A0A087X2R0_POEFO Loading...

Guanylate kinase-like domain-containing protein

AlphaFold DB , UniProt , Accession A0A087X2R0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 718 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	61.1	Low	82.8	Confident	179 Å²	179	113.5 Å²	113.5	88%	0.882	55%	0.55	S	S	*	*				0	-44.5	0	-71.5	-53.3	-72.8	0	0	111	I3 L4 Q5	M1-I3 PolarHBondContact O-N 2.74Å; M1-L4 PolarHBondContact O-N 2.87Å; M1-Q5 PolarHBondContact O-N 3.32Å
2	D	71.2	Confident	83.5	Confident	125 Å²	125	106.8 Å²	106.8	67%	0.668	53%	0.527	S	S	*	.	H	α-helix	trans	-51.2	-46.7	-177.3	-62.3	-87.5	0	0	0	115.7	L4 Q5 Q6	D2-L4 PolarHBondContact O-N 3.21Å; D2-Q5 CarbonylContact O-C 3.48Å; D2-Q5 WeakPolarHBondContact O-CA 3.28Å; D2-Q5 WeakPolarHBondContact O-CB 3.11Å; D2-Q5 PolarHBondContact O-N 2.97Å; D2-Q6 PolarHBondContact O-N 3.34Å
3	I	79.3	Confident	84.1	Confident	127 Å²	127	106.2 Å²	106.2	65%	0.651	52%	0.522	S	S	*	.	H	α-helix	trans	-54.3	-52.7	-176	-58.8	172.9	0	0	0	110.9	M1 Q5 Q6 D7	M1-I3 PolarHBondContact O-N 2.74Å; I3-Q5 PolarHBondContact O-N 3.49Å; I3-Q5 VanDerWaalsContact O-N 3.1Å; I3-Q6 CarbonylContact O-C 3.56Å; I3-Q6 WeakPolarHBondContact O-CA 3.49Å; I3-Q6 WeakPolarHBondContact O-CB 3.15Å; I3-Q6 PolarHBondContact O-N 3.41Å; I3-D7 PolarHBondContact O-N 3.35Å
4	L	84.3	Confident	84.8	Confident	128 Å²	128	106.6 Å²	106.6	67%	0.67	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-17.5	177	-62.9	175.2	0	0	0	114.2	M1 D2 R8	M1-L4 PolarHBondContact O-N 2.87Å; D2-L4 PolarHBondContact O-N 3.21Å; L4-R8 VanDerWaalsContact O-CB 3.31Å; L4-R8 WeakPolarHBondContact O-CB 3.46Å
5	Q	83	Confident	85.4	Confident	97 Å²	97	109.9 Å²	109.9	45%	0.453	53%	0.526	S	S	.	.	H	α-helix	trans	-86.2	-28.9	170.7	-65.6	-172.5	-9	0	0	112.1	M1 D2 I3 R9	M1-Q5 PolarHBondContact O-N 3.32Å; D2-Q5 CarbonylContact O-C 3.48Å; D2-Q5 WeakPolarHBondContact O-CA 3.28Å; D2-Q5 WeakPolarHBondContact O-CB 3.11Å; D2-Q5 PolarHBondContact O-N 2.97Å; I3-Q5 PolarHBondContact O-N 3.49Å; I3-Q5 VanDerWaalsContact O-N 3.1Å; Q5-R9 WeakPolarHBondContact O-CG 3.32Å; Q5-R9 PolarHBondContact O-N 3.44Å
6	Q	86.7	Confident	85.9	Confident	67 Å²	67	110.2 Å²	110.2	31%	0.313	53%	0.527	S	S	.	.	H	α-helix	trans	-71.4	-53.5	171.9	-176.4	60.8	16.8	0	0	111	D2 I3 R8 R9 E10	D2-Q6 PolarHBondContact O-N 3.34Å; I3-Q6 CarbonylContact O-C 3.56Å; I3-Q6 WeakPolarHBondContact O-CA 3.49Å; I3-Q6 WeakPolarHBondContact O-CB 3.15Å; I3-Q6 PolarHBondContact O-N 3.41Å; Q6-R8 PolarHBondContact O-N 3.2Å; Q6-R8 VanDerWaalsContact O-N 3.11Å; Q6-R9 WeakPolarHBondContact O-CA 3.4Å; Q6-R9 WeakPolarHBondContact O-CB 3.46Å; Q6-R9 PolarHBondContact O-N 3.28Å; Q6-E10 HydrophobicContact CG-CG 4.48Å; Q6-E10 VanDerWaalsContact CG-OE1 3.31Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.47Å; Q6-E10 PolarHBondContact NE2-OE1 3.35Å; Q6-E10 PolarHBondContact O-N 3.48Å
7	D	89.3	Confident	86.4	Confident	76 Å²	76	110.6 Å²	110.6	41%	0.406	53%	0.528	S	S	.	.	H	α-helix	trans	-52.3	-39.1	177	-50	-24.5	0	0	0	111.2	I3 A11	I3-D7 PolarHBondContact O-N 3.35Å; D7-A11 WeakPolarHBondContact O-CB 3.12Å; D7-A11 PolarHBondContact O-N 3.39Å
8	R	87.3	Confident	86.9	Confident	176 Å²	176	110.4 Å²	110.4	66%	0.664	53%	0.53	S	S	*	.	H	α-helix	trans	-73.1	-25.4	178.1	-168.7	-171.9	67.8	151.2	2.5	113.6	L4 Q6 A12	L4-R8 VanDerWaalsContact O-CB 3.31Å; L4-R8 WeakPolarHBondContact O-CB 3.46Å; Q6-R8 PolarHBondContact O-N 3.2Å; Q6-R8 VanDerWaalsContact O-N 3.11Å; R8-A12 WeakPolarHBondContact O-CB 3.49Å; R8-A12 PolarHBondContact O-N 3.12Å
9	R	88.1	Confident	87.3	Confident	139 Å²	139	108.4 Å²	108.4	53%	0.525	53%	0.528	S	S	.	.	H	α-helix	trans	-76.5	-50.5	170.5	-79.4	-170.9	-67.6	-164.4	-1.7	110.4	Q5 Q6 A11 A12 E13	Q5-R9 WeakPolarHBondContact O-CG 3.32Å; Q5-R9 PolarHBondContact O-N 3.44Å; Q6-R9 WeakPolarHBondContact O-CA 3.4Å; Q6-R9 WeakPolarHBondContact O-CB 3.46Å; Q6-R9 PolarHBondContact O-N 3.28Å; R9-A11 VanDerWaalsContact C-N 3.31Å; R9-A11 PolarHBondContact O-N 3.09Å; R9-A12 CarbonylContact O-C 3.53Å; R9-A12 WeakPolarHBondContact O-CA 3.3Å; R9-A12 WeakPolarHBondContact O-CB 3.25Å; R9-A12 PolarHBondContact O-N 2.97Å; R9-E13 WeakPolarHBondContact O-CG 3.48Å; R9-E13 PolarHBondContact O-N 3.21Å
10	E	89.6	Confident	87.7	Confident	82 Å²	82	108.3 Å²	108.3	38%	0.383	53%	0.526	S	S	.	.	H	α-helix	trans	-58.4	-43.3	179.1	-66.1	177.3	-169	0	0	111.2	Q6 A12 E13 Q14	Q6-E10 HydrophobicContact CG-CG 4.48Å; Q6-E10 VanDerWaalsContact CG-OE1 3.31Å; Q6-E10 WeakPolarHBondContact CG-OE1 3.47Å; Q6-E10 PolarHBondContact NE2-OE1 3.35Å; Q6-E10 PolarHBondContact O-N 3.48Å; E10-A12 PolarHBondContact O-N 3.26Å; E10-E13 PolarHBondContact O-N 2.84Å; E10-Q14 WeakPolarHBondContact O-CB 3.35Å; E10-Q14 VanDerWaalsContact O-CG 3.26Å; E10-Q14 WeakPolarHBondContact O-CG 3.32Å; E10-Q14 PolarHBondContact O-N 3.16Å
11	A	91.1	Very high	88	Confident	53 Å²	53	106.4 Å²	106.4	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-71	-12.8	173.9	0	0	0	0	0	114.7	D7 R9 R15	D7-A11 WeakPolarHBondContact O-CB 3.12Å; D7-A11 PolarHBondContact O-N 3.39Å; R9-A11 VanDerWaalsContact C-N 3.31Å; R9-A11 PolarHBondContact O-N 3.09Å; A11-R15 WeakPolarHBondContact O-CB 3.46Å
12	A	90.7	Very high	89.7	Confident	32 Å²	32	102.1 Å²	102.1	26%	0.264	50%	0.498	S	S	.	.	H	α-helix	trans	-89.9	-38	170.8	0	0	0	0	0	112	R8 R9 E10 R15 Q16	R8-A12 WeakPolarHBondContact O-CB 3.49Å; R8-A12 PolarHBondContact O-N 3.12Å; R9-A12 CarbonylContact O-C 3.53Å; R9-A12 WeakPolarHBondContact O-CA 3.3Å; R9-A12 WeakPolarHBondContact O-CB 3.25Å; R9-A12 PolarHBondContact O-N 2.97Å; E10-A12 PolarHBondContact O-N 3.26Å; A12-R15 PolarHBondContact O-N 2.73Å; A12-Q16 PolarHBondContact O-N 3.49Å
13	E	92.1	Very high	90.8	Very high	100 Å²	100	100.3 Å²	100.3	47%	0.467	49%	0.491	S	S	.	.	H	α-helix	trans	-65.2	-51.3	174.3	-71.7	155.7	-164.2	0	0	110.1	R9 E10 R15 Q16 E17	R9-E13 WeakPolarHBondContact O-CG 3.48Å; R9-E13 PolarHBondContact O-N 3.21Å; E10-E13 PolarHBondContact O-N 2.84Å; E13-R15 VanDerWaalsContact C-N 3.25Å; E13-R15 PolarHBondContact O-N 2.86Å; E13-Q16 CarbonylContact O-C 3.54Å; E13-Q16 WeakPolarHBondContact O-CA 3.41Å; E13-Q16 WeakPolarHBondContact O-CB 3.49Å; E13-Q16 PolarHBondContact O-N 2.61Å; E13-E17 WeakPolarHBondContact O-CG 3.47Å; E13-E17 PolarHBondContact O-N 3.43Å
14	Q	93.2	Very high	91.6	Very high	112 Å²	112	101.1 Å²	101.1	52%	0.523	49%	0.486	S	S	.	.	H	α-helix	trans	-56	-37.3	172.8	-71.9	171.5	8.1	0	0	112.9	E10 L18	E10-Q14 WeakPolarHBondContact O-CB 3.35Å; E10-Q14 VanDerWaalsContact O-CG 3.26Å; E10-Q14 WeakPolarHBondContact O-CG 3.32Å; E10-Q14 PolarHBondContact O-N 3.16Å; Q14-L18 WeakPolarHBondContact O-CB 3.47Å; Q14-L18 VanDerWaalsContact O-CG 3.26Å; Q14-L18 WeakPolarHBondContact O-CG 3.28Å; Q14-L18 PolarHBondContact O-N 2.75Å
15	R	93.6	Very high	92.2	Very high	155 Å²	155	99.3 Å²	99.3	59%	0.585	48%	0.477	S	S	*	.	H	α-helix	trans	-68.6	-36.8	175.6	-173.4	-175	65.6	-103.2	-7.3	111.4	A11 A12 E13 C19	A11-R15 WeakPolarHBondContact O-CB 3.46Å; A12-R15 PolarHBondContact O-N 2.73Å; E13-R15 VanDerWaalsContact C-N 3.25Å; E13-R15 PolarHBondContact O-N 2.86Å; R15-C19 PolarHBondContact O-N 2.98Å; R15-C19 PolarHBondContact O-SG 2.89Å
16	Q	93.9	Very high	92.7	Very high	115 Å²	115	100.3 Å²	100.3	54%	0.537	48%	0.481	S	S	.	.	H	α-helix	trans	-67.3	-47.4	174.7	179.6	175.7	-26.8	0	0	111	A12 E13 L18 C19 E20	A12-Q16 PolarHBondContact O-N 3.49Å; E13-Q16 CarbonylContact O-C 3.54Å; E13-Q16 WeakPolarHBondContact O-CA 3.41Å; E13-Q16 WeakPolarHBondContact O-CB 3.49Å; E13-Q16 PolarHBondContact O-N 2.61Å; Q16-L18 VanDerWaalsContact C-N 3.31Å; Q16-L18 PolarHBondContact O-N 3.2Å; Q16-C19 WeakPolarHBondContact O-CA 3.28Å; Q16-C19 WeakPolarHBondContact O-CB 3.43Å; Q16-C19 PolarHBondContact O-N 2.84Å; Q16-E20 HydrophobicContact CG-CG 4.45Å; Q16-E20 VanDerWaalsContact CG-OE1 3.27Å; Q16-E20 WeakPolarHBondContact CG-OE1 3.06Å; Q16-E20 PolarHBondContact NE2-OE1 3.09Å; Q16-E20 WeakPolarHBondContact O-CG 3.48Å; Q16-E20 PolarHBondContact O-N 3.25Å
17	E	94.4	Very high	93.2	Very high	118 Å²	118	99 Å²	99	55%	0.551	49%	0.486	S	S	*	.	H	α-helix	trans	-54.9	-45.2	174.9	-69.1	177.7	162.6	0	0	111.7	E13 C19 E20 I21	E13-E17 WeakPolarHBondContact O-CG 3.47Å; E13-E17 PolarHBondContact O-N 3.43Å; E17-C19 PolarHBondContact O-N 3.47Å; E17-E20 PolarHBondContact O-N 3.23Å; E17-I21 WeakPolarHBondContact O-CB 3.43Å; E17-I21 VanDerWaalsContact O-CG1 3.26Å; E17-I21 WeakPolarHBondContact O-CG1 3.47Å; E17-I21 PolarHBondContact O-N 3.3Å
18	L	94.8	Very high	93.4	Very high	107 Å²	107	99.8 Å²	99.8	56%	0.56	49%	0.487	S	S	*	.	H	α-helix	trans	-63.4	-39.2	175.6	-73.1	170.4	0	0	0	112.5	Q14 Q16 I21 I22	Q14-L18 WeakPolarHBondContact O-CB 3.47Å; Q14-L18 VanDerWaalsContact O-CG 3.26Å; Q14-L18 WeakPolarHBondContact O-CG 3.28Å; Q14-L18 PolarHBondContact O-N 2.75Å; Q16-L18 VanDerWaalsContact C-N 3.31Å; Q16-L18 PolarHBondContact O-N 3.2Å; L18-I21 PolarHBondContact O-N 3.49Å; L18-I22 WeakPolarHBondContact O-CB 3.42Å; L18-I22 WeakPolarHBondContact O-CD1 3.48Å; L18-I22 WeakPolarHBondContact O-CG1 3.43Å; L18-I22 PolarHBondContact O-N 3.33Å
19	C	95.1	Very high	93.8	Very high	71 Å²	71	95.9 Å²	95.9	48%	0.48	48%	0.479	S	S	.	.	H	α-helix	trans	-64.5	-41.1	173.5	-73.9	0	0	0	0	112.4	R15 Q16 E17 I22 T23	R15-C19 PolarHBondContact O-N 2.98Å; R15-C19 PolarHBondContact O-SG 2.89Å; Q16-C19 WeakPolarHBondContact O-CA 3.28Å; Q16-C19 WeakPolarHBondContact O-CB 3.43Å; Q16-C19 PolarHBondContact O-N 2.84Å; E17-C19 PolarHBondContact O-N 3.47Å; C19-I22 PolarHBondContact O-N 3.32Å; C19-T23 PolarHBondContact O-N 3.29Å; C19-T23 PolarHBondContact O-OG1 3.2Å
20	E	94.4	Very high	94.2	Very high	106 Å²	106	94.7 Å²	94.7	50%	0.495	48%	0.479	S	S	.	.	H	α-helix	trans	-68.5	-34.4	177.6	-70.4	175.7	-163.6	0	0	112.3	Q16 E17 T23 R24	Q16-E20 HydrophobicContact CG-CG 4.45Å; Q16-E20 VanDerWaalsContact CG-OE1 3.27Å; Q16-E20 WeakPolarHBondContact CG-OE1 3.06Å; Q16-E20 PolarHBondContact NE2-OE1 3.09Å; Q16-E20 WeakPolarHBondContact O-CG 3.48Å; Q16-E20 PolarHBondContact O-N 3.25Å; E17-E20 PolarHBondContact O-N 3.23Å; E20-T23 PolarHBondContact O-OG1 3.48Å; E20-R24 WeakPolarHBondContact O-CB 3.31Å; E20-R24 PolarHBondContact O-N 2.84Å; E20-R24 VanDerWaalsContact O-N 3.11Å
21	I	95.6	Very high	94.4	Very high	70 Å²	70	92.9 Å²	92.9	36%	0.359	48%	0.479	S	S	.	.	H	α-helix	trans	-66.2	-43	170.7	-70.2	163.8	0	0	0	110.7	E17 L18 R24 L25	E17-I21 WeakPolarHBondContact O-CB 3.43Å; E17-I21 VanDerWaalsContact O-CG1 3.26Å; E17-I21 WeakPolarHBondContact O-CG1 3.47Å; E17-I21 PolarHBondContact O-N 3.3Å; L18-I21 PolarHBondContact O-N 3.49Å; I21-R24 PolarHBondContact O-N 3.05Å; I21-L25 HydrophobicContact CG2-CD1 3.8Å; I21-L25 HydrophobicContact CG2-CG 4.4Å; I21-L25 WeakPolarHBondContact O-CB 3.4Å; I21-L25 VanDerWaalsContact O-CG 3.28Å; I21-L25 WeakPolarHBondContact O-CG 3.14Å; I21-L25 PolarHBondContact O-N 2.88Å
22	I	95.8	Very high	94.5	Very high	89 Å²	89	94.5 Å²	94.5	46%	0.456	48%	0.483	S	S	.	.	H	α-helix	trans	-63.6	-46.3	178.7	-72.5	163.9	0	0	0	111.3	L18 C19 R24 L25 Q26	L18-I22 WeakPolarHBondContact O-CB 3.42Å; L18-I22 WeakPolarHBondContact O-CD1 3.48Å; L18-I22 WeakPolarHBondContact O-CG1 3.43Å; L18-I22 PolarHBondContact O-N 3.33Å; C19-I22 PolarHBondContact O-N 3.32Å; I22-R24 VanDerWaalsContact C-N 3.35Å; I22-R24 PolarHBondContact O-N 3.39Å; I22-L25 PolarHBondContact O-N 3.35Å; I22-Q26 HydrophobicContact CG2-CG 4.49Å; I22-Q26 VanDerWaalsContact O-CG 3.3Å; I22-Q26 WeakPolarHBondContact O-CG 3.45Å; I22-Q26 PolarHBondContact O-N 3.33Å
23	T	95.4	Very high	94.7	Very high	87 Å²	87	97.7 Å²	97.7	53%	0.534	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-36	179.3	54.1	0	0	0	0	112.2	C19 E20 Q26 G27	C19-T23 PolarHBondContact O-N 3.29Å; C19-T23 PolarHBondContact O-OG1 3.2Å; E20-T23 PolarHBondContact O-OG1 3.48Å; T23-Q26 PolarHBondContact O-N 3.44Å; T23-G27 PolarHBondContact O-N 2.97Å; T23-G27 VanDerWaalsContact O-N 3.08Å
