanDerWaalsContact CG1-CD 3.47Å; V479-P602 HydrophobicContact CG1-CG 3.6Å; V479-A648 HydrophobicContact CG2-CB 3.95Å; V479-F651 HydrophobicContact CG2-CE2 3.78Å; V479-F651 HydrophobicContact CG2-CZ 3.87Å
480	S	83.2	Confident	87.7	Confident	22 Å²	22	41.1 Å²	41.1	15%	0.154	24%	0.243	C	C	.	.			trans	-72.5	79.4	173	-71.8	0	0	0	0	111	E443 Y674	E443-S480 WeakPolarHBondContact OE2-CB 3.35Å; E443-S480 PolarHBondContact OE2-OG 3.37Å; S480-Y674 VanDerWaalsContact O-CE1 3.27Å; S480-Y674 WeakPolarHBondContact O-CE1 3.23Å; S480-Y674 PolarHBondContact O-OH 3.38Å
481	Y	89.1	Confident	88	Confident	29 Å²	29	41.4 Å²	41.4	11%	0.114	25%	0.245	C	C	.	.			trans	-68.2	158.7	171.9	-64.1	-78.6	0	0	0	111.4	V479 Y556 I599 L600 E601 V677 I685	V479-Y481 VanDerWaalsContact C-N 3.29Å; V479-Y481 HydrophobicContact CB-CD2 4.14Å; V479-Y481 HydrophobicContact CB-CE2 3.66Å; V479-Y481 HydrophobicContact CG1-CD1 4.27Å; V479-Y481 HydrophobicContact CG1-CD2 4.23Å; V479-Y481 HydrophobicContact CG1-CE1 3.97Å; V479-Y481 HydrophobicContact CG1-CE2 3.96Å; V479-Y481 HydrophobicContact CG1-CG 4.38Å; V479-Y481 VanDerWaalsContact O-CD2 3.27Å; V479-Y481 WeakPolarHBondContact O-CD2 3.16Å; V479-Y481 PolarHBondContact O-N 3.48Å; Y481-Y556 HydrophobicContact CD2-CE1 4.16Å; Y481-Y556 AromaticContact CD2-CE2 3.95Å; Y481-Y556 HydrophobicContact CD2-CE2 3.95Å; Y481-Y556 AromaticContact CD2-CZ 3.65Å; Y481-Y556 HydrophobicContact CG-CD2 4.49Å; Y481-Y556 HydrophobicContact CG-CE2 4.15Å; Y481-Y556 WeakPolarHBondContact O-CB 3.41Å; Y481-I599 HydrophobicContact CD1-CG2 3.85Å; Y481-I599 HydrophobicContact CG-CG2 4.13Å; Y481-L600 WeakPolarHBondContact CA-O 3.31Å; Y481-L600 WeakPolarHBondContact CD1-O 3.28Å; Y481-E601 HydrophobicContact CD1-CB 3.94Å; Y481-E601 HydrophobicContact CE1-CB 3.76Å; Y481-V677 HydrophobicContact CD1-CG1 4.28Å; Y481-V677 HydrophobicContact CE1-CG1 4.13Å; Y481-I685 HydrophobicContact CD1-CD1 3.92Å; Y481-I685 HydrophobicContact CD2-CD1 4.43Å; Y481-I685 HydrophobicContact CE1-CD1 3.44Å; Y481-I685 VanDerWaalsContact CE1-CD1 3.44Å; Y481-I685 HydrophobicContact CE2-CD1 3.98Å; Y481-I685 HydrophobicContact CE2-CG1 4.39Å; Y481-I685 HydrophobicContact CG-CD1 4.4Å; Y481-I685 VanDerWaalsContact CZ-CD1 3.48Å
482	R	89.3	Confident	88.4	Confident	41 Å²	41	42.5 Å²	42.5	16%	0.155	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	167.4	169.2	-56.5	-67.5	175.4	159.6	-4	110.5	E443 V559 I599 L600 Y674	E443-R482 IonicContact OE1-CZ 2.68Å; E443-R482 IonicContact OE1-NH1 3.55Å; E443-R482 IonicContact OE1-NH2 3.68Å; E443-R482 PolarHBondContact OE1-NH2 3.07Å; E443-R482 IonicContact OE2-NH2 3.76Å; E443-R482 PolarHBondContact OE2-NH2 2.96Å; R482-V559 HydrophobicContact CB-CG1 4.47Å; R482-V559 HydrophobicContact CB-CG2 3.72Å; R482-V559 HydrophobicContact CG-CG1 4.32Å; R482-V559 HydrophobicContact CG-CG2 4.11Å; R482-I599 CarbonylContact O-C 3.53Å; R482-I599 WeakPolarHBondContact O-CA 3.26Å; R482-L600 HydrophobicContact CB-CB 4.14Å; R482-L600 HydrophobicContact CB-CD1 4.27Å; R482-L600 PolarHBondContact N-O 3.05Å; R482-L600 PolarHBondContact O-N 2.96Å; R482-Y674 HydrophobicContact CB-CD1 4.39Å; R482-Y674 HydrophobicContact CB-CE1 4.39Å; R482-Y674 HydrophobicContact CG-CD1 3.87Å; R482-Y674 HydrophobicContact CG-CD2 4.35Å; R482-Y674 HydrophobicContact CG-CE1 3.5Å; R482-Y674 HydrophobicContact CG-CE2 4.04Å; R482-Y674 HydrophobicContact CG-CG 4.29Å; R482-Y674 PolarHBondContact NE-OH 2.92Å
483	E	91.3	Very high	88.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	149.1	169.2	-74.4	178.4	-140.9	0	0	109.9	G551 V552 L553 A554 G555 Y556 P557 L558 V559 S598 I599	E483-G551 WeakPolarHBondContact OE2-CA 3.44Å; E483-V552 PolarHBondContact OE2-N 2.75Å; E483-L553 HydrophobicContact CG-CB 4.47Å; E483-L553 PolarHBondContact OE1-N 2.85Å; E483-L553 WeakPolarHBondContact OE2-CB 3.23Å; E483-L553 PolarHBondContact OE2-N 2.84Å; E483-A554 PolarHBondContact OE1-N 2.79Å; E483-G555 PolarHBondContact OE1-N 2.88Å; E483-Y556 PolarHBondContact OE1-N 2.8Å; E483-P557 PolarHBondContact N-O 3.43Å; E483-L558 HydrophobicContact CB-CD2 4.18Å; E483-L558 HydrophobicContact CB-CG 3.98Å; E483-L558 CarbonylContact O-C 3.57Å; E483-L558 VanDerWaalsContact O-CA 3.23Å; E483-L558 WeakPolarHBondContact O-CA 3.31Å; E483-V559 PolarHBondContact O-N 2.81Å; E483-S598 CarbonylContact C-O 3.57Å; E483-S598 VanDerWaalsContact CA-O 3.32Å; E483-S598 WeakPolarHBondContact CA-O 3.37Å; E483-I599 HydrophobicContact CG-CG1 4.29Å
484	T	92.7	Very high	88.9	Confident	2 Å²	2	42.4 Å²	42.4	1%	0.012	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	169.7	171.7	-165.8	0	0	0	0	111	V559 D560 P597 S598 L600	T484-V559 WeakPolarHBondContact CB-O 3.18Å; T484-V559 PolarHBondContact OG1-O 2.89Å; T484-D560 PolarHBondContact OG1-O 3Å; T484-P597 CarbonylContact O-C 3.56Å; T484-P597 VanDerWaalsContact O-CA 3.25Å; T484-P597 WeakPolarHBondContact O-CA 3.26Å; T484-S598 PolarHBondContact N-O 3.02Å; T484-S598 PolarHBondContact O-N 2.97Å; T484-L600 HydrophobicContact CG2-CD1 3.91Å; T484-L600 HydrophobicContact CG2-CD2 3.84Å; T484-L600 HydrophobicContact CG2-CG 4.02Å
485	F	92.5	Very high	89.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.9	171.8	-68.4	-13.6	0	0	0	110	F512 P514 L558 I561 L588 A591 A592 A595 P597	F485-F512 HydrophobicContact CD2-CB 4.11Å; F485-F512 HydrophobicContact CE2-CB 4.19Å; F485-F512 HydrophobicContact CE2-CD1 4.41Å; F485-F512 HydrophobicContact CE2-CG 4.28Å; F485-P514 VanDerWaalsContact O-CB 3.26Å; F485-P514 WeakPolarHBondContact O-CB 3.09Å; F485-P514 VanDerWaalsContact O-CG 3.23Å; F485-P514 WeakPolarHBondContact O-CG 3.2Å; F485-L558 HydrophobicContact CD1-CD2 3.95Å; F485-L558 HydrophobicContact CE1-CD2 3.68Å; F485-L558 HydrophobicContact CZ-CD2 4.19Å; F485-I561 HydrophobicContact CB-CD1 4.25Å; F485-I561 HydrophobicContact CB-CG1 4.32Å; F485-I561 HydrophobicContact CD1-CD1 4.14Å; F485-I561 HydrophobicContact CD2-CD1 3.68Å; F485-I561 HydrophobicContact CD2-CG1 4.22Å; F485-I561 HydrophobicContact CD2-CG2 4.48Å; F485-I561 HydrophobicContact CE1-CD1 4.43Å; F485-I561 HydrophobicContact CE2-CD1 4Å; F485-I561 HydrophobicContact CG-CD1 3.75Å; F485-I561 HydrophobicContact CG-CG1 4.31Å; F485-I561 HydrophobicContact CZ-CD1 4.37Å; F485-L588 HydrophobicContact CE2-CD1 4.04Å; F485-L588 HydrophobicContact CZ-CD1 4.04Å; F485-A591 HydrophobicContact CE2-CB 4.08Å; F485-A591 HydrophobicContact CZ-CB 4.45Å; F485-A592 HydrophobicContact CE1-CB 3.87Å; F485-A592 HydrophobicContact CZ-CB 3.87Å; F485-A595 HydrophobicContact CB-CB 3.85Å; F485-A595 HydrophobicContact CD1-CB 3.69Å; F485-A595 HydrophobicContact CD2-CB 3.48Å; F485-A595 VanDerWaalsContact CD2-CB 3.48Å; F485-A595 HydrophobicContact CE1-CB 4.08Å; F485-A595 HydrophobicContact CE2-CB 3.88Å; F485-A595 HydrophobicContact CG-CB 3.39Å; F485-A595 HydrophobicContact CZ-CB 4.17Å; F485-P597 HydrophobicContact CD1-CB 4.12Å; F485-P597 HydrophobicContact CE1-CB 4.26Å
486	R	90.1	Very high	89.5	Confident	102 Å²	102	42.9 Å²	42.9	39%	0.385	23%	0.234	S	C	.	.			trans	-107.2	-4	176.5	-64.9	-62.3	-172.5	-159.9	0.7	113.2	A595 N596 D676	R486-A595 PolarHBondContact N-O 2.65Å; R486-A595 VanDerWaalsContact N-O 3.11Å; R486-N596 PolarHBondContact N-O 3.3Å; R486-D676 IonicContact CZ-OD1 3.67Å; R486-D676 IonicContact CZ-OD2 3.59Å; R486-D676 VanDerWaalsContact CZ-OD2 3.27Å; R486-D676 IonicContact NE-OD1 3.28Å; R486-D676 PolarHBondContact NE-OD1 2.97Å; R486-D676 VanDerWaalsContact NE-OD1 3.09Å; R486-D676 IonicContact NE-OD2 3.18Å; R486-D676 PolarHBondContact NE-OD2 2.81Å; R486-D676 IonicContact NH2-OD1 2.74Å; R486-D676 PolarHBondContact NH2-OD1 3.49Å; R486-D676 IonicContact NH2-OD2 3.38Å; R486-D676 PolarHBondContact NH2-OD2 2.9Å
487	S	92.1	Very high	89.8	Confident	49 Å²	49	46.4 Å²	46.4	34%	0.343	23%	0.233	S	C	.	.	S	Bend	trans	-136.5	138.6	179.6	-63.3	0	0	0	0	111.8	A595	S487-A595 PolarHBondContact N-O 2.78Å
488	A	93.2	Very high	89.8	Confident	65 Å²	65	54 Å²	54	54%	0.537	27%	0.267	S	S	.	.			trans	-65.9	137.9	173.8	0	0	0	0	0	111	F512 T513	A488-F512 CarbonylContact C-O 3.59Å; A488-F512 VanDerWaalsContact CA-O 3.27Å; A488-F512 WeakPolarHBondContact CA-O 3.31Å; A488-T513 HydrophobicContact CB-CG2 3.82Å
489	T	94	Very high	89	Confident	18 Å²	18	52.4 Å²	52.4	11%	0.11	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	152.3	179	-157.5	0	0	0	0	112.9	F512 A591 K594 A595	T489-F512 HydrophobicContact CG2-CB 4.35Å; T489-F512 PolarHBondContact N-O 3.36Å; T489-F512 PolarHBondContact O-N 3.35Å; T489-A591 HydrophobicContact CG2-CB 3.61Å; T489-K594 WeakPolarHBondContact OG1-CB 3.25Å; T489-A595 HydrophobicContact CG2-CB 3.78Å
490	N	93.8	Very high	88.1	Confident	78 Å²	78	56.6 Å²	56.6	42%	0.417	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	134	173.1	-63.1	-27.2	0	0	0	109.3	E511	N490-E511 WeakPolarHBondContact OD1-CA 3.43Å; N490-E511 WeakPolarHBondContact OD1-CB 3.43Å; N490-E511 VanDerWaalsContact OD1-CG 3.29Å; N490-E511 WeakPolarHBondContact OD1-CG 3.27Å
491	A	94	Very high	87.4	Confident	5 Å²	5	58.5 Å²	58.5	4%	0.041	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	140.8	-179.3	0	0	0	0	0	112.8	I510 F512 A587 A590 A591	A491-I510 PolarHBondContact N-O 2.81Å; A491-I510 PolarHBondContact O-N 2.86Å; A491-F512 HydrophobicContact CB-CD2 4.38Å; A491-F512 HydrophobicContact CB-CE2 4.19Å; A491-A587 WeakPolarHBondContact CB-O 3.23Å; A491-A590 HydrophobicContact CB-CB 4.19Å; A491-A591 HydrophobicContact CB-CB 3.7Å
492	E	95	Very high	86.4	Confident	81 Å²	81	66.6 Å²	66.6	38%	0.379	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	130.1	173.6	-174.5	-176.2	173.5	0	0	109.8	K494 H507 W509	E492-K494 HydrophobicContact CG-CB 4.46Å; E492-H507 IonicContact OE1-CD2 3.86Å; E492-H507 IonicContact OE1-NE2 3.66Å; E492-H507 PolarHBondContact OE1-NE2 3.34Å; E492-W509 HydrophobicContact CB-CD2 4.04Å; E492-W509 HydrophobicContact CB-CE3 4.09Å; E492-W509 HydrophobicContact CB-CH2 3.71Å; E492-W509 HydrophobicContact CB-CZ2 3.61Å; E492-W509 HydrophobicContact CB-CZ3 3.94Å; E492-W509 HydrophobicContact CG-CD2 4.28Å; E492-W509 HydrophobicContact CG-CH2 4.25Å; E492-W509 HydrophobicContact CG-CZ2 3.62Å; E492-W509 WeakPolarHBondContact OE2-CZ2 3.27Å
493	G	94.2	Very high	86	Confident	0 Å²	0	65 Å²	65	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	108.4	167.6	0	0	0	0	0	109.8	H507 V508 A583	G493-H507 CarbonylContact O-C 3.54Å; G493-H507 VanDerWaalsContact O-CA 3.31Å; G493-H507 WeakPolarHBondContact O-CA 3.34Å; G493-V508 PolarHBondContact N-O 3.15Å; G493-V508 PolarHBondContact O-N 3.31Å; G493-A583 VanDerWaalsContact CA-O 3.25Å; G493-A583 WeakPolarHBondContact CA-O 3.49Å
494	K	94	Very high	85.8	Confident	96 Å²	96	67.6 Å²	67.6	42%	0.417	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.9	179.1	-169.4	173	-177.2	174.1	0	111.2	E492 V496 H507	E492-K494 HydrophobicContact CG-CB 4.46Å; K494-V496 HydrophobicContact CG-CG2 4.11Å; K494-H507 HydrophobicContact CG-CB 4.24Å
495	F	92.8	Very high	85.8	Confident	33 Å²	33	69.5 Å²	69.5	15%	0.145	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	113.7	177.5	-175.6	-110	0	0	0	110.1	R497 Q504 Y505 G506 A579 V582 A583 M586	F495-R497 HydrophobicContact CE1-CB 4.2Å; F495-R497 HydrophobicContact CE2-CB 4.47Å; F495-R497 HydrophobicContact CZ-CB 3.9Å; F495-Q504 HydrophobicContact CD1-CB 4.29Å; F495-Q504 HydrophobicContact CE1-CB 3.77Å; F495-Q504 VanDerWaalsContact CE1-OE1 3.31Å; F495-Y505 WeakPolarHBondContact O-CA 3.21Å; F495-G506 PolarHBondContact N-O 3.45Å; F495-G506 PolarHBondContact O-N 2.92Å; F495-A579 HydrophobicContact CD1-CB 4.02Å; F495-V582 HydrophobicContact CB-CG1 4.27Å; F495-V582 HydrophobicContact CD1-CB 4.28Å; F495-V582 HydrophobicContact CD1-CG1 4.3Å; F495-V582 HydrophobicContact CD2-CB 4.36Å; F495-V582 HydrophobicContact CD2-CG1 3.52Å; F495-V582 HydrophobicContact CE2-CG1 3.85Å; F495-V582 HydrophobicContact CG-CB 4.14Å; F495-V582 HydrophobicContact CG-CG1 3.77Å; F495-V582 HydrophobicContact CZ-CG1 4.35Å; F495-A583 HydrophobicContact CB-CB 4.23Å; F495-M586 HydrophobicContact CB-SD 4.19Å; F495-M586 HydrophobicContact CD2-SD 4.07Å
496	V	91.1	Very high	85.8	Confident	84 Å²	84	69.5 Å²	69.5	51%	0.509	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	117.3	176.2	-174.3	0	0	0	0	108.1	K494 Q504 Y505	K494-V496 HydrophobicContact CG-CG2 4.11Å; V496-Q504 WeakPolarHBondContact CA-O 3.42Å; V496-Y505 HydrophobicContact CG1-CD2 4.36Å; V496-Y505 HydrophobicContact CG2-CD2 3.7Å; V496-Y505 HydrophobicContact CG2-CE2 3.69Å
497	R	86.3	Confident	86.1	Confident	143 Å²	143	65.6 Å²	65.6	54%	0.54	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	118.1	176.5	-164.3	171.9	-177.1	163.8	1.4	110.5	F495 Q504	F495-R497 HydrophobicContact CE1-CB 4.2Å; F495-R497 HydrophobicContact CE2-CB 4.47Å; F495-R497 HydrophobicContact CZ-CB 3.9Å; R497-Q504 HydrophobicContact CB-CB 4.3Å; R497-Q504 PolarHBondContact N-O 2.7Å; R497-Q504 PolarHBondContact O-N 3.46Å
498	Q	77.4	Confident	86.3	Confident	170 Å²	170	63.3 Å²	63.3	79%	0.794	36%	0.357	S	S	*	.			trans	-108.8	90.9	170.3	-74.9	-175.5	-20.8	0	0	108.3
499	S	61.1	Low	86.4	Confident	69 Å²	69	63.8 Å²	63.8	48%	0.483	35%	0.345	S	S	.	.			trans	-119.2	98.6	173.8	56.1	0	0	0	0	109.9	G501	S499-G501 PolarHBondContact O-N 3.29Å
500	G	62.2	Low	86.5	Confident	102 Å²	102	63 Å²	63	100%	1.052	34%	0.34	S	S	*	.	S	Bend	trans	49.6	0.1	161.8	0	0	0	0	0	120.2
501	G	69.3	Low	86.6	Confident	61 Å²	61	62.3 Å²	62.3	63%	0.629	34%	0.335	S	S	*	.	S	Bend	trans	-150.5	-152.4	-172.4	0	0	0	0	0	110.8	S499 G503	S499-G501 PolarHBondContact O-N 3.29Å; G501-G503 PolarHBondContact O-N 3.39Å
502	K	68.8	Low	86.6	Confident	200 Å²	200	62.1 Å²	62.1	87%	0.87	33%	0.333	S	S	*	.	S	Bend	trans	-55.9	124.7	177.1	-71.8	-172.5	177.4	-174.4	0	109.7
503	G	80	Confident	86.5	Confident	6 Å²	6	59.9 Å²	59.9	6%	0.062	33%	0.325	C	S	.	.			trans	-62.5	155.9	177.4	0	0	0	0	0	111	G501 D574	G501-G503 PolarHBondContact O-N 3.39Å; G503-D574 CarbonylContact C-O 3.52Å; G503-D574 VanDerWaalsContact CA-OD1 3.28Å; G503-D574 WeakPolarHBondContact CA-OD1 3.34Å; G503-D574 PolarHBondContact N-OD1 3.1Å
504	Q	88.4	Confident	86.4	Confident	56 Å²	56	62.2 Å²	62.2	26%	0.262	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	121.5	173.4	-59.8	-171.6	-43.4	0	0	109.2	F495 V496 R497 D574 A579	F495-Q504 HydrophobicContact CD1-CB 4.29Å; F495-Q504 HydrophobicContact CE1-CB 3.77Å; F495-Q504 VanDerWaalsContact CE1-OE1 3.31Å; V496-Q504 WeakPolarHBondContact CA-O 3.42Å; R497-Q504 HydrophobicContact CB-CB 4.3Å; R497-Q504 PolarHBondContact N-O 2.7Å; R497-Q504 PolarHBondContact O-N 3.46Å; Q504-D574 CarbonylContact C-O 3.56Å; Q504-D574 VanDerWaalsContact CA-O 3.26Å; Q504-D574 WeakPolarHBondContact CA-O 3.49Å; Q504-A579 HydrophobicContact CB-CB 4.19Å
505	Y	92.3	Very high	86.3	Confident	41 Å²	41	59.4 Å²	59.4	16%	0.161	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	119.8	177.7	-171.4	-84.6	0	0	0	111.2	F495 V496 H507 S569 H571 D574 S575	F495-Y505 WeakPolarHBondContact O-CA 3.21Å; V496-Y505 HydrophobicContact CG1-CD2 4.36Å; V496-Y505 HydrophobicContact CG2-CD2 3.7Å; V496-Y505 HydrophobicContact CG2-CE2 3.69Å; Y505-H507 HydrophobicContact CE1-CB 3.95Å; Y505-S569 WeakPolarHBondContact CE1-O 3.15Å; Y505-S569 PolarHBondContact OH-OG 3.07Å; Y505-H571 HydrophobicContact CD1-CB 3.93Å; Y505-H571 HydrophobicContact CD2-CB 4.46Å; Y505-H571 HydrophobicContact CG-CB 3.84Å; Y505-D574 PolarHBondContact N-O 3.41Å; Y505-S575 VanDerWaalsContact O-CA 3.23Å; Y505-S575 WeakPolarHBondContact O-CA 3.18Å; Y505-S575 WeakPolarHBondContact O-CB 3.5Å; Y505-S575 PolarHBondContact O-OG 3.39Å
506	G	92.6	Very high	86	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	133.7	170.6	0	0	0	0	0	109.5	F495	F495-G506 PolarHBondContact N-O 3.45Å; F495-G506 PolarHBondContact O-N 2.92Å
507	H	95.5	Very high	85.6	Confident	21 Å²	21	67 Å²	67	10%	0.097	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	122.8	-179.9	177.8	-135	0	0	0	110.6	E492 G493 K494 Y505 W509 G568 S569	E492-H507 IonicContact OE1-CD2 3.86Å; E492-H507 IonicContact OE1-NE2 3.66Å; E492-H507 PolarHBondContact OE1-NE2 3.34Å; G493-H507 CarbonylContact O-C 3.54Å; G493-H507 VanDerWaalsContact O-CA 3.31Å; G493-H507 WeakPolarHBondContact O-CA 3.34Å; K494-H507 HydrophobicContact CG-CB 4.24Å; Y505-H507 HydrophobicContact CE1-CB 3.95Å; H507-W509 AromaticContact CE1-CD1 3.85Å; H507-W509 AromaticContact CE1-NE1 3.41Å; H507-W509 PolarHBondContact CE1-NE1 3.32Å; H507-W509 AromaticContact NE2-CD1 3.6Å; H507-W509 AromaticContact NE2-NE1 3.05Å; H507-W509 PolarHBondContact NE2-NE1 3.15Å; H507-G568 CarbonylContact O-C 3.56Å; H507-G568 WeakPolarHBondContact O-CA 3.47Å; H507-S569 PolarHBondContact N-O 3.24Å; H507-S569 PolarHBondContact ND1-N 3.33Å; H507-S569 PolarHBondContact ND1-OG 3.29Å; H507-S569 PolarHBondContact O-N 3.02Å
508	V	95.5	Very high	85.3	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	146.4	-176.8	-64.8	0	0	0	0	111.1	G493 I510 V540 L565 F580 A583 A587	G493-V508 PolarHBondContact N-O 3.15Å; G493-V508 PolarHBondContact O-N 3.31Å; V508-I510 HydrophobicContact CB-CD1 4.42Å; V508-I510 HydrophobicContact CB-CG1 4.38Å; V508-I510 HydrophobicContact CG2-CD1 3.94Å; V508-I510 HydrophobicContact CG2-CG1 4.31Å; V508-V540 HydrophobicContact CG1-CG1 4.28Å; V508-V540 HydrophobicContact CG1-CG2 3.77Å; V508-L565 HydrophobicContact CB-CD1 3.79Å; V508-L565 HydrophobicContact CG1-CD1 3.94Å; V508-F580 HydrophobicContact CG1-CD1 3.66Å; V508-F580 HydrophobicContact CG1-CE1 3.87Å; V508-A583 HydrophobicContact CG2-CB 4.11Å; V508-A587 HydrophobicContact CG2-CB 4.34Å