24	R	96.2	Very high	94.9	Very high	144 Å²	144	97.2 Å²	97.2	54%	0.543	49%	0.49	S	S	.	.	H	α-helix	trans	-62.4	-48.7	172.1	-168.7	-176.4	68.2	-131.9	-6.5	111.7	E20 I21 I22 Q26 G27 E28	E20-R24 WeakPolarHBondContact O-CB 3.31Å; E20-R24 PolarHBondContact O-N 2.84Å; E20-R24 VanDerWaalsContact O-N 3.11Å; I21-R24 PolarHBondContact O-N 3.05Å; I22-R24 VanDerWaalsContact C-N 3.35Å; I22-R24 PolarHBondContact O-N 3.39Å; R24-Q26 VanDerWaalsContact C-N 3.28Å; R24-Q26 PolarHBondContact O-N 3.43Å; R24-G27 PolarHBondContact O-N 2.84Å; R24-G27 VanDerWaalsContact O-N 3.14Å; R24-E28 WeakPolarHBondContact CD-OE1 3.12Å; R24-E28 HydrophobicContact CG-CG 4.46Å; R24-E28 VanDerWaalsContact CG-OE1 3.28Å; R24-E28 WeakPolarHBondContact CG-OE1 3.4Å; R24-E28 IonicContact NE-OE1 3.19Å; R24-E28 PolarHBondContact NE-OE1 3.38Å; R24-E28 WeakPolarHBondContact O-CG 3.31Å; R24-E28 PolarHBondContact O-N 3.4Å
25	L	95.3	Very high	94.9	Very high	90 Å²	90	96 Å²	96	47%	0.471	49%	0.487	S	S	.	.	H	α-helix	trans	-63	-32.6	178.7	-72.1	170.5	0	0	0	112.7	I21 I22 L29	I21-L25 HydrophobicContact CG2-CD1 3.8Å; I21-L25 HydrophobicContact CG2-CG 4.4Å; I21-L25 WeakPolarHBondContact O-CB 3.4Å; I21-L25 VanDerWaalsContact O-CG 3.28Å; I21-L25 WeakPolarHBondContact O-CG 3.14Å; I21-L25 PolarHBondContact O-N 2.88Å; I22-L25 PolarHBondContact O-N 3.35Å; L25-L29 VanDerWaalsContact O-CB 3.3Å; L25-L29 WeakPolarHBondContact O-CB 3.37Å; L25-L29 PolarHBondContact O-N 2.95Å
26	Q	95.1	Very high	94.9	Very high	117 Å²	117	94.9 Å²	94.9	55%	0.547	48%	0.483	S	S	.	.	H	α-helix	trans	-66.9	-41.9	172.6	-74.9	170.4	-20.6	0	0	112.2	I22 T23 R24 L29 Q30	I22-Q26 HydrophobicContact CG2-CG 4.49Å; I22-Q26 VanDerWaalsContact O-CG 3.3Å; I22-Q26 WeakPolarHBondContact O-CG 3.45Å; I22-Q26 PolarHBondContact O-N 3.33Å; T23-Q26 PolarHBondContact O-N 3.44Å; R24-Q26 VanDerWaalsContact C-N 3.28Å; R24-Q26 PolarHBondContact O-N 3.43Å; Q26-L29 PolarHBondContact O-N 2.85Å; Q26-Q30 PolarHBondContact O-N 3.4Å
27	G	95.9	Very high	95	Very high	40 Å²	40	91.4 Å²	91.4	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-67.1	-40.5	174.4	0	0	0	0	0	113.2	T23 R24 A31	T23-G27 PolarHBondContact O-N 2.97Å; T23-G27 VanDerWaalsContact O-N 3.08Å; R24-G27 PolarHBondContact O-N 2.84Å; R24-G27 VanDerWaalsContact O-N 3.14Å; G27-A31 WeakPolarHBondContact O-CB 3.18Å; G27-A31 PolarHBondContact O-N 3.19Å
28	E	94.8	Very high	95	Very high	93 Å²	93	90.3 Å²	90.3	44%	0.435	47%	0.467	S	S	.	.	H	α-helix	trans	-61.1	-45.1	172.8	-72.4	171.1	-162.2	0	0	111	R24 A31 T32	R24-E28 WeakPolarHBondContact CD-OE1 3.12Å; R24-E28 HydrophobicContact CG-CG 4.46Å; R24-E28 VanDerWaalsContact CG-OE1 3.28Å; R24-E28 WeakPolarHBondContact CG-OE1 3.4Å; R24-E28 IonicContact NE-OE1 3.19Å; R24-E28 PolarHBondContact NE-OE1 3.38Å; R24-E28 WeakPolarHBondContact O-CG 3.31Å; R24-E28 PolarHBondContact O-N 3.4Å; E28-A31 PolarHBondContact O-N 2.85Å; E28-T32 WeakPolarHBondContact O-CG2 3.27Å; E28-T32 PolarHBondContact O-N 3.49Å; E28-T32 PolarHBondContact O-OG1 2.76Å
29	L	94.9	Very high	95	Very high	94 Å²	94	90.2 Å²	90.2	49%	0.492	47%	0.467	S	S	.	.	H	α-helix	trans	-58.7	-53.7	175.5	178.2	61.8	0	0	0	111.5	L25 Q26 A31 T32 E33	L25-L29 VanDerWaalsContact O-CB 3.3Å; L25-L29 WeakPolarHBondContact O-CB 3.37Å; L25-L29 PolarHBondContact O-N 2.95Å; Q26-L29 PolarHBondContact O-N 2.85Å; L29-A31 VanDerWaalsContact C-N 3.3Å; L29-A31 PolarHBondContact O-N 2.96Å; L29-T32 PolarHBondContact O-N 3.07Å; L29-T32 PolarHBondContact O-OG1 3.33Å; L29-E33 HydrophobicContact CD1-CG 4.31Å; L29-E33 PolarHBondContact O-N 3.18Å
30	Q	96.1	Very high	95	Very high	113 Å²	113	91.2 Å²	91.2	53%	0.528	46%	0.464	S	S	.	.	H	α-helix	trans	-56.9	-43.7	179.2	-173.4	-171.6	-39	0	0	111.5	Q26 T32 E33 E34	Q26-Q30 PolarHBondContact O-N 3.4Å; Q30-T32 VanDerWaalsContact C-N 3.3Å; Q30-T32 PolarHBondContact O-N 3.36Å; Q30-E33 PolarHBondContact O-N 3.38Å; Q30-E33 VanDerWaalsContact O-N 3.14Å; Q30-E34 PolarHBondContact NE2-OE1 3.11Å; Q30-E34 WeakPolarHBondContact O-CG 3.41Å; Q30-E34 PolarHBondContact O-N 2.82Å
31	A	94.7	Very high	95	Very high	45 Å²	45	91.5 Å²	91.5	37%	0.372	47%	0.469	S	S	.	.	H	α-helix	trans	-62.4	-35.3	177	0	0	0	0	0	112.6	G27 E28 L29 N35	G27-A31 WeakPolarHBondContact O-CB 3.18Å; G27-A31 PolarHBondContact O-N 3.19Å; E28-A31 PolarHBondContact O-N 2.85Å; L29-A31 VanDerWaalsContact C-N 3.3Å; L29-A31 PolarHBondContact O-N 2.96Å; A31-N35 WeakPolarHBondContact O-CB 3.25Å; A31-N35 PolarHBondContact O-N 3.39Å; A31-N35 VanDerWaalsContact O-N 3.16Å; A31-N35 PolarHBondContact O-ND2 3.43Å; A31-N35 VanDerWaalsContact O-ND2 3.11Å
32	T	92.8	Very high	94.9	Very high	86 Å²	86	93.7 Å²	93.7	53%	0.528	48%	0.478	S	S	.	.	H	α-helix	trans	-71.2	-35	172.7	60.8	0	0	0	0	113.1	E28 L29 Q30 N35 R36	E28-T32 WeakPolarHBondContact O-CG2 3.27Å; E28-T32 PolarHBondContact O-N 3.49Å; E28-T32 PolarHBondContact O-OG1 2.76Å; L29-T32 PolarHBondContact O-N 3.07Å; L29-T32 PolarHBondContact O-OG1 3.33Å; Q30-T32 VanDerWaalsContact C-N 3.3Å; Q30-T32 PolarHBondContact O-N 3.36Å; T32-N35 PolarHBondContact O-N 3.29Å; T32-R36 WeakPolarHBondContact O-CB 3.5Å; T32-R36 PolarHBondContact O-N 3.24Å
33	E	94.8	Very high	94.8	Very high	100 Å²	100	92.7 Å²	92.7	47%	0.467	48%	0.478	S	S	.	.	H	α-helix	trans	-68.2	-43.1	176.1	-70	-178.5	159.6	0	0	112.1	L29 Q30 N35 R36 A37	L29-E33 HydrophobicContact CD1-CG 4.31Å; L29-E33 PolarHBondContact O-N 3.18Å; Q30-E33 PolarHBondContact O-N 3.38Å; Q30-E33 VanDerWaalsContact O-N 3.14Å; E33-N35 VanDerWaalsContact C-N 3.3Å; E33-N35 PolarHBondContact O-N 3.49Å; E33-R36 WeakPolarHBondContact O-CB 3.29Å; E33-R36 PolarHBondContact O-N 3.24Å; E33-A37 PolarHBondContact O-N 2.91Å
34	E	95.6	Very high	94.8	Very high	90 Å²	90	94.6 Å²	94.6	42%	0.421	48%	0.481	S	S	.	.	H	α-helix	trans	-62	-36.8	173.2	-73	-179.9	-153.5	0	0	112.4	Q30 K38	Q30-E34 PolarHBondContact NE2-OE1 3.11Å; Q30-E34 WeakPolarHBondContact O-CG 3.41Å; Q30-E34 PolarHBondContact O-N 2.82Å; E34-K38 WeakPolarHBondContact O-CD 3.39Å; E34-K38 WeakPolarHBondContact O-CE 3.45Å; E34-K38 VanDerWaalsContact O-CG 3.24Å; E34-K38 WeakPolarHBondContact O-CG 3.33Å; E34-K38 PolarHBondContact O-N 2.94Å; E34-K38 VanDerWaalsContact O-N 3.15Å; E34-K38 IonicContact OE2-NZ 3.64Å
35	N	92.9	Very high	94.7	Very high	86 Å²	86	93 Å²	93	46%	0.46	48%	0.48	S	S	.	.	H	α-helix	trans	-74.6	-32.6	176.7	-70.8	-22.1	0	0	0	112.3	A31 T32 E33 K38 L39	A31-N35 WeakPolarHBondContact O-CB 3.25Å; A31-N35 PolarHBondContact O-N 3.39Å; A31-N35 VanDerWaalsContact O-N 3.16Å; A31-N35 PolarHBondContact O-ND2 3.43Å; A31-N35 VanDerWaalsContact O-ND2 3.11Å; T32-N35 PolarHBondContact O-N 3.29Å; E33-N35 VanDerWaalsContact C-N 3.3Å; E33-N35 PolarHBondContact O-N 3.49Å; N35-K38 PolarHBondContact OD1-NZ 3.45Å; N35-L39 WeakPolarHBondContact O-CG 3.27Å; N35-L39 PolarHBondContact O-N 2.83Å; N35-L39 VanDerWaalsContact O-N 3.13Å
36	R	95	Very high	94.7	Very high	132 Å²	132	93.7 Å²	93.7	50%	0.498	48%	0.483	S	S	.	.	H	α-helix	trans	-61.3	-47.6	169.8	-176.6	-176.1	62.9	75.4	10.3	111	T32 E33 K38 L39 E40	T32-R36 WeakPolarHBondContact O-CB 3.5Å; T32-R36 PolarHBondContact O-N 3.24Å; E33-R36 WeakPolarHBondContact O-CB 3.29Å; E33-R36 PolarHBondContact O-N 3.24Å; R36-K38 PolarHBondContact O-N 3.32Å; R36-L39 PolarHBondContact O-N 3.04Å; R36-L39 VanDerWaalsContact O-N 3.16Å; R36-E40 VanDerWaalsContact CG-OE1 3.3Å; R36-E40 WeakPolarHBondContact CG-OE1 3.04Å; R36-E40 IonicContact CZ-OE1 3.7Å; R36-E40 IonicContact CZ-OE2 3.72Å; R36-E40 IonicContact NH1-OE1 2.69Å; R36-E40 PolarHBondContact NH1-OE1 3.17Å; R36-E40 IonicContact NH1-OE2 2.72Å; R36-E40 PolarHBondContact NH1-OE2 3.19Å; R36-E40 WeakPolarHBondContact O-CG 3.3Å; R36-E40 PolarHBondContact O-N 2.91Å
37	A	95.1	Very high	94.6	Very high	41 Å²	41	92.9 Å²	92.9	34%	0.339	48%	0.48	S	S	.	.	H	α-helix	trans	-59.1	-46.3	177.8	0	0	0	0	0	112.3	E33 L39 E40 D41	E33-A37 PolarHBondContact O-N 2.91Å; A37-L39 VanDerWaalsContact C-N 3.27Å; A37-L39 PolarHBondContact O-N 3.06Å; A37-E40 PolarHBondContact O-N 2.91Å; A37-E40 VanDerWaalsContact O-N 3.12Å; A37-D41 PolarHBondContact O-N 2.87Å
38	K	95.8	Very high	94.5	Very high	96 Å²	96	95.8 Å²	95.8	42%	0.417	49%	0.485	S	S	.	.	H	α-helix	trans	-60.1	-34.1	176.2	-67.7	160	-158.2	159.1	0	113	E34 N35 R36 Q42	E34-K38 WeakPolarHBondContact O-CD 3.39Å; E34-K38 WeakPolarHBondContact O-CE 3.45Å; E34-K38 VanDerWaalsContact O-CG 3.24Å; E34-K38 WeakPolarHBondContact O-CG 3.33Å; E34-K38 PolarHBondContact O-N 2.94Å; E34-K38 VanDerWaalsContact O-N 3.15Å; E34-K38 IonicContact OE2-NZ 3.64Å; N35-K38 PolarHBondContact OD1-NZ 3.45Å; R36-K38 PolarHBondContact O-N 3.32Å; K38-Q42 WeakPolarHBondContact O-CB 3.46Å; K38-Q42 VanDerWaalsContact O-CG 3.23Å; K38-Q42 WeakPolarHBondContact O-CG 3.38Å; K38-Q42 PolarHBondContact O-N 2.84Å
39	L	93.9	Very high	94.4	Very high	104 Å²	104	96.4 Å²	96.4	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-76	-33.4	176.1	-72	169.9	0	0	0	112.3	N35 R36 A37 Q42 C43	N35-L39 WeakPolarHBondContact O-CG 3.27Å; N35-L39 PolarHBondContact O-N 2.83Å; N35-L39 VanDerWaalsContact O-N 3.13Å; R36-L39 PolarHBondContact O-N 3.04Å; R36-L39 VanDerWaalsContact O-N 3.16Å; A37-L39 VanDerWaalsContact C-N 3.27Å; A37-L39 PolarHBondContact O-N 3.06Å; L39-Q42 PolarHBondContact O-N 2.81Å; L39-C43 WeakPolarHBondContact O-CB 3.28Å; L39-C43 PolarHBondContact O-N 3.38Å; L39-C43 PolarHBondContact O-SG 3.29Å
40	E	94.4	Very high	94.3	Very high	92 Å²	92	96.3 Å²	96.3	43%	0.43	49%	0.489	S	S	.	.	H	α-helix	trans	-65.1	-49.1	172.7	-74.9	165.2	-175.3	0	0	110.9	R36 A37 Q42 C43 E44	R36-E40 VanDerWaalsContact CG-OE1 3.3Å; R36-E40 WeakPolarHBondContact CG-OE1 3.04Å; R36-E40 IonicContact CZ-OE1 3.7Å; R36-E40 IonicContact CZ-OE2 3.72Å; R36-E40 IonicContact NH1-OE1 2.69Å; R36-E40 PolarHBondContact NH1-OE1 3.17Å; R36-E40 IonicContact NH1-OE2 2.72Å; R36-E40 PolarHBondContact NH1-OE2 3.19Å; R36-E40 WeakPolarHBondContact O-CG 3.3Å; R36-E40 PolarHBondContact O-N 2.91Å; A37-E40 PolarHBondContact O-N 2.91Å; A37-E40 VanDerWaalsContact O-N 3.12Å; E40-Q42 VanDerWaalsContact C-N 3.3Å; E40-Q42 PolarHBondContact O-N 3.2Å; E40-C43 WeakPolarHBondContact O-CB 3.3Å; E40-C43 PolarHBondContact O-N 2.86Å; E40-E44 PolarHBondContact O-N 2.87Å
41	D	94.8	Very high	94.1	Very high	112 Å²	112	97.5 Å²	97.5	60%	0.599	49%	0.489	S	S	*	.	H	α-helix	trans	-54.5	-44	173.1	-71.6	-16.2	0	0	0	112.3	A37 E44 Q45	A37-D41 PolarHBondContact O-N 2.87Å; D41-E44 PolarHBondContact O-N 2.88Å; D41-Q45 WeakPolarHBondContact O-CB 3.44Å; D41-Q45 PolarHBondContact O-N 3.15Å
42	Q	93.5	Very high	94.1	Very high	116 Å²	116	99 Å²	99	54%	0.542	49%	0.494	S	S	.	.	H	α-helix	trans	-65.7	-38.2	177.3	-76.2	175.6	13.3	0	0	112.2	K38 L39 E40 L46	K38-Q42 WeakPolarHBondContact O-CB 3.46Å; K38-Q42 VanDerWaalsContact O-CG 3.23Å; K38-Q42 WeakPolarHBondContact O-CG 3.38Å; K38-Q42 PolarHBondContact O-N 2.84Å; L39-Q42 PolarHBondContact O-N 2.81Å; E40-Q42 VanDerWaalsContact C-N 3.3Å; E40-Q42 PolarHBondContact O-N 3.2Å; Q42-L46 WeakPolarHBondContact O-CB 3.35Å; Q42-L46 VanDerWaalsContact O-CG 3.24Å; Q42-L46 WeakPolarHBondContact O-CG 3.38Å; Q42-L46 PolarHBondContact O-N 3.28Å
43	C	93.4	Very high	94.1	Very high	68 Å²	68	100.4 Å²	100.4	46%	0.459	50%	0.497	S	S	.	.	H	α-helix	trans	-66.6	-41.2	176	-72.7	0	0	0	0	111.7	L39 E40 L46 Q47	L39-C43 WeakPolarHBondContact O-CB 3.28Å; L39-C43 PolarHBondContact O-N 3.38Å; L39-C43 PolarHBondContact O-SG 3.29Å; E40-C43 WeakPolarHBondContact O-CB 3.3Å; E40-C43 PolarHBondContact O-N 2.86Å; C43-L46 PolarHBondContact O-N 3.26Å; C43-Q47 WeakPolarHBondContact O-CB 3.22Å; C43-Q47 VanDerWaalsContact O-CG 3.31Å; C43-Q47 WeakPolarHBondContact O-CG 3.47Å; C43-Q47 PolarHBondContact O-N 3.11Å
44	E	95.6	Very high	93.9	Very high	128 Å²	128	101 Å²	101	60%	0.598	50%	0.5	S	S	*	.	H	α-helix	trans	-64.9	-45.5	174.5	-67.5	-161.9	173.5	0	0	111.8	E40 D41 L46 Q47 L48	E40-E44 PolarHBondContact O-N 2.87Å; D41-E44 PolarHBondContact O-N 2.88Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 2.9Å; E44-Q47 PolarHBondContact O-N 2.89Å; E44-L48 WeakPolarHBondContact O-CG 3.34Å; E44-L48 PolarHBondContact O-N 3.48Å
45	Q	95.1	Very high	93.9	Very high	110 Å²	110	101.8 Å²	101.8	51%	0.514	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-36.5	178	-161.2	-166.5	86.7	0	0	112.3	D41 K49	D41-Q45 WeakPolarHBondContact O-CB 3.44Å; D41-Q45 PolarHBondContact O-N 3.15Å; Q45-K49 WeakPolarHBondContact O-CG 3.47Å; Q45-K49 PolarHBondContact O-N 2.82Å; Q45-K49 VanDerWaalsContact O-N 3.08Å
46	L	93.6	Very high	93.7	Very high	104 Å²	104	101.6 Å²	101.6	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-69.2	-40.9	173.5	-73.5	170.5	0	0	0	112.1	Q42 C43 E44 L48 K49 V50	Q42-L46 WeakPolarHBondContact O-CB 3.35Å; Q42-L46 VanDerWaalsContact O-CG 3.24Å; Q42-L46 WeakPolarHBondContact O-CG 3.38Å; Q42-L46 PolarHBondContact O-N 3.28Å; C43-L46 PolarHBondContact O-N 3.26Å; E44-L46 VanDerWaalsContact C-N 3.31Å; E44-L46 PolarHBondContact O-N 2.9Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.96Å; L46-K49 PolarHBondContact O-N 2.79Å; L46-V50 WeakPolarHBondContact O-CG2 3.42Å; L46-V50 PolarHBondContact O-N 2.78Å
47	Q	93.1	Very high	93.4	Very high	101 Å²	101	103 Å²	103	47%	0.472	51%	0.511	S	S	.	.	H	α-helix	trans	-60.6	-40.5	174.1	-77	179.9	45.4	0	0	112.3	C43 E44 V50 R51	C43-Q47 WeakPolarHBondContact O-CB 3.22Å; C43-Q47 VanDerWaalsContact O-CG 3.31Å; C43-Q47 WeakPolarHBondContact O-CG 3.47Å; C43-Q47 PolarHBondContact O-N 3.11Å; E44-Q47 PolarHBondContact O-N 2.89Å; Q47-V50 PolarHBondContact O-N 3.3Å; Q47-R51 WeakPolarHBondContact O-CG 3.18Å; Q47-R51 PolarHBondContact O-N 3.01Å
48	L	94.9	Very high	93.2	Very high	101 Å²	101	104.1 Å²	104.1	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-48.1	174.9	-70.1	173.1	0	0	0	111.3	E44 L46 V50 R51 T52	E44-L48 WeakPolarHBondContact O-CG 3.34Å; E44-L48 PolarHBondContact O-N 3.48Å; L46-L48 VanDerWaalsContact C-N 3.32Å; L46-L48 PolarHBondContact O-N 2.96Å; L48-V50 VanDerWaalsContact C-N 3.31Å; L48-V50 PolarHBondContact O-N 3.09Å; L48-R51 PolarHBondContact O-N 3.26Å; L48-R51 VanDerWaalsContact O-N 3.13Å; L48-T52 PolarHBondContact O-N 2.74Å; L48-T52 PolarHBondContact O-OG1 2.95Å
49	K	92.6	Very high	92.9	Very high	106 Å²	106	103.3 Å²	103.3	46%	0.461	51%	0.512	S	S	.	.	H	α-helix	trans	-56.6	-42	175.6	-75.5	166.3	173.6	170.8	0	112.5	Q45 L46 T52 L53	Q45-K49 WeakPolarHBondContact O-CG 3.47Å; Q45-K49 PolarHBondContact O-N 2.82Å; Q45-K49 VanDerWaalsContact O-N 3.08Å; L46-K49 PolarHBondContact O-N 2.79Å; K49-T52 PolarHBondContact O-N 3.33Å; K49-L53 WeakPolarHBondContact O-CB 3.4Å; K49-L53 VanDerWaalsContact O-CG 3.32Å; K49-L53 WeakPolarHBondContact O-CG 3.46Å; K49-L53 PolarHBondContact O-N 2.68Å
50	V	93.1	Very high	92.4	Very high	91 Å²	91	103 Å²	103	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-64.1	-42.5	176	170.1	0	0	0	0	111.7	L46 Q47 L48 L53 Q54	L46-V50 WeakPolarHBondContact O-CG2 3.42Å; L46-V50 PolarHBondContact O-N 2.78Å; Q47-V50 PolarHBondContact O-N 3.3Å; L48-V50 VanDerWaalsContact C-N 3.31Å; L48-V50 PolarHBondContact O-N 3.09Å; V50-L53 PolarHBondContact O-N 3.14Å; V50-Q54 WeakPolarHBondContact O-CB 3.38Å; V50-Q54 PolarHBondContact O-N 3.25Å
51	R	92.3	Very high	92.1	Very high	138 Å²	138	103.7 Å²	103.7	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-41.8	176.3	-71.9	176.2	-171.1	139.5	11.1	112.3	Q47 L48 Q54 L55	Q47-R51 WeakPolarHBondContact O-CG 3.18Å; Q47-R51 PolarHBondContact O-N 3.01Å; L48-R51 PolarHBondContact O-N 3.26Å; L48-R51 VanDerWaalsContact O-N 3.13Å; R51-Q54 PolarHBondContact O-N 3.2Å; R51-L55 WeakPolarHBondContact O-CG 3.16Å; R51-L55 PolarHBondContact O-N 3.38Å; R51-L55 VanDerWaalsContact O-N 3.15Å
52	T	94	Very high	91.7	Very high	77 Å²	77	104 Å²	104	47%	0.472	51%	0.507	S	S	.	.	H	α-helix	trans	-62.2	-51.9	175.7	-54.4	0	0	0	0	111	L48 K49 Q54 L55 D56	L48-T52 PolarHBondContact O-N 2.74Å; L48-T52 PolarHBondContact O-OG1 2.95Å; K49-T52 PolarHBondContact O-N 3.33Å; T52-Q54 PolarHBondContact O-N 2.74Å; T52-L55 WeakPolarHBondContact O-CB 3.46Å; T52-L55 PolarHBondContact O-N 2.92Å; T52-D56 VanDerWaalsContact O-CG 3.29Å; T52-D56 PolarHBondContact O-N 3.32Å
53	L	93.1	Very high	91.4	Very high	116 Å²	116	103.2 Å²	103.2	61%	0.607	50%	0.5	S	S	*	.	H	α-helix	trans	-60.3	-30.8	178.8	-70.9	170.9	0	0	0	113.1	K49 V50 W57	K49-L53 WeakPolarHBondContact O-CB 3.4Å; K49-L53 VanDerWaalsContact O-CG 3.32Å; K49-L53 WeakPolarHBondContact O-CG 3.46Å; K49-L53 PolarHBondContact O-N 2.68Å; V50-L53 PolarHBondContact O-N 3.14Å; L53-W57 VanDerWaalsContact O-CB 3.27Å; L53-W57 WeakPolarHBondContact O-CB 3.32Å; L53-W57 PolarHBondContact O-N 3.26Å
54	Q	90.8	Very high	90.6	Very high	112 Å²	112	103.6 Å²	103.6	52%	0.523	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-40.9	173.7	-175.9	176.6	-12.9	0	0	112.1	V50 R51 T52 W57 E58	V50-Q54 WeakPolarHBondContact O-CB 3.38Å; V50-Q54 PolarHBondContact O-N 3.25Å; R51-Q54 PolarHBondContact O-N 3.2Å; T52-Q54 PolarHBondContact O-N 2.74Å; Q54-W57 PolarHBondContact O-N 2.87Å; Q54-E58 WeakPolarHBondContact O-CB 3.11Å; Q54-E58 PolarHBondContact O-N 3.36Å
55	L	93.8	Very high	90.1	Very high	107 Å²	107	102.6 Å²	102.6	56%	0.56	50%	0.501	S	S	*	.	H	α-helix	trans	-68.4	-40.5	175.2	-70.8	165.7	0	0	0	111.9	R51 T52 E58 T59	R51-L55 WeakPolarHBondContact O-CG 3.16Å; R51-L55 PolarHBondContact O-N 3.38Å; R51-L55 VanDerWaalsContact O-N 3.15Å; T52-L55 WeakPolarHBondContact O-CB 3.46Å; T52-L55 PolarHBondContact O-N 2.92Å; L55-E58 PolarHBondContact O-N 2.85Å; L55-T59 WeakPolarHBondContact O-CG2 3.38Å; L55-T59 PolarHBondContact O-N 2.97Å; L55-T59 PolarHBondContact O-OG1 2.98Å
56	D	90	Very high	89.7	Confident	82 Å²	82	100 Å²	100	44%	0.439	50%	0.495	S	S	.	.	H	α-helix	trans	-61.6	-44.4	174.4	-63.2	-25.9	0	0	0	110.9	T52 T59 E60	T52-D56 VanDerWaalsContact O-CG 3.29Å; T52-D56 PolarHBondContact O-N 3.32Å; D56-T59 PolarHBondContact O-N 3.31Å; D56-T59 PolarHBondContact O-OG1 3.23Å; D56-E60 PolarHBondContact O-N 3.42Å
57	W	89.2	Confident	89.3	Confident	161 Å²	161	100 Å²	100	61%	0.61	49%	0.489	S	S	*	.	H	α-helix	trans	-62.5	-43.5	175	176.6	85.1	0	0	0	112.4	L53 Q54 T59 Q61	L53-W57 VanDerWaalsContact O-CB 3.27Å; L53-W57 WeakPolarHBondContact O-CB 3.32Å; L53-W57 PolarHBondContact O-N 3.26Å; Q54-W57 PolarHBondContact O-N 2.87Å; W57-T59 PolarHBondContact O-N 3.35Å; W57-Q61 VanDerWaalsContact O-CB 3.31Å; W57-Q61 WeakPolarHBondContact O-CB 3.38Å; W57-Q61 PolarHBondContact O-N 3.16Å
58	E	90.4	Very high	88.9	Confident	64 Å²	64	101.5 Å²	101.5	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-38.6	175.9	-88	-164.5	-140.7	0	0	113	Q54 L55 K62	Q54-E58 WeakPolarHBondContact O-CB 3.11Å; Q54-E58 PolarHBondContact O-N 3.36Å; L55-E58 PolarHBondContact O-N 2.85Å; E58-K62 WeakPolarHBondContact O-CD 3.45Å; E58-K62 VanDerWaalsContact O-CG 3.22Å; E58-K62 WeakPolarHBondContact O-CG 3.46Å; E58-K62 PolarHBondContact O-N 3.4Å; E58-K62 VanDerWaalsContact O-N 3.09Å; E58-K62 IonicContact OE2-NZ 2.72Å; E58-K62 PolarHBondContact OE2-NZ 3.04Å
59	T	88.9	Confident	88.3	Confident	79 Å²	79	100.8 Å²	100.8	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-72.3	-42.3	179.5	53.8	0	0	0	0	111.4	L55 D56 W57 Q61 K62 R63	L55-T59 WeakPolarHBondContact O-CG2 3.38Å; L55-T59 PolarHBondContact O-N 2.97Å; L55-T59 PolarHBondContact O-OG1 2.98Å; D56-T59 PolarHBondContact O-N 3.31Å; D56-T59 PolarHBondContact O-OG1 3.23Å; W57-T59 PolarHBondContact O-N 3.35Å; T59-Q61 VanDerWaalsContact C-N 3.34Å; T59-Q61 PolarHBondContact O-N 3.4Å; T59-K62 PolarHBondContact O-N 3Å; T59-R63 WeakPolarHBondContact O-CB 3.46Å; T59-R63 PolarHBondContact O-N 3.39Å
60	E	84.3	Confident	87.9	Confident	97 Å²	97	100.5 Å²	100.5	45%	0.453	49%	0.491	S	S	.	.	H	α-helix	trans	-67	-31.4	172.7	-79.3	-61.3	140.6	0	0	112.9	D56 R63 S64	D56-E60 PolarHBondContact O-N 3.42Å; E60-R63 PolarHBondContact O-N 3.17Å; E60-R63 WeakPolarHBondContact OE1-CD 3.39Å; E60-R63 IonicContact OE1-CZ 3.69Å; E60-R63 IonicContact OE1-NE 2.81Å; E60-R63 IonicContact OE1-NH1 3.18Å; E60-R63 PolarHBondContact OE1-NH1 3.3Å; E60-R63 WeakPolarHBondContact OE2-CD 3.45Å; E60-S64 VanDerWaalsContact O-CB 3.24Å; E60-S64 WeakPolarHBondContact O-CB 3.25Å; E60-S64 PolarHBondContact O-N 3.49Å
61	Q	86.8	Confident	87.1	Confident	107 Å²	107	99.8 Å²	99.8	50%	0.5	49%	0.487	S	S	.	.	H	α-helix	trans	-62.5	-46.4	170.4	-170.8	-172.6	54.9	0	0	111.4	W57 T59 R63 S64 L65	W57-Q61 VanDerWaalsContact O-CB 3.31Å; W57-Q61 WeakPolarHBondContact O-CB 3.38Å; W57-Q61 PolarHBondContact O-N 3.16Å; T59-Q61 VanDerWaalsContact C-N 3.34Å; T59-Q61 PolarHBondContact O-N 3.4Å; Q61-R63 VanDerWaalsContact C-N 3.34Å; Q61-R63 PolarHBondContact O-N 3.07Å; Q61-S64 PolarHBondContact O-N 3.38Å; Q61-L65 PolarHBondContact O-N 3.38Å
62	K	87.5	Confident	86.7	Confident	118 Å²	118	96.6 Å²	96.6	51%	0.513	48%	0.482	S	S	.	.	H	α-helix	trans	-63	-39.4	175.9	-69	156.2	-167	156.4	0	111.3	E58 T59 S66	E58-K62 WeakPolarHBondContact O-CD 3.45Å; E58-K62 VanDerWaalsContact O-CG 3.22Å; E58-K62 WeakPolarHBondContact O-CG 3.46Å; E58-K62 PolarHBondContact O-N 3.4Å; E58-K62 VanDerWaalsContact O-N 3.09Å; E58-K62 IonicContact OE2-NZ 2.72Å; E58-K62 PolarHBondContact OE2-NZ 3.04Å; T59-K62 PolarHBondContact O-N 3Å; K62-S66 PolarHBondContact O-N 3.04Å; K62-S66 VanDerWaalsContact O-N 3.12Å
63	R	87.3	Confident	86.1	Confident	101 Å²	101	99.4 Å²	99.4	38%	0.381	49%	0.49	S	S	.	.	H	α-helix	trans	-64.8	-46.3	176.1	-165.9	-170.9	-171.3	161	5.2	112.3	T59 E60 Q61 L65 S66 Y67	T59-R63 WeakPolarHBondContact O-CB 3.46Å; T59-R63 PolarHBondContact O-N 3.39Å; E60-R63 PolarHBondContact O-N 3.17Å; E60-R63 WeakPolarHBondContact OE1-CD 3.39Å; E60-R63 IonicContact OE1-CZ 3.69Å; E60-R63 IonicContact OE1-NE 2.81Å; E60-R63 IonicContact OE1-NH1 3.18Å; E60-R63 PolarHBondContact OE1-NH1 3.3Å; E60-R63 WeakPolarHBondContact OE2-CD 3.45Å; Q61-R63 VanDerWaalsContact C-N 3.34Å; Q61-R63 PolarHBondContact O-N 3.07Å; R63-L65 PolarHBondContact O-N 3.24Å; R63-S66 WeakPolarHBondContact O-CB 3.34Å; R63-S66 PolarHBondContact O-N 3.31Å; R63-S66 VanDerWaalsContact O-N 3.15Å; R63-Y67 HydrophobicContact CG-CD2 4.18Å; R63-Y67 HydrophobicContact CG-CE2 3.55Å; R63-Y67 PolarHBondContact NE-OH 2.67Å; R63-Y67 PolarHBondContact NH2-OH 3.35Å; R63-Y67 PolarHBondContact O-N 2.92Å
64	S	76.6	Confident	85.3	Confident	75 Å²	75	97.9 Å²	97.9	52%	0.524	48%	0.482	S	S	.	.	H	α-helix	trans	-59.4	-44.5	176.1	-176.7	0	0	0	0	111.8	E60 Q61 S66 Y67 F68	E60-S64 VanDerWaalsContact O-CB 3.24Å; E60-S64 WeakPolarHBondContact O-CB 3.25Å; E60-S64 PolarHBondContact O-N 3.49Å; Q61-S64 PolarHBondContact O-N 3.38Å; S64-S66 VanDerWaalsContact C-N 3.31Å; S64-S66 PolarHBondContact O-N 2.95Å; S64-Y67 PolarHBondContact O-N 3.41Å; S64-F68 WeakPolarHBondContact O-CB 3.39Å; S64-F68 PolarHBondContact O-N 2.88Å
65	L	84.8	Confident	84.7	Confident	108 Å²	108	96.6 Å²	96.6	57%	0.565	48%	0.476	S	S	*	.	H	α-helix	trans	-60.4	-39.6	174.4	-167.7	74.8	0	0	0	112.2	Q61 R63 F68 N69	Q61-L65 PolarHBondContact O-N 3.38Å; R63-L65 PolarHBondContact O-N 3.24Å; L65-F68 PolarHBondContact O-N 3.41Å; L65-N69 VanDerWaalsContact O-CG 3.28Å; L65-N69 PolarHBondContact O-N 2.79Å; L65-N69 PolarHBondContact O-ND2 3.46Å
66	S	87.6	Confident	84.3	Confident	55 Å²	55	98.6 Å²	98.6	39%	0.385	48%	0.48	S	S	.	.	H	α-helix	trans	-63.3	-47.7	175.6	-169.6	0	0	0	0	112	K62 R63 S64 F68 N69 Q70	K62-S66 PolarHBondContact O-N 3.04Å; K62-S66 VanDerWaalsContact O-N 3.12Å; R63-S66 WeakPolarHBondContact O-CB 3.34Å; R63-S66 PolarHBondContact O-N 3.31Å; R63-S66 VanDerWaalsContact O-N 3.15Å; S64-S66 VanDerWaalsContact C-N 3.31Å; S64-S66 PolarHBondContact O-N 2.95Å; S66-F68 VanDerWaalsContact C-N 3.34Å; S66-F68 PolarHBondContact O-N 2.94Å; S66-N69 PolarHBondContact O-N 3.02Å; S66-Q70 WeakPolarHBondContact O-CG 3.38Å; S66-Q70 PolarHBondContact O-N 3.06Å