509	W	96.2	Very high	85.5	Confident	76 Å²	76	58.1 Å²	58.1	29%	0.288	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	123.7	167.7	-76	81.1	0	0	0	109	E492 H507 Y566 D567	E492-W509 HydrophobicContact CB-CD2 4.04Å; E492-W509 HydrophobicContact CB-CE3 4.09Å; E492-W509 HydrophobicContact CB-CH2 3.71Å; E492-W509 HydrophobicContact CB-CZ2 3.61Å; E492-W509 HydrophobicContact CB-CZ3 3.94Å; E492-W509 HydrophobicContact CG-CD2 4.28Å; E492-W509 HydrophobicContact CG-CH2 4.25Å; E492-W509 HydrophobicContact CG-CZ2 3.62Å; E492-W509 WeakPolarHBondContact OE2-CZ2 3.27Å; H507-W509 AromaticContact CE1-CD1 3.85Å; H507-W509 AromaticContact CE1-NE1 3.41Å; H507-W509 PolarHBondContact CE1-NE1 3.32Å; H507-W509 AromaticContact NE2-CD1 3.6Å; H507-W509 AromaticContact NE2-NE1 3.05Å; H507-W509 PolarHBondContact NE2-NE1 3.15Å; W509-Y566 HydrophobicContact CB-CE1 4.07Å; W509-Y566 HydrophobicContact CB-CE2 3.98Å; W509-Y566 PolarHBondContact O-N 2.82Å; W509-D567 HydrophobicContact CB-CB 3.95Å; W509-D567 HydrophobicContact CG-CB 4.38Å; W509-D567 PolarHBondContact N-O 3.23Å
510	I	95.5	Very high	86.7	Confident	0 Å²	0	56 Å²	56	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	130.2	-173.6	-57.1	169.6	0	0	0	108.2	A491 V508 F512 V540 L544 A563 K564 L565 A587	A491-I510 PolarHBondContact N-O 2.81Å; A491-I510 PolarHBondContact O-N 2.86Å; V508-I510 HydrophobicContact CB-CD1 4.42Å; V508-I510 HydrophobicContact CB-CG1 4.38Å; V508-I510 HydrophobicContact CG2-CD1 3.94Å; V508-I510 HydrophobicContact CG2-CG1 4.31Å; I510-F512 HydrophobicContact CB-CD2 4.39Å; I510-F512 HydrophobicContact CB-CE2 3.78Å; I510-F512 HydrophobicContact CB-CZ 4.01Å; I510-F512 HydrophobicContact CD1-CZ 4.35Å; I510-F512 HydrophobicContact CG2-CD1 4.26Å; I510-F512 HydrophobicContact CG2-CD2 4.04Å; I510-F512 HydrophobicContact CG2-CE1 3.89Å; I510-F512 HydrophobicContact CG2-CE2 3.66Å; I510-F512 HydrophobicContact CG2-CG 4.34Å; I510-F512 HydrophobicContact CG2-CZ 3.59Å; I510-V540 HydrophobicContact CD1-CG1 4.05Å; I510-L544 HydrophobicContact CD1-CD1 4.13Å; I510-L544 HydrophobicContact CD1-CD2 4.04Å; I510-L544 HydrophobicContact CD1-CG 4.42Å; I510-A563 HydrophobicContact CG2-CB 3.95Å; I510-K564 WeakPolarHBondContact CA-O 3.49Å; I510-L565 HydrophobicContact CG1-CD1 3.86Å; I510-A587 HydrophobicContact CD1-CB 4.03Å
511	E	95.7	Very high	88.1	Confident	65 Å²	65	53.9 Å²	53.9	30%	0.304	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.1	166.5	174.5	173.6	-157.3	0	0	107.8	N490 T513 K564 Y566	N490-E511 WeakPolarHBondContact OD1-CA 3.43Å; N490-E511 WeakPolarHBondContact OD1-CB 3.43Å; N490-E511 VanDerWaalsContact OD1-CG 3.29Å; N490-E511 WeakPolarHBondContact OD1-CG 3.27Å; E511-T513 HydrophobicContact CG-CG2 4.21Å; E511-K564 HydrophobicContact CB-CB 4.26Å; E511-K564 PolarHBondContact N-O 3.38Å; E511-K564 PolarHBondContact O-N 3.11Å; E511-Y566 HydrophobicContact CB-CD1 3.99Å; E511-Y566 HydrophobicContact CB-CE1 4.05Å
512	F	94.9	Very high	89.3	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	125.1	174.5	-66	-83.7	0	0	0	108.9	F485 A488 T489 A491 I510 L544 I561 K562 A563 A587 L588 A591	F485-F512 HydrophobicContact CD2-CB 4.11Å; F485-F512 HydrophobicContact CE2-CB 4.19Å; F485-F512 HydrophobicContact CE2-CD1 4.41Å; F485-F512 HydrophobicContact CE2-CG 4.28Å; A488-F512 CarbonylContact C-O 3.59Å; A488-F512 VanDerWaalsContact CA-O 3.27Å; A488-F512 WeakPolarHBondContact CA-O 3.31Å; T489-F512 HydrophobicContact CG2-CB 4.35Å; T489-F512 PolarHBondContact N-O 3.36Å; T489-F512 PolarHBondContact O-N 3.35Å; A491-F512 HydrophobicContact CB-CD2 4.38Å; A491-F512 HydrophobicContact CB-CE2 4.19Å; I510-F512 HydrophobicContact CB-CD2 4.39Å; I510-F512 HydrophobicContact CB-CE2 3.78Å; I510-F512 HydrophobicContact CB-CZ 4.01Å; I510-F512 HydrophobicContact CD1-CZ 4.35Å; I510-F512 HydrophobicContact CG2-CD1 4.26Å; I510-F512 HydrophobicContact CG2-CD2 4.04Å; I510-F512 HydrophobicContact CG2-CE1 3.89Å; I510-F512 HydrophobicContact CG2-CE2 3.66Å; I510-F512 HydrophobicContact CG2-CG 4.34Å; I510-F512 HydrophobicContact CG2-CZ 3.59Å; F512-L544 HydrophobicContact CE1-CD2 3.9Å; F512-L544 HydrophobicContact CZ-CD2 3.74Å; F512-I561 HydrophobicContact CD1-CG2 3.89Å; F512-K562 WeakPolarHBondContact CA-O 3.26Å; F512-A563 HydrophobicContact CD1-CB 3.95Å; F512-A563 HydrophobicContact CE1-CB 3.83Å; F512-A587 HydrophobicContact CE2-CB 4.4Å; F512-L588 HydrophobicContact CD1-CD1 4.11Å; F512-L588 HydrophobicContact CE1-CD1 3.55Å; F512-L588 HydrophobicContact CZ-CB 4.11Å; F512-L588 HydrophobicContact CZ-CD1 3.89Å; F512-A591 HydrophobicContact CD2-CB 3.35Å; F512-A591 HydrophobicContact CE2-CB 3.66Å; F512-A591 HydrophobicContact CG-CB 4.08Å
513	T	93.3	Very high	90.5	Very high	35 Å²	35	47.1 Å²	47.1	22%	0.215	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	142.8	175	50.2	0	0	0	0	109.8	A488 E511 N515 K562	A488-T513 HydrophobicContact CB-CG2 3.82Å; E511-T513 HydrophobicContact CG-CG2 4.21Å; T513-N515 PolarHBondContact O-N 3Å; T513-K562 PolarHBondContact N-O 3.44Å; T513-K562 PolarHBondContact O-N 3.13Å; T513-K562 WeakPolarHBondContact OG1-CB 3.46Å
514	P	92.4	Very high	91.2	Very high	49 Å²	49	49.7 Å²	49.7	32%	0.318	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	138.2	168.2	-19.9	31.5	0	0	0	110.3	F485	F485-P514 VanDerWaalsContact O-CB 3.26Å; F485-P514 WeakPolarHBondContact O-CB 3.09Å; F485-P514 VanDerWaalsContact O-CG 3.23Å; F485-P514 WeakPolarHBondContact O-CG 3.2Å
515	N	90.7	Very high	91.4	Very high	37 Å²	37	51.1 Å²	51.1	20%	0.198	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-93.2	173.1	173.5	-151.1	-4.9	0	0	0	110.7	T513 A519 G520 D560	T513-N515 PolarHBondContact O-N 3Å; N515-A519 HydrophobicContact CB-CB 4.42Å; N515-A519 WeakPolarHBondContact ND2-CB 3.21Å; N515-G520 PolarHBondContact ND2-O 3.19Å; N515-G520 VanDerWaalsContact ND2-O 3.15Å; N515-D560 HydrophobicContact CB-CB 4.3Å; N515-D560 WeakPolarHBondContact CB-O 3.21Å; N515-D560 PolarHBondContact N-O 3.16Å
516	E	86.8	Confident	91.4	Very high	158 Å²	158	50.5 Å²	50.5	74%	0.738	28%	0.281	S	S	*	.	P	Polyproline II helix	trans	-63.6	149.3	167.4	-66.8	-174.3	175.9	0	0	110.5	G518 A519	E516-G518 PolarHBondContact O-N 2.82Å; E516-A519 HydrophobicContact CB-CB 4.17Å; E516-A519 WeakPolarHBondContact O-CB 3.38Å; E516-A519 PolarHBondContact O-N 3.12Å
517	E	82.9	Confident	91.3	Very high	119 Å²	119	51.9 Å²	51.9	56%	0.556	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	127	-178.3	-166.3	-177.7	149.3	0	0	110.8	A519 H673	E517-A519 VanDerWaalsContact C-N 3.25Å; E517-A519 PolarHBondContact O-N 3.33Å; E517-H673 WeakPolarHBondContact OE1-CB 3.26Å; E517-H673 IonicContact OE1-CD2 2.85Å; E517-H673 PolarHBondContact OE1-CD2 3.4Å; E517-H673 IonicContact OE1-CG 2.78Å
518	G	79.4	Confident	90.8	Very high	70 Å²	70	56.5 Å²	56.5	72%	0.722	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	0.5	-176.7	0	0	0	0	0	115.2	E516 G520 D560	E516-G518 PolarHBondContact O-N 2.82Å; G518-G520 VanDerWaalsContact C-N 3.28Å; G518-G520 PolarHBondContact O-N 2.97Å; G518-D560 PolarHBondContact N-OD1 2.97Å; G518-D560 PolarHBondContact N-OD2 3.1Å
519	A	83	Confident	90.2	Very high	56 Å²	56	60.3 Å²	60.3	46%	0.463	36%	0.357	S	S	.	.			trans	-75.4	-17.1	175.8	0	0	0	0	0	113	N515 E516 E517 D560	N515-A519 HydrophobicContact CB-CB 4.42Å; N515-A519 WeakPolarHBondContact ND2-CB 3.21Å; E516-A519 HydrophobicContact CB-CB 4.17Å; E516-A519 WeakPolarHBondContact O-CB 3.38Å; E516-A519 PolarHBondContact O-N 3.12Å; E517-A519 VanDerWaalsContact C-N 3.25Å; E517-A519 PolarHBondContact O-N 3.33Å; A519-D560 PolarHBondContact N-OD1 3.32Å
520	G	86	Confident	89.5	Confident	23 Å²	23	58.4 Å²	58.4	24%	0.237	36%	0.361	C	S	.	.			trans	72.9	-153.4	177.3	0	0	0	0	0	113.7	N515 G518 D560 I561	N515-G520 PolarHBondContact ND2-O 3.19Å; N515-G520 VanDerWaalsContact ND2-O 3.15Å; G518-G520 VanDerWaalsContact C-N 3.28Å; G518-G520 PolarHBondContact O-N 2.97Å; G520-D560 WeakPolarHBondContact CA-OD1 3.35Å; G520-D560 PolarHBondContact N-OD1 3.39Å; G520-D560 WeakPolarHBondContact O-CA 3.5Å; G520-I561 PolarHBondContact O-N 3.42Å
521	F	91.7	Very high	89.2	Confident	59 Å²	59	61 Å²	61	26%	0.259	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	125.1	-179.5	176.8	-118.3	0	0	0	111.4	F523 E541 L544 E545 M548 I561 A563	F521-F523 HydrophobicContact CE1-CB 4.03Å; F521-F523 HydrophobicContact CZ-CB 4.02Å; F521-F523 HydrophobicContact CZ-CD2 4.29Å; F521-E541 HydrophobicContact CE1-CG 4.4Å; F521-L544 HydrophobicContact CE2-CB 4.38Å; F521-L544 HydrophobicContact CE2-CD1 4.37Å; F521-L544 HydrophobicContact CZ-CB 3.85Å; F521-L544 HydrophobicContact CZ-CD1 3.92Å; F521-E545 HydrophobicContact CD1-CG 4.05Å; F521-E545 HydrophobicContact CE1-CG 3.89Å; F521-M548 HydrophobicContact CB-CE 4.03Å; F521-M548 HydrophobicContact CB-SD 4.48Å; F521-M548 HydrophobicContact CD2-CE 3.66Å; F521-M548 HydrophobicContact CD2-SD 3.32Å; F521-M548 WeakPolarHBondContact CD2-SD 3.27Å; F521-M548 HydrophobicContact CE2-CE 4.46Å; F521-M548 HydrophobicContact CE2-SD 3.57Å; F521-M548 VanDerWaalsContact CE2-SD 3.57Å; F521-M548 HydrophobicContact CG-CE 4.08Å; F521-M548 HydrophobicContact CG-SD 3.92Å; F521-M548 HydrophobicContact CZ-SD 4.34Å; F521-I561 WeakPolarHBondContact CA-O 3.34Å; F521-I561 WeakPolarHBondContact CD2-O 3.48Å; F521-A563 HydrophobicContact CE2-CB 3.72Å; F521-A563 HydrophobicContact CZ-CB 4.18Å
522	E	93.2	Very high	88.9	Confident	82 Å²	82	57.9 Å²	57.9	38%	0.383	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	126	174.2	-170	-171.8	152.2	0	0	110.3	I561 K562 A563	E522-I561 PolarHBondContact N-O 3.37Å; E522-I561 VanDerWaalsContact N-O 3.07Å; E522-K562 HydrophobicContact CB-CB 4.24Å; E522-K562 HydrophobicContact CB-CG 4.18Å; E522-K562 HydrophobicContact CG-CG 4.46Å; E522-K562 CarbonylContact O-C 3.52Å; E522-K562 VanDerWaalsContact O-CA 3.3Å; E522-K562 WeakPolarHBondContact O-CA 3.35Å; E522-K562 WeakPolarHBondContact OE1-CE 3.42Å; E522-K562 IonicContact OE1-NZ 3.94Å; E522-K562 PolarHBondContact OE1-NZ 3.33Å; E522-K562 IonicContact OE2-NZ 2.66Å; E522-A563 PolarHBondContact O-N 2.86Å
523	F	94.6	Very high	88.6	Confident	36 Å²	36	58.9 Å²	58.9	16%	0.158	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.1	176	-176.9	-105	0	0	0	111.3	F521 N525 I537 V540 E541 L544 A563 L565	F521-F523 HydrophobicContact CE1-CB 4.03Å; F521-F523 HydrophobicContact CZ-CB 4.02Å; F521-F523 HydrophobicContact CZ-CD2 4.29Å; F523-N525 HydrophobicContact CE1-CB 4.38Å; F523-I537 HydrophobicContact CE1-CG2 3.77Å; F523-I537 HydrophobicContact CZ-CG2 4.06Å; F523-V540 HydrophobicContact CE2-CG1 4.37Å; F523-V540 HydrophobicContact CZ-CG1 4.5Å; F523-E541 HydrophobicContact CB-CG 4.02Å; F523-E541 HydrophobicContact CD1-CB 3.91Å; F523-E541 HydrophobicContact CD1-CG 3.89Å; F523-E541 HydrophobicContact CD2-CB 4.28Å; F523-E541 HydrophobicContact CD2-CG 4.36Å; F523-E541 HydrophobicContact CE1-CB 3.98Å; F523-E541 HydrophobicContact CE1-CG 4.47Å; F523-E541 HydrophobicContact CE2-CB 4.34Å; F523-E541 HydrophobicContact CG-CB 4.07Å; F523-E541 HydrophobicContact CG-CG 3.83Å; F523-E541 HydrophobicContact CZ-CB 4.19Å; F523-L544 HydrophobicContact CD2-CD1 3.95Å; F523-L544 HydrophobicContact CE2-CD1 4.02Å; F523-A563 WeakPolarHBondContact CA-O 3.25Å; F523-A563 HydrophobicContact CD2-CB 4.38Å; F523-L565 HydrophobicContact CE2-CB 4.01Å; F523-L565 HydrophobicContact CZ-CB 3.89Å; F523-L565 HydrophobicContact CZ-CD2 4.09Å
524	E	94.5	Very high	88.4	Confident	61 Å²	61	68 Å²	68	29%	0.285	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	119.8	176.6	-175	-174.8	144.1	0	0	110.3	K562 A563 K564 L565	E524-K562 WeakPolarHBondContact OE2-CE 3.45Å; E524-K562 IonicContact OE2-NZ 2.82Å; E524-K562 PolarHBondContact OE2-NZ 3.3Å; E524-A563 PolarHBondContact N-O 3.13Å; E524-K564 HydrophobicContact CB-CB 4.17Å; E524-K564 HydrophobicContact CB-CG 4.19Å; E524-K564 HydrophobicContact CG-CG 4.21Å; E524-K564 CarbonylContact O-C 3.6Å; E524-K564 WeakPolarHBondContact O-CA 3.33Å; E524-K564 WeakPolarHBondContact OE1-CD 3.44Å; E524-K564 WeakPolarHBondContact OE1-CE 3.43Å; E524-K564 IonicContact OE1-NZ 3.37Å; E524-K564 PolarHBondContact OE1-NZ 3.13Å; E524-L565 PolarHBondContact O-N 2.84Å
525	N	92.9	Very high	88.3	Confident	85 Å²	85	72 Å²	72	46%	0.455	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	107.5	171.4	175.8	13.7	0	0	0	110.8	F523 I527 I537	F523-N525 HydrophobicContact CE1-CB 4.38Å; N525-I527 WeakPolarHBondContact OD1-CB 3.3Å; N525-I527 PolarHBondContact OD1-N 3.32Å; N525-I527 VanDerWaalsContact OD1-N 3.11Å; N525-I537 HydrophobicContact CB-CG2 4.38Å; N525-I537 VanDerWaalsContact ND2-CD1 3.29Å; N525-I537 WeakPolarHBondContact ND2-CD1 3.35Å
526	A	92.8	Very high	88.4	Confident	28 Å²	28	72.3 Å²	72.3	23%	0.231	41%	0.412	C	S	.	.			trans	-112.8	19.6	177.2	0	0	0	0	0	113.2	V528 K564 L565	A526-V528 PolarHBondContact O-N 2.88Å; A526-K564 HydrophobicContact CB-CD 4.33Å; A526-K564 VanDerWaalsContact CB-CE 3.45Å; A526-K564 HydrophobicContact CB-CG 3.91Å; A526-L565 CarbonylContact C-O 3.41Å; A526-L565 WeakPolarHBondContact CA-O 2.98Å; A526-L565 WeakPolarHBondContact CB-O 3.41Å; A526-L565 PolarHBondContact N-O 3.11Å
527	I	90.7	Very high	88.6	Confident	29 Å²	29	65.4 Å²	65.4	15%	0.149	38%	0.38	C	S	.	.			trans	-67.1	125.8	-179.7	-67.9	-68.2	0	0	0	111.3	N525 V531 V532 L565	N525-I527 WeakPolarHBondContact OD1-CB 3.3Å; N525-I527 PolarHBondContact OD1-N 3.32Å; N525-I527 VanDerWaalsContact OD1-N 3.11Å; I527-V531 HydrophobicContact CD1-CG2 4.11Å; I527-V531 HydrophobicContact CG2-CG2 4.04Å; I527-V532 HydrophobicContact CD1-CB 4.08Å; I527-V532 HydrophobicContact CD1-CG2 3.8Å; I527-V532 HydrophobicContact CG1-CB 4.24Å; I527-V532 HydrophobicContact CG1-CG2 4.47Å; I527-V532 HydrophobicContact CG2-CB 4.41Å; I527-L565 HydrophobicContact CD1-CD1 4.3Å; I527-L565 HydrophobicContact CD1-CD2 4.23Å; I527-L565 HydrophobicContact CD1-CG 3.81Å; I527-L565 HydrophobicContact CG1-CD2 3.79Å; I527-L565 HydrophobicContact CG1-CG 3.74Å; I527-L565 PolarHBondContact N-O 2.85Å
528	V	85.2	Confident	89.2	Confident	119 Å²	119	63.4 Å²	63.4	72%	0.721	38%	0.378	S	S	*	.			trans	-110	143.4	174.5	-172.3	0	0	0	0	110	A526 G530	A526-V528 PolarHBondContact O-N 2.88Å; V528-G530 VanDerWaalsContact C-N 3.26Å; V528-G530 PolarHBondContact O-N 2.87Å
529	G	81.8	Confident	89.8	Confident	80 Å²	80	60.2 Å²	60.2	83%	0.825	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.2	4.9	171.8	0	0	0	0	0	116.3	V531	G529-V531 VanDerWaalsContact C-N 3.33Å; G529-V531 PolarHBondContact O-N 2.84Å
530	G	82.3	Confident	90.4	Very high	36 Å²	36	57.5 Å²	57.5	37%	0.371	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	23.6	175.9	0	0	0	0	0	114.5	V528 V532	V528-G530 VanDerWaalsContact C-N 3.26Å; V528-G530 PolarHBondContact O-N 2.87Å; G530-V532 PolarHBondContact O-N 2.74Å
531	V	88.4	Confident	90.8	Very high	53 Å²	53	59.6 Å²	59.6	32%	0.321	33%	0.326	S	S	.	.	S	Bend	trans	-61.8	-22.3	175.8	-63.4	0	0	0	0	113.1	I527 G529 S569 Y570	I527-V531 HydrophobicContact CD1-CG2 4.11Å; I527-V531 HydrophobicContact CG2-CG2 4.04Å; G529-V531 VanDerWaalsContact C-N 3.33Å; G529-V531 PolarHBondContact O-N 2.84Å; V531-S569 CarbonylContact O-C 3.39Å; V531-S569 WeakPolarHBondContact O-CA 3.32Å; V531-Y570 WeakPolarHBondContact O-CD1 3.39Å
532	V	89.8	Confident	90.8	Very high	1 Å²	1	60.7 Å²	60.7	1%	0.006	33%	0.331	C	S	.	.	S	Bend	trans	-118.3	119.9	160.2	179.2	0	0	0	0	107.1	I527 G530 R534 I537 F580	I527-V532 HydrophobicContact CD1-CB 4.08Å; I527-V532 HydrophobicContact CD1-CG2 3.8Å; I527-V532 HydrophobicContact CG1-CB 4.24Å; I527-V532 HydrophobicContact CG1-CG2 4.47Å; I527-V532 HydrophobicContact CG2-CB 4.41Å; G530-V532 PolarHBondContact O-N 2.74Å; V532-R534 PolarHBondContact O-N 2.95Å; V532-I537 HydrophobicContact CG1-CG1 4.15Å; V532-F580 HydrophobicContact CB-CE1 4.5Å; V532-F580 HydrophobicContact CG1-CD1 4.22Å; V532-F580 HydrophobicContact CG1-CE1 3.71Å; V532-F580 HydrophobicContact CG1-CZ 4.17Å; V532-F580 HydrophobicContact CG2-CE1 4.14Å
533	P	89.4	Confident	90.8	Very high	21 Å²	21	56.9 Å²	56.9	14%	0.136	31%	0.313	C	S	.	.			trans	-55.6	136.9	177	-27.7	35.2	0	0	0	111.5	E535 Y536 Y570	P533-E535 HydrophobicContact CB-CG 3.85Å; P533-E535 PolarHBondContact O-N 3.49Å; P533-E535 VanDerWaalsContact O-N 3.08Å; P533-Y536 HydrophobicContact CB-CD2 3.72Å; P533-Y536 HydrophobicContact CB-CE2 3.99Å; P533-Y536 HydrophobicContact CG-CD2 3.77Å; P533-Y536 HydrophobicContact CG-CE2 3.91Å; P533-Y536 PolarHBondContact O-N 3.03Å; P533-Y570 HydrophobicContact CG-CD1 3.8Å; P533-Y570 HydrophobicContact CG-CD2 3.93Å; P533-Y570 HydrophobicContact CG-CE1 4.1Å; P533-Y570 HydrophobicContact CG-CE2 4.23Å; P533-Y570 HydrophobicContact CG-CG 3.7Å
534	R	88.9	Confident	90.7	Very high	226 Å²	226	55.2 Å²	55.2	85%	0.853	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.3	-176.8	-70.6	-177.1	176.6	179	-2	113.5	V532 Y536 I537	V532-R534 PolarHBondContact O-N 2.95Å; R534-Y536 VanDerWaalsContact C-N 3.29Å; R534-Y536 PolarHBondContact O-N 3.3Å; R534-I537 HydrophobicContact CG-CD1 4.5Å
535	E	89.5	Confident	90.5	Very high	134 Å²	134	56 Å²	56	63%	0.626	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-25.6	176.5	59	-174.8	-171	0	0	113.9	P533	P533-E535 HydrophobicContact CB-CG 3.85Å; P533-E535 PolarHBondContact O-N 3.49Å; P533-E535 VanDerWaalsContact O-N 3.08Å
536	Y	92	Very high	90.4	Very high	42 Å²	42	55.4 Å²	55.4	17%	0.165	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.9	-179.6	-57.8	-46.2	0	0	0	113.7	P533 R534 A539 V540 E577 F580	P533-Y536 HydrophobicContact CB-CD2 3.72Å; P533-Y536 HydrophobicContact CB-CE2 3.99Å; P533-Y536 HydrophobicContact CG-CD2 3.77Å; P533-Y536 HydrophobicContact CG-CE2 3.91Å; P533-Y536 PolarHBondContact O-N 3.03Å; R534-Y536 VanDerWaalsContact C-N 3.29Å; R534-Y536 PolarHBondContact O-N 3.3Å; Y536-A539 VanDerWaalsContact O-CB 3.23Å; Y536-A539 WeakPolarHBondContact O-CB 3.27Å; Y536-A539 PolarHBondContact O-N 3.31Å; Y536-V540 PolarHBondContact O-N 2.99Å; Y536-V540 VanDerWaalsContact O-N 3.16Å; Y536-E577 HydrophobicContact CD1-CB 4.49Å; Y536-F580 HydrophobicContact CD1-CD2 4.39Å; Y536-F580 AromaticContact CD2-CD2 3.72Å; Y536-F580 HydrophobicContact CD2-CD2 3.72Å; Y536-F580 AromaticContact CD2-CE2 3.51Å; Y536-F580 HydrophobicContact CD2-CE2 3.51Å; Y536-F580 HydrophobicContact CD2-CZ 4.36Å; Y536-F580 HydrophobicContact CE2-CE2 4.23Å; Y536-F580 AromaticContact CG-CD2 3.66Å; Y536-F580 HydrophobicContact CG-CD2 3.66Å; Y536-F580 AromaticContact CG-CE2 3.96Å; Y536-F580 HydrophobicContact CG-CE2 3.96Å; Y536-F580 HydrophobicContact CG-CG 4.35Å
537	I	92.8	Very high	90.2	Very high	13 Å²	13	54.8 Å²	54.8	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-45.8	179.9	-60.7	179.2	0	0	0	111.8	F523 N525 V532 R534 A539 V540 E541 L565	F523-I537 HydrophobicContact CE1-CG2 3.77Å; F523-I537 HydrophobicContact CZ-CG2 4.06Å; N525-I537 HydrophobicContact CB-CG2 4.38Å; N525-I537 VanDerWaalsContact ND2-CD1 3.29Å; N525-I537 WeakPolarHBondContact ND2-CD1 3.35Å; V532-I537 HydrophobicContact CG1-CG1 4.15Å; R534-I537 HydrophobicContact CG-CD1 4.5Å; I537-A539 PolarHBondContact O-N 3.45Å; I537-V540 WeakPolarHBondContact O-CB 3.43Å; I537-V540 PolarHBondContact O-N 2.97Å; I537-E541 PolarHBondContact O-N 3.2Å; I537-E541 VanDerWaalsContact O-N 3.12Å; I537-L565 HydrophobicContact CG1-CD2 4.4Å; I537-L565 HydrophobicContact CG2-CD2 4.31Å
538	P	94.1	Very high	90.1	Very high	78 Å²	78	53.9 Å²	53.9	51%	0.506	30%	0.297	S	S	.	.	H	α-helix	trans	-59.6	-28.4	174.2	-24.5	35.3	0	0	0	113.5	K542	P538-K542 VanDerWaalsContact O-CB 3.31Å; P538-K542 WeakPolarHBondContact O-CB 3.33Å; P538-K542 PolarHBondContact O-N 3.23Å
539	A	93.6	Very high	90.1	Very high	2 Å²	2	50.8 Å²	50.8	2%	0.017	28%	0.283	C	S	.	.	H	α-helix	trans	-72.2	-33.1	176.9	0	0	0	0	0	112.9	Y536 I537 G543 E577 F580 R581	Y536-A539 VanDerWaalsContact O-CB 3.23Å; Y536-A539 WeakPolarHBondContact O-CB 3.27Å; Y536-A539 PolarHBondContact O-N 3.31Å; I537-A539 PolarHBondContact O-N 3.45Å; A539-G543 PolarHBondContact O-N 3.4Å; A539-E577 HydrophobicContact CB-CB 4.38Å; A539-E577 HydrophobicContact CB-CG 3.32Å; A539-F580 HydrophobicContact CB-CB 4.45Å; A539-R581 WeakPolarHBondContact O-CA 3.44Å
540	V	93.8	Very high	90.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67	-49.8	174	176.6	0	0	0	0	109.4	V508 I510 F523 Y536 I537 K542 G543 L544 L565 F580 A584	V508-V540 HydrophobicContact CG1-CG1 4.28Å; V508-V540 HydrophobicContact CG1-CG2 3.77Å; I510-V540 HydrophobicContact CD1-CG1 4.05Å; F523-V540 HydrophobicContact CE2-CG1 4.37Å; F523-V540 HydrophobicContact CZ-CG1 4.5Å; Y536-V540 PolarHBondContact O-N 2.99Å; Y536-V540 VanDerWaalsContact O-N 3.16Å; I537-V540 WeakPolarHBondContact O-CB 3.43Å; I537-V540 PolarHBondContact O-N 2.97Å; V540-K542 PolarHBondContact O-N 3.16Å; V540-G543 WeakPolarHBondContact O-CA 3.42Å; V540-G543 PolarHBondContact O-N 3.22Å; V540-G543 VanDerWaalsContact O-N 3.1Å; V540-L544 PolarHBondContact O-N 3.18Å; V540-L565 HydrophobicContact CB-CD2 4.47Å; V540-L565 HydrophobicContact CG1-CD1 4.32Å; V540-L565 HydrophobicContact CG1-CD2 4.22Å; V540-F580 HydrophobicContact CG2-CB 3.99Å; V540-F580 HydrophobicContact CG2-CD1 3.81Å; V540-F580 HydrophobicContact CG2-CG 4.32Å; V540-A584 HydrophobicContact CB-CB 4.4Å; V540-A584 HydrophobicContact CG1-CB 3.83Å; V540-A584 WeakPolarHBondContact O-CB 3.48Å
541	E	94.2	Very high	90.1	Very high	67 Å²	67	51.6 Å²	51.6	31%	0.313	26%	0.264	S	S	.	.	H	α-helix	trans	-55.7	-52.3	175.9	-177.7	174.2	-157.5	0	0	111.1	F521 F523 I537 G543 L544 E545	F521-E541 HydrophobicContact CE1-CG 4.4Å; F523-E541 HydrophobicContact CB-CG 4.02Å; F523-E541 HydrophobicContact CD1-CB 3.91Å; F523-E541 HydrophobicContact CD1-CG 3.89Å; F523-E541 HydrophobicContact CD2-CB 4.28Å; F523-E541 HydrophobicContact CD2-CG 4.36Å; F523-E541 HydrophobicContact CE1-CB 3.98Å; F523-E541 HydrophobicContact CE1-CG 4.47Å; F523-E541 HydrophobicContact CE2-CB 4.34Å; F523-E541 HydrophobicContact CG-CB 4.07Å; F523-E541 HydrophobicContact CG-CG 3.83Å; F523-E541 HydrophobicContact CZ-CB 4.19Å; I537-E541 PolarHBondContact O-N 3.2Å; I537-E541 VanDerWaalsContact O-N 3.12Å; E541-G543 PolarHBondContact O-N 2.92Å; E541-L544 WeakPolarHBondContact O-CB 3.46Å; E541-L544 PolarHBondContact O-N 3.45Å; E541-E545 PolarHBondContact O-N 3.21Å
542	K	92.5	Very high	89.8	Confident	82 Å²	82	52.2 Å²	52.2	36%	0.357	27%	0.267	S	S	.	.	H	α-helix	trans	-58.6	-35.8	176.1	-166.1	71.6	-147.9	151.5	0	112.7	P538 V540 E545 D546	P538-K542 VanDerWaalsContact O-CB 3.31Å; P538-K542 WeakPolarHBondContact O-CB 3.33Å; P538-K542 PolarHBondContact O-N 3.23Å; V540-K542 PolarHBondContact O-N 3.16Å; K542-E545 IonicContact NZ-OE2 3.71Å; K542-E545 PolarHBondContact NZ-OE2 2.66Å; K542-E545 PolarHBondContact O-N 3.47Å; K542-D546 WeakPolarHBondContact CE-OD1 3.25Å; K542-D546 IonicContact NZ-OD1 2.97Å; K542-D546 WeakPolarHBondContact O-CB 3.47Å; K542-D546 PolarHBondContact O-N 3.29Å
543	G	92.4	Very high	89.5	Confident	2 Å²	2	54 Å²	54	2%	0.021	28%	0.277	C	S	.	.	H	α-helix	trans	-69.6	-29.9	176.9	0	0	0	0	0	114.2	A539 V540 E541 A547	A539-G543 PolarHBondContact O-N 3.4Å; V540-G543 WeakPolarHBondContact O-CA 3.42Å; V540-G543 PolarHBondContact O-N 3.22Å; V540-G543 VanDerWaalsContact O-N 3.1Å; E541-G543 PolarHBondContact O-N 2.92Å; G543-A547 WeakPolarHBondContact O-CB 3.43Å; G543-A547 PolarHBondContact O-N 3.17Å
544	L	92.8	Very high	89.2	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-72.3	-49.5	170.4	-66.9	173.7	0	0	0	110.6	I510 F512 F521 F523 V540 E541 D546 A547 M548 A563 A584 L588	I510-L544 HydrophobicContact CD1-CD1 4.13Å; I510-L544 HydrophobicContact CD1-CD2 4.04Å; I510-L544 HydrophobicContact CD1-CG 4.42Å; F512-L544 HydrophobicContact CE1-CD2 3.9Å; F512-L544 HydrophobicContact CZ-CD2 3.74Å; F521-L544 HydrophobicContact CE2-CB 4.38Å; F521-L544 HydrophobicContact CE2-CD1 4.37Å; F521-L544 HydrophobicContact CZ-CB 3.85Å; F521-L544 HydrophobicContact CZ-CD1 3.92Å; F523-L544 HydrophobicContact CD2-CD1 3.95Å; F523-L544 HydrophobicContact CE2-CD1 4.02Å; V540-L544 PolarHBondContact O-N 3.18Å; E541-L544 WeakPolarHBondContact O-CB 3.46Å; E541-L544 PolarHBondContact O-N 3.45Å; L544-D546 PolarHBondContact O-N 3.14Å; L544-A547 CarbonylContact O-C 3.46Å; L544-A547 PolarHBondContact O-N 2.64Å; L544-A547 VanDerWaalsContact O-N 3.08Å; L544-M548 WeakPolarHBondContact O-CB 3.43Å; L544-M548 VanDerWaalsContact O-CG 3.27Å; L544-M548 WeakPolarHBondContact O-CG 3.34Å; L544-M548 PolarHBondContact O-N 2.61Å; L544-A563 HydrophobicContact CD1-CB 3.65Å; L544-A584 HydrophobicContact CD2-CB 4.16Å; L544-A584 HydrophobicContact CG-CB 4.13Å; L544-L588 HydrophobicContact CD2-CB 4.18Å
545	E	91.5	Very high	89	Confident	77 Å²	77	44.6 Å²	44.6	36%	0.36	25%	0.252	S	S	.	.	H	α-helix	trans	-54.2	-50.2	177.2	-69.6	179.4	172.1	0	0	111.8	F521 E541 K542 A547 M548 A549	F521-E545 HydrophobicContact CD1-CG 4.05Å; F521-E545 HydrophobicContact CE1-CG 3.89Å; E541-E545 PolarHBondContact O-N 3.21Å; K542-E545 IonicContact NZ-OE2 3.71Å; K542-E545 PolarHBondContact NZ-OE2 2.66Å; K542-E545 PolarHBondContact O-N 3.47Å; E545-A547 VanDerWaalsContact C-N 3.26Å; E545-A547 PolarHBondContact O-N 2.93Å; E545-M548 PolarHBondContact O-N 3.36Å; E545-A549 PolarHBondContact O-N 2.81Å
546	D	89.2	Confident	88.8	Confident	73 Å²	73	40.4 Å²	40.4	39%	0.39	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-35	179.5	-69.5	-14.9	0	0	0	111.3	K542 L544 R581	K542-D546 WeakPolarHBondContact CE-OD1 3.25Å; K542-D546 IonicContact NZ-OD1 2.97Å; K542-D546 WeakPolarHBondContact O-CB 3.47Å; K542-D546 PolarHBondContact O-N 3.29Å; L544-D546 PolarHBondContact O-N 3.14Å; D546-R581 IonicContact OD2-CZ 3.21Å; D546-R581 IonicContact OD2-NH1 2.94Å; D546-R581 PolarHBondContact OD2-NH1 2.81Å
547	A	89.2	Confident	88.7	Confident	16 Å²	16	40.4 Å²	40.4	13%	0.132	24%	0.236	C	C	.	.	H	α-helix	trans	-79.2	-30.7	179.6	0	0	0	0	0	113	G543 L544 E545 A549 N550 L588	G543-A547 WeakPolarHBondContact O-CB 3.43Å; G543-A547 PolarHBondContact O-N 3.17Å; L544-A547 CarbonylContact O-C 3.46Å; L544-A547 PolarHBondContact O-N 2.64Å; L544-A547 VanDerWaalsContact O-N 3.08Å; E545-A547 VanDerWaalsContact C-N 3.26Å; E545-A547 PolarHBondContact O-N 2.93Å; A547-A549 VanDerWaalsContact C-N 3.25Å; A547-A549 PolarHBondContact O-N 3.17Å; A547-N550 PolarHBondContact O-N 2.97Å; A547-N550 VanDerWaalsContact O-O 3.1Å; A547-L588 HydrophobicContact CB-CD2 3.73Å
548	M	89.4	Confident	88.6	Confident	10 Å²	10	40.2 Å²	40.2	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-70.5	-21.4	178	-75.8	177	65.5	0	0	112.5	F521 L544 E545 N550 P557 L558 I561 L588	F521-M548 HydrophobicContact CB-CE 4.03Å; F521-M548 HydrophobicContact CB-SD 4.48Å; F521-M548 HydrophobicContact CD2-CE 3.66Å; F521-M548 HydrophobicContact CD2-SD 3.32Å; F521-M548 WeakPolarHBondContact CD2-SD 3.27Å; F521-M548 HydrophobicContact CE2-CE 4.46Å; F521-M548 HydrophobicContact CE2-SD 3.57Å; F521-M548 VanDerWaalsContact CE2-SD 3.57Å; F521-M548 HydrophobicContact CG-CE 4.08Å; F521-M548 HydrophobicContact CG-SD 3.92Å; F521-M548 HydrophobicContact CZ-SD 4.34Å; L544-M548 WeakPolarHBondContact O-CB 3.43Å; L544-M548 VanDerWaalsContact O-CG 3.27Å; L544-M548 WeakPolarHBondContact O-CG 3.34Å; L544-M548 PolarHBondContact O-N 2.61Å; E545-M548 PolarHBondContact O-N 3.36Å; M548-N550 PolarHBondContact O-N 2.87Å; M548-P557 CarbonylContact O-C 3.49Å; M548-P557 WeakPolarHBondContact O-CA 3.38Å; M548-L558 HydrophobicContact CB-CB 4Å; M548-L558 HydrophobicContact CE-CB 4.05Å; M548-L558 WeakPolarHBondContact CE-O 3.4Å; M548-L558 HydrophobicContact CG-CB 4.04Å; M548-L558 PolarHBondContact O-N 3.46Å; M548-I561 HydrophobicContact CE-CB 4.19Å; M548-I561 HydrophobicContact CE-CD1 4.44Å; M548-L588 HydrophobicContact CG-CD1 4.43Å; M548-L588 HydrophobicContact CG-CD2 3.64Å
549	A	84.8	Confident	88.4	Confident	53 Å²	53	37.9 Å²	37.9	44%	0.438	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-26.2	174	0	0	0	0	0	113.5	E545 A547	E545-A549 PolarHBondContact O-N 2.81Å; A547-A549 VanDerWaalsContact C-N 3.25Å; A547-A549 PolarHBondContact O-N 3.17Å
550	N	83.6	Confident	88.3	Confident	121 Å²	121	38.4 Å²	38.4	65%	0.647	22%	0.222	S	C	*	.	S	Bend	trans	-119.9	105.1	175	-69.4	-63.4	0	0	0	110.2	A547 M548	A547-N550 PolarHBondContact O-N 2.97Å; A547-N550 VanDerWaalsContact O-O 3.1Å; M548-N550 PolarHBondContact O-N 2.87Å
551	G	79.9	Confident	88.2	Confident	13 Å²	13	38.4 Å²	38.4	13%	0.134	22%	0.222	C	C	.	.			trans	-56.5	168.7	176.3	0	0	0	0	0	114.7	E483 Y556	E483-G551 WeakPolarHBondContact OE2-CA 3.44Å; G551-Y556 WeakPolarHBondContact CA-O 3.18Å; G551-Y556 PolarHBondContact N-O 3.46Å
552	V	82.3	Confident	88.2	Confident	65 Å²	65	37.5 Å²	37.5	39%	0.394	22%	0.217	S	C	.	.	S	Bend	trans	-97	-24.7	-174.6	-166.8	0	0	0	0	112.1	E483 L558 A592	E483-V552 PolarHBondContact OE2-N 2.75Å; V552-L558 HydrophobicContact CG2-CD1 4.12Å; V552-A592 HydrophobicContact CB-CB 3.7Å; V552-A592 HydrophobicContact CG1-CB 3.63Å; V552-A592 HydrophobicContact CG2-CB 3.46Å; V552-A592 VanDerWaalsContact CG2-CB 3.46Å
553	L	83	Confident	88.3	Confident	40 Å²	40	33.6 Å²	33.6	21%	0.209	20%	0.2	C	C	.	.	S	Bend	trans	-85.2	-62.4	-179.7	-69.3	176.8	0	0	0	112.4	E483 P597 I599 I686	E483-L553 HydrophobicContact CG-CB 4.47Å; E483-L553 PolarHBondContact OE1-N 2.85Å; E483-L553 WeakPolarHBondContact OE2-CB 3.23Å; E483-L553 PolarHBondContact OE2-N 2.84Å; L553-P597 HydrophobicContact CD1-CB 3.81Å; L553-P597 HydrophobicContact CD1-CG 4.09Å; L553-P597 HydrophobicContact CD2-CB 4.43Å; L553-P597 HydrophobicContact CD2-CG 3.86Å; L553-P597 HydrophobicContact CG-CB 3.93Å; L553-P597 HydrophobicContact CG-CG 3.92Å; L553-I599 HydrophobicContact CB-CD1 4.45Å; L553-I599 HydrophobicContact CB-CG1 4.39Å; L553-I599 HydrophobicContact CD1-CG1 3.86Å; L553-I686 HydrophobicContact CB-CD1 4.42Å; L553-I686 HydrophobicContact CB-CG1 4.34Å; L553-I686 HydrophobicContact CD2-CD1 4.14Å
554	A	83.6	Confident	88.5	Confident	15 Å²	15	36.5 Å²	36.5	12%	0.124	21%	0.212	C	C	.	.	S	Bend	trans	-127.4	2.7	-171.8	0	0	0	0	0	112.6	E483 Y556 I599 I685 N689	E483-A554 PolarHBondContact OE1-N 2.79Å; A554-Y556 HydrophobicContact CB-CD2 3.66Å; A554-Y556 HydrophobicContact CB-CE2 3.54Å; A554-I599 HydrophobicContact CB-CD1 3.94Å; A554-I685 HydrophobicContact CB-CG2 4.08Å; A554-N689 HydrophobicContact CB-CB 4.33Å; A554-N689 PolarHBondContact O-ND2 3.37Å; A554-N689 VanDerWaalsContact O-ND2 3.13Å
555	G	83.9	Confident	88.6	Confident	33 Å²	33	36.5 Å²	36.5	34%	0.34	21%	0.212	S	C	.	.	S	Bend	trans	89.9	10.1	175.6	0	0	0	0	0	113.9	E483	E483-G555 PolarHBondContact OE1-N 2.88Å
556	Y	87.1	Confident	88.8	Confident	47 Å²	47	36.3 Å²	36.3	18%	0.184	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-81.8	153.6	-179.6	-62.8	-66	0	0	0	111.9	Y481 E483 G551 A554 L558 I685 N689	Y481-Y556 HydrophobicContact CD2-CE1 4.16Å; Y481-Y556 AromaticContact CD2-CE2 3.95Å; Y481-Y556 HydrophobicContact CD2-CE2 3.95Å; Y481-Y556 AromaticContact CD2-CZ 3.65Å; Y481-Y556 HydrophobicContact CG-CD2 4.49Å; Y481-Y556 HydrophobicContact CG-CE2 4.15Å; Y481-Y556 WeakPolarHBondContact O-CB 3.41Å; E483-Y556 PolarHBondContact OE1-N 2.8Å; G551-Y556 WeakPolarHBondContact CA-O 3.18Å; G551-Y556 PolarHBondContact N-O 3.46Å; A554-Y556 HydrophobicContact CB-CD2 3.66Å; A554-Y556 HydrophobicContact CB-CE2 3.54Å; Y556-L558 PolarHBondContact O-N 3.32Å; Y556-I685 HydrophobicContact CE2-CG2 3.68Å; Y556-N689 PolarHBondContact OH-ND2 2.83Å
557	P	88.8	Confident	89	Confident	42 Å²	42	36.2 Å²	36.2	27%	0.273	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-56.8	130.9	-179	-25.4	34.6	0	0	0	112.5	E483 M548	E483-P557 PolarHBondContact N-O 3.43Å; M548-P557 CarbonylContact O-C 3.49Å; M548-P557 WeakPolarHBondContact O-CA 3.38Å
558	L	90.9	Very high	89.1	Confident	9 Å²	9	35.8 Å²	35.8	5%	0.047	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-75.7	128.6	172.6	-92.5	142.9	0	0	0	110.3	E483 F485 M548 V552 Y556 I561 L588	E483-L558 HydrophobicContact CB-CD2 4.18Å; E483-L558 HydrophobicContact CB-CG 3.98Å; E483-L558 CarbonylContact O-C 3.57Å; E483-L558 VanDerWaalsContact O-CA 3.23Å; E483-L558 WeakPolarHBondContact O-CA 3.31Å; F485-L558 HydrophobicContact CD1-CD2 3.95Å; F485-L558 HydrophobicContact CE1-CD2 3.68Å; F485-L558 HydrophobicContact CZ-CD2 4.19Å; M548-L558 HydrophobicContact CB-CB 4Å; M548-L558 HydrophobicContact CE-CB 4.05Å; M548-L558 WeakPolarHBondContact CE-O 3.4Å; M548-L558 HydrophobicContact CG-CB 4.04Å; M548-L558 PolarHBondContact O-N 3.46Å; V552-L558 HydrophobicContact CG2-CD1 4.12Å; Y556-L558 PolarHBondContact O-N 3.32Å; L558-I561 HydrophobicContact CB-CD1 4.25Å; L558-I561 HydrophobicContact CD2-CD1 3.26Å; L558-I561 HydrophobicContact CG-CD1 4.33Å; L558-L588 HydrophobicContact CD1-CD2 4.42Å
559	V	90.3	Very high	89.3	Confident	28 Å²	28	37 Å²	37	17%	0.17	21%	0.214	C	C	.	.			trans	-133.7	166.7	-179	-58.9	0	0	0	0	111.4	R482 E483 T484 I561 L600	R482-V559 HydrophobicContact CB-CG1 4.47Å; R482-V559 HydrophobicContact CB-CG2 3.72Å; R482-V559 HydrophobicContact CG-CG1 4.32Å; R482-V559 HydrophobicContact CG-CG2 4.11Å; E483-V559 PolarHBondContact O-N 2.81Å; T484-V559 WeakPolarHBondContact CB-O 3.18Å; T484-V559 PolarHBondContact OG1-O 2.89Å; V559-I561 PolarHBondContact O-N 3.5Å; V559-L600 HydrophobicContact CG2-CD1 3.95Å
560	D	90.3	Very high	89.6	Confident	14 Å²	14	39.5 Å²	39.5	8%	0.075	21%	0.213	C	C	.	.	S	Bend	trans	53.8	52.6	177.4	-57.5	-21	0	0	0	113	T484 N515 G518 A519 G520	T484-D560 PolarHBondContact OG1-O 3Å; N515-D560 HydrophobicContact CB-CB 4.3Å; N515-D560 WeakPolarHBondContact CB-O 3.21Å; N515-D560 PolarHBondContact N-O 3.16Å; G518-D560 PolarHBondContact N-OD1 2.97Å; G518-D560 PolarHBondContact N-OD2 3.1Å; A519-D560 PolarHBondContact N-OD1 3.32Å; G520-D560 WeakPolarHBondContact CA-OD1 3.35Å; G520-D560 PolarHBondContact N-OD1 3.39Å; G520-D560 WeakPolarHBondContact O-CA 3.5Å