67	Y	84.1	Confident	84	Confident	105 Å²	105	97.7 Å²	97.7	41%	0.412	47%	0.473	S	S	.	.	H	α-helix	trans	-65.1	-34.4	176.6	-65	-36.9	0	0	0	113.1	R63 S64 T71	R63-Y67 HydrophobicContact CG-CD2 4.18Å; R63-Y67 HydrophobicContact CG-CE2 3.55Å; R63-Y67 PolarHBondContact NE-OH 2.67Å; R63-Y67 PolarHBondContact NH2-OH 3.35Å; R63-Y67 PolarHBondContact O-N 2.92Å; S64-Y67 PolarHBondContact O-N 3.41Å; Y67-T71 WeakPolarHBondContact O-CB 3.23Å; Y67-T71 PolarHBondContact O-N 3.5Å; Y67-T71 PolarHBondContact O-OG1 3.32Å
68	F	84.2	Confident	83.8	Confident	132 Å²	132	93.5 Å²	93.5	58%	0.579	46%	0.458	S	S	*	.	H	α-helix	trans	-61.2	-49.9	171.9	-179.2	-97.1	0	0	0	111.3	S64 L65 S66 Q70 T71 V72	S64-F68 WeakPolarHBondContact O-CB 3.39Å; S64-F68 PolarHBondContact O-N 2.88Å; L65-F68 PolarHBondContact O-N 3.41Å; S66-F68 VanDerWaalsContact C-N 3.34Å; S66-F68 PolarHBondContact O-N 2.94Å; F68-Q70 PolarHBondContact O-N 2.87Å; F68-T71 WeakPolarHBondContact O-CB 3.24Å; F68-T71 PolarHBondContact O-N 2.78Å; F68-T71 VanDerWaalsContact O-N 3.11Å; F68-V72 HydrophobicContact CD1-CG2 4.31Å; F68-V72 HydrophobicContact CE1-CG2 3.89Å; F68-V72 HydrophobicContact CE2-CG2 4.5Å; F68-V72 HydrophobicContact CZ-CG2 3.99Å; F68-V72 WeakPolarHBondContact O-CG2 3.47Å; F68-V72 PolarHBondContact O-N 2.76Å
69	N	83.9	Confident	83.3	Confident	86 Å²	86	92.9 Å²	92.9	46%	0.46	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-45.3	178.1	-69.1	-26.5	0	0	0	112.1	L65 S66 T71 V72 E73	L65-N69 VanDerWaalsContact O-CG 3.28Å; L65-N69 PolarHBondContact O-N 2.79Å; L65-N69 PolarHBondContact O-ND2 3.46Å; S66-N69 PolarHBondContact O-N 3.02Å; N69-T71 VanDerWaalsContact C-N 3.26Å; N69-T71 PolarHBondContact O-N 3.34Å; N69-V72 PolarHBondContact O-N 2.95Å; N69-E73 PolarHBondContact O-N 2.94Å
70	Q	83.3	Confident	83.2	Confident	100 Å²	100	95.3 Å²	95.3	47%	0.467	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-35.3	175	-70.4	178.3	9.2	0	0	112.6	S66 F68 L74	S66-Q70 WeakPolarHBondContact O-CG 3.38Å; S66-Q70 PolarHBondContact O-N 3.06Å; F68-Q70 PolarHBondContact O-N 2.87Å; Q70-L74 WeakPolarHBondContact O-CG 3.4Å; Q70-L74 PolarHBondContact O-N 3.12Å; Q70-L74 VanDerWaalsContact O-N 3.07Å
71	T	77.1	Confident	83	Confident	76 Å²	76	92.4 Å²	92.4	47%	0.466	45%	0.454	S	S	.	.	H	α-helix	trans	-66.8	-46.5	175.9	-57.3	0	0	0	0	110.8	Y67 F68 N69 E73 L74 E75	Y67-T71 WeakPolarHBondContact O-CB 3.23Å; Y67-T71 PolarHBondContact O-N 3.5Å; Y67-T71 PolarHBondContact O-OG1 3.32Å; F68-T71 WeakPolarHBondContact O-CB 3.24Å; F68-T71 PolarHBondContact O-N 2.78Å; F68-T71 VanDerWaalsContact O-N 3.11Å; N69-T71 VanDerWaalsContact C-N 3.26Å; N69-T71 PolarHBondContact O-N 3.34Å; T71-E73 VanDerWaalsContact C-N 3.31Å; T71-E73 PolarHBondContact O-N 3.34Å; T71-L74 WeakPolarHBondContact O-CB 3.49Å; T71-L74 PolarHBondContact O-N 2.91Å; T71-L74 VanDerWaalsContact O-N 3.14Å; T71-E75 WeakPolarHBondContact O-CG 3.21Å; T71-E75 PolarHBondContact O-N 3.09Å
72	V	82.4	Confident	82.6	Confident	70 Å²	70	89.8 Å²	89.8	42%	0.424	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-38.2	177	173.6	0	0	0	0	111.9	F68 N69 E75 K76	F68-V72 HydrophobicContact CD1-CG2 4.31Å; F68-V72 HydrophobicContact CE1-CG2 3.89Å; F68-V72 HydrophobicContact CE2-CG2 4.5Å; F68-V72 HydrophobicContact CZ-CG2 3.99Å; F68-V72 WeakPolarHBondContact O-CG2 3.47Å; F68-V72 PolarHBondContact O-N 2.76Å; N69-V72 PolarHBondContact O-N 2.95Å; V72-E75 PolarHBondContact O-N 2.89Å; V72-K76 PolarHBondContact O-N 2.66Å; V72-K76 VanDerWaalsContact O-N 3.09Å
73	E	82.2	Confident	82.4	Confident	137 Å²	137	91.4 Å²	91.4	64%	0.64	45%	0.447	S	S	*	.	H	α-helix	trans	-66.1	-41.6	173.5	-69.7	-162.5	140.4	0	0	112.7	N69 T71 E75 K76 E77	N69-E73 PolarHBondContact O-N 2.94Å; T71-E73 VanDerWaalsContact C-N 3.31Å; T71-E73 PolarHBondContact O-N 3.34Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.43Å; E73-K76 WeakPolarHBondContact O-CB 3.39Å; E73-K76 PolarHBondContact O-N 2.91Å; E73-E77 PolarHBondContact O-N 2.96Å
74	L	77.1	Confident	82.2	Confident	83 Å²	83	89.8 Å²	89.8	44%	0.435	45%	0.451	S	S	.	.	H	α-helix	trans	-63.4	-36.8	175.3	-77.5	170.2	0	0	0	112.8	Q70 T71 K76 R78	Q70-L74 WeakPolarHBondContact O-CG 3.4Å; Q70-L74 PolarHBondContact O-N 3.12Å; Q70-L74 VanDerWaalsContact O-N 3.07Å; T71-L74 WeakPolarHBondContact O-CB 3.49Å; T71-L74 PolarHBondContact O-N 2.91Å; T71-L74 VanDerWaalsContact O-N 3.14Å; L74-K76 VanDerWaalsContact C-N 3.35Å; L74-R78 VanDerWaalsContact O-CB 3.28Å; L74-R78 WeakPolarHBondContact O-CB 3.45Å; L74-R78 PolarHBondContact O-N 2.96Å
75	E	77.5	Confident	82.7	Confident	86 Å²	86	90.3 Å²	90.3	40%	0.402	44%	0.441	S	S	.	.	H	α-helix	trans	-66.3	-38	173.4	-65.5	-153.6	106.8	0	0	111.9	T71 V72 E73 R78 D79	T71-E75 WeakPolarHBondContact O-CG 3.21Å; T71-E75 PolarHBondContact O-N 3.09Å; V72-E75 PolarHBondContact O-N 2.89Å; E73-E75 VanDerWaalsContact C-N 3.34Å; E73-E75 PolarHBondContact O-N 3.43Å; E75-R78 WeakPolarHBondContact O-CB 3.3Å; E75-R78 PolarHBondContact O-N 2.92Å; E75-R78 IonicContact OE1-CZ 3.4Å; E75-R78 IonicContact OE1-NH1 3.86Å; E75-R78 PolarHBondContact OE1-NH1 3.39Å; E75-R78 IonicContact OE1-NH2 3.69Å; E75-R78 PolarHBondContact OE1-NH2 3.32Å; E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 VanDerWaalsContact O-CG 3.27Å; E75-D79 PolarHBondContact O-N 2.88Å
76	K	86.3	Confident	82.6	Confident	148 Å²	148	88.6 Å²	88.6	64%	0.643	43%	0.433	S	S	*	.	H	α-helix	trans	-67.3	-43.6	175	-172.5	-178.8	176.5	-174.5	0	112.5	V72 E73 L74 D79 Q80	V72-K76 PolarHBondContact O-N 2.66Å; V72-K76 VanDerWaalsContact O-N 3.09Å; E73-K76 WeakPolarHBondContact O-CB 3.39Å; E73-K76 PolarHBondContact O-N 2.91Å; L74-K76 VanDerWaalsContact C-N 3.35Å; K76-D79 PolarHBondContact O-N 3.45Å; K76-Q80 WeakPolarHBondContact O-CB 3.32Å; K76-Q80 PolarHBondContact O-N 2.91Å; K76-Q80 VanDerWaalsContact O-N 3.14Å
77	E	82.5	Confident	82.7	Confident	64 Å²	64	88.9 Å²	88.9	30%	0.299	44%	0.435	S	S	.	.	H	α-helix	trans	-58.2	-47.9	172	-73.8	-166.9	136.9	0	0	110.4	E73 Q80 A81 S216 R220	E73-E77 PolarHBondContact O-N 2.96Å; E77-Q80 PolarHBondContact O-N 3.01Å; E77-A81 PolarHBondContact O-N 3Å; E77-S216 WeakPolarHBondContact OE1-CB 3.26Å; E77-S216 PolarHBondContact OE1-OG 3.48Å; E77-R220 IonicContact OE1-NH2 2.69Å; E77-R220 IonicContact OE2-NH2 3.75Å; E77-R220 PolarHBondContact OE2-NH2 3.49Å
78	R	84.4	Confident	82.7	Confident	73 Å²	73	88.7 Å²	88.7	28%	0.275	44%	0.44	S	S	.	.	H	α-helix	trans	-55.7	-52.8	176.8	172.7	-160.2	72.8	-157.8	2.7	112.2	L74 E75 Q80 A81 L82	L74-R78 VanDerWaalsContact O-CB 3.28Å; L74-R78 WeakPolarHBondContact O-CB 3.45Å; L74-R78 PolarHBondContact O-N 2.96Å; E75-R78 WeakPolarHBondContact O-CB 3.3Å; E75-R78 PolarHBondContact O-N 2.92Å; E75-R78 IonicContact OE1-CZ 3.4Å; E75-R78 IonicContact OE1-NH1 3.86Å; E75-R78 PolarHBondContact OE1-NH1 3.39Å; E75-R78 IonicContact OE1-NH2 3.69Å; E75-R78 PolarHBondContact OE1-NH2 3.32Å; R78-Q80 VanDerWaalsContact C-N 3.28Å; R78-Q80 PolarHBondContact O-N 3.25Å; R78-A81 WeakPolarHBondContact O-CB 3.48Å; R78-A81 PolarHBondContact O-N 3.37Å; R78-A81 VanDerWaalsContact O-N 3.12Å; R78-L82 HydrophobicContact CG-CD1 4.11Å; R78-L82 WeakPolarHBondContact O-CG 3.5Å; R78-L82 PolarHBondContact O-N 2.81Å
79	D	80.4	Confident	82.7	Confident	51 Å²	51	87.1 Å²	87.1	27%	0.273	44%	0.435	S	S	.	.	H	α-helix	trans	-71.8	-26.3	-172.4	-68.4	-17.1	0	0	0	112.1	E75 K76 R83	E75-D79 WeakPolarHBondContact O-CB 3.39Å; E75-D79 VanDerWaalsContact O-CG 3.27Å; E75-D79 PolarHBondContact O-N 2.88Å; K76-D79 PolarHBondContact O-N 3.45Å; D79-R83 WeakPolarHBondContact O-CG 3.43Å; D79-R83 PolarHBondContact O-N 3.3Å; D79-R83 VanDerWaalsContact O-N 3.14Å; D79-R83 PolarHBondContact O-NE 3.5Å; D79-R83 PolarHBondContact O-NH2 2.96Å
80	Q	87.1	Confident	82.8	Confident	130 Å²	130	88.4 Å²	88.4	61%	0.607	44%	0.441	S	S	*	.	H	α-helix	trans	-68.8	-42	168.5	-176.9	170	-15.5	0	0	111.9	K76 E77 R78 R83 S84	K76-Q80 WeakPolarHBondContact O-CB 3.32Å; K76-Q80 PolarHBondContact O-N 2.91Å; K76-Q80 VanDerWaalsContact O-N 3.14Å; E77-Q80 PolarHBondContact O-N 3.01Å; R78-Q80 VanDerWaalsContact C-N 3.28Å; R78-Q80 PolarHBondContact O-N 3.25Å; Q80-R83 PolarHBondContact O-N 2.86Å; Q80-S84 WeakPolarHBondContact O-CB 3.38Å; Q80-S84 PolarHBondContact O-N 3.42Å
81	A	79.6	Confident	83.2	Confident	35 Å²	35	88.3 Å²	88.3	29%	0.289	44%	0.44	S	S	.	.	H	α-helix	trans	-65	-38.2	176.1	0	0	0	0	0	112.7	E77 R78 S84 R85 P209	E77-A81 PolarHBondContact O-N 3Å; R78-A81 WeakPolarHBondContact O-CB 3.48Å; R78-A81 PolarHBondContact O-N 3.37Å; R78-A81 VanDerWaalsContact O-N 3.12Å; A81-S84 PolarHBondContact O-N 3.43Å; A81-R85 PolarHBondContact O-N 2.9Å; A81-P209 HydrophobicContact CB-CB 4.5Å
82	L	78.2	Confident	83.6	Confident	52 Å²	52	91.9 Å²	91.9	27%	0.272	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-51.2	174.4	-69.7	173.1	0	0	0	111.6	R78 S84 R85 D86	R78-L82 HydrophobicContact CG-CD1 4.11Å; R78-L82 WeakPolarHBondContact O-CG 3.5Å; R78-L82 PolarHBondContact O-N 2.81Å; L82-S84 VanDerWaalsContact C-N 3.26Å; L82-S84 PolarHBondContact O-N 3.24Å; L82-R85 WeakPolarHBondContact O-CB 3.46Å; L82-R85 PolarHBondContact O-N 2.95Å; L82-R85 VanDerWaalsContact O-N 3.16Å; L82-D86 PolarHBondContact O-N 3.41Å
83	R	83.5	Confident	83.9	Confident	153 Å²	153	91.8 Å²	91.8	58%	0.577	45%	0.446	S	S	*	.	H	α-helix	trans	-57.2	-37.8	176.4	-74.6	-176.8	-67.5	-93	-1.8	113	D79 Q80 D86 S87	D79-R83 WeakPolarHBondContact O-CG 3.43Å; D79-R83 PolarHBondContact O-N 3.3Å; D79-R83 VanDerWaalsContact O-N 3.14Å; D79-R83 PolarHBondContact O-NE 3.5Å; D79-R83 PolarHBondContact O-NH2 2.96Å; Q80-R83 PolarHBondContact O-N 2.86Å; R83-D86 PolarHBondContact O-N 3.34Å; R83-S87 PolarHBondContact O-N 2.88Å; R83-S87 VanDerWaalsContact O-N 3.14Å
84	S	83.2	Confident	84.3	Confident	67 Å²	67	89.7 Å²	89.7	47%	0.469	44%	0.439	S	S	.	.	H	α-helix	trans	-63	-49.9	175.4	179.8	0	0	0	0	112.1	Q80 A81 L82 D86 S87 L88	Q80-S84 WeakPolarHBondContact O-CB 3.38Å; Q80-S84 PolarHBondContact O-N 3.42Å; A81-S84 PolarHBondContact O-N 3.43Å; L82-S84 VanDerWaalsContact C-N 3.26Å; L82-S84 PolarHBondContact O-N 3.24Å; S84-D86 VanDerWaalsContact C-N 3.3Å; S84-D86 PolarHBondContact O-N 3.23Å; S84-S87 PolarHBondContact O-N 3.19Å; S84-L88 WeakPolarHBondContact O-CG 3.21Å; S84-L88 PolarHBondContact O-N 3.11Å
85	R	87.5	Confident	85	Confident	86 Å²	86	89.8 Å²	89.8	33%	0.325	45%	0.446	S	S	.	.	H	α-helix	trans	-56.8	-45.2	175.4	-178.6	-160.7	67.1	-173.8	-4	111.5	A81 L82 S87 L88 Q89	A81-R85 PolarHBondContact O-N 2.9Å; L82-R85 WeakPolarHBondContact O-CB 3.46Å; L82-R85 PolarHBondContact O-N 2.95Å; L82-R85 VanDerWaalsContact O-N 3.16Å; R85-S87 VanDerWaalsContact C-N 3.35Å; R85-S87 PolarHBondContact O-N 2.66Å; R85-L88 PolarHBondContact O-N 2.77Å; R85-Q89 HydrophobicContact CG-CG 4.43Å; R85-Q89 WeakPolarHBondContact O-CG 3.37Å; R85-Q89 PolarHBondContact O-N 3.24Å
86	D	82.8	Confident	85.6	Confident	72 Å²	72	88.8 Å²	88.8	39%	0.385	44%	0.443	S	S	.	.	H	α-helix	trans	-70.6	-32.4	-172.3	-61.9	-10.1	0	0	0	111.7	L82 R83 S84 L90	L82-D86 PolarHBondContact O-N 3.41Å; R83-D86 PolarHBondContact O-N 3.34Å; S84-D86 VanDerWaalsContact C-N 3.3Å; S84-D86 PolarHBondContact O-N 3.23Å; D86-L90 PolarHBondContact O-N 2.9Å; D86-L90 VanDerWaalsContact O-N 3.11Å
87	S	88.8	Confident	85.7	Confident	61 Å²	61	86.3 Å²	86.3	43%	0.427	44%	0.436	S	S	.	.	H	α-helix	trans	-61.3	-52.6	168.1	-166.2	0	0	0	0	111.6	R83 S84 R85 Q89 L90 E91	R83-S87 PolarHBondContact O-N 2.88Å; R83-S87 VanDerWaalsContact O-N 3.14Å; S84-S87 PolarHBondContact O-N 3.19Å; R85-S87 VanDerWaalsContact C-N 3.35Å; R85-S87 PolarHBondContact O-N 2.66Å; S87-Q89 VanDerWaalsContact C-N 3.25Å; S87-Q89 PolarHBondContact O-N 2.91Å; S87-L90 WeakPolarHBondContact O-CB 3.34Å; S87-L90 PolarHBondContact O-N 3.22Å; S87-E91 WeakPolarHBondContact O-CG 3.2Å; S87-E91 PolarHBondContact O-N 3Å; S87-E91 PolarHBondContact OG-OE1 3.47Å