561	I	91.8	Very high	89.9	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.5	178.2	-68.7	169	0	0	0	109.6	F485 F512 G520 F521 E522 M548 L558 V559	F485-I561 HydrophobicContact CB-CD1 4.25Å; F485-I561 HydrophobicContact CB-CG1 4.32Å; F485-I561 HydrophobicContact CD1-CD1 4.14Å; F485-I561 HydrophobicContact CD2-CD1 3.68Å; F485-I561 HydrophobicContact CD2-CG1 4.22Å; F485-I561 HydrophobicContact CD2-CG2 4.48Å; F485-I561 HydrophobicContact CE1-CD1 4.43Å; F485-I561 HydrophobicContact CE2-CD1 4Å; F485-I561 HydrophobicContact CG-CD1 3.75Å; F485-I561 HydrophobicContact CG-CG1 4.31Å; F485-I561 HydrophobicContact CZ-CD1 4.37Å; F512-I561 HydrophobicContact CD1-CG2 3.89Å; G520-I561 PolarHBondContact O-N 3.42Å; F521-I561 WeakPolarHBondContact CA-O 3.34Å; F521-I561 WeakPolarHBondContact CD2-O 3.48Å; E522-I561 PolarHBondContact N-O 3.37Å; E522-I561 VanDerWaalsContact N-O 3.07Å; M548-I561 HydrophobicContact CE-CB 4.19Å; M548-I561 HydrophobicContact CE-CD1 4.44Å; L558-I561 HydrophobicContact CB-CD1 4.25Å; L558-I561 HydrophobicContact CD2-CD1 3.26Å; L558-I561 HydrophobicContact CG-CD1 4.33Å; V559-I561 PolarHBondContact O-N 3.5Å
562	K	94.6	Very high	90	Very high	47 Å²	47	43.9 Å²	43.9	20%	0.204	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	126.7	167.9	176.5	169.4	-177.8	151.1	0	109.9	F512 T513 E522 E524	F512-K562 WeakPolarHBondContact CA-O 3.26Å; T513-K562 PolarHBondContact N-O 3.44Å; T513-K562 PolarHBondContact O-N 3.13Å; T513-K562 WeakPolarHBondContact OG1-CB 3.46Å; E522-K562 HydrophobicContact CB-CB 4.24Å; E522-K562 HydrophobicContact CB-CG 4.18Å; E522-K562 HydrophobicContact CG-CG 4.46Å; E522-K562 CarbonylContact O-C 3.52Å; E522-K562 VanDerWaalsContact O-CA 3.3Å; E522-K562 WeakPolarHBondContact O-CA 3.35Å; E522-K562 WeakPolarHBondContact OE1-CE 3.42Å; E522-K562 IonicContact OE1-NZ 3.94Å; E522-K562 PolarHBondContact OE1-NZ 3.33Å; E522-K562 IonicContact OE2-NZ 2.66Å; E524-K562 WeakPolarHBondContact OE2-CE 3.45Å; E524-K562 IonicContact OE2-NZ 2.82Å; E524-K562 PolarHBondContact OE2-NZ 3.3Å
563	A	95.4	Very high	90.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	114	179.5	0	0	0	0	0	110.4	I510 F512 F521 E522 F523 E524 L544	I510-A563 HydrophobicContact CG2-CB 3.95Å; F512-A563 HydrophobicContact CD1-CB 3.95Å; F512-A563 HydrophobicContact CE1-CB 3.83Å; F521-A563 HydrophobicContact CE2-CB 3.72Å; F521-A563 HydrophobicContact CZ-CB 4.18Å; E522-A563 PolarHBondContact O-N 2.86Å; F523-A563 WeakPolarHBondContact CA-O 3.25Å; F523-A563 HydrophobicContact CD2-CB 4.38Å; E524-A563 PolarHBondContact N-O 3.13Å; L544-A563 HydrophobicContact CD1-CB 3.65Å
564	K	95.9	Very high	90.2	Very high	63 Å²	63	46.2 Å²	46.2	27%	0.274	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	108.6	179.3	179.5	176.9	-178	160.5	0	110.8	I510 E511 E524 A526 Y566	I510-K564 WeakPolarHBondContact CA-O 3.49Å; E511-K564 HydrophobicContact CB-CB 4.26Å; E511-K564 PolarHBondContact N-O 3.38Å; E511-K564 PolarHBondContact O-N 3.11Å; E524-K564 HydrophobicContact CB-CB 4.17Å; E524-K564 HydrophobicContact CB-CG 4.19Å; E524-K564 HydrophobicContact CG-CG 4.21Å; E524-K564 CarbonylContact O-C 3.6Å; E524-K564 WeakPolarHBondContact O-CA 3.33Å; E524-K564 WeakPolarHBondContact OE1-CD 3.44Å; E524-K564 WeakPolarHBondContact OE1-CE 3.43Å; E524-K564 IonicContact OE1-NZ 3.37Å; E524-K564 PolarHBondContact OE1-NZ 3.13Å; A526-K564 HydrophobicContact CB-CD 4.33Å; A526-K564 VanDerWaalsContact CB-CE 3.45Å; A526-K564 HydrophobicContact CB-CG 3.91Å; K564-Y566 PolarHBondContact O-N 3.02Å
565	L	95.5	Very high	90.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	108.5	174.9	177.2	67	0	0	0	109.3	V508 I510 F523 E524 A526 I527 I537 V540	V508-L565 HydrophobicContact CB-CD1 3.79Å; V508-L565 HydrophobicContact CG1-CD1 3.94Å; I510-L565 HydrophobicContact CG1-CD1 3.86Å; F523-L565 HydrophobicContact CE2-CB 4.01Å; F523-L565 HydrophobicContact CZ-CB 3.89Å; F523-L565 HydrophobicContact CZ-CD2 4.09Å; E524-L565 PolarHBondContact O-N 2.84Å; A526-L565 CarbonylContact C-O 3.41Å; A526-L565 WeakPolarHBondContact CA-O 2.98Å; A526-L565 WeakPolarHBondContact CB-O 3.41Å; A526-L565 PolarHBondContact N-O 3.11Å; I527-L565 HydrophobicContact CD1-CD1 4.3Å; I527-L565 HydrophobicContact CD1-CD2 4.23Å; I527-L565 HydrophobicContact CD1-CG 3.81Å; I527-L565 HydrophobicContact CG1-CD2 3.79Å; I527-L565 HydrophobicContact CG1-CG 3.74Å; I527-L565 PolarHBondContact N-O 2.85Å; I537-L565 HydrophobicContact CG1-CD2 4.4Å; I537-L565 HydrophobicContact CG2-CD2 4.31Å; V540-L565 HydrophobicContact CB-CD2 4.47Å; V540-L565 HydrophobicContact CG1-CD1 4.32Å; V540-L565 HydrophobicContact CG1-CD2 4.22Å
566	Y	94.3	Very high	90.8	Very high	73 Å²	73	46.5 Å²	46.5	29%	0.286	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-21.5	-172.8	71.2	-96.2	0	0	0	114.9	W509 E511 K564	W509-Y566 HydrophobicContact CB-CE1 4.07Å; W509-Y566 HydrophobicContact CB-CE2 3.98Å; W509-Y566 PolarHBondContact O-N 2.82Å; E511-Y566 HydrophobicContact CB-CD1 3.99Å; E511-Y566 HydrophobicContact CB-CE1 4.05Å; K564-Y566 PolarHBondContact O-N 3.02Å
567	D	93.6	Very high	91	Very high	71 Å²	71	49.2 Å²	49.2	38%	0.38	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	171.8	178.9	-161	3.8	0	0	0	111.4	W509	W509-D567 HydrophobicContact CB-CB 3.95Å; W509-D567 HydrophobicContact CG-CB 4.38Å; W509-D567 PolarHBondContact N-O 3.23Å
568	G	92.7	Very high	91	Very high	7 Å²	7	51.2 Å²	51.2	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-172.8	179.8	0	0	0	0	0	112.6	H507	H507-G568 CarbonylContact O-C 3.56Å; H507-G568 WeakPolarHBondContact O-CA 3.47Å
569	S	92.8	Very high	91.1	Very high	36 Å²	36	50.8 Å²	50.8	25%	0.252	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	162.6	166.4	64.4	0	0	0	0	111.8	Y505 H507 V531 F580	Y505-S569 WeakPolarHBondContact CE1-O 3.15Å; Y505-S569 PolarHBondContact OH-OG 3.07Å; H507-S569 PolarHBondContact N-O 3.24Å; H507-S569 PolarHBondContact ND1-N 3.33Å; H507-S569 PolarHBondContact ND1-OG 3.29Å; H507-S569 PolarHBondContact O-N 3.02Å; V531-S569 CarbonylContact O-C 3.39Å; V531-S569 WeakPolarHBondContact O-CA 3.32Å; S569-F580 WeakPolarHBondContact O-CZ 3.17Å
570	Y	91.5	Very high	91.3	Very high	106 Å²	106	49.5 Å²	49.5	42%	0.416	25%	0.254	S	S	.	.			trans	-132.3	167.5	175.2	74.2	-80.1	0	0	0	110.8	V531 P533 D572 S575	V531-Y570 WeakPolarHBondContact O-CD1 3.39Å; P533-Y570 HydrophobicContact CG-CD1 3.8Å; P533-Y570 HydrophobicContact CG-CD2 3.93Å; P533-Y570 HydrophobicContact CG-CE1 4.1Å; P533-Y570 HydrophobicContact CG-CE2 4.23Å; P533-Y570 HydrophobicContact CG-CG 3.7Å; Y570-D572 VanDerWaalsContact CE2-OD1 3.28Å; Y570-D572 WeakPolarHBondContact CE2-OD1 3.35Å; Y570-S575 WeakPolarHBondContact CA-OG 3.27Å; Y570-S575 WeakPolarHBondContact CB-OG 3.44Å
571	H	89.1	Confident	91.4	Very high	86 Å²	86	52.7 Å²	52.7	40%	0.398	27%	0.265	S	S	.	.			trans	-123	130.5	171.9	-172.8	-99.7	0	0	0	108.9	Y505 V573 D574 S575	Y505-H571 HydrophobicContact CD1-CB 3.93Å; Y505-H571 HydrophobicContact CD2-CB 4.46Å; Y505-H571 HydrophobicContact CG-CB 3.84Å; H571-V573 PolarHBondContact O-N 3.04Å; H571-D574 HydrophobicContact CB-CB 4.29Å; H571-D574 IonicContact CE1-OD2 3.78Å; H571-D574 PolarHBondContact CE1-OD2 2.97Å; H571-D574 PolarHBondContact ND1-N 2.91Å; H571-D574 IonicContact ND1-OD2 3.06Å; H571-D574 PolarHBondContact ND1-OD2 3.22Å; H571-D574 PolarHBondContact O-N 3.28Å; H571-S575 PolarHBondContact N-OG 3.14Å; H571-S575 VanDerWaalsContact O-CB 3.26Å; H571-S575 WeakPolarHBondContact O-CB 3.39Å; H571-S575 PolarHBondContact O-N 3.15Å; H571-S575 PolarHBondContact O-OG 2.86Å
572	D	82.4	Confident	91.4	Very high	139 Å²	139	55.1 Å²	55.1	74%	0.743	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-29.5	-169.5	-64.5	-37.2	0	0	0	114.5	Y570	Y570-D572 VanDerWaalsContact CE2-OD1 3.28Å; Y570-D572 WeakPolarHBondContact CE2-OD1 3.35Å
573	V	84	Confident	91.4	Very high	117 Å²	117	52.9 Å²	52.9	71%	0.709	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.7	-29.9	-174.5	-175	0	0	0	0	113	H571	H571-V573 PolarHBondContact O-N 3.04Å
574	D	86.5	Confident	91.3	Very high	37 Å²	37	52.9 Å²	52.9	20%	0.198	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-11.6	-168.4	-65.1	-35.2	0	0	0	112.7	G503 Q504 Y505 H571 N576	G503-D574 CarbonylContact C-O 3.52Å; G503-D574 VanDerWaalsContact CA-OD1 3.28Å; G503-D574 WeakPolarHBondContact CA-OD1 3.34Å; G503-D574 PolarHBondContact N-OD1 3.1Å; Q504-D574 CarbonylContact C-O 3.56Å; Q504-D574 VanDerWaalsContact CA-O 3.26Å; Q504-D574 WeakPolarHBondContact CA-O 3.49Å; Y505-D574 PolarHBondContact N-O 3.41Å; H571-D574 HydrophobicContact CB-CB 4.29Å; H571-D574 IonicContact CE1-OD2 3.78Å; H571-D574 PolarHBondContact CE1-OD2 2.97Å; H571-D574 PolarHBondContact ND1-N 2.91Å; H571-D574 IonicContact ND1-OD2 3.06Å; H571-D574 PolarHBondContact ND1-OD2 3.22Å; H571-D574 PolarHBondContact O-N 3.28Å; D574-N576 PolarHBondContact O-ND2 3.4Å
575	S	89.4	Confident	91.1	Very high	15 Å²	15	51.2 Å²	51.2	11%	0.105	27%	0.266	C	S	.	.	B	Isolated β-bridge	trans	-75.4	138.4	175.8	-76.2	0	0	0	0	112.7	Y505 Y570 H571	Y505-S575 VanDerWaalsContact O-CA 3.23Å; Y505-S575 WeakPolarHBondContact O-CA 3.18Å; Y505-S575 WeakPolarHBondContact O-CB 3.5Å; Y505-S575 PolarHBondContact O-OG 3.39Å; Y570-S575 WeakPolarHBondContact CA-OG 3.27Å; Y570-S575 WeakPolarHBondContact CB-OG 3.44Å; H571-S575 PolarHBondContact N-OG 3.14Å; H571-S575 VanDerWaalsContact O-CB 3.26Å; H571-S575 WeakPolarHBondContact O-CB 3.39Å; H571-S575 PolarHBondContact O-N 3.15Å; H571-S575 PolarHBondContact O-OG 2.86Å
576	N	89.5	Confident	90.9	Very high	40 Å²	40	55.2 Å²	55.2	21%	0.214	29%	0.286	C	S	.	.			trans	-154.4	165.8	177.5	58.6	71.2	0	0	0	110.3	D574 T578 A579 F580	D574-N576 PolarHBondContact O-ND2 3.4Å; N576-T578 VanDerWaalsContact C-N 3.33Å; N576-T578 PolarHBondContact O-N 3.48Å; N576-T578 PolarHBondContact OD1-N 3.19Å; N576-A579 WeakPolarHBondContact O-CB 3.23Å; N576-A579 PolarHBondContact O-N 3.07Å; N576-A579 VanDerWaalsContact O-N 3.16Å; N576-A579 WeakPolarHBondContact OD1-CB 3.15Å; N576-A579 PolarHBondContact OD1-N 3.38Å; N576-F580 PolarHBondContact O-N 3.42Å
577	E	90.7	Very high	90.9	Very high	103 Å²	103	51.7 Å²	51.7	48%	0.481	27%	0.272	S	S	.	.	H	α-helix	trans	-54.4	-45.9	-177.9	-161.9	-164.9	140.9	0	0	112.7	Y536 A539 A579 F580 R581	Y536-E577 HydrophobicContact CD1-CB 4.49Å; A539-E577 HydrophobicContact CB-CB 4.38Å; A539-E577 HydrophobicContact CB-CG 3.32Å; E577-A579 VanDerWaalsContact C-N 3.32Å; E577-A579 PolarHBondContact O-N 3.19Å; E577-F580 PolarHBondContact O-N 2.95Å; E577-R581 PolarHBondContact O-N 3.24Å; E577-R581 IonicContact OE1-NH2 2.79Å; E577-R581 PolarHBondContact OE1-NH2 2.91Å
578	T	90.3	Very high	90.8	Very high	85 Å²	85	48.5 Å²	48.5	52%	0.521	26%	0.255	S	S	.	.	H	α-helix	trans	-63.9	-38.3	-178.9	-41.8	0	0	0	0	111.8	N576 R581 V582	N576-T578 VanDerWaalsContact C-N 3.33Å; N576-T578 PolarHBondContact O-N 3.48Å; N576-T578 PolarHBondContact OD1-N 3.19Å; T578-R581 PolarHBondContact O-N 2.97Å; T578-V582 WeakPolarHBondContact O-CG2 3.28Å; T578-V582 PolarHBondContact O-N 2.84Å
579	A	92.3	Very high	90.6	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-40.8	179.1	0	0	0	0	0	111.9	F495 Q504 N576 E577 V582 A583	F495-A579 HydrophobicContact CD1-CB 4.02Å; Q504-A579 HydrophobicContact CB-CB 4.19Å; N576-A579 WeakPolarHBondContact O-CB 3.23Å; N576-A579 PolarHBondContact O-N 3.07Å; N576-A579 VanDerWaalsContact O-N 3.16Å; N576-A579 WeakPolarHBondContact OD1-CB 3.15Å; N576-A579 PolarHBondContact OD1-N 3.38Å; E577-A579 VanDerWaalsContact C-N 3.32Å; E577-A579 PolarHBondContact O-N 3.19Å; A579-V582 PolarHBondContact O-N 3.41Å; A579-A583 WeakPolarHBondContact O-CB 3.45Å; A579-A583 PolarHBondContact O-N 2.98Å
580	F	94.1	Very high	90.5	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-68.7	-37	174.9	-86.8	-80.8	0	0	0	112.7	V508 V532 Y536 A539 V540 S569 N576 E577 V582 A583 A584	V508-F580 HydrophobicContact CG1-CD1 3.66Å; V508-F580 HydrophobicContact CG1-CE1 3.87Å; V532-F580 HydrophobicContact CB-CE1 4.5Å; V532-F580 HydrophobicContact CG1-CD1 4.22Å; V532-F580 HydrophobicContact CG1-CE1 3.71Å; V532-F580 HydrophobicContact CG1-CZ 4.17Å; V532-F580 HydrophobicContact CG2-CE1 4.14Å; Y536-F580 HydrophobicContact CD1-CD2 4.39Å; Y536-F580 AromaticContact CD2-CD2 3.72Å; Y536-F580 HydrophobicContact CD2-CD2 3.72Å; Y536-F580 AromaticContact CD2-CE2 3.51Å; Y536-F580 HydrophobicContact CD2-CE2 3.51Å; Y536-F580 HydrophobicContact CD2-CZ 4.36Å; Y536-F580 HydrophobicContact CE2-CE2 4.23Å; Y536-F580 AromaticContact CG-CD2 3.66Å; Y536-F580 HydrophobicContact CG-CD2 3.66Å; Y536-F580 AromaticContact CG-CE2 3.96Å; Y536-F580 HydrophobicContact CG-CE2 3.96Å; Y536-F580 HydrophobicContact CG-CG 4.35Å; A539-F580 HydrophobicContact CB-CB 4.45Å; V540-F580 HydrophobicContact CG2-CB 3.99Å; V540-F580 HydrophobicContact CG2-CD1 3.81Å; V540-F580 HydrophobicContact CG2-CG 4.32Å; S569-F580 WeakPolarHBondContact O-CZ 3.17Å; N576-F580 PolarHBondContact O-N 3.42Å; E577-F580 PolarHBondContact O-N 2.95Å; F580-V582 PolarHBondContact O-N 2.82Å; F580-A583 PolarHBondContact O-N 2.8Å; F580-A584 PolarHBondContact O-N 2.8Å
581	R	93	Very high	90.4	Very high	81 Å²	81	51.5 Å²	51.5	31%	0.306	27%	0.267	S	S	.	.	H	α-helix	trans	-60	-46	173.6	-163.1	-177.3	-67.4	-154.8	6.1	112	A539 D546 E577 T578 A584 S585	A539-R581 WeakPolarHBondContact O-CA 3.44Å; D546-R581 IonicContact OD2-CZ 3.21Å; D546-R581 IonicContact OD2-NH1 2.94Å; D546-R581 PolarHBondContact OD2-NH1 2.81Å; E577-R581 PolarHBondContact O-N 3.24Å; E577-R581 IonicContact OE1-NH2 2.79Å; E577-R581 PolarHBondContact OE1-NH2 2.91Å; T578-R581 PolarHBondContact O-N 2.97Å; R581-A584 PolarHBondContact O-N 3.31Å; R581-S585 PolarHBondContact O-N 2.72Å
582	V	92.4	Very high	90.3	Very high	52 Å²	52	47.6 Å²	47.6	32%	0.315	25%	0.249	S	C	.	.	H	α-helix	trans	-67.6	-40.5	177.2	177	0	0	0	0	111.3	F495 T578 A579 F580 A584 S585 M586	F495-V582 HydrophobicContact CB-CG1 4.27Å; F495-V582 HydrophobicContact CD1-CB 4.28Å; F495-V582 HydrophobicContact CD1-CG1 4.3Å; F495-V582 HydrophobicContact CD2-CB 4.36Å; F495-V582 HydrophobicContact CD2-CG1 3.52Å; F495-V582 HydrophobicContact CE2-CG1 3.85Å; F495-V582 HydrophobicContact CG-CB 4.14Å; F495-V582 HydrophobicContact CG-CG1 3.77Å; F495-V582 HydrophobicContact CZ-CG1 4.35Å; T578-V582 WeakPolarHBondContact O-CG2 3.28Å; T578-V582 PolarHBondContact O-N 2.84Å; A579-V582 PolarHBondContact O-N 3.41Å; F580-V582 PolarHBondContact O-N 2.82Å; V582-A584 VanDerWaalsContact C-N 3.32Å; V582-A584 PolarHBondContact O-N 2.89Å; V582-S585 PolarHBondContact O-N 3.09Å; V582-M586 HydrophobicContact CG1-CG 4.46Å; V582-M586 HydrophobicContact CG1-SD 4.2Å; V582-M586 WeakPolarHBondContact O-CG 3.32Å; V582-M586 PolarHBondContact O-N 2.99Å
583	A	94.2	Very high	90.4	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-58.7	-43.5	175.8	0	0	0	0	0	111.6	G493 F495 V508 A579 F580 M586 A587	G493-A583 VanDerWaalsContact CA-O 3.25Å; G493-A583 WeakPolarHBondContact CA-O 3.49Å; F495-A583 HydrophobicContact CB-CB 4.23Å; V508-A583 HydrophobicContact CG2-CB 4.11Å; A579-A583 WeakPolarHBondContact O-CB 3.45Å; A579-A583 PolarHBondContact O-N 2.98Å; F580-A583 PolarHBondContact O-N 2.8Å; A583-M586 PolarHBondContact O-N 3.34Å; A583-A587 PolarHBondContact O-N 3.22Å
584	A	93.3	Very high	90.6	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-60.2	-46.5	175.7	0	0	0	0	0	112.7	V540 L544 F580 R581 V582 M586 A587 L588	V540-A584 HydrophobicContact CB-CB 4.4Å; V540-A584 HydrophobicContact CG1-CB 3.83Å; V540-A584 WeakPolarHBondContact O-CB 3.48Å; L544-A584 HydrophobicContact CD2-CB 4.16Å; L544-A584 HydrophobicContact CG-CB 4.13Å; F580-A584 PolarHBondContact O-N 2.8Å; R581-A584 PolarHBondContact O-N 3.31Å; V582-A584 VanDerWaalsContact C-N 3.32Å; V582-A584 PolarHBondContact O-N 2.89Å; A584-M586 VanDerWaalsContact C-N 3.29Å; A584-M586 PolarHBondContact O-N 2.96Å; A584-A587 WeakPolarHBondContact O-CB 3.45Å; A584-A587 PolarHBondContact O-N 3.07Å; A584-A587 VanDerWaalsContact O-N 3.13Å; A584-L588 PolarHBondContact O-N 3.21Å; A584-L588 VanDerWaalsContact O-N 3.07Å
585	S	91.4	Very high	90.6	Very high	28 Å²	28	49.7 Å²	49.7	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-38.2	175.4	-178.6	0	0	0	0	112.5	R581 V582 L588 R589	R581-S585 PolarHBondContact O-N 2.72Å; V582-S585 PolarHBondContact O-N 3.09Å; S585-L588 PolarHBondContact O-N 2.99Å; S585-R589 PolarHBondContact O-N 3.1Å
586	M	92.1	Very high	90.6	Very high	83 Å²	83	53.8 Å²	53.8	41%	0.409	26%	0.261	S	S	.	.	H	α-helix	trans	-66.8	-38.9	174.9	-69.5	177.6	74	0	0	112.2	F495 V582 A583 A584 R589 A590	F495-M586 HydrophobicContact CB-SD 4.19Å; F495-M586 HydrophobicContact CD2-SD 4.07Å; V582-M586 HydrophobicContact CG1-CG 4.46Å; V582-M586 HydrophobicContact CG1-SD 4.2Å; V582-M586 WeakPolarHBondContact O-CG 3.32Å; V582-M586 PolarHBondContact O-N 2.99Å; A583-M586 PolarHBondContact O-N 3.34Å; A584-M586 VanDerWaalsContact C-N 3.29Å; A584-M586 PolarHBondContact O-N 2.96Å; M586-R589 PolarHBondContact O-N 3.42Å; M586-A590 WeakPolarHBondContact O-CB 3.44Å; M586-A590 PolarHBondContact O-N 3.39Å
587	A	93.6	Very high	90.7	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-46	175.8	0	0	0	0	0	111.3	A491 V508 I510 F512 A583 A584 R589 A590 A591	A491-A587 WeakPolarHBondContact CB-O 3.23Å; V508-A587 HydrophobicContact CG2-CB 4.34Å; I510-A587 HydrophobicContact CD1-CB 4.03Å; F512-A587 HydrophobicContact CE2-CB 4.4Å; A583-A587 PolarHBondContact O-N 3.22Å; A584-A587 WeakPolarHBondContact O-CB 3.45Å; A584-A587 PolarHBondContact O-N 3.07Å; A584-A587 VanDerWaalsContact O-N 3.13Å; A587-R589 PolarHBondContact O-N 3.31Å; A587-A590 PolarHBondContact O-N 2.97Å; A587-A591 WeakPolarHBondContact O-CB 3.31Å; A587-A591 PolarHBondContact O-N 2.87Å
588	L	91.6	Very high	90.7	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-45.5	177.9	-175.4	69.5	0	0	0	112	F485 F512 L544 A547 M548 L558 A584 S585 A590 A591 A592	F485-L588 HydrophobicContact CE2-CD1 4.04Å; F485-L588 HydrophobicContact CZ-CD1 4.04Å; F512-L588 HydrophobicContact CD1-CD1 4.11Å; F512-L588 HydrophobicContact CE1-CD1 3.55Å; F512-L588 HydrophobicContact CZ-CB 4.11Å; F512-L588 HydrophobicContact CZ-CD1 3.89Å; L544-L588 HydrophobicContact CD2-CB 4.18Å; A547-L588 HydrophobicContact CB-CD2 3.73Å; M548-L588 HydrophobicContact CG-CD1 4.43Å; M548-L588 HydrophobicContact CG-CD2 3.64Å; L558-L588 HydrophobicContact CD1-CD2 4.42Å; A584-L588 PolarHBondContact O-N 3.21Å; A584-L588 VanDerWaalsContact O-N 3.07Å; S585-L588 PolarHBondContact O-N 2.99Å; L588-A590 VanDerWaalsContact C-N 3.31Å; L588-A590 PolarHBondContact O-N 3.47Å; L588-A591 WeakPolarHBondContact O-CB 3.46Å; L588-A591 PolarHBondContact O-N 3.06Å; L588-A592 PolarHBondContact O-N 3.29Å; L588-A592 VanDerWaalsContact O-N 3.08Å
589	R	88.1	Confident	90.8	Very high	170 Å²	170	44.6 Å²	44.6	64%	0.642	21%	0.214	S	C	*	.	H	α-helix	trans	-64.2	-34.6	176.4	-74	-177.7	178.3	167	1.1	113.1	S585 M586 A587	S585-R589 PolarHBondContact O-N 3.1Å; M586-R589 PolarHBondContact O-N 3.42Å; A587-R589 PolarHBondContact O-N 3.31Å
590	A	90.8	Very high	90.8	Very high	41 Å²	41	44.7 Å²	44.7	34%	0.339	22%	0.215	S	C	.	.	H	α-helix	trans	-71.2	-37	175.5	0	0	0	0	0	111.8	A491 M586 A587 L588	A491-A590 HydrophobicContact CB-CB 4.19Å; M586-A590 WeakPolarHBondContact O-CB 3.44Å; M586-A590 PolarHBondContact O-N 3.39Å; A587-A590 PolarHBondContact O-N 2.97Å; L588-A590 VanDerWaalsContact C-N 3.31Å; L588-A590 PolarHBondContact O-N 3.47Å
591	A	90.5	Very high	90.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.5	-45.3	176.4	0	0	0	0	0	112	F485 T489 A491 F512 A587 L588 K593 K594 A595	F485-A591 HydrophobicContact CE2-CB 4.08Å; F485-A591 HydrophobicContact CZ-CB 4.45Å; T489-A591 HydrophobicContact CG2-CB 3.61Å; A491-A591 HydrophobicContact CB-CB 3.7Å; F512-A591 HydrophobicContact CD2-CB 3.35Å; F512-A591 HydrophobicContact CE2-CB 3.66Å; F512-A591 HydrophobicContact CG-CB 4.08Å; A587-A591 WeakPolarHBondContact O-CB 3.31Å; A587-A591 PolarHBondContact O-N 2.87Å; L588-A591 WeakPolarHBondContact O-CB 3.46Å; L588-A591 PolarHBondContact O-N 3.06Å; A591-K593 PolarHBondContact O-N 2.68Å; A591-K594 PolarHBondContact O-N 2.83Å; A591-A595 WeakPolarHBondContact O-CB 3.45Å; A591-A595 PolarHBondContact O-N 3.4Å
592	A	85.7	Confident	90.7	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.033	20%	0.202	C	C	.	.	H	α-helix	trans	-56.1	-26.9	-176.6	0	0	0	0	0	114.4	F485 V552 L588 K594 P597	F485-A592 HydrophobicContact CE1-CB 3.87Å; F485-A592 HydrophobicContact CZ-CB 3.87Å; V552-A592 HydrophobicContact CB-CB 3.7Å; V552-A592 HydrophobicContact CG1-CB 3.63Å; V552-A592 HydrophobicContact CG2-CB 3.46Å; V552-A592 VanDerWaalsContact CG2-CB 3.46Å; L588-A592 PolarHBondContact O-N 3.29Å; L588-A592 VanDerWaalsContact O-N 3.08Å; A592-K594 PolarHBondContact O-N 2.84Å; A592-P597 WeakPolarHBondContact O-CD 3.36Å
593	K	84.7	Confident	90.7	Very high	186 Å²	186	39 Å²	39	81%	0.809	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.7	175.4	-63.7	-175.6	179.2	-175.1	0	114.1	A591	A591-K593 PolarHBondContact O-N 2.68Å
594	K	88.2	Confident	90.6	Very high	152 Å²	152	39.9 Å²	39.9	66%	0.661	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.3	-15.6	-174.8	-63.2	179.7	-176.1	174.3	0	113	T489 A591 A592 N596	T489-K594 WeakPolarHBondContact OG1-CB 3.25Å; A591-K594 PolarHBondContact O-N 2.83Å; A592-K594 PolarHBondContact O-N 2.84Å; K594-N596 VanDerWaalsContact C-N 3.26Å; K594-N596 PolarHBondContact O-N 2.83Å
595	A	87.6	Confident	90.6	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.209	C	C	.	.	S	Bend	trans	-82.4	2	-174.7	0	0	0	0	0	114.4	F485 R486 S487 T489 A591	F485-A595 HydrophobicContact CB-CB 3.85Å; F485-A595 HydrophobicContact CD1-CB 3.69Å; F485-A595 HydrophobicContact CD2-CB 3.48Å; F485-A595 VanDerWaalsContact CD2-CB 3.48Å; F485-A595 HydrophobicContact CE1-CB 4.08Å; F485-A595 HydrophobicContact CE2-CB 3.88Å; F485-A595 HydrophobicContact CG-CB 3.39Å; F485-A595 HydrophobicContact CZ-CB 4.17Å; R486-A595 PolarHBondContact N-O 2.65Å; R486-A595 VanDerWaalsContact N-O 3.11Å; S487-A595 PolarHBondContact N-O 2.78Å; T489-A595 HydrophobicContact CG2-CB 3.78Å; A591-A595 WeakPolarHBondContact O-CB 3.45Å; A591-A595 PolarHBondContact O-N 3.4Å
596	N	89.1	Confident	90.6	Very high	101 Å²	101	42.3 Å²	42.3	54%	0.54	20%	0.2	S	C	.	.			trans	49.3	69	-175.1	-171.4	42.8	0	0	0	111.8	R486 K594	R486-N596 PolarHBondContact N-O 3.3Å; K594-N596 VanDerWaalsContact C-N 3.26Å; K594-N596 PolarHBondContact O-N 2.83Å
597	P	90.2	Very high	90.6	Very high	23 Å²	23	40.5 Å²	40.5	15%	0.149	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	143.8	-177.7	28.4	-34.5	0	0	0	110.8	T484 F485 L553 A592	T484-P597 CarbonylContact O-C 3.56Å; T484-P597 VanDerWaalsContact O-CA 3.25Å; T484-P597 WeakPolarHBondContact O-CA 3.26Å; F485-P597 HydrophobicContact CD1-CB 4.12Å; F485-P597 HydrophobicContact CE1-CB 4.26Å; L553-P597 HydrophobicContact CD1-CB 3.81Å; L553-P597 HydrophobicContact CD1-CG 4.09Å; L553-P597 HydrophobicContact CD2-CB 4.43Å; L553-P597 HydrophobicContact CD2-CG 3.86Å; L553-P597 HydrophobicContact CG-CB 3.93Å; L553-P597 HydrophobicContact CG-CG 3.92Å; A592-P597 WeakPolarHBondContact O-CD 3.36Å
598	S	92	Very high	90.6	Very high	11 Å²	11	40.6 Å²	40.6	8%	0.077	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.4	179	-169.6	0	0	0	0	109.9	E483 T484 D676	E483-S598 CarbonylContact C-O 3.57Å; E483-S598 VanDerWaalsContact CA-O 3.32Å; E483-S598 WeakPolarHBondContact CA-O 3.37Å; T484-S598 PolarHBondContact N-O 3.02Å; T484-S598 PolarHBondContact O-N 2.97Å; S598-D676 VanDerWaalsContact CB-OD1 3.26Å; S598-D676 WeakPolarHBondContact CB-OD1 3.26Å; S598-D676 PolarHBondContact OG-OD1 2.96Å
599	I	92.8	Very high	90.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.5	171.5	-61.4	-178.5	0	0	0	108.3	Y481 R482 E483 L553 A554 V677 Q682 I685 I686	Y481-I599 HydrophobicContact CD1-CG2 3.85Å; Y481-I599 HydrophobicContact CG-CG2 4.13Å; R482-I599 CarbonylContact O-C 3.53Å; R482-I599 WeakPolarHBondContact O-CA 3.26Å; E483-I599 HydrophobicContact CG-CG1 4.29Å; L553-I599 HydrophobicContact CB-CD1 4.45Å; L553-I599 HydrophobicContact CB-CG1 4.39Å; L553-I599 HydrophobicContact CD1-CG1 3.86Å; A554-I599 HydrophobicContact CB-CD1 3.94Å; I599-V677 HydrophobicContact CB-CG2 3.88Å; I599-V677 HydrophobicContact CG2-CG1 4.11Å; I599-V677 HydrophobicContact CG2-CG2 4.28Å; I599-V677 WeakPolarHBondContact O-CG2 3.29Å; I599-V677 PolarHBondContact O-N 2.77Å; I599-Q682 HydrophobicContact CB-CG 4.14Å; I599-Q682 HydrophobicContact CD1-CG 3.85Å; I599-Q682 HydrophobicContact CG1-CG 3.89Å; I599-I685 HydrophobicContact CD1-CB 4.14Å; I599-I685 HydrophobicContact CD1-CG2 3.75Å; I599-I685 HydrophobicContact CG2-CD1 4.25Å; I599-I686 HydrophobicContact CD1-CG1 3.99Å
600	L	91.9	Very high	90.7	Very high	2 Å²	2	34.2 Å²	34.2	1%	0.01	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	137.8	174.1	-49	176	0	0	0	110.2	Y481 R482 T484 V559 Y674 E675 D676	Y481-L600 WeakPolarHBondContact CA-O 3.31Å; Y481-L600 WeakPolarHBondContact CD1-O 3.28Å; R482-L600 HydrophobicContact CB-CB 4.14Å; R482-L600 HydrophobicContact CB-CD1 4.27Å; R482-L600 PolarHBondContact N-O 3.05Å; R482-L600 PolarHBondContact O-N 2.96Å; T484-L600 HydrophobicContact CG2-CD1 3.91Å; T484-L600 HydrophobicContact CG2-CD2 3.84Å; T484-L600 HydrophobicContact CG2-CG 4.02Å; V559-L600 HydrophobicContact CG2-CD1 3.95Å; L600-Y674 HydrophobicContact CB-CD1 4.04Å; L600-Y674 HydrophobicContact CB-CG 4.42Å; L600-E675 CarbonylContact C-O 3.49Å; L600-E675 WeakPolarHBondContact CA-O 3.28Å; L600-D676 VanDerWaalsContact CD2-OD1 3.26Å; L600-D676 WeakPolarHBondContact CD2-OD1 3.41Å
601	E	92.9	Very high	90.5	Very high	3 Å²	3	33.2 Å²	33.2	1%	0.014	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	147.2	170	62.5	-171.4	146.8	0	0	111.6	Y481 M603 R626 P646 Y674 E675 V677 P678	Y481-E601 HydrophobicContact CD1-CB 3.94Å; Y481-E601 HydrophobicContact CE1-CB 3.76Å; E601-M603 HydrophobicContact CG-SD 4.13Å; E601-M603 PolarHBondContact O-N 3.39Å; E601-R626 IonicContact OE1-CZ 3.77Å; E601-R626 IonicContact OE1-NH1 3.3Å; E601-R626 PolarHBondContact OE1-NH1 3.5Å; E601-R626 IonicContact OE1-NH2 2.78Å; E601-R626 IonicContact OE2-CZ 3.97Å; E601-R626 IonicContact OE2-NH1 3.27Å; E601-R626 IonicContact OE2-NH2 2.97Å; E601-R626 PolarHBondContact OE2-NH2 2.97Å; E601-P646 HydrophobicContact CG-CB 4.43Å; E601-P646 WeakPolarHBondContact OE2-CB 3.41Å; E601-Y674 WeakPolarHBondContact O-CA 3.41Å; E601-E675 PolarHBondContact N-O 2.77Å; E601-E675 PolarHBondContact O-N 2.82Å; E601-V677 HydrophobicContact CB-CG1 3.61Å; E601-V677 HydrophobicContact CG-CG1 3.74Å; E601-P678 WeakPolarHBondContact OE1-CD 3.2Å
602	P	90.7	Very high	90.5	Very high	4 Å²	4	39.6 Å²	39.6	3%	0.026	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	127.8	175.1	27.9	-31.5	0	0	0	110.6	V479 L647 F671 Y674	V479-P602 VanDerWaalsContact CG1-CD 3.47Å; V479-P602 HydrophobicContact CG1-CG 3.6Å; P602-L647 HydrophobicContact CG-CB 3.98Å; P602-L647 HydrophobicContact CG-CD2 4.08Å; P602-L647 PolarHBondContact O-N 3.5Å; P602-F671 HydrophobicContact CB-CD2 4.04Å; P602-F671 HydrophobicContact CB-CE2 3.85Å; P602-Y674 HydrophobicContact CB-CD1 4.28Å; P602-Y674 HydrophobicContact CB-CE1 3.83Å; P602-Y674 HydrophobicContact CG-CE1 4.28Å
603	M	92.8	Very high	90.6	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.039	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	130.5	175.6	-59.5	-57.5	-71.3	0	0	109.6	E601 I644 P646 D672 H673 E675	E601-M603 HydrophobicContact CG-SD 4.13Å; E601-M603 PolarHBondContact O-N 3.39Å; M603-I644 HydrophobicContact CB-CG2 3.82Å; M603-I644 HydrophobicContact CE-CG2 3.73Å; M603-I644 HydrophobicContact CG-CG2 4.49Å; M603-P646 HydrophobicContact CE-CB 4.47Å; M603-P646 HydrophobicContact CE-CG 3.77Å; M603-P646 HydrophobicContact SD-CB 3.94Å; M603-P646 HydrophobicContact SD-CG 3.77Å; M603-D672 PolarHBondContact O-N 3.47Å; M603-H673 PolarHBondContact N-O 3.18Å; M603-E675 HydrophobicContact CG-CB 3.55Å; M603-E675 HydrophobicContact SD-CB 4.1Å
604	M	91.9	Very high	91	Very high	17 Å²	17	38.9 Å²	38.9	8%	0.084	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.2	-179.9	-55.8	-58	-72.8	0	0	109.7	V606 I644 V645 L647 M669 V670 F671	M604-V606 HydrophobicContact CB-CG2 4.12Å; M604-V606 PolarHBondContact O-N 2.72Å; M604-I644 CarbonylContact O-C 3.59Å; M604-I644 VanDerWaalsContact O-CA 3.31Å; M604-I644 WeakPolarHBondContact O-CA 3.33Å; M604-V645 WeakPolarHBondContact CB-O 3.31Å; M604-V645 PolarHBondContact N-O 3.03Å; M604-V645 PolarHBondContact O-N 3.49Å; M604-L647 HydrophobicContact CE-CD1 4.26Å; M604-L647 HydrophobicContact CG-CB 3.76Å; M604-L647 HydrophobicContact CG-CD1 3.84Å; M604-L647 HydrophobicContact CG-CG 4.36Å; M604-L647 HydrophobicContact SD-CB 4.12Å; M604-L647 HydrophobicContact SD-CD1 3.99Å; M604-L647 HydrophobicContact SD-CD2 4.46Å; M604-L647 HydrophobicContact SD-CG 4.41Å; M604-M669 HydrophobicContact CB-CB 4.28Å; M604-M669 HydrophobicContact CE-CB 4.17Å; M604-M669 HydrophobicContact CE-CE 4.45Å; M604-M669 HydrophobicContact CE-CG 3.84Å; M604-M669 HydrophobicContact CE-SD 4.02Å; M604-M669 HydrophobicContact CG-SD 4.35Å; M604-V670 CarbonylContact C-O 3.56Å; M604-V670 WeakPolarHBondContact CA-O 3.47Å; M604-V670 VanDerWaalsContact CE-C 3.5Å; M604-F671 HydrophobicContact SD-CB 4.4Å
605	K	93.2	Very high	91.1	Very high	78 Å²	78	33.6 Å²	33.6	34%	0.339	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	114.3	163.7	-176.6	173.2	-171.6	168	0	108.4	M669 V670 D672	K605-M669 CarbonylContact O-C 3.47Å; K605-M669 VanDerWaalsContact O-CA 3.26Å; K605-M669 WeakPolarHBondContact O-CA 3.42Å; K605-V670 HydrophobicContact CB-CG2 4Å; K605-V670 PolarHBondContact N-O 3.05Å; K605-V670 PolarHBondContact O-N 2.85Å; K605-D672 HydrophobicContact CB-CB 4.04Å
606	V	93.2	Very high	91.3	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	126.1	-175.2	-168.5	0	0	0	0	109.4	M604 I608 N642 A643 V645 M650 F667 M668 M669	M604-V606 HydrophobicContact CB-CG2 4.12Å; M604-V606 PolarHBondContact O-N 2.72Å; V606-I608 HydrophobicContact CG1-CD1 4.18Å; V606-I608 HydrophobicContact CG1-CG1 3.77Å; V606-N642 WeakPolarHBondContact O-CA 3.33Å; V606-A643 PolarHBondContact N-O 3.43Å; V606-A643 PolarHBondContact O-N 3.25Å; V606-V645 HydrophobicContact CB-CG2 4.35Å; V606-V645 HydrophobicContact CG2-CB 3.97Å; V606-V645 HydrophobicContact CG2-CG2 3.78Å; V606-M650 HydrophobicContact CB-CE 4.48Å; V606-M650 HydrophobicContact CG1-CE 3.81Å; V606-M650 HydrophobicContact CG2-CE 3.77Å; V606-M650 HydrophobicContact CG2-SD 4.09Å; V606-F667 HydrophobicContact CG1-CB 4.38Å; V606-F667 HydrophobicContact CG1-CD2 3.95Å; V606-M668 CarbonylContact C-O 3.22Å; V606-M668 WeakPolarHBondContact CA-O 3.27Å; V606-M669 HydrophobicContact CG2-CB 4.14Å
607	T	91.9	Very high	91.4	Very high	46 Å²	46	35.7 Å²	35.7	28%	0.282	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118.2	172.7	-63.3	0	0	0	0	108.1	I640 V641 N642 F667 M668	T607-I640 HydrophobicContact CG2-CG2 3.5Å; T607-I640 VanDerWaalsContact CG2-CG2 3.5Å; T607-V641 WeakPolarHBondContact CA-O 3.49Å; T607-N642 PolarHBondContact OG1-OD1 2.92Å; T607-F667 CarbonylContact O-C 3.6Å; T607-F667 WeakPolarHBondContact O-CA 3.38Å; T607-F667 WeakPolarHBondContact O-CB 3.42Å; T607-M668 PolarHBondContact N-O 2.97Å; T607-M668 PolarHBondContact O-N 2.88Å
608	I	93.1	Very high	91.6	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	124.2	-174.7	-55.7	157.5	0	0	0	108.7	V606 V610 V618 V622 I640 V641 Y653 L657 T666 F667	V606-I608 HydrophobicContact CG1-CD1 4.18Å; V606-I608 HydrophobicContact CG1-CG1 3.77Å; I608-V610 HydrophobicContact CG2-CG1 3.97Å; I608-V618 HydrophobicContact CB-CG1 4.42Å; I608-V618 HydrophobicContact CD1-CG1 3.9Å; I608-V618 HydrophobicContact CG2-CG1 3.88Å; I608-V622 HydrophobicContact CD1-CG2 3.68Å; I608-I640 CarbonylContact O-C 3.56Å; I608-I640 WeakPolarHBondContact O-CA 3.47Å; I608-V641 HydrophobicContact CB-CB 4.35Å; I608-V641 PolarHBondContact N-O 3.33Å; I608-V641 PolarHBondContact O-N 3.09Å; I608-Y653 HydrophobicContact CD1-CE1 4.2Å; I608-Y653 WeakPolarHBondContact CD1-OH 3.47Å; I608-Y653 HydrophobicContact CG1-CE1 4.24Å; I608-L657 HydrophobicContact CG2-CD1 3.98Å; I608-L657 HydrophobicContact CG2-CD2 4.15Å; I608-T666 CarbonylContact C-O 3.58Å; I608-T666 WeakPolarHBondContact CA-O 3.43Å; I608-F667 HydrophobicContact CB-CB 4.43Å; I608-F667 HydrophobicContact CG1-CB 3.98Å
609	T	89.6	Confident	91.6	Very high	40 Å²	40	36.8 Å²	36.8	25%	0.245	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120	177.1	-55.8	0	0	0	0	109.4	Q639 I640 G665 T666	T609-Q639 WeakPolarHBondContact CA-O 3.23Å; T609-I640 HydrophobicContact CG2-CG1 4.43Å; T609-G665 WeakPolarHBondContact O-CA 3.29Å; T609-T666 PolarHBondContact N-O 2.78Å; T609-T666 PolarHBondContact O-N 2.92Å
610	V	91.6	Very high	91.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	155	-179.5	-70.4	0	0	0	0	112.3	I608 V618 S638 Q639 L657 T661	I608-V610 HydrophobicContact CG2-CG1 3.97Å; V610-V618 HydrophobicContact CB-CG2 4.36Å; V610-V618 HydrophobicContact CG1-CG2 3.75Å; V610-V618 HydrophobicContact CG2-CG2 3.98Å; V610-S638 CarbonylContact O-C 3.55Å; V610-S638 WeakPolarHBondContact O-CA 3.47Å; V610-Q639 PolarHBondContact N-O 3.08Å; V610-Q639 PolarHBondContact O-N 3.38Å; V610-L657 HydrophobicContact CG1-CD1 4.04Å; V610-T661 HydrophobicContact CB-CG2 4.39Å; V610-T661 HydrophobicContact CG1-CG2 3.6Å
611	P	87.9	Confident	91.6	Very high	20 Å²	20	40.6 Å²	40.6	13%	0.13	23%	0.23	C	C	.	.			trans	-58.4	149.8	163.8	-20	30.9	0	0	0	111.6	D613 Y614 R664	P611-D613 PolarHBondContact O-N 2.81Å; P611-Y614 HydrophobicContact CB-CD2 3.87Å; P611-Y614 HydrophobicContact CB-CE2 4.12Å; P611-Y614 HydrophobicContact CG-CD2 3.9Å; P611-Y614 HydrophobicContact CG-CE2 4.03Å; P611-Y614 PolarHBondContact O-N 3.28Å; P611-R664 HydrophobicContact CG-CB 3.76Å; P611-R664 HydrophobicContact CG-CG 4.47Å
612	E	88.7	Confident	91.7	Very high	135 Å²	135	40.6 Å²	40.6	63%	0.631	23%	0.231	S	C	*	.	G	3₁₀ helix	trans	-57.8	-32.8	-177.9	-173.3	169.1	-179.4	0	0	112.7	Y614 L615 Q639	E612-Y614 PolarHBondContact O-N 2.79Å; E612-Y614 VanDerWaalsContact O-N 3.14Å; E612-L615 WeakPolarHBondContact O-CB 3.34Å; E612-L615 PolarHBondContact O-N 2.84Å; E612-Q639 HydrophobicContact CB-CG 4.14Å; E612-Q639 HydrophobicContact CG-CG 4.33Å
613	D	89.2	Confident	91.8	Very high	145 Å²	145	45.1 Å²	45.1	78%	0.775	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-59.1	-27.4	-179.6	-58.9	-36.2	0	0	0	113.9	P611	P611-D613 PolarHBondContact O-N 2.81Å