88	L	85.4	Confident	86.3	Confident	101 Å²	101	86.6 Å²	86.6	53%	0.529	44%	0.44	S	S	.	.	H	α-helix	trans	-63	-31.5	-179	-67.6	171.5	0	0	0	112.6	S84 R85 Y92	S84-L88 WeakPolarHBondContact O-CG 3.21Å; S84-L88 PolarHBondContact O-N 3.11Å; R85-L88 PolarHBondContact O-N 2.77Å; L88-Y92 VanDerWaalsContact O-CB 3.29Å; L88-Y92 WeakPolarHBondContact O-CB 3.35Å; L88-Y92 PolarHBondContact O-N 2.94Å
89	Q	84.4	Confident	86.7	Confident	99 Å²	99	88.4 Å²	88.4	46%	0.463	45%	0.45	S	S	.	.	H	α-helix	trans	-68.6	-39.7	172.5	-75.8	-172.7	-36.7	0	0	112.2	R85 S87 Y92 T93	R85-Q89 HydrophobicContact CG-CG 4.43Å; R85-Q89 WeakPolarHBondContact O-CG 3.37Å; R85-Q89 PolarHBondContact O-N 3.24Å; S87-Q89 VanDerWaalsContact C-N 3.25Å; S87-Q89 PolarHBondContact O-N 2.91Å; Q89-Y92 PolarHBondContact O-N 3.44Å; Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å
90	L	86.3	Confident	87.4	Confident	112 Å²	112	89.8 Å²	89.8	59%	0.586	46%	0.457	S	S	*	.	H	α-helix	trans	-63.7	-50.2	175.7	-168.8	70.2	0	0	0	111.1	D86 S87 Y92 T93 D94	D86-L90 PolarHBondContact O-N 2.9Å; D86-L90 VanDerWaalsContact O-N 3.11Å; S87-L90 WeakPolarHBondContact O-CB 3.34Å; S87-L90 PolarHBondContact O-N 3.22Å; L90-Y92 VanDerWaalsContact C-N 3.29Å; L90-Y92 PolarHBondContact O-N 3.41Å; L90-T93 WeakPolarHBondContact CA-OG1 3.25Å; L90-T93 PolarHBondContact O-N 3.25Å; L90-T93 PolarHBondContact O-OG1 2.89Å; L90-D94 PolarHBondContact O-N 2.79Å
91	E	90.3	Very high	87.8	Confident	98 Å²	98	91.2 Å²	91.2	46%	0.458	46%	0.457	S	S	.	.	H	α-helix	trans	-56	-42.2	175.9	-68	161.8	-128.8	0	0	111.9	S87 D94 C95	S87-E91 WeakPolarHBondContact O-CG 3.2Å; S87-E91 PolarHBondContact O-N 3Å; S87-E91 PolarHBondContact OG-OE1 3.47Å; E91-D94 PolarHBondContact O-N 2.7Å; E91-C95 PolarHBondContact O-N 3.12Å; E91-C95 PolarHBondContact O-SG 3.3Å
92	Y	86.6	Confident	88.5	Confident	151 Å²	151	94.3 Å²	94.3	59%	0.592	47%	0.468	S	S	*	.	H	α-helix	trans	-65.1	-40	174.3	-179.5	-104.2	0	0	0	112.9	L88 Q89 L90 C95 L96	L88-Y92 VanDerWaalsContact O-CB 3.29Å; L88-Y92 WeakPolarHBondContact O-CB 3.35Å; L88-Y92 PolarHBondContact O-N 2.94Å; Q89-Y92 PolarHBondContact O-N 3.44Å; L90-Y92 VanDerWaalsContact C-N 3.29Å; L90-Y92 PolarHBondContact O-N 3.41Å; Y92-C95 PolarHBondContact O-N 3.44Å; Y92-L96 HydrophobicContact CD1-CD1 4.1Å; Y92-L96 HydrophobicContact CD1-CG 4.45Å; Y92-L96 HydrophobicContact CE1-CD1 3.43Å; Y92-L96 VanDerWaalsContact CE1-CD1 3.43Å; Y92-L96 HydrophobicContact CE1-CG 3.98Å; Y92-L96 HydrophobicContact CE2-CG 4.43Å; Y92-L96 PolarHBondContact O-N 2.82Å
93	T	88.9	Confident	89.2	Confident	68 Å²	68	98.9 Å²	98.9	42%	0.417	48%	0.482	S	S	.	.	H	α-helix	trans	-65.2	-39.4	175.8	47.7	0	0	0	0	112.6	Q89 L90 L96 L97	Q89-T93 PolarHBondContact O-N 3.3Å; Q89-T93 PolarHBondContact O-OG1 2.87Å; L90-T93 WeakPolarHBondContact CA-OG1 3.25Å; L90-T93 PolarHBondContact O-N 3.25Å; L90-T93 PolarHBondContact O-OG1 2.89Å; T93-L96 PolarHBondContact O-N 3.29Å; T93-L97 WeakPolarHBondContact O-CG 3.46Å; T93-L97 PolarHBondContact O-N 3.33Å
94	D	90.3	Very high	89.8	Confident	94 Å²	94	98.1 Å²	98.1	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-64.3	-40.8	174.9	-79.9	-22.3	0	0	0	111.6	L90 E91 L96 L97 D98	L90-D94 PolarHBondContact O-N 2.79Å; E91-D94 PolarHBondContact O-N 2.7Å; D94-L96 VanDerWaalsContact C-N 3.31Å; D94-L96 PolarHBondContact O-N 3.5Å; D94-L97 PolarHBondContact O-N 3.08Å; D94-D98 PolarHBondContact O-N 3.1Å
95	C	91.6	Very high	90.3	Very high	85 Å²	85	99.8 Å²	99.8	57%	0.574	48%	0.483	S	S	*	.	H	α-helix	trans	-62.7	-35.3	174.3	-69.5	0	0	0	0	112.9	E91 Y92 K99	E91-C95 PolarHBondContact O-N 3.12Å; E91-C95 PolarHBondContact O-SG 3.3Å; Y92-C95 PolarHBondContact O-N 3.44Å; C95-K99 VanDerWaalsContact O-CB 3.24Å; C95-K99 WeakPolarHBondContact O-CB 3.31Å; C95-K99 PolarHBondContact O-N 3.5Å
96	L	89.4	Confident	90.6	Very high	65 Å²	65	100.2 Å²	100.2	34%	0.34	49%	0.49	S	S	.	.	H	α-helix	trans	-71.2	-39.4	173.5	-75.3	-175.9	0	0	0	112.6	Y92 T93 D94 N100	Y92-L96 HydrophobicContact CD1-CD1 4.1Å; Y92-L96 HydrophobicContact CD1-CG 4.45Å; Y92-L96 HydrophobicContact CE1-CD1 3.43Å; Y92-L96 VanDerWaalsContact CE1-CD1 3.43Å; Y92-L96 HydrophobicContact CE1-CG 3.98Å; Y92-L96 HydrophobicContact CE2-CG 4.43Å; Y92-L96 PolarHBondContact O-N 2.82Å; T93-L96 PolarHBondContact O-N 3.29Å; D94-L96 VanDerWaalsContact C-N 3.31Å; D94-L96 PolarHBondContact O-N 3.5Å; L96-N100 VanDerWaalsContact O-CG 3.28Å; L96-N100 PolarHBondContact O-N 2.59Å; L96-N100 PolarHBondContact O-ND2 3.42Å
97	L	89.8	Confident	91.2	Very high	95 Å²	95	99.2 Å²	99.2	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-45.9	175.2	-71.9	172.5	0	0	0	110.8	T93 D94 N100 R101	T93-L97 WeakPolarHBondContact O-CG 3.46Å; T93-L97 PolarHBondContact O-N 3.33Å; D94-L97 PolarHBondContact O-N 3.08Å; L97-N100 PolarHBondContact O-N 3.12Å; L97-N100 VanDerWaalsContact O-N 3.14Å; L97-R101 PolarHBondContact O-N 2.99Å
98	D	94.1	Very high	91.5	Very high	70 Å²	70	99.9 Å²	99.9	37%	0.374	49%	0.489	S	S	.	.	H	α-helix	trans	-68.6	-41.4	-179.7	-154.5	65.7	0	0	0	112.5	D94 N100 R101 L102	D94-D98 PolarHBondContact O-N 3.1Å; D98-N100 PolarHBondContact O-N 2.89Å; D98-R101 WeakPolarHBondContact O-CA 3.43Å; D98-R101 WeakPolarHBondContact O-CB 3.4Å; D98-R101 PolarHBondContact O-N 2.87Å; D98-R101 WeakPolarHBondContact OD1-CD 3.37Å; D98-R101 IonicContact OD1-CZ 2.66Å; D98-R101 IonicContact OD1-NH1 3.74Å; D98-R101 PolarHBondContact OD1-NH1 2.89Å; D98-L102 WeakPolarHBondContact O-CG 3.42Å; D98-L102 PolarHBondContact O-N 3.14Å
99	K	93.4	Very high	91.9	Very high	111 Å²	111	99.2 Å²	99.2	48%	0.483	49%	0.485	S	S	.	.	H	α-helix	trans	-55	-34.7	169.3	-179.7	174.9	-179.8	174.2	0	112.8	C95 R103	C95-K99 VanDerWaalsContact O-CB 3.24Å; C95-K99 WeakPolarHBondContact O-CB 3.31Å; C95-K99 PolarHBondContact O-N 3.5Å; K99-R103 WeakPolarHBondContact O-CB 3.36Å; K99-R103 WeakPolarHBondContact O-CD 3.44Å; K99-R103 VanDerWaalsContact O-CG 3.27Å; K99-R103 WeakPolarHBondContact O-CG 3.2Å; K99-R103 PolarHBondContact O-N 2.62Å
100	N	93.9	Very high	92.4	Very high	80 Å²	80	99.9 Å²	99.9	43%	0.428	49%	0.488	S	S	.	.	H	α-helix	trans	-76.8	-32	176	-71.8	-27.6	0	0	0	112.8	L96 L97 D98 R103 K104	L96-N100 VanDerWaalsContact O-CG 3.28Å; L96-N100 PolarHBondContact O-N 2.59Å; L96-N100 PolarHBondContact O-ND2 3.42Å; L97-N100 PolarHBondContact O-N 3.12Å; L97-N100 VanDerWaalsContact O-N 3.14Å; D98-N100 PolarHBondContact O-N 2.89Å; N100-R103 PolarHBondContact OD1-NH1 3.41Å; N100-R103 VanDerWaalsContact OD1-NH1 3.15Å; N100-K104 PolarHBondContact O-N 2.95Å; N100-K104 VanDerWaalsContact O-N 3.07Å
101	R	95.3	Very high	92.8	Very high	160 Å²	160	96.8 Å²	96.8	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-61.1	-49	168	-62.8	174	-172.6	143.4	-2.7	111	L97 D98 R103 K104 H105	L97-R101 PolarHBondContact O-N 2.99Å; D98-R101 WeakPolarHBondContact O-CA 3.43Å; D98-R101 WeakPolarHBondContact O-CB 3.4Å; D98-R101 PolarHBondContact O-N 2.87Å; D98-R101 WeakPolarHBondContact OD1-CD 3.37Å; D98-R101 IonicContact OD1-CZ 2.66Å; D98-R101 IonicContact OD1-NH1 3.74Å; D98-R101 PolarHBondContact OD1-NH1 2.89Å; R101-R103 VanDerWaalsContact C-N 3.35Å; R101-R103 PolarHBondContact O-N 2.92Å; R101-K104 WeakPolarHBondContact O-CB 3.04Å; R101-K104 PolarHBondContact O-N 2.86Å; R101-K104 VanDerWaalsContact O-N 3.14Å; R101-H105 PolarHBondContact O-N 2.86Å
102	L	94.8	Very high	93	Very high	101 Å²	101	96.6 Å²	96.6	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-60.1	-42.6	178.3	-67.4	172.6	0	0	0	111.9	D98 K104 H105 I106	D98-L102 WeakPolarHBondContact O-CG 3.42Å; D98-L102 PolarHBondContact O-N 3.14Å; L102-K104 PolarHBondContact O-N 3.15Å; L102-H105 PolarHBondContact O-N 2.63Å; L102-I106 WeakPolarHBondContact O-CG1 3.26Å; L102-I106 PolarHBondContact O-N 2.69Å
103	R	93.8	Very high	93.3	Very high	147 Å²	147	94.5 Å²	94.5	56%	0.555	48%	0.48	S	S	*	.	H	α-helix	trans	-58.8	-43.2	173	-79.7	165.3	156.1	-175.1	-12.1	113	K99 N100 R101 H105 I106 A107	K99-R103 WeakPolarHBondContact O-CB 3.36Å; K99-R103 WeakPolarHBondContact O-CD 3.44Å; K99-R103 VanDerWaalsContact O-CG 3.27Å; K99-R103 WeakPolarHBondContact O-CG 3.2Å; K99-R103 PolarHBondContact O-N 2.62Å; N100-R103 PolarHBondContact OD1-NH1 3.41Å; N100-R103 VanDerWaalsContact OD1-NH1 3.15Å; R101-R103 VanDerWaalsContact C-N 3.35Å; R101-R103 PolarHBondContact O-N 2.92Å; R103-H105 VanDerWaalsContact C-N 3.34Å; R103-I106 PolarHBondContact O-N 3.18Å; R103-A107 PolarHBondContact O-N 2.78Å; R103-A107 VanDerWaalsContact O-N 3.12Å
104	K	94.6	Very high	93.6	Very high	137 Å²	137	96.1 Å²	96.1	60%	0.596	48%	0.482	S	S	*	.	H	α-helix	trans	-61.9	-44.1	176	-174.6	176.3	-177	-82.9	0	110.8	N100 R101 L102 I106 A107 E108	N100-K104 PolarHBondContact O-N 2.95Å; N100-K104 VanDerWaalsContact O-N 3.07Å; R101-K104 WeakPolarHBondContact O-CB 3.04Å; R101-K104 PolarHBondContact O-N 2.86Å; R101-K104 VanDerWaalsContact O-N 3.14Å; L102-K104 PolarHBondContact O-N 3.15Å; K104-I106 PolarHBondContact O-N 3.09Å; K104-A107 PolarHBondContact O-N 2.79Å; K104-E108 IonicContact NZ-OE1 3.85Å; K104-E108 PolarHBondContact NZ-OE1 3.07Å; K104-E108 WeakPolarHBondContact O-CG 3.41Å; K104-E108 PolarHBondContact O-N 3.42Å
105	H	94.7	Very high	93.7	Very high	102 Å²	102	96 Å²	96	47%	0.472	48%	0.479	S	S	.	.	H	α-helix	trans	-65.6	-37.5	179.1	-165	49	0	0	0	113.2	R101 L102 R103 A107 E108 L109	R101-H105 PolarHBondContact O-N 2.86Å; L102-H105 PolarHBondContact O-N 2.63Å; R103-H105 VanDerWaalsContact C-N 3.34Å; H105-A107 PolarHBondContact O-N 3.29Å; H105-E108 IonicContact ND1-OE2 2.79Å; H105-E108 PolarHBondContact ND1-OE2 2.84Å; H105-E108 PolarHBondContact O-N 3.34Å; H105-L109 WeakPolarHBondContact O-CG 3.31Å; H105-L109 PolarHBondContact O-N 3.32Å
106	I	94.8	Very high	93.7	Very high	95 Å²	95	98.1 Å²	98.1	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-60.8	-44.4	172.3	-69.2	163.1	0	0	0	110.9	L102 R103 K104 L109 Q110	L102-I106 WeakPolarHBondContact O-CG1 3.26Å; L102-I106 PolarHBondContact O-N 2.69Å; R103-I106 PolarHBondContact O-N 3.18Å; K104-I106 PolarHBondContact O-N 3.09Å; I106-L109 PolarHBondContact O-N 2.98Å; I106-Q110 HydrophobicContact CG2-CG 4.46Å; I106-Q110 WeakPolarHBondContact O-CB 3.3Å; I106-Q110 VanDerWaalsContact O-CG 3.3Å; I106-Q110 WeakPolarHBondContact O-CG 3.32Å; I106-Q110 PolarHBondContact O-N 2.93Å
107	A	94.3	Very high	93.7	Very high	52 Å²	52	101 Å²	101	43%	0.43	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-37.7	177.8	0	0	0	0	0	112.8	R103 K104 H105 Q110 A111	R103-A107 PolarHBondContact O-N 2.78Å; R103-A107 VanDerWaalsContact O-N 3.12Å; K104-A107 PolarHBondContact O-N 2.79Å; H105-A107 PolarHBondContact O-N 3.29Å; A107-Q110 PolarHBondContact O-N 3.1Å; A107-A111 WeakPolarHBondContact O-CB 3.17Å; A107-A111 PolarHBondContact O-N 3.02Å
108	E	95.3	Very high	93.8	Very high	75 Å²	75	101.1 Å²	101.1	35%	0.35	49%	0.486	S	S	.	.	H	α-helix	trans	-61.9	-45.2	172.9	-70.9	164.4	172.7	0	0	111.7	K104 H105 A111 N112	K104-E108 IonicContact NZ-OE1 3.85Å; K104-E108 PolarHBondContact NZ-OE1 3.07Å; K104-E108 WeakPolarHBondContact O-CG 3.41Å; K104-E108 PolarHBondContact O-N 3.42Å; H105-E108 IonicContact ND1-OE2 2.79Å; H105-E108 PolarHBondContact ND1-OE2 2.84Å; H105-E108 PolarHBondContact O-N 3.34Å; E108-A111 PolarHBondContact O-N 3.17Å; E108-N112 VanDerWaalsContact O-CG 3.24Å; E108-N112 PolarHBondContact O-N 3Å; E108-N112 VanDerWaalsContact O-N 3.1Å; E108-N112 PolarHBondContact O-ND2 2.99Å
109	L	94.3	Very high	93.6	Very high	86 Å²	86	101.7 Å²	101.7	45%	0.45	49%	0.486	S	S	.	.	H	α-helix	trans	-65.3	-38.9	176.6	-70.4	170.1	0	0	0	112.3	H105 I106 N112 L113	H105-L109 WeakPolarHBondContact O-CG 3.31Å; H105-L109 PolarHBondContact O-N 3.32Å; I106-L109 PolarHBondContact O-N 2.98Å; L109-N112 PolarHBondContact O-N 3.45Å; L109-L113 WeakPolarHBondContact O-CG 3.37Å; L109-L113 PolarHBondContact O-N 2.95Å
110	Q	94.4	Very high	93.3	Very high	113 Å²	113	100.4 Å²	100.4	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-63	-47.4	175.2	-74.9	173.4	-43.5	0	0	111.7	I106 A107 N112 L113 E114	I106-Q110 HydrophobicContact CG2-CG 4.46Å; I106-Q110 WeakPolarHBondContact O-CB 3.3Å; I106-Q110 VanDerWaalsContact O-CG 3.3Å; I106-Q110 WeakPolarHBondContact O-CG 3.32Å; I106-Q110 PolarHBondContact O-N 2.93Å; A107-Q110 PolarHBondContact O-N 3.1Å; Q110-N112 VanDerWaalsContact C-N 3.29Å; Q110-N112 PolarHBondContact O-N 3.43Å; Q110-L113 PolarHBondContact O-N 2.66Å; Q110-E114 PolarHBondContact O-N 3.28Å
111	A	94.3	Very high	93	Very high	48 Å²	48	101.8 Å²	101.8	40%	0.397	49%	0.488	S	S	.	.	H	α-helix	trans	-60.5	-37.6	177.3	0	0	0	0	0	112.7	A107 E108 Q115	A107-A111 WeakPolarHBondContact O-CB 3.17Å; A107-A111 PolarHBondContact O-N 3.02Å; E108-A111 PolarHBondContact O-N 3.17Å; A111-Q115 WeakPolarHBondContact O-CB 3.43Å; A111-Q115 PolarHBondContact O-N 2.67Å
112	N	94.1	Very high	92.5	Very high	94 Å²	94	100 Å²	100	50%	0.503	48%	0.482	S	S	.	.	H	α-helix	trans	-66.9	-41.5	175	-70.5	-22	0	0	0	112.3	E108 L109 Q110 Q115 Q116	E108-N112 VanDerWaalsContact O-CG 3.24Å; E108-N112 PolarHBondContact O-N 3Å; E108-N112 VanDerWaalsContact O-N 3.1Å; E108-N112 PolarHBondContact O-ND2 2.99Å; L109-N112 PolarHBondContact O-N 3.45Å; Q110-N112 VanDerWaalsContact C-N 3.29Å; Q110-N112 PolarHBondContact O-N 3.43Å; N112-Q115 PolarHBondContact O-N 3.03Å; N112-Q116 PolarHBondContact O-N 3.17Å
113	L	94.2	Very high	92.1	Very high	107 Å²	107	100.7 Å²	100.7	56%	0.56	48%	0.482	S	S	*	.	H	α-helix	trans	-64	-45	176.6	-75	170	0	0	0	111.8	L109 Q110 Q115 Q116 Q117	L109-L113 WeakPolarHBondContact O-CG 3.37Å; L109-L113 PolarHBondContact O-N 2.95Å; Q110-L113 PolarHBondContact O-N 2.66Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 3.02Å; L113-Q116 PolarHBondContact O-N 2.91Å; L113-Q117 WeakPolarHBondContact O-CG 3.42Å; L113-Q117 PolarHBondContact O-N 3.48Å
114	E	93.9	Very high	91.5	Very high	101 Å²	101	100.8 Å²	100.8	47%	0.472	48%	0.482	S	S	.	.	H	α-helix	trans	-61.8	-36.4	173.4	-67.7	178.7	-164.5	0	0	112.3	Q110 Q117 R118	Q110-E114 PolarHBondContact O-N 3.28Å; E114-Q117 PolarHBondContact O-N 2.98Å; E114-R118 WeakPolarHBondContact O-CB 3.49Å; E114-R118 VanDerWaalsContact O-CG 3.3Å; E114-R118 WeakPolarHBondContact O-CG 3.32Å; E114-R118 PolarHBondContact O-N 2.79Å; E114-R118 PolarHBondContact O-NE 3.31Å; E114-R118 IonicContact OE2-CZ 3.77Å; E114-R118 IonicContact OE2-NH2 3.23Å; E114-R118 PolarHBondContact OE2-NH2 2.83Å
115	Q	93.5	Very high	90.9	Very high	92 Å²	92	99.6 Å²	99.6	43%	0.43	48%	0.479	S	S	.	.	H	α-helix	trans	-63.3	-48.1	175.6	176	169.9	-19.5	0	0	111.3	A111 N112 L113 Q117 R118 E119	A111-Q115 WeakPolarHBondContact O-CB 3.43Å; A111-Q115 PolarHBondContact O-N 2.67Å; N112-Q115 PolarHBondContact O-N 3.03Å; L113-Q115 VanDerWaalsContact C-N 3.28Å; L113-Q115 PolarHBondContact O-N 3.02Å; Q115-Q117 VanDerWaalsContact C-N 3.33Å; Q115-Q117 PolarHBondContact O-N 3.06Å; Q115-R118 PolarHBondContact O-N 3.13Å; Q115-E119 HydrophobicContact CG-CG 4.48Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.43Å; Q115-E119 PolarHBondContact NE2-OE1 2.85Å; Q115-E119 WeakPolarHBondContact O-CG 3.38Å; Q115-E119 PolarHBondContact O-N 2.91Å
116	Q	91.1	Very high	90.2	Very high	130 Å²	130	101.3 Å²	101.3	61%	0.607	48%	0.481	S	S	*	.	H	α-helix	trans	-64.5	-36.8	177.4	-70.5	-159.7	-36.3	0	0	112.4	N112 L113 E119 L120	N112-Q116 PolarHBondContact O-N 3.17Å; L113-Q116 PolarHBondContact O-N 2.91Å; Q116-E119 PolarHBondContact O-N 3.43Å; Q116-L120 VanDerWaalsContact O-CB 3.26Å; Q116-L120 WeakPolarHBondContact O-CB 3.46Å; Q116-L120 PolarHBondContact O-N 3.25Å
117	Q	90.1	Very high	89.2	Confident	125 Å²	125	100.5 Å²	100.5	58%	0.584	48%	0.483	S	S	*	.	H	α-helix	trans	-59.7	-49.3	171.6	-74.4	175	-13.5	0	0	111.4	L113 E114 Q115 E119 L120 E121	L113-Q117 WeakPolarHBondContact O-CG 3.42Å; L113-Q117 PolarHBondContact O-N 3.48Å; E114-Q117 PolarHBondContact O-N 2.98Å; Q115-Q117 VanDerWaalsContact C-N 3.33Å; Q115-Q117 PolarHBondContact O-N 3.06Å; Q117-E119 VanDerWaalsContact C-N 3.27Å; Q117-E119 PolarHBondContact O-N 3.02Å; Q117-L120 PolarHBondContact O-N 2.94Å; Q117-E121 WeakPolarHBondContact O-CB 3.49Å; Q117-E121 WeakPolarHBondContact O-CG 3.48Å; Q117-E121 PolarHBondContact O-N 3.35Å
118	R	90.8	Very high	87.9	Confident	98 Å²	98	105.7 Å²	105.7	37%	0.37	49%	0.492	S	S	.	.	H	α-helix	trans	-63.5	-27.3	177	-73.6	-179.9	-100.9	110.4	-11.2	113.5	E114 Q115 R122	E114-R118 WeakPolarHBondContact O-CB 3.49Å; E114-R118 VanDerWaalsContact O-CG 3.3Å; E114-R118 WeakPolarHBondContact O-CG 3.32Å; E114-R118 PolarHBondContact O-N 2.79Å; E114-R118 PolarHBondContact O-NE 3.31Å; E114-R118 IonicContact OE2-CZ 3.77Å; E114-R118 IonicContact OE2-NH2 3.23Å; E114-R118 PolarHBondContact OE2-NH2 2.83Å; Q115-R118 PolarHBondContact O-N 3.13Å; R118-R122 WeakPolarHBondContact O-CD 3.47Å; R118-R122 WeakPolarHBondContact O-CG 3.47Å; R118-R122 PolarHBondContact O-N 3.48Å; R118-R122 PolarHBondContact O-NE 2.86Å; R118-R122 PolarHBondContact O-NH1 3.34Å
119	E	89.1	Confident	86.6	Confident	81 Å²	81	107.9 Å²	107.9	38%	0.379	50%	0.502	S	S	.	.	H	α-helix	trans	-77.3	-43	174	-74.6	166.3	-174.2	0	0	111.9	Q115 Q116 Q117 R122 E123	Q115-E119 HydrophobicContact CG-CG 4.48Å; Q115-E119 WeakPolarHBondContact CG-OE1 3.43Å; Q115-E119 PolarHBondContact NE2-OE1 2.85Å; Q115-E119 WeakPolarHBondContact O-CG 3.38Å; Q115-E119 PolarHBondContact O-N 2.91Å; Q116-E119 PolarHBondContact O-N 3.43Å; Q117-E119 VanDerWaalsContact C-N 3.27Å; Q117-E119 PolarHBondContact O-N 3.02Å; E119-R122 PolarHBondContact O-N 2.95Å; E119-E123 PolarHBondContact O-N 2.91Å
120	L	89.2	Confident	85.1	Confident	85 Å²	85	110.7 Å²	110.7	45%	0.445	51%	0.513	S	S	.	.	H	α-helix	trans	-69.1	-32.9	178.7	-155.1	162.4	0	0	0	111.6	Q116 Q117 E123 R124	Q116-L120 VanDerWaalsContact O-CB 3.26Å; Q116-L120 WeakPolarHBondContact O-CB 3.46Å; Q116-L120 PolarHBondContact O-N 3.25Å; Q117-L120 PolarHBondContact O-N 2.94Å; L120-E123 PolarHBondContact O-N 3.36Å; L120-R124 HydrophobicContact CD2-CG 4.23Å; L120-R124 VanDerWaalsContact CD2-NE 3.27Å; L120-R124 WeakPolarHBondContact O-CG 3.4Å; L120-R124 PolarHBondContact O-N 2.91Å
121	E	86.6	Confident	83.2	Confident	108 Å²	108	112.3 Å²	112.3	51%	0.505	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-46.3	169	-75	179.3	151.5	0	0	112.1	Q117 E123 R124 E125	Q117-E121 WeakPolarHBondContact O-CB 3.49Å; Q117-E121 WeakPolarHBondContact O-CG 3.48Å; Q117-E121 PolarHBondContact O-N 3.35Å; E121-E123 VanDerWaalsContact C-N 3.25Å; E121-E123 PolarHBondContact O-N 3.2Å; E121-R124 CarbonylContact O-C 3.49Å; E121-R124 WeakPolarHBondContact O-CA 3.39Å; E121-R124 WeakPolarHBondContact O-CB 3.38Å; E121-R124 PolarHBondContact O-N 3.18Å; E121-E125 WeakPolarHBondContact O-CG 3.41Å; E121-E125 PolarHBondContact O-N 3.32Å
122	R	85.8	Confident	81.4	Confident	123 Å²	123	118 Å²	118	46%	0.464	54%	0.541	S	S	.	.	H	α-helix	trans	-64.4	-26.8	174.8	-67.6	164.8	-169	141.9	-5.6	113.1	R118 E119 R126	R118-R122 WeakPolarHBondContact O-CD 3.47Å; R118-R122 WeakPolarHBondContact O-CG 3.47Å; R118-R122 PolarHBondContact O-N 3.48Å; R118-R122 PolarHBondContact O-NE 2.86Å; R118-R122 PolarHBondContact O-NH1 3.34Å; E119-R122 PolarHBondContact O-N 2.95Å; R122-R126 WeakPolarHBondContact O-CB 3.44Å; R122-R126 VanDerWaalsContact O-CG 3.28Å; R122-R126 WeakPolarHBondContact O-CG 3.39Å; R122-R126 PolarHBondContact O-N 2.98Å; R122-R126 VanDerWaalsContact O-N 3.16Å; R122-R126 PolarHBondContact O-NE 3.41Å
123	E	84.6	Confident	79.4	Confident	115 Å²	115	121.5 Å²	121.5	54%	0.537	55%	0.554	S	S	.	*	H	α-helix	trans	-71.7	-43.3	168.2	-75	-169.7	160.4	0	0	111.9	E119 L120 E121 E125 R126 C127	E119-E123 PolarHBondContact O-N 2.91Å; L120-E123 PolarHBondContact O-N 3.36Å; E121-E123 VanDerWaalsContact C-N 3.25Å; E121-E123 PolarHBondContact O-N 3.2Å; E123-E125 VanDerWaalsContact C-N 3.28Å; E123-E125 PolarHBondContact O-N 3.45Å; E123-R126 PolarHBondContact O-N 3.39Å; E123-R126 IonicContact OE1-NH2 2.86Å; E123-C127 WeakPolarHBondContact O-CB 3.42Å; E123-C127 PolarHBondContact O-N 2.82Å; E123-C127 PolarHBondContact O-SG 3.3Å; E123-C127 VanDerWaalsContact O-SG 3.32Å
124	R	82.8	Confident	76.9	Confident	149 Å²	149	120.2 Å²	120.2	56%	0.562	55%	0.554	S	S	*	*	H	α-helix	trans	-62.7	-32.2	174.7	-72	167.2	171.6	-177	-0.5	113.2	L120 E121 R128	L120-R124 HydrophobicContact CD2-CG 4.23Å; L120-R124 VanDerWaalsContact CD2-NE 3.27Å; L120-R124 WeakPolarHBondContact O-CG 3.4Å; L120-R124 PolarHBondContact O-N 2.91Å; E121-R124 CarbonylContact O-C 3.49Å; E121-R124 WeakPolarHBondContact O-CA 3.39Å; E121-R124 WeakPolarHBondContact O-CB 3.38Å; E121-R124 PolarHBondContact O-N 3.18Å; R124-R128 WeakPolarHBondContact O-CG 3.4Å; R124-R128 PolarHBondContact O-N 3.04Å; R124-R128 VanDerWaalsContact O-N 3.17Å
125	E	80.9	Confident	74.9	Confident	113 Å²	113	120.8 Å²	120.8	53%	0.528	57%	0.566	S	S	.	*	H	α-helix	trans	-70.3	-53.1	173	-71.9	178.3	148.1	0	0	111	E121 E123 C127 R128 E129	E121-E125 WeakPolarHBondContact O-CG 3.41Å; E121-E125 PolarHBondContact O-N 3.32Å; E123-E125 VanDerWaalsContact C-N 3.28Å; E123-E125 PolarHBondContact O-N 3.45Å; E125-C127 VanDerWaalsContact C-N 3.28Å; E125-C127 PolarHBondContact O-N 3.39Å; E125-R128 WeakPolarHBondContact O-CA 3.37Å; E125-R128 WeakPolarHBondContact O-CB 3.49Å; E125-R128 PolarHBondContact O-N 3.41Å; E125-E129 PolarHBondContact O-N 3.2Å
126	R	80.6	Confident	72.3	Confident	138 Å²	138	122 Å²	122	52%	0.521	58%	0.584	S	S	.	*	H	α-helix	trans	-55.3	-41.5	175.9	-75.1	177.8	-72	171.8	1	112.6	R122 E123 R128 E129 Q130	R122-R126 WeakPolarHBondContact O-CB 3.44Å; R122-R126 VanDerWaalsContact O-CG 3.28Å; R122-R126 WeakPolarHBondContact O-CG 3.39Å; R122-R126 PolarHBondContact O-N 2.98Å; R122-R126 VanDerWaalsContact O-N 3.16Å; R122-R126 PolarHBondContact O-NE 3.41Å; E123-R126 PolarHBondContact O-N 3.39Å; E123-R126 IonicContact OE1-NH2 2.86Å; R126-R128 PolarHBondContact O-N 2.97Å; R126-E129 PolarHBondContact O-N 3.48Å; R126-Q130 VanDerWaalsContact O-CB 3.28Å; R126-Q130 WeakPolarHBondContact O-CB 3.42Å; R126-Q130 PolarHBondContact O-N 3.26Å
127	C	72.6	Confident	69.9	Low	78 Å²	78	122.8 Å²	122.8	53%	0.527	59%	0.591	S	S	.	*	H	α-helix	trans	-64.5	-36.2	173.9	-72.6	0	0	0	0	112.9	E123 E125 M131	E123-C127 WeakPolarHBondContact O-CB 3.42Å; E123-C127 PolarHBondContact O-N 2.82Å; E123-C127 PolarHBondContact O-SG 3.3Å; E123-C127 VanDerWaalsContact O-SG 3.32Å; E125-C127 VanDerWaalsContact C-N 3.28Å; E125-C127 PolarHBondContact O-N 3.39Å; C127-M131 WeakPolarHBondContact O-CB 3.29Å; C127-M131 PolarHBondContact O-N 2.94Å
128	R	68.4	Low	67.4	Low	160 Å²	160	124.1 Å²	124.1	60%	0.604	60%	0.602	S	S	*	*	H	α-helix	trans	-68.9	-42.2	175.1	-84	-170.8	-96.7	-148.8	4	112.4	R124 E125 R126 M131 Q132	R124-R128 WeakPolarHBondContact O-CG 3.4Å; R124-R128 PolarHBondContact O-N 3.04Å; R124-R128 VanDerWaalsContact O-N 3.17Å; E125-R128 WeakPolarHBondContact O-CA 3.37Å; E125-R128 WeakPolarHBondContact O-CB 3.49Å; E125-R128 PolarHBondContact O-N 3.41Å; R126-R128 PolarHBondContact O-N 2.97Å; R128-M131 PolarHBondContact O-N 3Å; R128-Q132 WeakPolarHBondContact O-CG 3.43Å; R128-Q132 PolarHBondContact O-N 3.06Å
129	E	66.7	Low	64.5	Low	121 Å²	121	125.7 Å²	125.7	57%	0.565	63%	0.627	S	S	*	*	H	α-helix	trans	-61.8	-44.4	174.8	-66.9	177.2	148.1	0	0	111.1	E125 R126 M131 Q132	E125-E129 PolarHBondContact O-N 3.2Å; R126-E129 PolarHBondContact O-N 3.48Å; E129-M131 VanDerWaalsContact C-N 3.3Å; E129-M131 PolarHBondContact O-N 3.16Å; E129-Q132 PolarHBondContact O-N 3.42Å; E129-Q132 VanDerWaalsContact O-N 3.11Å