614	Y	92	Very high	91.8	Very high	30 Å²	30	48.6 Å²	48.6	12%	0.118	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-104.6	5.3	-175.9	-53.3	-71.7	0	0	0	113.4	P611 E612 G616 D617 V618 S660 T661 Q662 R664	P611-Y614 HydrophobicContact CB-CD2 3.87Å; P611-Y614 HydrophobicContact CB-CE2 4.12Å; P611-Y614 HydrophobicContact CG-CD2 3.9Å; P611-Y614 HydrophobicContact CG-CE2 4.03Å; P611-Y614 PolarHBondContact O-N 3.28Å; E612-Y614 PolarHBondContact O-N 2.79Å; E612-Y614 VanDerWaalsContact O-N 3.14Å; Y614-G616 VanDerWaalsContact C-N 3.27Å; Y614-G616 PolarHBondContact O-N 3.34Å; Y614-D617 PolarHBondContact O-N 3.02Å; Y614-V618 PolarHBondContact O-N 3.01Å; Y614-S660 WeakPolarHBondContact CD1-O 3.26Å; Y614-T661 HydrophobicContact CG-CG2 4.26Å; Y614-Q662 HydrophobicContact CE1-CG 4.32Å; Y614-Q662 VanDerWaalsContact OH-CD 3.26Å; Y614-Q662 PolarHBondContact OH-OE1 2.89Å; Y614-R664 PolarHBondContact OH-NH1 3.11Å
615	L	91	Very high	91.9	Very high	41 Å²	41	49.9 Å²	49.9	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-60.8	-37.4	-174.1	-174.7	145.9	0	0	0	112.1	E612 D617 V618 M619 M632 Q639	E612-L615 WeakPolarHBondContact O-CB 3.34Å; E612-L615 PolarHBondContact O-N 2.84Å; L615-D617 PolarHBondContact O-N 2.89Å; L615-V618 PolarHBondContact O-N 3.31Å; L615-M619 HydrophobicContact CD2-CG 4.14Å; L615-M619 VanDerWaalsContact O-CG 3.23Å; L615-M619 WeakPolarHBondContact O-CG 3.37Å; L615-M619 PolarHBondContact O-N 3.39Å; L615-M632 HydrophobicContact CD1-CE 3.37Å; L615-M632 HydrophobicContact CD2-CE 3.46Å; L615-M632 VanDerWaalsContact CD2-CE 3.46Å; L615-M632 HydrophobicContact CG-CE 3.47Å; L615-M632 VanDerWaalsContact CG-CE 3.47Å; L615-Q639 HydrophobicContact CD1-CB 3.71Å; L615-Q639 HydrophobicContact CD1-CG 3.65Å
616	G	91.5	Very high	91.9	Very high	56 Å²	56	49.8 Å²	49.8	58%	0.577	29%	0.289	S	S	*	.	H	α-helix	trans	-60.2	-44.1	177.2	0	0	0	0	0	113.3	Y614 M619 G620	Y614-G616 VanDerWaalsContact C-N 3.27Å; Y614-G616 PolarHBondContact O-N 3.34Å; G616-M619 PolarHBondContact O-N 2.96Å; G616-G620 PolarHBondContact O-N 3.22Å; G616-G620 VanDerWaalsContact O-N 3.14Å
617	D	92.3	Very high	91.9	Very high	88 Å²	88	50.4 Å²	50.4	47%	0.471	30%	0.296	S	S	.	.	H	α-helix	trans	-67.1	-41.8	179.9	-65.5	-36.5	0	0	0	111.2	Y614 L615 M619 G620 H621	Y614-D617 PolarHBondContact O-N 3.02Å; L615-D617 PolarHBondContact O-N 2.89Å; D617-M619 PolarHBondContact O-N 3.3Å; D617-G620 PolarHBondContact O-N 3.35Å; D617-H621 PolarHBondContact O-CD2 3.48Å; D617-H621 VanDerWaalsContact O-CD2 3.31Å; D617-H621 VanDerWaalsContact O-CG 3.28Å; D617-H621 PolarHBondContact O-N 3.34Å
618	V	92.7	Very high	92	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-44.1	176.7	174.7	0	0	0	0	111.6	I608 V610 Y614 L615 G620 H621 V622 V641 L657 T661	I608-V618 HydrophobicContact CB-CG1 4.42Å; I608-V618 HydrophobicContact CD1-CG1 3.9Å; I608-V618 HydrophobicContact CG2-CG1 3.88Å; V610-V618 HydrophobicContact CB-CG2 4.36Å; V610-V618 HydrophobicContact CG1-CG2 3.75Å; V610-V618 HydrophobicContact CG2-CG2 3.98Å; Y614-V618 PolarHBondContact O-N 3.01Å; L615-V618 PolarHBondContact O-N 3.31Å; V618-G620 VanDerWaalsContact C-N 3.28Å; V618-G620 PolarHBondContact O-N 3.39Å; V618-H621 PolarHBondContact O-N 2.94Å; V618-H621 VanDerWaalsContact O-N 3.15Å; V618-V622 HydrophobicContact CG1-CG2 4.45Å; V618-V622 WeakPolarHBondContact O-CG2 3.32Å; V618-V622 PolarHBondContact O-N 3.03Å; V618-V641 HydrophobicContact CG1-CG2 4.49Å; V618-L657 HydrophobicContact CG2-CD1 3.93Å; V618-T661 HydrophobicContact CG2-CG2 4.37Å
619	M	92.6	Very high	92.1	Very high	57 Å²	57	55.3 Å²	55.3	28%	0.281	32%	0.315	S	S	.	.	H	α-helix	trans	-61.1	-39.5	177	-67.7	-64.1	-70.1	0	0	111.7	L615 G616 D617 T623 V629 M632 V641	L615-M619 HydrophobicContact CD2-CG 4.14Å; L615-M619 VanDerWaalsContact O-CG 3.23Å; L615-M619 WeakPolarHBondContact O-CG 3.37Å; L615-M619 PolarHBondContact O-N 3.39Å; G616-M619 PolarHBondContact O-N 2.96Å; D617-M619 PolarHBondContact O-N 3.3Å; M619-T623 PolarHBondContact O-N 2.97Å; M619-T623 PolarHBondContact O-OG1 3.1Å; M619-V629 HydrophobicContact CE-CB 4.2Å; M619-V629 HydrophobicContact CE-CG1 4.2Å; M619-V629 HydrophobicContact CE-CG2 3.77Å; M619-V629 HydrophobicContact SD-CG1 4.31Å; M619-V629 HydrophobicContact SD-CG2 3.83Å; M619-M632 HydrophobicContact CE-SD 4.23Å; M619-M632 HydrophobicContact CG-CE 4.45Å; M619-M632 HydrophobicContact SD-CE 3.92Å; M619-M632 HydrophobicContact SD-SD 3.96Å; M619-V641 HydrophobicContact SD-CG1 4.16Å
620	G	93.3	Very high	92.2	Very high	38 Å²	38	58.7 Å²	58.7	39%	0.392	33%	0.328	S	S	.	.	H	α-helix	trans	-61.2	-45.1	173	0	0	0	0	0	112.4	G616 D617 V618 T623 A624	G616-G620 PolarHBondContact O-N 3.22Å; G616-G620 VanDerWaalsContact O-N 3.14Å; D617-G620 PolarHBondContact O-N 3.35Å; V618-G620 VanDerWaalsContact C-N 3.28Å; V618-G620 PolarHBondContact O-N 3.39Å; G620-T623 PolarHBondContact O-N 2.87Å; G620-A624 WeakPolarHBondContact O-CB 3.46Å; G620-A624 PolarHBondContact O-N 3.27Å
621	H	92.3	Very high	92.2	Very high	45 Å²	45	60.1 Å²	60.1	21%	0.208	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-45.6	-180	-67.8	179.3	0	0	0	113.1	D617 V618 T623 A624 R625 Y653 S660	D617-H621 PolarHBondContact O-CD2 3.48Å; D617-H621 VanDerWaalsContact O-CD2 3.31Å; D617-H621 VanDerWaalsContact O-CG 3.28Å; D617-H621 PolarHBondContact O-N 3.34Å; V618-H621 PolarHBondContact O-N 2.94Å; V618-H621 VanDerWaalsContact O-N 3.15Å; H621-T623 VanDerWaalsContact C-N 3.28Å; H621-T623 PolarHBondContact O-N 3.4Å; H621-A624 PolarHBondContact O-N 3.02Å; H621-R625 WeakPolarHBondContact O-CB 3.37Å; H621-R625 WeakPolarHBondContact O-CG 3.42Å; H621-R625 PolarHBondContact O-N 2.93Å; H621-Y653 HydrophobicContact CB-CE2 4.17Å; H621-S660 VanDerWaalsContact CE1-CB 3.46Å; H621-S660 WeakPolarHBondContact CE1-CB 3.49Å; H621-S660 PolarHBondContact CE1-OG 2.98Å; H621-S660 VanDerWaalsContact CE1-OG 3.23Å
622	V	93.8	Very high	92.5	Very high	3 Å²	3	63 Å²	63	2%	0.018	36%	0.355	C	S	.	.	H	α-helix	trans	-58	-46.6	177.4	172.8	0	0	0	0	109.7	I608 V618 R625 G627 V629 A643 V645	I608-V622 HydrophobicContact CD1-CG2 3.68Å; V618-V622 HydrophobicContact CG1-CG2 4.45Å; V618-V622 WeakPolarHBondContact O-CG2 3.32Å; V618-V622 PolarHBondContact O-N 3.03Å; V622-R625 PolarHBondContact O-N 3.49Å; V622-G627 VanDerWaalsContact O-CA 3.25Å; V622-G627 WeakPolarHBondContact O-CA 3.4Å; V622-G627 PolarHBondContact O-N 3.44Å; V622-V629 HydrophobicContact CB-CG2 4.32Å; V622-V629 HydrophobicContact CG1-CG2 3.8Å; V622-A643 HydrophobicContact CG1-CB 3.73Å; V622-A643 HydrophobicContact CG2-CB 4.34Å; V622-V645 HydrophobicContact CG1-CG2 4.3Å
623	T	93.1	Very high	92.6	Very high	98 Å²	98	62.3 Å²	62.3	60%	0.601	35%	0.352	S	S	*	.	H	α-helix	trans	-65.3	-42.2	179.9	-52.1	0	0	0	0	111.9	M619 G620 H621 R625 R626	M619-T623 PolarHBondContact O-N 2.97Å; M619-T623 PolarHBondContact O-OG1 3.1Å; G620-T623 PolarHBondContact O-N 2.87Å; H621-T623 VanDerWaalsContact C-N 3.28Å; H621-T623 PolarHBondContact O-N 3.4Å; T623-R625 PolarHBondContact O-N 2.97Å; T623-R626 PolarHBondContact O-N 3.07Å
624	A	93.4	Very high	92.5	Very high	81 Å²	81	59.1 Å²	59.1	67%	0.669	35%	0.345	S	S	*	.	H	α-helix	trans	-63.3	-30.5	178.6	0	0	0	0	0	112.7	G620 H621 R626	G620-A624 WeakPolarHBondContact O-CB 3.46Å; G620-A624 PolarHBondContact O-N 3.27Å; H621-A624 PolarHBondContact O-N 3.02Å; A624-R626 VanDerWaalsContact C-N 3.26Å; A624-R626 PolarHBondContact O-N 3.34Å
625	R	93.3	Very high	91.8	Very high	44 Å²	44	63.6 Å²	63.6	17%	0.166	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	24.4	178.3	-70.5	177.7	-179.9	-98	4.4	113.3	H621 V622 T623 G627 V645 E649 F651 T656	H621-R625 WeakPolarHBondContact O-CB 3.37Å; H621-R625 WeakPolarHBondContact O-CG 3.42Å; H621-R625 PolarHBondContact O-N 2.93Å; V622-R625 PolarHBondContact O-N 3.49Å; T623-R625 PolarHBondContact O-N 2.97Å; R625-G627 PolarHBondContact O-N 3.21Å; R625-G627 VanDerWaalsContact O-N 3.11Å; R625-V645 HydrophobicContact CB-CG1 4.05Å; R625-V645 WeakPolarHBondContact O-CG1 3.21Å; R625-E649 HydrophobicContact CB-CB 3.96Å; R625-E649 VanDerWaalsContact CD-O 3.31Å; R625-E649 WeakPolarHBondContact CD-O 3.2Å; R625-E649 HydrophobicContact CG-CB 4.48Å; R625-E649 PolarHBondContact NH1-O 3.19Å; R625-E649 WeakPolarHBondContact O-CB 3.25Å; R625-E649 WeakPolarHBondContact O-CG 3.47Å; R625-F651 PolarHBondContact NH1-O 3.07Å; R625-F651 VanDerWaalsContact NH1-O 3.15Å; R625-T656 PolarHBondContact NH2-OG1 3.05Å
626	R	93.8	Very high	91.1	Very high	76 Å²	76	65.3 Å²	65.3	29%	0.287	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	22.5	-178.1	-51.8	-173.5	-69.5	119.7	-6.3	113.8	E601 T623 A624 P646 E649 P678	E601-R626 IonicContact OE1-CZ 3.77Å; E601-R626 IonicContact OE1-NH1 3.3Å; E601-R626 PolarHBondContact OE1-NH1 3.5Å; E601-R626 IonicContact OE1-NH2 2.78Å; E601-R626 IonicContact OE2-CZ 3.97Å; E601-R626 IonicContact OE2-NH1 3.27Å; E601-R626 IonicContact OE2-NH2 2.97Å; E601-R626 PolarHBondContact OE2-NH2 2.97Å; T623-R626 PolarHBondContact O-N 3.07Å; A624-R626 VanDerWaalsContact C-N 3.26Å; A624-R626 PolarHBondContact O-N 3.34Å; R626-P646 HydrophobicContact CB-CG 4.18Å; R626-E649 IonicContact CZ-OE1 2.72Å; R626-E649 IonicContact NE-OE1 3.02Å; R626-E649 PolarHBondContact NE-OE1 3.43Å; R626-E649 IonicContact NH2-OE1 3.42Å; R626-E649 PolarHBondContact NH2-OE1 3.42Å; R626-E649 VanDerWaalsContact NH2-OE1 3.13Å; R626-P678 VanDerWaalsContact NH1-CD 3.35Å
627	G	93.2	Very high	90.5	Very high	15 Å²	15	69.5 Å²	69.5	16%	0.155	40%	0.404	C	S	.	.			trans	-85.3	155	178.8	0	0	0	0	0	113.1	V622 R625 I644	V622-G627 VanDerWaalsContact O-CA 3.25Å; V622-G627 WeakPolarHBondContact O-CA 3.4Å; V622-G627 PolarHBondContact O-N 3.44Å; R625-G627 PolarHBondContact O-N 3.21Å; R625-G627 VanDerWaalsContact O-N 3.11Å; G627-I644 CarbonylContact C-O 3.53Å; G627-I644 WeakPolarHBondContact CA-O 3.37Å
628	R	94	Very high	90.1	Very high	101 Å²	101	66.8 Å²	66.8	38%	0.381	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	129	172.3	61.6	-177.4	-167.7	-128.5	1.6	110	A643 I644 H673 E675	R628-A643 CarbonylContact O-C 3.5Å; R628-A643 WeakPolarHBondContact O-CA 3.44Å; R628-A643 WeakPolarHBondContact O-CB 3.41Å; R628-I644 HydrophobicContact CG-CB 3.87Å; R628-I644 PolarHBondContact N-O 3.32Å; R628-I644 PolarHBondContact O-N 2.95Å; R628-H673 PolarHBondContact NH2-CE1 3.36Å; R628-H673 VanDerWaalsContact NH2-CE1 3.34Å; R628-E675 IonicContact CZ-OE2 2.76Å; R628-E675 IonicContact NH1-OE1 3.21Å; R628-E675 IonicContact NH1-OE2 3.09Å; R628-E675 PolarHBondContact NH1-OE2 3.38Å
629	V	94.8	Very high	90	Very high	49 Å²	49	68.4 Å²	68.4	30%	0.297	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	127.3	175.9	178.4	0	0	0	0	109	M619 V622 M632 V641 A643	M619-V629 HydrophobicContact CE-CB 4.2Å; M619-V629 HydrophobicContact CE-CG1 4.2Å; M619-V629 HydrophobicContact CE-CG2 3.77Å; M619-V629 HydrophobicContact SD-CG1 4.31Å; M619-V629 HydrophobicContact SD-CG2 3.83Å; V622-V629 HydrophobicContact CB-CG2 4.32Å; V622-V629 HydrophobicContact CG1-CG2 3.8Å; V629-M632 HydrophobicContact CG1-CG 4.21Å; V629-V641 HydrophobicContact CG1-CG1 3.93Å; V629-V641 HydrophobicContact CG2-CG1 4.26Å; V629-A643 HydrophobicContact CG2-CB 4.39Å
630	E	92.5	Very high	90	Very high	111 Å²	111	66.9 Å²	66.9	52%	0.519	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-35.1	178.1	-63.7	-154.9	125	0	0	112.3	N642 I644	E630-N642 PolarHBondContact N-O 2.98Å; E630-I644 HydrophobicContact CG-CD1 4.31Å; E630-I644 HydrophobicContact CG-CG1 4.12Å; E630-I644 VanDerWaalsContact OE1-CD1 3.28Å; E630-I644 WeakPolarHBondContact OE1-CD1 3.34Å
631	G	91.5	Very high	90	Very high	29 Å²	29	65.1 Å²	65.1	30%	0.299	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	165.6	-176.2	0	0	0	0	0	113.1	N642	G631-N642 PolarHBondContact N-O 3.31Å; G631-N642 PolarHBondContact O-N 3.24Å
632	M	92.5	Very high	90.1	Very high	80 Å²	80	64.4 Å²	64.4	39%	0.394	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	136.4	179.7	-59.3	172.1	80.9	0	0	109.1	L615 M619 V629 I640 V641	L615-M632 HydrophobicContact CD1-CE 3.37Å; L615-M632 HydrophobicContact CD2-CE 3.46Å; L615-M632 VanDerWaalsContact CD2-CE 3.46Å; L615-M632 HydrophobicContact CG-CE 3.47Å; L615-M632 VanDerWaalsContact CG-CE 3.47Å; M619-M632 HydrophobicContact CE-SD 4.23Å; M619-M632 HydrophobicContact CG-CE 4.45Å; M619-M632 HydrophobicContact SD-CE 3.92Å; M619-M632 HydrophobicContact SD-SD 3.96Å; V629-M632 HydrophobicContact CG1-CG 4.21Å; M632-I640 CarbonylContact C-O 3.59Å; M632-I640 VanDerWaalsContact CA-O 3.25Å; M632-I640 WeakPolarHBondContact CA-O 3.2Å; M632-V641 HydrophobicContact CE-CG2 3.79Å; M632-V641 HydrophobicContact CG-CG1 4.34Å; M632-V641 HydrophobicContact CG-CG2 4.31Å
633	E	91	Very high	90.2	Very high	122 Å²	122	64.2 Å²	64.2	57%	0.57	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.9	134.4	-177.2	-65.2	-179.2	-174	0	0	110	Q639 I640	E633-Q639 PolarHBondContact O-OE1 2.97Å; E633-I640 PolarHBondContact N-O 2.76Å; E633-I640 PolarHBondContact O-N 2.97Å
634	A	87.1	Confident	90.4	Very high	77 Å²	77	59.7 Å²	59.7	64%	0.636	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.8	131.8	172.3	0	0	0	0	0	109.9
635	H	77.1	Confident	90.5	Very high	125 Å²	125	55.9 Å²	55.9	58%	0.579	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	92.2	178.6	-165	79	0	0	0	110.9	N637 S638 I640	H635-N637 PolarHBondContact O-N 3.43Å; H635-S638 CarbonylContact C-O 3.55Å; H635-S638 PolarHBondContact N-O 2.61Å; H635-S638 PolarHBondContact O-N 2.92Å; H635-S638 VanDerWaalsContact O-O 3.09Å; H635-I640 HydrophobicContact CB-CD1 3.52Å; H635-I640 HydrophobicContact CB-CG1 3.77Å
636	G	77.3	Confident	90.5	Very high	76 Å²	76	53.9 Å²	53.9	78%	0.784	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.2	-123.4	-175.2	0	0	0	0	0	111.3	S638	G636-S638 VanDerWaalsContact C-N 3.27Å; G636-S638 PolarHBondContact O-N 2.97Å
637	N	78.4	Confident	90.3	Very high	144 Å²	144	51.9 Å²	51.9	77%	0.77	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	16	177.3	-60.8	1.5	0	0	0	112.5	H635	H635-N637 PolarHBondContact O-N 3.43Å
638	S	85.1	Confident	90.1	Very high	32 Å²	32	52.3 Å²	52.3	22%	0.224	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	162.2	-179.2	-61	0	0	0	0	110.5	V610 H635 G636	V610-S638 CarbonylContact O-C 3.55Å; V610-S638 WeakPolarHBondContact O-CA 3.47Å; H635-S638 CarbonylContact C-O 3.55Å; H635-S638 PolarHBondContact N-O 2.61Å; H635-S638 PolarHBondContact O-N 2.92Å; H635-S638 VanDerWaalsContact O-O 3.09Å; G636-S638 VanDerWaalsContact C-N 3.27Å; G636-S638 PolarHBondContact O-N 2.97Å
639	Q	90.3	Very high	89.9	Confident	33 Å²	33	50.5 Å²	50.5	15%	0.154	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	135.2	176.3	-69.1	-73.8	-7.1	0	0	108.4	T609 V610 E612 L615 E633	T609-Q639 WeakPolarHBondContact CA-O 3.23Å; V610-Q639 PolarHBondContact N-O 3.08Å; V610-Q639 PolarHBondContact O-N 3.38Å; E612-Q639 HydrophobicContact CB-CG 4.14Å; E612-Q639 HydrophobicContact CG-CG 4.33Å; L615-Q639 HydrophobicContact CD1-CB 3.71Å; L615-Q639 HydrophobicContact CD1-CG 3.65Å; E633-Q639 PolarHBondContact O-OE1 2.97Å
640	I	91.7	Very high	89.7	Confident	26 Å²	26	48.7 Å²	48.7	13%	0.133	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	124.1	174.8	-60.4	179.5	0	0	0	107.8	T607 I608 T609 M632 E633 H635	T607-I640 HydrophobicContact CG2-CG2 3.5Å; T607-I640 VanDerWaalsContact CG2-CG2 3.5Å; I608-I640 CarbonylContact O-C 3.56Å; I608-I640 WeakPolarHBondContact O-CA 3.47Å; T609-I640 HydrophobicContact CG2-CG1 4.43Å; M632-I640 CarbonylContact C-O 3.59Å; M632-I640 VanDerWaalsContact CA-O 3.25Å; M632-I640 WeakPolarHBondContact CA-O 3.2Å; E633-I640 PolarHBondContact N-O 2.76Å; E633-I640 PolarHBondContact O-N 2.97Å; H635-I640 HydrophobicContact CB-CD1 3.52Å; H635-I640 HydrophobicContact CB-CG1 3.77Å
641	V	94	Very high	89.2	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.3	175.8	-176.3	0	0	0	0	108.5	T607 I608 V618 M619 V629 M632	T607-V641 WeakPolarHBondContact CA-O 3.49Å; I608-V641 HydrophobicContact CB-CB 4.35Å; I608-V641 PolarHBondContact N-O 3.33Å; I608-V641 PolarHBondContact O-N 3.09Å; V618-V641 HydrophobicContact CG1-CG2 4.49Å; M619-V641 HydrophobicContact SD-CG1 4.16Å; V629-V641 HydrophobicContact CG1-CG1 3.93Å; V629-V641 HydrophobicContact CG2-CG1 4.26Å; M632-V641 HydrophobicContact CE-CG2 3.79Å; M632-V641 HydrophobicContact CG-CG1 4.34Å; M632-V641 HydrophobicContact CG-CG2 4.31Å
642	N	94.8	Very high	88.8	Confident	30 Å²	30	46.3 Å²	46.3	16%	0.16	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	125.7	173.6	-68	-51.3	0	0	0	109.2	V606 T607 E630 G631	V606-N642 WeakPolarHBondContact O-CA 3.33Å; T607-N642 PolarHBondContact OG1-OD1 2.92Å; E630-N642 PolarHBondContact N-O 2.98Å; G631-N642 PolarHBondContact N-O 3.31Å; G631-N642 PolarHBondContact O-N 3.24Å
643	A	96.2	Very high	88.6	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	158.9	-178	0	0	0	0	0	111.8	V606 V622 R628 V629 V645	V606-A643 PolarHBondContact N-O 3.43Å; V606-A643 PolarHBondContact O-N 3.25Å; V622-A643 HydrophobicContact CG1-CB 3.73Å; V622-A643 HydrophobicContact CG2-CB 4.34Å; R628-A643 CarbonylContact O-C 3.5Å; R628-A643 WeakPolarHBondContact O-CA 3.44Å; R628-A643 WeakPolarHBondContact O-CB 3.41Å; V629-A643 HydrophobicContact CG2-CB 4.39Å; A643-V645 HydrophobicContact CB-CG2 4.22Å