130	Q	62.4	Low	62.2	Low	146 Å²	146	126.5 Å²	126.5	68%	0.682	64%	0.641	S	S	*	*	H	α-helix	trans	-63.8	-34.3	177.6	-164.8	165.5	22.8	0	0	112.3	R126 Q132 Q133	R126-Q130 VanDerWaalsContact O-CB 3.28Å; R126-Q130 WeakPolarHBondContact O-CB 3.42Å; R126-Q130 PolarHBondContact O-N 3.26Å; Q130-Q132 VanDerWaalsContact C-N 3.29Å; Q130-Q132 PolarHBondContact O-N 2.68Å; Q130-Q133 PolarHBondContact O-N 2.66Å
131	M	56.3	Low	59.6	Low	147 Å²	147	131 Å²	131	72%	0.724	66%	0.659	S	S	*	*	H	α-helix	trans	-76	-11.9	176.2	-154.1	171.1	78.7	0	0	113.8	C127 R128 E129	C127-M131 WeakPolarHBondContact O-CB 3.29Å; C127-M131 PolarHBondContact O-N 2.94Å; R128-M131 PolarHBondContact O-N 3Å; E129-M131 VanDerWaalsContact C-N 3.3Å; E129-M131 PolarHBondContact O-N 3.16Å
132	Q	55.3	Low	57.3	Low	168 Å²	168	133.2 Å²	133.2	79%	0.785	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7.1	173.8	-72	180	15.3	0	0	113.7	R128 E129 Q130	R128-Q132 WeakPolarHBondContact O-CG 3.43Å; R128-Q132 PolarHBondContact O-N 3.06Å; E129-Q132 PolarHBondContact O-N 3.42Å; E129-Q132 VanDerWaalsContact O-N 3.11Å; Q130-Q132 VanDerWaalsContact C-N 3.29Å; Q130-Q132 PolarHBondContact O-N 2.68Å
133	Q	53.5	Low	55.2	Low	167 Å²	167	132.9 Å²	132.9	78%	0.78	69%	0.691	S	S	*	*	S	Bend	trans	-101.6	3.2	-177.2	-64.2	-173.8	8.9	0	0	114.3	Q130	Q130-Q133 PolarHBondContact O-N 2.66Å
134	S	41.5	Very low	53	Low	80 Å²	80	135.3 Å²	135.3	56%	0.559	71%	0.706	S	S	*	*			trans	-111.6	117.7	-180	56	0	0	0	0	112.8
135	P	50.6	Low	50.7	Low	112 Å²	112	133.5 Å²	133.5	73%	0.727	72%	0.715	S	S	*	*			trans	-80.8	176.5	169.7	34.7	-35	0	0	0	112.3
136	C	38.4	Very low	48.5	Very low	118 Å²	118	132.8 Å²	132.8	80%	0.797	72%	0.723	S	S	*	*			trans	74.6	143.3	-174.6	-55.6	0	0	0	0	114.3
137	L	41.5	Very low	46.5	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	74%	0.737	S	S	*	*			cis	161.6	129.2	-20.3	-106.9	163.6	0	0	0	103.7
138	N	38	Very low	44.8	Very low	153 Å²	153	136.5 Å²	136.5	82%	0.818	74%	0.742	S	S	*	*			trans	42.9	121.2	165.5	-62.7	-3.8	0	0	0	120.1
139	C	29.5	Very low	43.3	Very low	131 Å²	131	136.4 Å²	136.4	89%	0.885	75%	0.749	S	S	*	*				-153.1	155.8	107.8	-153.8	0	0	0	0	111.7
140	S	41.1	Very low	41.8	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	76%	0.757	S	S	*	*			trans	-119.7	171.1	-179.8	-51.1	0	0	0	0	111.1
141	H	35.7	Very low	40.7	Very low	179 Å²	179	138.4 Å²	138.4	83%	0.829	77%	0.766	S	S	*	*			trans	77	156.9	162.4	-89.4	-96.2	0	0	0	119.8
142	L	36.5	Very low	39.6	Very low	156 Å²	156	134.8 Å²	134.8	82%	0.817	77%	0.767	S	S	*	*			trans	66.7	104	178.6	-50.9	179.4	0	0	0	113.2
143	S	42.7	Very low	39	Very low	115 Å²	115	132.6 Å²	132.6	80%	0.804	77%	0.767	S	S	*	*			cis	58.4	104.6	26.1	-162.1	0	0	0	0	114
144	L	39.3	Very low	37.9	Very low	166 Å²	166	129.9 Å²	129.9	87%	0.869	77%	0.765	S	S	*	*			trans	-142.5	141.4	165.9	-110.2	166.1	0	0	0	108.3
145	C	34.4	Very low	37.6	Very low	111 Å²	111	131.8 Å²	131.8	75%	0.75	78%	0.777	S	S	*	*			trans	-45.2	139.6	-171.2	-51.8	0	0	0	0	113.9
146	S	34	Very low	36.7	Very low	99 Å²	99	131 Å²	131	69%	0.692	77%	0.774	S	S	*	*				66	125.2	54.3	-61.4	0	0	0	0	114.1
147	E	37.8	Very low	36.3	Very low	175 Å²	175	132.6 Å²	132.6	82%	0.818	77%	0.774	S	S	*	*			trans	70.5	139.2	156.2	-69	157	-178.5	0	0	116.7
148	D	36.8	Very low	35.6	Very low	119 Å²	119	131.5 Å²	131.5	64%	0.636	77%	0.769	S	S	*	*			cis	-155.3	164.4	6.9	-137.9	-14.8	0	0	0	117.4
149	Q	37	Very low	35.2	Very low	157 Å²	157	131.1 Å²	131.1	73%	0.734	77%	0.766	S	S	*	*			trans	47.4	107.4	152.4	-75.7	162.6	61.3	0	0	121.2
150	C	35.3	Very low	35.1	Very low	110 Å²	110	130.9 Å²	130.9	74%	0.743	76%	0.756	S	S	*	*				-169.5	115	106.7	-106.6	0	0	0	0	113.6
151	F	39.2	Very low	34.6	Very low	200 Å²	200	134.4 Å²	134.4	88%	0.877	77%	0.766	S	S	*	*			trans	55.9	100.3	162.9	-57.2	-76.8	0	0	0	120.4
152	G	32.8	Very low	34.3	Very low	71 Å²	71	130.4 Å²	130.4	73%	0.732	76%	0.759	S	S	*	*			trans	-103.6	-147.7	151.9	0	0	0	0	0	110.8
153	P	44	Very low	34.1	Very low	121 Å²	121	131 Å²	131	79%	0.786	76%	0.762	S	S	*	*			cis	-115.6	143.1	-10.9	36.2	-21.7	0	0	0	112.5
154	C	30.7	Very low	33.6	Very low	110 Å²	110	133.9 Å²	133.9	74%	0.743	76%	0.762	S	S	*	*				70.1	113	72.9	-61.5	0	0	0	0	117.2
155	C	33.6	Very low	33.9	Very low	121 Å²	121	131 Å²	131	82%	0.818	75%	0.754	S	S	*	*			trans	71.3	151.1	134.2	-61.7	0	0	0	0	119.6
156	S	32.3	Very low	33.6	Very low	95 Å²	95	131.6 Å²	131.6	66%	0.664	75%	0.754	S	S	*	*			cis	-169.2	167.1	-4.9	-110.4	0	0	0	0	112.1
157	L	29.7	Very low	33.2	Very low	151 Å²	151	133.4 Å²	133.4	79%	0.791	76%	0.755	S	S	*	*			trans	68.2	148.2	164.5	-60	149.6	0	0	0	115.1
158	D	26.7	Very low	32.7	Very low	125 Å²	125	135.2 Å²	135.2	67%	0.668	75%	0.754	S	S	*	*			cis	-149	-161.6	1.4	-131.2	-24.7	0	0	0	108.6
159	L	29.4	Very low	32.3	Very low	144 Å²	144	137.9 Å²	137.9	75%	0.754	76%	0.76	S	S	*	*			cis	-153.6	128.4	14.1	-166.7	68.6	0	0	0	111.6
160	D	28	Very low	31.7	Very low	126 Å²	126	136.4 Å²	136.4	67%	0.674	76%	0.762	S	S	*	*			trans	43.7	150	140.1	-160	25.6	0	0	0	124.1
161	L	30.8	Very low	32.4	Very low	171 Å²	171	136.6 Å²	136.6	90%	0.895	76%	0.762	S	S	*	*			trans	-152.4	80.3	164.5	-123	179.1	0	0	0	112.2
162	S	28.7	Very low	32.6	Very low	95 Å²	95	132.5 Å²	132.5	66%	0.664	76%	0.755	S	S	*	*			trans	-93.3	176.1	174	-164.1	0	0	0	0	113.4
163	L	33.4	Very low	32.3	Very low	168 Å²	168	140 Å²	140	88%	0.88	76%	0.762	S	S	*	*			trans	-80.3	158.8	-170.6	-72.8	158.9	0	0	0	114.4
164	Q	32.9	Very low	31.6	Very low	176 Å²	176	137.2 Å²	137.2	82%	0.822	76%	0.755	S	S	*	*			trans	-52.6	163.7	173	-71.1	-122.2	5.9	0	0	114.1
165	P	45.1	Very low	31.6	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	75%	0.753	S	S	*	*			cis	-155.3	-170.7	33.9	44.6	-22.3	0	0	0	119.6
166	V	27.7	Very low	31.3	Very low	122 Å²	122	138.9 Å²	138.9	74%	0.739	74%	0.743	S	S	*	*			trans	83.4	110.7	143.2	156	0	0	0	0	122
167	L	25.9	Very low	31.2	Very low	138 Å²	138	139.7 Å²	139.7	72%	0.723	74%	0.74	S	S	*	*			trans	89.4	126.8	134.9	-138.5	75.4	0	0	0	125
168	R	26.4	Very low	31.1	Very low	212 Å²	212	139.2 Å²	139.2	80%	0.8	73%	0.734	S	S	*	*			trans	90.5	130.5	137.8	-106.3	172.7	-166.2	177.3	4.4	122.9
169	K	27.9	Very low	31.2	Very low	175 Å²	175	139.8 Å²	139.8	76%	0.761	74%	0.737	S	S	*	*			trans	78.6	94.1	143.1	-88.3	-173	173.4	-171	0	122.1
170	T	25.8	Very low	31	Very low	126 Å²	126	138.8 Å²	138.8	77%	0.773	74%	0.742	S	S	*	*				66.5	151.7	121.4	47.4	0	0	0	0	121.8
171	P	49.1	Very low	31.1	Very low	115 Å²	115	142 Å²	142	75%	0.747	75%	0.753	S	S	*	*			trans	-106.7	-170.5	-161.7	47.7	-38.9	0	0	0	112.1
172	P	44.6	Very low	30.9	Very low	113 Å²	113	137.5 Å²	137.5	73%	0.734	75%	0.747	S	S	*	*				-159.7	177.1	73	45.8	-25.1	0	0	0	119
173	R	26.1	Very low	30.9	Very low	230 Å²	230	137.9 Å²	137.9	87%	0.868	75%	0.75	S	S	*	*			trans	83.4	139.3	136.6	-160.8	175.3	-174.3	179.6	1.3	122
174	G	27.9	Very low	30.5	Very low	62 Å²	62	136.6 Å²	136.6	64%	0.639	74%	0.743	S	S	*	*			trans	118.1	108.9	172.8	0	0	0	0	0	110.5
175	Q	32.3	Very low	30.3	Very low	152 Å²	152	138.8 Å²	138.8	71%	0.71	75%	0.745	S	S	*	*			cis	63.7	130.5	46.2	-54.1	-162.9	-85.9	0	0	113
176	N	27.2	Very low	29.3	Very low	113 Å²	113	141 Å²	141	60%	0.604	75%	0.751	S	S	*	*			cis	-161	167.6	2.4	-121.7	34.8	0	0	0	111
177	N	28.8	Very low	29.4	Very low	112 Å²	112	141.1 Å²	141.1	60%	0.599	76%	0.757	S	S	*	*			trans	20.5	151.1	133.2	-62.3	35.5	0	0	0	120.9
178	E	29.2	Very low	29.5	Very low	142 Å²	142	143.7 Å²	143.7	66%	0.664	77%	0.766	S	S	*	*			cis	-168.1	169.7	-0.9	-113.9	169.8	138.4	0	0	112.4
179	N	27.3	Very low	29.5	Very low	136 Å²	136	142.6 Å²	142.6	73%	0.727	77%	0.77	S	S	*	*			trans	7.5	143.5	146	-40.2	-27.3	0	0	0	121.3
180	S	27	Very low	29.7	Very low	124 Å²	124	141 Å²	141	87%	0.867	77%	0.769	S	S	*	*				-159	155.9	119.3	-163.2	0	0	0	0	112
181	E	28.5	Very low	29.8	Very low	194 Å²	194	142.8 Å²	142.8	91%	0.907	77%	0.773	S	S	*	*			trans	-99.3	171.8	-178.3	-54.7	170.2	117.9	0	0	112.2
182	G	26.9	Very low	28.7	Very low	75 Å²	75	144.5 Å²	144.5	77%	0.773	78%	0.776	S	S	*	*			trans	173.3	96.4	167.3	0	0	0	0	0	120
183	S	28	Very low	28.2	Very low	104 Å²	104	144.5 Å²	144.5	73%	0.727	78%	0.778	S	S	*	*			trans	54.7	100.7	144.5	-165.1	0	0	0	0	122.9
184	I	26.8	Very low	28.3	Very low	140 Å²	140	139 Å²	139	72%	0.718	78%	0.775	S	S	*	*				29.8	126.9	111.8	-58.8	165.3	0	0	0	118.9
185	Y	27.5	Very low	28.3	Very low	222 Å²	222	141.8 Å²	141.8	87%	0.871	79%	0.785	S	S	*	*				-164.9	151.7	119.1	-107.4	-71.7	0	0	0	112.3
186	N	25.5	Very low	28.3	Very low	154 Å²	154	142.9 Å²	142.9	82%	0.824	79%	0.787	S	S	*	*			trans	-99.5	145.8	-178.1	-72.1	-7	0	0	0	113.1
187	S	28.7	Very low	28.8	Very low	124 Å²	124	142.9 Å²	142.9	87%	0.867	79%	0.787	S	S	*	*			trans	-163.3	148.9	136.2	45.6	0	0	0	0	111.2
188	E	27.8	Very low	29	Very low	192 Å²	192	142.2 Å²	142.2	90%	0.897	79%	0.791	S	S	*	*			trans	-103.2	140.2	177	-57.6	178	124.8	0	0	110.2
189	E	27	Very low	29.4	Very low	190 Å²	190	143.8 Å²	143.8	89%	0.888	80%	0.799	S	S	*	*				-163.4	170.3	122	-117.4	-166.1	132.9	0	0	112
190	N	30.8	Very low	30.1	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	80%	0.798	S	S	*	*			trans	-91.3	142	-164.3	-66.5	-89.4	0	0	0	113.4
191	L	28.6	Very low	30.8	Very low	163 Å²	163	148.4 Å²	148.4	85%	0.853	80%	0.799	S	S	*	*				163.4	163.3	112.2	-84.2	171.2	0	0	0	113.1
192	L	27.1	Very low	31.4	Very low	152 Å²	152	145 Å²	145	80%	0.796	79%	0.786	S	S	*	*			trans	74.1	90.3	167.9	-56.6	-177	0	0	0	119.9
193	S	33.3	Very low	32	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	78%	0.781	S	S	*	*				41.1	99.6	125.7	62.5	0	0	0	0	120.7
194	S	28.3	Very low	32.7	Very low	115 Å²	115	153.7 Å²	153.7	80%	0.804	79%	0.789	S	S	*	*			trans	-162.7	91.3	143.4	-176.2	0	0	0	0	111.2
195	S	27.3	Very low	33.3	Very low	121 Å²	121	154.3 Å²	154.3	85%	0.846	79%	0.793	S	S	*	*			trans	-97.4	95.6	168.4	-168	0	0	0	0	109.7
196	K	32.4	Very low	33.9	Very low	175 Å²	175	147.1 Å²	147.1	76%	0.761	78%	0.775	S	S	*	*			trans	-119.9	146.3	162.6	-109.7	-172.6	176.7	-176.6	0	108.4
197	D	38.4	Very low	34.7	Very low	112 Å²	112	144.6 Å²	144.6	60%	0.599	77%	0.766	S	S	*	*	S	Bend	trans	55.8	77	166.7	-70.7	-76.3	0	0	0	117.3	K200	D197-K200 WeakPolarHBondContact OD1-CE 3.47Å; D197-K200 IonicContact OD1-NZ 3.41Å; D197-K200 PolarHBondContact OD1-NZ 3.06Å
198	S	32.9	Very low	35.3	Very low	99 Å²	99	146.4 Å²	146.4	69%	0.692	76%	0.758	S	S	*	*			trans	-134.2	-1.1	150.3	65.4	0	0	0	0	115.1	K200	S198-K200 PolarHBondContact O-N 2.95Å
199	E	38.2	Very low	36	Very low	175 Å²	175	140.6 Å²	140.6	82%	0.818	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.2	15.2	177.5	-62.5	-164.6	138.8	0	0	115.1
200	K	41.8	Very low	37	Very low	166 Å²	166	138.9 Å²	138.9	72%	0.722	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	8.1	-173.7	-78	174.5	-178.9	155	0	115.3	D197 S198	D197-K200 WeakPolarHBondContact OD1-CE 3.47Å; D197-K200 IonicContact OD1-NZ 3.41Å; D197-K200 PolarHBondContact OD1-NZ 3.06Å; S198-K200 PolarHBondContact O-N 2.95Å
201	E	42	Very low	38	Very low	190 Å²	190	137.2 Å²	137.2	89%	0.888	72%	0.724	S	S	*	*			trans	-144	33	176	-130	156.2	-124.2	0	0	116.3	N203	E201-N203 PolarHBondContact O-N 3.42Å
202	I	39.4	Very low	39	Very low	122 Å²	122	132 Å²	132	63%	0.626	70%	0.7	S	S	*	*	S	Bend	trans	-98.4	87	167.3	-52.4	-176.8	0	0	0	110.5	R204 F210	I202-R204 PolarHBondContact O-N 2.75Å; I202-R204 VanDerWaalsContact O-N 3.08Å; I202-F210 HydrophobicContact CG2-CE1 4.38Å; I202-F210 HydrophobicContact CG2-CZ 4.36Å
203	N	39.3	Very low	40.2	Very low	125 Å²	125	128.6 Å²	128.6	67%	0.668	69%	0.687	S	S	*	*			trans	3.7	84	160.7	-155.3	-13	0	0	0	117	E201 L205 S206	E201-N203 PolarHBondContact O-N 3.42Å; N203-L205 PolarHBondContact O-N 3.3Å; N203-S206 PolarHBondContact O-N 2.62Å
204	R	42.6	Very low	41.1	Very low	237 Å²	237	127.6 Å²	127.6	89%	0.894	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	28.5	-174.5	-67.2	-174.1	171.6	-168.6	-4.1	115.7	I202	I202-R204 PolarHBondContact O-N 2.75Å; I202-R204 VanDerWaalsContact O-N 3.08Å