644	I	96.4	Very high	88.2	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	123.2	169.2	-65.6	-175.2	0	0	0	108.1	M603 M604 G627 R628 E630	M603-I644 HydrophobicContact CB-CG2 3.82Å; M603-I644 HydrophobicContact CE-CG2 3.73Å; M603-I644 HydrophobicContact CG-CG2 4.49Å; M604-I644 CarbonylContact O-C 3.59Å; M604-I644 VanDerWaalsContact O-CA 3.31Å; M604-I644 WeakPolarHBondContact O-CA 3.33Å; G627-I644 CarbonylContact C-O 3.53Å; G627-I644 WeakPolarHBondContact CA-O 3.37Å; R628-I644 HydrophobicContact CG-CB 3.87Å; R628-I644 PolarHBondContact N-O 3.32Å; R628-I644 PolarHBondContact O-N 2.95Å; E630-I644 HydrophobicContact CG-CD1 4.31Å; E630-I644 HydrophobicContact CG-CG1 4.12Å; E630-I644 VanDerWaalsContact OE1-CD1 3.28Å; E630-I644 WeakPolarHBondContact OE1-CD1 3.34Å
645	V	95.4	Very high	88	Confident	2 Å²	2	35.7 Å²	35.7	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	137.9	-173.3	-166.6	0	0	0	0	109.8	M604 V606 V622 R625 A643 L647 E649 M650	M604-V645 WeakPolarHBondContact CB-O 3.31Å; M604-V645 PolarHBondContact N-O 3.03Å; M604-V645 PolarHBondContact O-N 3.49Å; V606-V645 HydrophobicContact CB-CG2 4.35Å; V606-V645 HydrophobicContact CG2-CB 3.97Å; V606-V645 HydrophobicContact CG2-CG2 3.78Å; V622-V645 HydrophobicContact CG1-CG2 4.3Å; R625-V645 HydrophobicContact CB-CG1 4.05Å; R625-V645 WeakPolarHBondContact O-CG1 3.21Å; A643-V645 HydrophobicContact CB-CG2 4.22Å; V645-L647 PolarHBondContact O-N 2.98Å; V645-E649 HydrophobicContact CG1-CB 4.45Å; V645-M650 HydrophobicContact CB-CG 4.22Å; V645-M650 HydrophobicContact CB-SD 3.77Å; V645-M650 HydrophobicContact CG1-CG 4.05Å; V645-M650 HydrophobicContact CG1-SD 3.56Å; V645-M650 VanDerWaalsContact CG1-SD 3.56Å; V645-M650 HydrophobicContact CG2-SD 4.24Å
646	P	94	Very high	88.6	Confident	1 Å²	1	32 Å²	32	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61	136	175.4	-19.2	29.3	0	0	0	112.1	E601 M603 R626 A648 E649 M650	E601-P646 HydrophobicContact CG-CB 4.43Å; E601-P646 WeakPolarHBondContact OE2-CB 3.41Å; M603-P646 HydrophobicContact CE-CB 4.47Å; M603-P646 HydrophobicContact CE-CG 3.77Å; M603-P646 HydrophobicContact SD-CB 3.94Å; M603-P646 HydrophobicContact SD-CG 3.77Å; R626-P646 HydrophobicContact CB-CG 4.18Å; P646-A648 PolarHBondContact O-N 3.23Å; P646-E649 HydrophobicContact CB-CG 4.16Å; P646-E649 HydrophobicContact CG-CG 4.27Å; P646-E649 PolarHBondContact O-N 3.36Å; P646-M650 PolarHBondContact O-N 2.95Å
647	L	89.8	Confident	89.2	Confident	35 Å²	35	28.4 Å²	28.4	18%	0.183	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-56.6	-37.5	179	-178.6	60.3	0	0	0	112.1	P602 M604 V645 E649 M650 M669	P602-L647 HydrophobicContact CG-CB 3.98Å; P602-L647 HydrophobicContact CG-CD2 4.08Å; P602-L647 PolarHBondContact O-N 3.5Å; M604-L647 HydrophobicContact CE-CD1 4.26Å; M604-L647 HydrophobicContact CG-CB 3.76Å; M604-L647 HydrophobicContact CG-CD1 3.84Å; M604-L647 HydrophobicContact CG-CG 4.36Å; M604-L647 HydrophobicContact SD-CB 4.12Å; M604-L647 HydrophobicContact SD-CD1 3.99Å; M604-L647 HydrophobicContact SD-CD2 4.46Å; M604-L647 HydrophobicContact SD-CG 4.41Å; V645-L647 PolarHBondContact O-N 2.98Å; L647-E649 PolarHBondContact O-N 3.28Å; L647-E649 VanDerWaalsContact O-N 3.16Å; L647-M650 PolarHBondContact O-N 3.49Å; L647-M669 HydrophobicContact CD1-CE 4.04Å; L647-M669 HydrophobicContact CD1-SD 4.32Å
648	A	88.2	Confident	89.4	Confident	24 Å²	24	23.9 Å²	23.9	20%	0.198	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-58	-28.4	177.9	0	0	0	0	0	113.3	V479 P646 F651	V479-A648 HydrophobicContact CG2-CB 3.95Å; P646-A648 PolarHBondContact O-N 3.23Å; A648-F651 VanDerWaalsContact O-CD2 3.27Å; A648-F651 WeakPolarHBondContact O-CD2 3.23Å
649	E	91	Very high	89.5	Confident	62 Å²	62	26.8 Å²	26.8	29%	0.29	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-95.6	0.8	179.8	-57.5	-66.9	166.3	0	0	112.3	R625 R626 V645 P646 L647	R625-E649 HydrophobicContact CB-CB 3.96Å; R625-E649 VanDerWaalsContact CD-O 3.31Å; R625-E649 WeakPolarHBondContact CD-O 3.2Å; R625-E649 HydrophobicContact CG-CB 4.48Å; R625-E649 PolarHBondContact NH1-O 3.19Å; R625-E649 WeakPolarHBondContact O-CB 3.25Å; R625-E649 WeakPolarHBondContact O-CG 3.47Å; R626-E649 IonicContact CZ-OE1 2.72Å; R626-E649 IonicContact NE-OE1 3.02Å; R626-E649 PolarHBondContact NE-OE1 3.43Å; R626-E649 IonicContact NH2-OE1 3.42Å; R626-E649 PolarHBondContact NH2-OE1 3.42Å; R626-E649 VanDerWaalsContact NH2-OE1 3.13Å; V645-E649 HydrophobicContact CG1-CB 4.45Å; P646-E649 HydrophobicContact CB-CG 4.16Å; P646-E649 HydrophobicContact CG-CG 4.27Å; P646-E649 PolarHBondContact O-N 3.36Å; L647-E649 PolarHBondContact O-N 3.28Å; L647-E649 VanDerWaalsContact O-N 3.16Å
650	M	89.6	Confident	89.5	Confident	11 Å²	11	26.4 Å²	26.4	5%	0.054	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-10.8	-179.4	-70.4	-61.1	-67.9	0	0	113.3	V606 V645 P646 L647 G652 Y653 F667 M669	V606-M650 HydrophobicContact CB-CE 4.48Å; V606-M650 HydrophobicContact CG1-CE 3.81Å; V606-M650 HydrophobicContact CG2-CE 3.77Å; V606-M650 HydrophobicContact CG2-SD 4.09Å; V645-M650 HydrophobicContact CB-CG 4.22Å; V645-M650 HydrophobicContact CB-SD 3.77Å; V645-M650 HydrophobicContact CG1-CG 4.05Å; V645-M650 HydrophobicContact CG1-SD 3.56Å; V645-M650 VanDerWaalsContact CG1-SD 3.56Å; V645-M650 HydrophobicContact CG2-SD 4.24Å; P646-M650 PolarHBondContact O-N 2.95Å; L647-M650 PolarHBondContact O-N 3.49Å; M650-G652 PolarHBondContact O-N 3.13Å; M650-Y653 HydrophobicContact CE-CD1 3.43Å; M650-Y653 VanDerWaalsContact CE-CD1 3.43Å; M650-Y653 HydrophobicContact CE-CE1 4.09Å; M650-Y653 HydrophobicContact CE-CG 3.91Å; M650-Y653 WeakPolarHBondContact O-CB 3.47Å; M650-Y653 PolarHBondContact O-N 2.83Å; M650-Y653 HydrophobicContact SD-CD1 4.35Å; M650-Y653 HydrophobicContact SD-CG 4.36Å; M650-F667 HydrophobicContact CE-CD2 3.99Å; M650-F667 HydrophobicContact CE-CE2 3.73Å; M650-M669 HydrophobicContact CB-SD 4.15Å; M650-M669 HydrophobicContact CE-SD 4.2Å; M650-M669 HydrophobicContact CG-SD 4.35Å
651	F	82.9	Confident	89.4	Confident	60 Å²	60	25.1 Å²	25.1	26%	0.263	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	131.3	176.1	-58.1	-53	0	0	0	111.3	A476 P477 V479 R625 A648 Y653	A476-F651 HydrophobicContact CB-CD2 4.25Å; A476-F651 HydrophobicContact CB-CE2 4.47Å; A476-F651 HydrophobicContact CB-CG 4.4Å; P477-F651 HydrophobicContact CB-CE1 4.01Å; P477-F651 HydrophobicContact CB-CZ 4.25Å; P477-F651 HydrophobicContact CG-CD1 4.47Å; P477-F651 HydrophobicContact CG-CE1 3.84Å; P477-F651 VanDerWaalsContact O-CZ 3.28Å; P477-F651 WeakPolarHBondContact O-CZ 3.26Å; V479-F651 HydrophobicContact CG2-CE2 3.78Å; V479-F651 HydrophobicContact CG2-CZ 3.87Å; R625-F651 PolarHBondContact NH1-O 3.07Å; R625-F651 VanDerWaalsContact NH1-O 3.15Å; A648-F651 VanDerWaalsContact O-CD2 3.27Å; A648-F651 WeakPolarHBondContact O-CD2 3.23Å; F651-Y653 PolarHBondContact O-N 3.42Å
652	G	81.7	Confident	88.9	Confident	30 Å²	30	30.6 Å²	30.6	31%	0.309	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	11.9	-176.2	0	0	0	0	0	115.1	M650 A654 T655 T656	M650-G652 PolarHBondContact O-N 3.13Å; G652-A654 VanDerWaalsContact C-N 3.34Å; G652-A654 PolarHBondContact O-N 3.34Å; G652-T655 PolarHBondContact O-N 3.27Å; G652-T656 PolarHBondContact O-N 3.45Å; G652-T656 PolarHBondContact O-OG1 3.37Å
653	Y	88.4	Confident	88.1	Confident	4 Å²	4	30.3 Å²	30.3	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-64.1	-37.9	-179.3	-177.8	-120.4	0	0	0	112.5	I608 H621 M650 F651 T655 T656 L657 F667	I608-Y653 HydrophobicContact CD1-CE1 4.2Å; I608-Y653 WeakPolarHBondContact CD1-OH 3.47Å; I608-Y653 HydrophobicContact CG1-CE1 4.24Å; H621-Y653 HydrophobicContact CB-CE2 4.17Å; M650-Y653 HydrophobicContact CE-CD1 3.43Å; M650-Y653 VanDerWaalsContact CE-CD1 3.43Å; M650-Y653 HydrophobicContact CE-CE1 4.09Å; M650-Y653 HydrophobicContact CE-CG 3.91Å; M650-Y653 WeakPolarHBondContact O-CB 3.47Å; M650-Y653 PolarHBondContact O-N 2.83Å; M650-Y653 HydrophobicContact SD-CD1 4.35Å; M650-Y653 HydrophobicContact SD-CG 4.36Å; F651-Y653 PolarHBondContact O-N 3.42Å; Y653-T655 VanDerWaalsContact C-N 3.3Å; Y653-T655 PolarHBondContact O-N 3.16Å; Y653-T656 PolarHBondContact O-N 3.15Å; Y653-T656 VanDerWaalsContact O-N 3.11Å; Y653-L657 HydrophobicContact CE1-CB 4.34Å; Y653-L657 HydrophobicContact CE1-CD2 4.15Å; Y653-L657 HydrophobicContact CE2-CB 4.41Å; Y653-L657 WeakPolarHBondContact O-CB 3.17Å; Y653-L657 PolarHBondContact O-N 3.12Å; Y653-F667 AromaticContact CD1-CD1 3.93Å; Y653-F667 HydrophobicContact CD1-CD1 3.93Å; Y653-F667 HydrophobicContact CD1-CD2 4.02Å; Y653-F667 HydrophobicContact CD1-CE1 4.01Å; Y653-F667 HydrophobicContact CD1-CE2 4.08Å; Y653-F667 AromaticContact CD1-CG 3.94Å; Y653-F667 HydrophobicContact CD1-CG 3.94Å; Y653-F667 HydrophobicContact CD1-CZ 4.08Å; Y653-F667 HydrophobicContact CE1-CB 4.28Å; Y653-F667 HydrophobicContact CE1-CD1 4.19Å; Y653-F667 HydrophobicContact CE1-CD2 4.31Å; Y653-F667 AromaticContact CE1-CG 3.98Å; Y653-F667 HydrophobicContact CE1-CG 3.98Å
654	A	83.1	Confident	87.4	Confident	5 Å²	5	33 Å²	33	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-51.8	-47.3	175.9	0	0	0	0	0	112.3	V406 G652 R658 F667	V406-A654 HydrophobicContact CG2-CB 4.28Å; G652-A654 VanDerWaalsContact C-N 3.34Å; G652-A654 PolarHBondContact O-N 3.34Å; A654-R658 WeakPolarHBondContact O-CB 3.4Å; A654-R658 WeakPolarHBondContact O-CG 3.3Å; A654-R658 PolarHBondContact O-N 2.87Å; A654-F667 HydrophobicContact CB-CE1 3.81Å; A654-F667 HydrophobicContact CB-CZ 4.47Å
655	T	83.2	Confident	86.9	Confident	48 Å²	48	33.1 Å²	33.1	29%	0.294	19%	0.19	S	C	.	.	H	α-helix	trans	-62.4	-48.2	178	-52	0	0	0	0	110.7	E454 G652 Y653 L657 R658 S659	E454-T655 PolarHBondContact OE2-OG1 2.97Å; G652-T655 PolarHBondContact O-N 3.27Å; Y653-T655 VanDerWaalsContact C-N 3.3Å; Y653-T655 PolarHBondContact O-N 3.16Å; T655-L657 PolarHBondContact O-N 3.5Å; T655-R658 PolarHBondContact O-N 3.07Å; T655-S659 PolarHBondContact O-N 3.31Å; T655-S659 PolarHBondContact O-OG 2.82Å; T655-S659 VanDerWaalsContact O-OG 3.1Å
656	T	88.8	Confident	86.3	Confident	46 Å²	46	37.1 Å²	37.1	28%	0.282	22%	0.215	S	C	.	.	H	α-helix	trans	-62.1	-45.3	-179.7	-52.8	0	0	0	0	111.8	R625 G652 Y653 S659 S660	R625-T656 PolarHBondContact NH2-OG1 3.05Å; G652-T656 PolarHBondContact O-N 3.45Å; G652-T656 PolarHBondContact O-OG1 3.37Å; Y653-T656 PolarHBondContact O-N 3.15Å; Y653-T656 VanDerWaalsContact O-N 3.11Å; T656-S659 PolarHBondContact O-N 3.45Å; T656-S660 PolarHBondContact O-N 3.08Å; T656-S660 VanDerWaalsContact O-N 3.1Å; T656-S660 PolarHBondContact O-OG 3Å
657	L	90	Very high	86	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-62.9	-46.6	179.5	178.3	64.4	0	0	0	111	I608 V610 V618 Y653 T655 S659 S660 T661 F667	I608-L657 HydrophobicContact CG2-CD1 3.98Å; I608-L657 HydrophobicContact CG2-CD2 4.15Å; V610-L657 HydrophobicContact CG1-CD1 4.04Å; V618-L657 HydrophobicContact CG2-CD1 3.93Å; Y653-L657 HydrophobicContact CE1-CB 4.34Å; Y653-L657 HydrophobicContact CE1-CD2 4.15Å; Y653-L657 HydrophobicContact CE2-CB 4.41Å; Y653-L657 WeakPolarHBondContact O-CB 3.17Å; Y653-L657 PolarHBondContact O-N 3.12Å; T655-L657 PolarHBondContact O-N 3.5Å; L657-S659 VanDerWaalsContact C-N 3.34Å; L657-S659 PolarHBondContact O-N 2.95Å; L657-S660 PolarHBondContact O-N 3.01Å; L657-S660 PolarHBondContact O-OG 3.23Å; L657-S660 VanDerWaalsContact O-OG 3.12Å; L657-T661 HydrophobicContact CD1-CG2 3.82Å; L657-T661 HydrophobicContact CG-CG2 4.46Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 VanDerWaalsContact O-CG2 3.27Å; L657-T661 WeakPolarHBondContact O-CG2 3.39Å; L657-T661 PolarHBondContact O-N 2.88Å; L657-T661 PolarHBondContact O-OG1 3.18Å; L657-F667 HydrophobicContact CD2-CB 4.05Å; L657-F667 HydrophobicContact CD2-CD1 3.84Å; L657-F667 HydrophobicContact CD2-CG 4.35Å
658	R	84.1	Confident	85.6	Confident	48 Å²	48	42.1 Å²	42.1	18%	0.181	24%	0.238	C	C	.	.	H	α-helix	trans	-63	-42.3	177.9	-75.4	180	-178.7	167.5	0.4	111.4	D87 M452 A654 T655 S660 T661 Q662 G663	D87-R658 IonicContact OD1-CZ 3.75Å; D87-R658 IonicContact OD1-NH1 2.74Å; D87-R658 PolarHBondContact OD1-NH1 3.18Å; M452-R658 PolarHBondContact O-NH1 3.07Å; M452-R658 PolarHBondContact O-NH2 3.42Å; A654-R658 WeakPolarHBondContact O-CB 3.4Å; A654-R658 WeakPolarHBondContact O-CG 3.3Å; A654-R658 PolarHBondContact O-N 2.87Å; T655-R658 PolarHBondContact O-N 3.07Å; R658-S660 PolarHBondContact O-N 3.3Å; R658-T661 PolarHBondContact O-N 3.06Å; R658-Q662 CarbonylContact O-C 3.57Å; R658-Q662 PolarHBondContact O-N 3.16Å; R658-G663 PolarHBondContact O-N 3.39Å
659	S	87.1	Confident	85.5	Confident	93 Å²	93	43.6 Å²	43.6	65%	0.65	24%	0.242	S	C	*	.	H	α-helix	trans	-60.7	-44.2	177.6	-64.6	0	0	0	0	112.7	T655 T656 L657	T655-S659 PolarHBondContact O-N 3.31Å; T655-S659 PolarHBondContact O-OG 2.82Å; T655-S659 VanDerWaalsContact O-OG 3.1Å; T656-S659 PolarHBondContact O-N 3.45Å; L657-S659 VanDerWaalsContact C-N 3.34Å; L657-S659 PolarHBondContact O-N 2.95Å
660	S	90	Very high	85.1	Confident	25 Å²	25	44.2 Å²	44.2	18%	0.175	25%	0.25	C	C	.	.	H	α-helix	trans	-74.1	-28.1	-180	59.6	0	0	0	0	113.7	Y614 H621 T656 L657 R658	Y614-S660 WeakPolarHBondContact CD1-O 3.26Å; H621-S660 VanDerWaalsContact CE1-CB 3.46Å; H621-S660 WeakPolarHBondContact CE1-CB 3.49Å; H621-S660 PolarHBondContact CE1-OG 2.98Å; H621-S660 VanDerWaalsContact CE1-OG 3.23Å; T656-S660 PolarHBondContact O-N 3.08Å; T656-S660 VanDerWaalsContact O-N 3.1Å; T656-S660 PolarHBondContact O-OG 3Å; L657-S660 PolarHBondContact O-N 3.01Å; L657-S660 PolarHBondContact O-OG 3.23Å; L657-S660 VanDerWaalsContact O-OG 3.12Å; R658-S660 PolarHBondContact O-N 3.3Å
661	T	88.2	Confident	84.9	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	10.4	-176.3	61.6	0	0	0	0	113.5	V610 Y614 V618 L657 R658 G663 R664 G665	V610-T661 HydrophobicContact CB-CG2 4.39Å; V610-T661 HydrophobicContact CG1-CG2 3.6Å; Y614-T661 HydrophobicContact CG-CG2 4.26Å; V618-T661 HydrophobicContact CG2-CG2 4.37Å; L657-T661 HydrophobicContact CD1-CG2 3.82Å; L657-T661 HydrophobicContact CG-CG2 4.46Å; L657-T661 WeakPolarHBondContact O-CB 3.42Å; L657-T661 VanDerWaalsContact O-CG2 3.27Å; L657-T661 WeakPolarHBondContact O-CG2 3.39Å; L657-T661 PolarHBondContact O-N 2.88Å; L657-T661 PolarHBondContact O-OG1 3.18Å; R658-T661 PolarHBondContact O-N 3.06Å; T661-G663 PolarHBondContact O-N 2.94Å; T661-R664 WeakPolarHBondContact O-CB 3.34Å; T661-R664 PolarHBondContact O-N 3.41Å; T661-G665 WeakPolarHBondContact OG1-CA 3.08Å; T661-G665 PolarHBondContact OG1-N 3.08Å
662	Q	83.5	Confident	85.1	Confident	114 Å²	114	49.2 Å²	49.2	53%	0.533	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	35.6	-173.3	-57.1	-179.6	-12.1	0	0	113	P114 Y614 R658 R664	P114-Q662 WeakPolarHBondContact CB-O 3.28Å; P114-Q662 HydrophobicContact CG-CB 4.27Å; P114-Q662 WeakPolarHBondContact CG-O 3.44Å; Y614-Q662 HydrophobicContact CE1-CG 4.32Å; Y614-Q662 VanDerWaalsContact OH-CD 3.26Å; Y614-Q662 PolarHBondContact OH-OE1 2.89Å; R658-Q662 CarbonylContact O-C 3.57Å; R658-Q662 PolarHBondContact O-N 3.16Å; Q662-R664 VanDerWaalsContact C-N 3.31Å; Q662-R664 PolarHBondContact O-N 2.86Å
663	G	78.9	Confident	85.4	Confident	24 Å²	24	49.4 Å²	49.4	25%	0.247	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-2.9	-179.5	0	0	0	0	0	115.2	R658 T661	R658-G663 PolarHBondContact O-N 3.39Å; T661-G663 PolarHBondContact O-N 2.94Å
664	R	82.3	Confident	85.5	Confident	58 Å²	58	51.2 Å²	51.2	22%	0.219	27%	0.274	C	S	.	.			trans	-82.1	-15.6	-177.3	-61.5	-173.8	177.1	106	-2.1	114.2	P114 E117 P611 Y614 T661 Q662	P114-R664 HydrophobicContact CB-CG 4.32Å; E117-R664 IonicContact OE1-CZ 3.54Å; E117-R664 IonicContact OE1-NE 2.72Å; E117-R664 PolarHBondContact OE1-NE 2.95Å; E117-R664 IonicContact OE1-NH2 3.84Å; E117-R664 PolarHBondContact OE1-NH2 3.22Å; E117-R664 IonicContact OE2-CZ 2.99Å; E117-R664 IonicContact OE2-NE 3.21Å; E117-R664 PolarHBondContact OE2-NE 2.91Å; E117-R664 IonicContact OE2-NH2 3.92Å; P611-R664 HydrophobicContact CG-CB 3.76Å; P611-R664 HydrophobicContact CG-CG 4.47Å; Y614-R664 PolarHBondContact OH-NH1 3.11Å; T661-R664 WeakPolarHBondContact O-CB 3.34Å; T661-R664 PolarHBondContact O-N 3.41Å; Q662-R664 VanDerWaalsContact C-N 3.31Å; Q662-R664 PolarHBondContact O-N 2.86Å
665	G	84.3	Confident	85.9	Confident	3 Å²	3	54.4 Å²	54.4	3%	0.031	29%	0.289	C	S	.	.			trans	-83	136.4	-179.5	0	0	0	0	0	113.3	T609 T661	T609-G665 WeakPolarHBondContact O-CA 3.29Å; T661-G665 WeakPolarHBondContact OG1-CA 3.08Å; T661-G665 PolarHBondContact OG1-N 3.08Å
666	T	84	Confident	86.3	Confident	86 Å²	86	55.1 Å²	55.1	53%	0.528	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	156.9	172	57.5	0	0	0	0	109.8	I608 T609	I608-T666 CarbonylContact C-O 3.58Å; I608-T666 WeakPolarHBondContact CA-O 3.43Å; T609-T666 PolarHBondContact N-O 2.78Å; T609-T666 PolarHBondContact O-N 2.92Å
667	F	88.2	Confident	86.5	Confident	26 Å²	26	53.3 Å²	53.3	11%	0.114	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	156.3	172.5	78.7	-75.3	0	0	0	111	V406 V606 T607 I608 M650 Y653 A654 L657 M669	V406-F667 HydrophobicContact CB-CE1 4.43Å; V406-F667 WeakPolarHBondContact O-CZ 3.23Å; V606-F667 HydrophobicContact CG1-CB 4.38Å; V606-F667 HydrophobicContact CG1-CD2 3.95Å; T607-F667 CarbonylContact O-C 3.6Å; T607-F667 WeakPolarHBondContact O-CA 3.38Å; T607-F667 WeakPolarHBondContact O-CB 3.42Å; I608-F667 HydrophobicContact CB-CB 4.43Å; I608-F667 HydrophobicContact CG1-CB 3.98Å; M650-F667 HydrophobicContact CE-CD2 3.99Å; M650-F667 HydrophobicContact CE-CE2 3.73Å; Y653-F667 AromaticContact CD1-CD1 3.93Å; Y653-F667 HydrophobicContact CD1-CD1 3.93Å; Y653-F667 HydrophobicContact CD1-CD2 4.02Å; Y653-F667 HydrophobicContact CD1-CE1 4.01Å; Y653-F667 HydrophobicContact CD1-CE2 4.08Å; Y653-F667 AromaticContact CD1-CG 3.94Å; Y653-F667 HydrophobicContact CD1-CG 3.94Å; Y653-F667 HydrophobicContact CD1-CZ 4.08Å; Y653-F667 HydrophobicContact CE1-CB 4.28Å; Y653-F667 HydrophobicContact CE1-CD1 4.19Å; Y653-F667 HydrophobicContact CE1-CD2 4.31Å; Y653-F667 AromaticContact CE1-CG 3.98Å; Y653-F667 HydrophobicContact CE1-CG 3.98Å; A654-F667 HydrophobicContact CB-CE1 3.81Å; A654-F667 HydrophobicContact CB-CZ 4.47Å; L657-F667 HydrophobicContact CD2-CB 4.05Å; L657-F667 HydrophobicContact CD2-CD1 3.84Å; L657-F667 HydrophobicContact CD2-CG 4.35Å; F667-M669 HydrophobicContact CE2-CG 4.3Å; F667-M669 HydrophobicContact CE2-SD 4.22Å
668	M	80.4	Confident	86.6	Confident	115 Å²	115	55.5 Å²	55.5	57%	0.567	29%	0.294	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125	149.2	168.3	-169	-179.1	-164.4	0	0	108.1	V606 T607	V606-M668 CarbonylContact C-O 3.22Å; V606-M668 WeakPolarHBondContact CA-O 3.27Å; T607-M668 PolarHBondContact N-O 2.97Å; T607-M668 PolarHBondContact O-N 2.88Å
669	M	86.6	Confident	86.7	Confident	55 Å²	55	61.5 Å²	61.5	27%	0.271	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	143.1	172.5	67.9	179.1	-176.9	0	0	111.7	M604 K605 V606 L647 M650 F667	M604-M669 HydrophobicContact CB-CB 4.28Å; M604-M669 HydrophobicContact CE-CB 4.17Å; M604-M669 HydrophobicContact CE-CE 4.45Å; M604-M669 HydrophobicContact CE-CG 3.84Å; M604-M669 HydrophobicContact CE-SD 4.02Å; M604-M669 HydrophobicContact CG-SD 4.35Å; K605-M669 CarbonylContact O-C 3.47Å; K605-M669 VanDerWaalsContact O-CA 3.26Å; K605-M669 WeakPolarHBondContact O-CA 3.42Å; V606-M669 HydrophobicContact CG2-CB 4.14Å; L647-M669 HydrophobicContact CD1-CE 4.04Å; L647-M669 HydrophobicContact CD1-SD 4.32Å; M650-M669 HydrophobicContact CB-SD 4.15Å; M650-M669 HydrophobicContact CE-SD 4.2Å; M650-M669 HydrophobicContact CG-SD 4.35Å; F667-M669 HydrophobicContact CE2-CG 4.3Å; F667-M669 HydrophobicContact CE2-SD 4.22Å
670	V	82.5	Confident	86.8	Confident	75 Å²	75	61.1 Å²	61.1	46%	0.455	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.3	174	-64.5	0	0	0	0	109.5	M604 K605 D672	M604-V670 CarbonylContact C-O 3.56Å; M604-V670 WeakPolarHBondContact CA-O 3.47Å; M604-V670 VanDerWaalsContact CE-C 3.5Å; K605-V670 HydrophobicContact CB-CG2 4Å; K605-V670 PolarHBondContact N-O 3.05Å; K605-V670 PolarHBondContact O-N 2.85Å; V670-D672 PolarHBondContact O-N 3.38Å
671	F	84.3	Confident	86.7	Confident	107 Å²	107	61.2 Å²	61.2	47%	0.469	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	135	173.8	173.4	-94.3	0	0	0	110	P602 M604 H673 Y674	P602-F671 HydrophobicContact CB-CD2 4.04Å; P602-F671 HydrophobicContact CB-CE2 3.85Å; M604-F671 HydrophobicContact SD-CB 4.4Å; F671-H673 WeakPolarHBondContact CE2-O 3.33Å; F671-Y674 AromaticContact CE2-CD2 3.95Å; F671-Y674 HydrophobicContact CE2-CD2 3.95Å; F671-Y674 AromaticContact CE2-CE2 3.7Å; F671-Y674 HydrophobicContact CE2-CE2 3.7Å; F671-Y674 AromaticContact CZ-CD2 3.61Å; F671-Y674 HydrophobicContact CZ-CD2 3.61Å; F671-Y674 AromaticContact CZ-CE2 3.56Å; F671-Y674 HydrophobicContact CZ-CE2 3.56Å; F671-Y674 HydrophobicContact CZ-CG 4.47Å
672	D	87.6	Confident	86.7	Confident	70 Å²	70	63 Å²	63	37%	0.374	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	-62.7	179.3	-163.4	-96.8	0	0	0	111.2	M603 K605 V670	M603-D672 PolarHBondContact O-N 3.47Å; K605-D672 HydrophobicContact CB-CB 4.04Å; V670-D672 PolarHBondContact O-N 3.38Å
673	H	89.2	Confident	86.9	Confident	34 Å²	34	63.6 Å²	63.6	16%	0.157	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	-174.1	-178.6	64	-79.8	0	0	0	112.4	E517 M603 R628 F671 E675	E517-H673 WeakPolarHBondContact OE1-CB 3.26Å; E517-H673 IonicContact OE1-CD2 2.85Å; E517-H673 PolarHBondContact OE1-CD2 3.4Å; E517-H673 IonicContact OE1-CG 2.78Å; M603-H673 PolarHBondContact N-O 3.18Å; R628-H673 PolarHBondContact NH2-CE1 3.36Å; R628-H673 VanDerWaalsContact NH2-CE1 3.34Å; F671-H673 WeakPolarHBondContact CE2-O 3.33Å; H673-E675 IonicContact NE2-OE2 3.33Å
674	Y	90.1	Very high	87.3	Confident	42 Å²	42	69.1 Å²	69.1	17%	0.165	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.2	176.6	-85	-79	0	0	0	110.6	S480 R482 L600 E601 P602 F671	S480-Y674 VanDerWaalsContact O-CE1 3.27Å; S480-Y674 WeakPolarHBondContact O-CE1 3.23Å; S480-Y674 PolarHBondContact O-OH 3.38Å; R482-Y674 HydrophobicContact CB-CD1 4.39Å; R482-Y674 HydrophobicContact CB-CE1 4.39Å; R482-Y674 HydrophobicContact CG-CD1 3.87Å; R482-Y674 HydrophobicContact CG-CD2 4.35Å; R482-Y674 HydrophobicContact CG-CE1 3.5Å; R482-Y674 HydrophobicContact CG-CE2 4.04Å; R482-Y674 HydrophobicContact CG-CG 4.29Å; R482-Y674 PolarHBondContact NE-OH 2.92Å; L600-Y674 HydrophobicContact CB-CD1 4.04Å; L600-Y674 HydrophobicContact CB-CG 4.42Å; E601-Y674 WeakPolarHBondContact O-CA 3.41Å; P602-Y674 HydrophobicContact CB-CD1 4.28Å; P602-Y674 HydrophobicContact CB-CE1 3.83Å; P602-Y674 HydrophobicContact CG-CE1 4.28Å; F671-Y674 AromaticContact CE2-CD2 3.95Å; F671-Y674 HydrophobicContact CE2-CD2 3.95Å; F671-Y674 AromaticContact CE2-CE2 3.7Å; F671-Y674 HydrophobicContact CE2-CE2 3.7Å; F671-Y674 AromaticContact CZ-CD2 3.61Å; F671-Y674 HydrophobicContact CZ-CD2 3.61Å; F671-Y674 AromaticContact CZ-CE2 3.56Å; F671-Y674 HydrophobicContact CZ-CE2 3.56Å; F671-Y674 HydrophobicContact CZ-CG 4.47Å
675	E	91.3	Very high	87.4	Confident	72 Å²	72	67 Å²	67	34%	0.336	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	155.9	-179.6	-166.7	171	168.2	0	0	111.3	L600 E601 M603 R628 H673 V677	L600-E675 CarbonylContact C-O 3.49Å; L600-E675 WeakPolarHBondContact CA-O 3.28Å; E601-E675 PolarHBondContact N-O 2.77Å; E601-E675 PolarHBondContact O-N 2.82Å; M603-E675 HydrophobicContact CG-CB 3.55Å; M603-E675 HydrophobicContact SD-CB 4.1Å; R628-E675 IonicContact CZ-OE2 2.76Å; R628-E675 IonicContact NH1-OE1 3.21Å; R628-E675 IonicContact NH1-OE2 3.09Å; R628-E675 PolarHBondContact NH1-OE2 3.38Å; H673-E675 IonicContact NE2-OE2 3.33Å; E675-V677 PolarHBondContact O-N 2.8Å
676	D	91.5	Very high	87.4	Confident	62 Å²	62	67.2 Å²	67.2	33%	0.332	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	130.9	174.6	-79.8	-36	0	0	0	111.2	R486 S598 L600	R486-D676 IonicContact CZ-OD1 3.67Å; R486-D676 IonicContact CZ-OD2 3.59Å; R486-D676 VanDerWaalsContact CZ-OD2 3.27Å; R486-D676 IonicContact NE-OD1 3.28Å; R486-D676 PolarHBondContact NE-OD1 2.97Å; R486-D676 VanDerWaalsContact NE-OD1 3.09Å; R486-D676 IonicContact NE-OD2 3.18Å; R486-D676 PolarHBondContact NE-OD2 2.81Å; R486-D676 IonicContact NH2-OD1 2.74Å; R486-D676 PolarHBondContact NH2-OD1 3.49Å; R486-D676 IonicContact NH2-OD2 3.38Å; R486-D676 PolarHBondContact NH2-OD2 2.9Å; S598-D676 VanDerWaalsContact CB-OD1 3.26Å; S598-D676 WeakPolarHBondContact CB-OD1 3.26Å; S598-D676 PolarHBondContact OG-OD1 2.96Å; L600-D676 VanDerWaalsContact CD2-OD1 3.26Å; L600-D676 WeakPolarHBondContact CD2-OD1 3.41Å
677	V	92.5	Very high	87.4	Confident	8 Å²	8	71.3 Å²	71.3	5%	0.048	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.8	147.6	169.4	-59.4	0	0	0	0	110.2	Y481 I599 E601 E675 K679 V681 Q682 I685	Y481-V677 HydrophobicContact CD1-CG1 4.28Å; Y481-V677 HydrophobicContact CE1-CG1 4.13Å; I599-V677 HydrophobicContact CB-CG2 3.88Å; I599-V677 HydrophobicContact CG2-CG1 4.11Å; I599-V677 HydrophobicContact CG2-CG2 4.28Å; I599-V677 WeakPolarHBondContact O-CG2 3.29Å; I599-V677 PolarHBondContact O-N 2.77Å; E601-V677 HydrophobicContact CB-CG1 3.61Å; E601-V677 HydrophobicContact CG-CG1 3.74Å; E675-V677 PolarHBondContact O-N 2.8Å; V677-K679 PolarHBondContact O-N 2.85Å; V677-V681 HydrophobicContact CB-CB 4.26Å; V677-V681 HydrophobicContact CB-CG1 4.25Å; V677-V681 HydrophobicContact CG1-CG1 4.48Å; V677-Q682 HydrophobicContact CG2-CB 3.56Å; V677-Q682 HydrophobicContact CG2-CG 4.05Å; V677-I685 HydrophobicContact CG1-CD1 4.29Å
678	P	91.9	Very high	86.9	Confident	49 Å²	49	79 Å²	79	32%	0.318	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-55.5	143.6	167.1	-23.6	32.8	0	0	0	110.9	E601 R626 S680 V681 Q682	E601-P678 WeakPolarHBondContact OE1-CD 3.2Å; R626-P678 VanDerWaalsContact NH1-CD 3.35Å; P678-S680 PolarHBondContact O-N 3.49Å; P678-S680 VanDerWaalsContact O-N 3.07Å; P678-V681 HydrophobicContact CB-CG2 4.17Å; P678-V681 HydrophobicContact CG-CG2 4.22Å; P678-V681 WeakPolarHBondContact O-CA 3.28Å; P678-V681 WeakPolarHBondContact O-CB 3.44Å; P678-V681 PolarHBondContact O-N 3Å; P678-Q682 PolarHBondContact O-N 2.87Å
679	K	86.9	Confident	86.6	Confident	174 Å²	174	77.2 Å²	77.2	76%	0.757	38%	0.378	S	S	*	.	H	α-helix	trans	-51.9	-38.6	-176.9	-71.9	-172.1	175	-175.2	0	114	V677 V681 Q682 E683	V677-K679 PolarHBondContact O-N 2.85Å; K679-V681 VanDerWaalsContact C-N 3.32Å; K679-V681 PolarHBondContact O-N 2.88Å; K679-Q682 WeakPolarHBondContact O-CB 3.42Å; K679-Q682 PolarHBondContact O-N 2.74Å; K679-E683 WeakPolarHBondContact O-CG 3.49Å; K679-E683 PolarHBondContact O-N 3.28Å; K679-E683 VanDerWaalsContact O-N 3.1Å
680	S	89.1	Confident	85.4	Confident	84 Å²	84	77.9 Å²	77.9	59%	0.587	40%	0.399	S	S	*	.	H	α-helix	trans	-62.5	-39.6	177.1	52	0	0	0	0	112.6	P678 E684	P678-S680 PolarHBondContact O-N 3.49Å; P678-S680 VanDerWaalsContact O-N 3.07Å; S680-E684 PolarHBondContact O-N 3.21Å
681	V	87.7	Confident	84	Confident	27 Å²	27	75.7 Å²	75.7	16%	0.164	39%	0.391	C	S	.	.	H	α-helix	trans	-71.6	-38.9	177.6	-178.9	0	0	0	0	110	V677 P678 K679 E683 E684 I685	V677-V681 HydrophobicContact CB-CB 4.26Å; V677-V681 HydrophobicContact CB-CG1 4.25Å; V677-V681 HydrophobicContact CG1-CG1 4.48Å; P678-V681 HydrophobicContact CB-CG2 4.17Å; P678-V681 HydrophobicContact CG-CG2 4.22Å; P678-V681 WeakPolarHBondContact O-CA 3.28Å; P678-V681 WeakPolarHBondContact O-CB 3.44Å; P678-V681 PolarHBondContact O-N 3Å; K679-V681 VanDerWaalsContact C-N 3.32Å; K679-V681 PolarHBondContact O-N 2.88Å; V681-E683 PolarHBondContact O-N 3.46Å; V681-E684 PolarHBondContact O-N 3.05Å; V681-I685 HydrophobicContact CG1-CD1 3.8Å; V681-I685 HydrophobicContact CG1-CG1 4.31Å; V681-I685 VanDerWaalsContact O-CG1 3.3Å; V681-I685 WeakPolarHBondContact O-CG1 3.34Å; V681-I685 PolarHBondContact O-N 2.93Å
682	Q	88.4	Confident	82.1	Confident	37 Å²	37	78.7 Å²	78.7	17%	0.173	40%	0.404	C	S	.	.	H	α-helix	trans	-56.5	-49	174.9	-163.1	171.7	-66.2	0	0	111.9	I599 V677 P678 K679 E684 I685 I686	I599-Q682 HydrophobicContact CB-CG 4.14Å; I599-Q682 HydrophobicContact CD1-CG 3.85Å; I599-Q682 HydrophobicContact CG1-CG 3.89Å; V677-Q682 HydrophobicContact CG2-CB 3.56Å; V677-Q682 HydrophobicContact CG2-CG 4.05Å; P678-Q682 PolarHBondContact O-N 2.87Å; K679-Q682 WeakPolarHBondContact O-CB 3.42Å; K679-Q682 PolarHBondContact O-N 2.74Å; Q682-E684 VanDerWaalsContact C-N 3.28Å; Q682-E684 PolarHBondContact O-N 3.41Å; Q682-I685 PolarHBondContact O-N 2.79Å; Q682-I686 HydrophobicContact CG-CD1 3.92Å; Q682-I686 VanDerWaalsContact O-CG1 3.26Å; Q682-I686 WeakPolarHBondContact O-CG1 3.07Å; Q682-I686 PolarHBondContact O-N 2.78Å
683	E	87.5	Confident	80	Confident	128 Å²	128	79 Å²	79	60%	0.598	42%	0.416	S	S	*	.	H	α-helix	trans	-61.3	-38.3	179.8	-72.4	175.1	-170.9	0	0	111.8	K679 V681 K687	K679-E683 WeakPolarHBondContact O-CG 3.49Å; K679-E683 PolarHBondContact O-N 3.28Å; K679-E683 VanDerWaalsContact O-N 3.1Å; V681-E683 PolarHBondContact O-N 3.46Å; E683-K687 WeakPolarHBondContact O-CB 3.44Å; E683-K687 PolarHBondContact O-N 3.11Å; E683-K687 VanDerWaalsContact O-N 3.09Å
684	E	87.8	Confident	77.5	Confident	140 Å²	140	88.2 Å²	88.2	65%	0.654	46%	0.459	S	S	*	.	H	α-helix	trans	-67.4	-44.7	177.6	-168.9	173.7	-179.5	0	0	112.2	S680 V681 Q682 K687 K688	S680-E684 PolarHBondContact O-N 3.21Å; V681-E684 PolarHBondContact O-N 3.05Å; Q682-E684 VanDerWaalsContact C-N 3.28Å; Q682-E684 PolarHBondContact O-N 3.41Å; E684-K687 PolarHBondContact O-N 3.05Å; E684-K688 PolarHBondContact O-N 3.46Å
685	I	84.5	Confident	76.8	Confident	13 Å²	13	90.5 Å²	90.5	7%	0.067	47%	0.474	C	S	.	.	H	α-helix	trans	-61.4	-47.9	177	-67	166.6	0	0	0	110.7	Y481 A554 Y556 I599 V677 V681 Q682 K687 K688 N689	Y481-I685 HydrophobicContact CD1-CD1 3.92Å; Y481-I685 HydrophobicContact CD2-CD1 4.43Å; Y481-I685 HydrophobicContact CE1-CD1 3.44Å; Y481-I685 VanDerWaalsContact CE1-CD1 3.44Å; Y481-I685 HydrophobicContact CE2-CD1 3.98Å; Y481-I685 HydrophobicContact CE2-CG1 4.39Å; Y481-I685 HydrophobicContact CG-CD1 4.4Å; Y481-I685 VanDerWaalsContact CZ-CD1 3.48Å; A554-I685 HydrophobicContact CB-CG2 4.08Å; Y556-I685 HydrophobicContact CE2-CG2 3.68Å; I599-I685 HydrophobicContact CD1-CB 4.14Å; I599-I685 HydrophobicContact CD1-CG2 3.75Å; I599-I685 HydrophobicContact CG2-CD1 4.25Å; V677-I685 HydrophobicContact CG1-CD1 4.29Å; V681-I685 HydrophobicContact CG1-CD1 3.8Å; V681-I685 HydrophobicContact CG1-CG1 4.31Å; V681-I685 VanDerWaalsContact O-CG1 3.3Å; V681-I685 WeakPolarHBondContact O-CG1 3.34Å; V681-I685 PolarHBondContact O-N 2.93Å; Q682-I685 PolarHBondContact O-N 2.79Å; I685-K687 VanDerWaalsContact C-N 3.27Å; I685-K687 PolarHBondContact O-N 2.85Å; I685-K688 PolarHBondContact O-N 2.82Å; I685-K688 VanDerWaalsContact O-N 3.16Å; I685-N689 PolarHBondContact O-N 3.37Å; I685-N689 VanDerWaalsContact O-N 3.13Å
686	I	83.8	Confident	76.1	Confident	8 Å²	8	91.5 Å²	91.5	4%	0.041	48%	0.481	C	S	.	.	H	α-helix	trans	-57.5	-44.2	178.3	-69.2	168.1	0	0	0	110.4	L553 I599 Q682 K688 N689 G690 G691 A693	L553-I686 HydrophobicContact CB-CD1 4.42Å; L553-I686 HydrophobicContact CB-CG1 4.34Å; L553-I686 HydrophobicContact CD2-CD1 4.14Å; I599-I686 HydrophobicContact CD1-CG1 3.99Å; Q682-I686 HydrophobicContact CG-CD1 3.92Å; Q682-I686 VanDerWaalsContact O-CG1 3.26Å; Q682-I686 WeakPolarHBondContact O-CG1 3.07Å; Q682-I686 PolarHBondContact O-N 2.78Å; I686-K688 PolarHBondContact O-N 2.92Å; I686-N689 PolarHBondContact O-N 3.2Å; I686-G690 PolarHBondContact O-N 3.06Å; I686-G691 PolarHBondContact O-N 3.19Å; I686-A693 HydrophobicContact CG2-CB 4.25Å
687	K	83.2	Confident	75.2	Confident	171 Å²	171	93.1 Å²	93.1	74%	0.743	49%	0.49	S	S	*	.	H	α-helix	trans	-64.7	-39.8	179.3	-174	178.6	178.7	-174.9	0	112.3	E683 E684 I685 G690	E683-K687 WeakPolarHBondContact O-CB 3.44Å; E683-K687 PolarHBondContact O-N 3.11Å; E683-K687 VanDerWaalsContact O-N 3.09Å; E684-K687 PolarHBondContact O-N 3.05Å; I685-K687 VanDerWaalsContact C-N 3.27Å; I685-K687 PolarHBondContact O-N 2.85Å; K687-G690 PolarHBondContact O-N 2.83Å
688	K	78.6	Confident	74.2	Confident	188 Å²	188	98.1 Å²	98.1	82%	0.817	52%	0.516	S	S	*	.	H	α-helix	trans	-65.6	-37.1	-180	-164.9	177.7	178.5	-175.7	0	112.2	E684 I685 I686 G690	E684-K688 PolarHBondContact O-N 3.46Å; I685-K688 PolarHBondContact O-N 2.82Å; I685-K688 VanDerWaalsContact O-N 3.16Å; I686-K688 PolarHBondContact O-N 2.92Å; K688-G690 VanDerWaalsContact C-N 3.3Å; K688-G690 PolarHBondContact O-N 3.47Å
689	N	73.1	Confident	73.1	Confident	78 Å²	78	101.2 Å²	101.2	42%	0.417	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	11	178.4	-72	-10.2	0	0	0	114.3	A554 Y556 I685 I686 G691	A554-N689 HydrophobicContact CB-CB 4.33Å; A554-N689 PolarHBondContact O-ND2 3.37Å; A554-N689 VanDerWaalsContact O-ND2 3.13Å; Y556-N689 PolarHBondContact OH-ND2 2.83Å; I685-N689 PolarHBondContact O-N 3.37Å; I685-N689 VanDerWaalsContact O-N 3.13Å; I686-N689 PolarHBondContact O-N 3.2Å; N689-G691 VanDerWaalsContact C-N 3.28Å; N689-G691 PolarHBondContact O-N 3.24Å
690	G	61	Low	72.2	Confident	69 Å²	69	96.3 Å²	96.3	71%	0.711	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	12.2	175	0	0	0	0	0	114.9	I686 K687 K688	I686-G690 PolarHBondContact O-N 3.06Å; K687-G690 PolarHBondContact O-N 2.83Å; K688-G690 VanDerWaalsContact C-N 3.3Å; K688-G690 PolarHBondContact O-N 3.47Å
691	G	54.2	Low	71	Confident	28 Å²	28	97.2 Å²	97.2	29%	0.289	51%	0.507	S	S	.	.			trans	-73.9	144.6	171.3	0	0	0	0	0	111.5	I686 N689	I686-G691 PolarHBondContact O-N 3.19Å; N689-G691 VanDerWaalsContact C-N 3.28Å; N689-G691 PolarHBondContact O-N 3.24Å
692	K	44	Very low	69.7	Low	171 Å²	171	102.6 Å²	102.6	74%	0.743	53%	0.534	S	S	*	.			trans	-87.8	120.9	162.7	-74.3	-174.6	175.7	-173.6	0	107.6	E694	K692-E694 VanDerWaalsContact C-N 3.27Å; K692-E694 HydrophobicContact CB-CG 4.4Å; K692-E694 IonicContact NZ-OE1 3.98Å; K692-E694 PolarHBondContact O-N 3.39Å
693	A	43.9	Very low	68.1	Low	75 Å²	75	108.1 Å²	108.1	62%	0.62	56%	0.564	S	S	*	*			trans	-69.1	89.9	163.7	0	0	0	0	0	107.8	I686	I686-A693 HydrophobicContact CG2-CB 4.25Å
694	E	36	Very low	66.4	Low	228 Å²	228	106.3 Å²	106.3	100%	1.065	56%	0.561	S	S	*	*			trans	-115.5	0	171.5	-86	-176.1	-164.4	0	0	111	K692	K692-E694 VanDerWaalsContact C-N 3.27Å; K692-E694 HydrophobicContact CB-CG 4.4Å; K692-E694 IonicContact NZ-OE1 3.98Å; K692-E694 PolarHBondContact O-N 3.39Å

Retrieved 694 of 694 residues in 1984.1 ms (Link to these results)

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