205	L	41.1	Very low	42.3	Very low	154 Å²	154	127.3 Å²	127.3	81%	0.806	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.1	4	176	-67	174.4	0	0	0	113.1	N203 T207	N203-L205 PolarHBondContact O-N 3.3Å; L205-T207 PolarHBondContact O-N 3.28Å
206	S	40	Very low	43.7	Very low	71 Å²	71	122.1 Å²	122.1	50%	0.497	63%	0.63	S	S	.	*			trans	-75.7	111.5	180	-173.5	0	0	0	0	112.4	N203 F208	N203-S206 PolarHBondContact O-N 2.62Å; S206-F208 PolarHBondContact O-N 2.98Å
207	T	40.8	Very low	44.7	Very low	101 Å²	101	117.7 Å²	117.7	62%	0.62	61%	0.614	S	S	*	*			trans	-79.2	2.8	174.1	-25.8	0	0	0	0	113.5	L205	L205-T207 PolarHBondContact O-N 3.28Å
208	F	42.1	Very low	45.3	Very low	161 Å²	161	116.6 Å²	116.6	71%	0.706	61%	0.608	S	S	*	*	S	Bend	trans	-92.1	141.5	-171.8	-70.2	-86.3	0	0	0	112.8	S206	S206-F208 PolarHBondContact O-N 2.98Å
209	P	43.2	Very low	46.5	Very low	70 Å²	70	120.5 Å²	120.5	46%	0.455	61%	0.607	S	S	.	*	P	Polyproline II helix	trans	-66.8	138	170.7	29.5	-33.8	0	0	0	110.4	A81	A81-P209 HydrophobicContact CB-CB 4.5Å
210	F	46.7	Very low	47.4	Very low	155 Å²	155	117.8 Å²	117.8	68%	0.68	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-65.4	149.5	177.8	-73.1	-87.7	0	0	0	111.9	I202	I202-F210 HydrophobicContact CG2-CE1 4.38Å; I202-F210 HydrophobicContact CG2-CZ 4.36Å
211	P	51.6	Low	47.5	Very low	105 Å²	105	117 Å²	117	68%	0.682	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-64.3	156.9	175.6	28.2	-35.4	0	0	0	111.9
212	P	50.1	Low	47.2	Very low	55 Å²	55	115.8 Å²	115.8	36%	0.357	58%	0.58	S	S	.	*	P	Polyproline II helix	trans	-61.7	150.2	177.4	28.2	-35.8	0	0	0	111.2
213	C	53.4	Low	47.3	Very low	79 Å²	79	115 Å²	115	53%	0.534	58%	0.581	S	S	.	*	P	Polyproline II helix	trans	-64.7	158.2	-171.6	67.3	0	0	0	0	113	N215 S216 I217	C213-N215 PolarHBondContact O-N 3.25Å; C213-N215 VanDerWaalsContact O-N 3.1Å; C213-S216 WeakPolarHBondContact O-CA 3.46Å; C213-S216 VanDerWaalsContact O-CB 3.31Å; C213-S216 WeakPolarHBondContact O-CB 3.47Å; C213-S216 PolarHBondContact O-N 3.48Å; C213-I217 PolarHBondContact O-N 3.32Å
214	V	52.3	Low	47.2	Very low	92 Å²	92	116.2 Å²	116.2	56%	0.558	58%	0.583	S	S	*	*	H	α-helix	trans	-52.1	-35.1	177.8	142.6	0	0	0	0	112.7	S216 I217 N218	V214-S216 PolarHBondContact O-N 3.21Å; V214-I217 PolarHBondContact O-N 2.97Å; V214-N218 PolarHBondContact O-N 3.35Å; V214-N218 PolarHBondContact O-OD1 2.99Å
215	N	52.5	Low	46.8	Very low	108 Å²	108	112.2 Å²	112.2	58%	0.578	57%	0.573	S	S	*	*	H	α-helix	trans	-72.3	-11.9	177.4	-61.4	-8.9	0	0	0	113.7	C213 R219	C213-N215 PolarHBondContact O-N 3.25Å; C213-N215 VanDerWaalsContact O-N 3.1Å; N215-R219 PolarHBondContact O-NE 3.12Å; N215-R219 PolarHBondContact O-NH2 2.72Å
216	S	55.9	Low	46.4	Very low	13 Å²	13	111 Å²	111	9%	0.091	57%	0.567	C	S	.	*	H	α-helix	trans	-92.8	-24	169	-163.8	0	0	0	0	111.7	E77 C213 V214 R220	E77-S216 WeakPolarHBondContact OE1-CB 3.26Å; E77-S216 PolarHBondContact OE1-OG 3.48Å; C213-S216 WeakPolarHBondContact O-CA 3.46Å; C213-S216 VanDerWaalsContact O-CB 3.31Å; C213-S216 WeakPolarHBondContact O-CB 3.47Å; C213-S216 PolarHBondContact O-N 3.48Å; V214-S216 PolarHBondContact O-N 3.21Å; S216-R220 PolarHBondContact O-NE 2.91Å; S216-R220 PolarHBondContact OG-NH2 2.65Å
217	I	54	Low	46.6	Very low	82 Å²	82	113.7 Å²	113.7	42%	0.421	58%	0.58	S	S	.	*	H	α-helix	trans	-77.4	-50.5	173.4	-66.5	167	0	0	0	110.5	C213 V214 R219 R220 F221	C213-I217 PolarHBondContact O-N 3.32Å; V214-I217 PolarHBondContact O-N 2.97Å; I217-R219 VanDerWaalsContact C-N 3.28Å; I217-R219 PolarHBondContact O-N 3.07Å; I217-R220 WeakPolarHBondContact O-CA 2.82Å; I217-R220 WeakPolarHBondContact O-CB 3.35Å; I217-R220 PolarHBondContact O-N 3.5Å; I217-F221 PolarHBondContact O-N 3.47Å
218	N	50.6	Low	46.2	Very low	88 Å²	88	117.6 Å²	117.6	47%	0.471	59%	0.591	S	S	.	*	H	α-helix	trans	-63.2	-32.3	-176.7	-67.2	4	0	0	0	112.8	V214 R220 F221 H222	V214-N218 PolarHBondContact O-N 3.35Å; V214-N218 PolarHBondContact O-OD1 2.99Å; N218-R220 VanDerWaalsContact C-N 3.25Å; N218-R220 PolarHBondContact O-N 2.78Å; N218-F221 PolarHBondContact O-N 2.96Å; N218-H222 PolarHBondContact O-N 3.43Å
219	R	58	Low	46	Very low	182 Å²	182	114.3 Å²	114.3	69%	0.687	59%	0.588	S	S	*	*	H	α-helix	trans	-67.4	-22	172.8	-85.3	-176.4	-71.9	178.2	1.9	114	N215 I217	N215-R219 PolarHBondContact O-NE 3.12Å; N215-R219 PolarHBondContact O-NH2 2.72Å; I217-R219 VanDerWaalsContact C-N 3.28Å; I217-R219 PolarHBondContact O-N 3.07Å
220	R	59	Low	45.5	Very low	118 Å²	118	123 Å²	123	45%	0.445	61%	0.612	S	S	.	*	H	α-helix	trans	-87.6	-21.4	173.6	-70.7	178.2	-107.1	-154.3	-11.5	112.7	E77 S216 I217 N218	E77-R220 IonicContact OE1-NH2 2.69Å; E77-R220 IonicContact OE2-NH2 3.75Å; E77-R220 PolarHBondContact OE2-NH2 3.49Å; S216-R220 PolarHBondContact O-NE 2.91Å; S216-R220 PolarHBondContact OG-NH2 2.65Å; I217-R220 WeakPolarHBondContact O-CA 2.82Å; I217-R220 WeakPolarHBondContact O-CB 3.35Å; I217-R220 PolarHBondContact O-N 3.5Å; N218-R220 VanDerWaalsContact C-N 3.25Å; N218-R220 PolarHBondContact O-N 2.78Å
221	F	43	Very low	44.7	Very low	150 Å²	150	118.8 Å²	118.8	66%	0.658	61%	0.612	S	S	*	*	H	α-helix	trans	-74.2	-37.3	178.7	-148.7	-81.5	0	0	0	112.2	I217 N218 T223	I217-F221 PolarHBondContact O-N 3.47Å; N218-F221 PolarHBondContact O-N 2.96Å; F221-T223 PolarHBondContact O-N 2.78Å; F221-T223 VanDerWaalsContact O-N 3.14Å
222	H	36.4	Very low	43.7	Very low	164 Å²	164	119.2 Å²	119.2	76%	0.759	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	8.6	177.7	-81	-62.3	0	0	0	115.6	N218	N218-H222 PolarHBondContact O-N 3.43Å
223	T	40.6	Very low	42.8	Very low	105 Å²	105	124.8 Å²	124.8	64%	0.644	64%	0.644	S	S	*	*	S	Bend	trans	-102	61.3	169.1	-43.6	0	0	0	0	108.9	F221 F225	F221-T223 PolarHBondContact O-N 2.78Å; F221-T223 VanDerWaalsContact O-N 3.14Å; T223-F225 PolarHBondContact O-N 2.95Å
224	E	37	Very low	42.2	Very low	151 Å²	151	129.7 Å²	129.7	71%	0.706	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-64.4	124.4	-178.3	-64.7	-176.3	163.3	0	0	109.8	D226	E224-D226 PolarHBondContact O-N 3.43Å
225	F	34.7	Very low	41.3	Very low	153 Å²	153	130.5 Å²	130.5	67%	0.671	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.7	160.2	-101.6	-108.3	0	0	0	106.7	T223 V227	T223-F225 PolarHBondContact O-N 2.95Å; F225-V227 HydrophobicContact CB-CG2 4.36Å; F225-V227 PolarHBondContact O-N 2.88Å
226	D	33.6	Very low	40.2	Very low	128 Å²	128	132.6 Å²	132.6	68%	0.684	67%	0.672	S	S	*	*	P	Polyproline II helix	trans	-66.8	124.2	165.9	-170.2	-12	0	0	0	108.6	E224 E228	E224-D226 PolarHBondContact O-N 3.43Å; D226-E228 PolarHBondContact OD1-N 3.33Å
227	V	43.4	Very low	39.1	Very low	128 Å²	128	138.1 Å²	138.1	78%	0.776	70%	0.7	S	S	*	*			trans	-115.4	6.2	-176.4	175.6	0	0	0	0	110.8	F225	F225-V227 HydrophobicContact CB-CG2 4.36Å; F225-V227 PolarHBondContact O-N 2.88Å
228	E	32.7	Very low	38.1	Very low	183 Å²	183	141.9 Å²	141.9	86%	0.855	72%	0.719	S	S	*	*			trans	-121	48.9	-177.8	-62.8	-164.2	163.3	0	0	113	D226	D226-E228 PolarHBondContact OD1-N 3.33Å
229	S	36.5	Very low	37.5	Very low	92 Å²	92	144 Å²	144	64%	0.643	74%	0.738	S	S	*	*			trans	-138.2	57.3	173.8	-142.9	0	0	0	0	115.2
230	W	32.9	Very low	36.1	Very low	253 Å²	253	138.5 Å²	138.5	96%	0.958	74%	0.739	S	S	*	*			trans	-140	102.7	155.4	-76.2	101.5	0	0	0	110.1
231	G	30.4	Very low	35.2	Very low	66 Å²	66	142.6 Å²	142.6	68%	0.68	76%	0.763	S	S	*	*			trans	-62.9	148.3	162	0	0	0	0	0	110
232	S	30	Very low	34.5	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	77%	0.774	S	S	*	*			cis	63.5	81.5	49	-174.3	0	0	0	0	112.5
233	D	32.3	Very low	34.3	Very low	172 Å²	172	143.1 Å²	143.1	92%	0.92	78%	0.777	S	S	*	*			trans	-133.3	145	135.2	-102.1	-35.1	0	0	0	107.5
234	E	39.5	Very low	33.7	Very low	183 Å²	183	146.6 Å²	146.6	86%	0.855	79%	0.786	S	S	*	*			trans	-101.5	154.7	-172.9	-72	-157.5	130.3	0	0	113.7
235	N	33.5	Very low	33.3	Very low	108 Å²	108	144.9 Å²	144.9	58%	0.578	79%	0.788	S	S	*	*			trans	58.1	115.8	150	178.8	83.4	0	0	0	118.6	N237	N235-N237 PolarHBondContact OD1-ND2 2.67Å
236	D	30.4	Very low	33.1	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	78%	0.776	S	S	*	*				-146.3	154.7	107.6	-124.8	-20.6	0	0	0	114.2
237	N	33.7	Very low	33.1	Very low	130 Å²	130	141.9 Å²	141.9	70%	0.695	78%	0.783	S	S	*	*			trans	-101	120.3	-168.6	-86.7	-96	0	0	0	113.1	N235	N235-N237 PolarHBondContact OD1-ND2 2.67Å
238	I	32.1	Very low	32.6	Very low	160 Å²	160	143.7 Å²	143.7	82%	0.821	78%	0.776	S	S	*	*			trans	-135.9	123	164.2	-59.1	-69.6	0	0	0	109.6
239	P	37.3	Very low	32.4	Very low	132 Å²	132	140.7 Å²	140.7	86%	0.857	77%	0.766	S	S	*	*			trans	-87	120.4	174.6	32.5	-31.1	0	0	0	111.5
240	G	28.6	Very low	32.2	Very low	68 Å²	68	140.8 Å²	140.8	70%	0.701	77%	0.766	S	S	*	*			trans	-161.6	132.2	173	0	0	0	0	0	112.3	Q242	G240-Q242 PolarHBondContact O-N 2.92Å
241	E	40.5	Very low	32.3	Very low	203 Å²	203	135.2 Å²	135.2	95%	0.949	75%	0.745	S	S	*	*			trans	-72.9	109.5	179.1	-64.6	179	115.2	0	0	111.2
242	Q	29.3	Very low	32.3	Very low	191 Å²	191	137.2 Å²	137.2	89%	0.893	74%	0.744	S	S	*	*			trans	-136.2	145.3	159.7	-67.3	-163.5	13.5	0	0	110.9	G240	G240-Q242 PolarHBondContact O-N 2.92Å
243	T	32.3	Very low	32.4	Very low	135 Å²	135	136.4 Å²	136.4	83%	0.828	74%	0.739	S	S	*	*			trans	-76.6	135.3	-176	-54.4	0	0	0	0	110.4	P245	T243-P245 WeakPolarHBondContact O-CD 3.49Å
244	E	26.4	Very low	32.2	Very low	178 Å²	178	135.4 Å²	135.4	83%	0.832	73%	0.733	S	S	*	*			trans	-60.3	129.7	172.9	-73.6	-166.9	148.2	0	0	111.5	S246	E244-S246 PolarHBondContact O-N 3.04Å
245	P	28.5	Very low	31.6	Very low	114 Å²	114	133.5 Å²	133.5	74%	0.74	72%	0.724	S	S	*	*			trans	-68.8	110.6	163.7	-14.6	29.9	0	0	0	109.4	T243	T243-P245 WeakPolarHBondContact O-CD 3.49Å
246	S	31.2	Very low	31.5	Very low	62 Å²	62	134.3 Å²	134.3	43%	0.434	74%	0.737	S	S	.	*			trans	-64.2	149.3	178.8	57.7	0	0	0	0	112.3	E244 W248	E244-S246 PolarHBondContact O-N 3.04Å; S246-W248 PolarHBondContact O-N 3.43Å
247	L	34.6	Very low	31.4	Very low	156 Å²	156	132.9 Å²	132.9	82%	0.817	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	38	-178.8	-66.1	165.3	0	0	0	115.2	W251	L247-W251 PolarHBondContact O-NE1 2.74Å
248	W	31.7	Very low	31.1	Very low	166 Å²	166	134.4 Å²	134.4	63%	0.629	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-20.5	179.7	-68.1	-18	0	0	0	113.3	S246 S250	S246-W248 PolarHBondContact O-N 3.43Å; W248-S250 VanDerWaalsContact C-N 3.32Å; W248-S250 PolarHBondContact O-N 2.92Å
249	D	29.3	Very low	30.9	Very low	121 Å²	121	135.4 Å²	135.4	65%	0.647	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-72.9	-22.1	-174.6	-61.3	-36.5	0	0	0	113.9	W251	D249-W251 PolarHBondContact O-N 3.48Å; D249-W251 VanDerWaalsContact O-N 3.13Å
250	S	31.9	Very low	30.4	Very low	94 Å²	94	134.5 Å²	134.5	66%	0.657	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-73	0.8	179.5	-51.9	0	0	0	0	115.1	W248 T252	W248-S250 VanDerWaalsContact C-N 3.32Å; W248-S250 PolarHBondContact O-N 2.92Å; S250-T252 VanDerWaalsContact C-N 3.33Å; S250-T252 PolarHBondContact O-N 3.11Å
251	W	34.4	Very low	30.6	Very low	135 Å²	135	136.2 Å²	136.2	51%	0.511	72%	0.724	S	S	.	*	G	3₁₀ helix	trans	-81.7	-7.4	-170.6	-73.6	62.9	0	0	0	114.7	L247 D249 L467	L247-W251 PolarHBondContact O-NE1 2.74Å; D249-W251 PolarHBondContact O-N 3.48Å; D249-W251 VanDerWaalsContact O-N 3.13Å; W251-L467 HydrophobicContact CZ3-CD2 4.25Å
252	T	31.8	Very low	30.1	Very low	108 Å²	108	133.6 Å²	133.6	66%	0.663	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-87.2	-19.7	179.9	50.5	0	0	0	0	114.3	S250	S250-T252 VanDerWaalsContact C-N 3.33Å; S250-T252 PolarHBondContact O-N 3.11Å
253	S	30.5	Very low	30.1	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	71%	0.714	S	S	*	*			trans	-82.9	-14.8	-169	-160.7	0	0	0	0	115	H255	S253-H255 VanDerWaalsContact C-N 3.25Å; S253-H255 PolarHBondContact O-N 3.13Å
254	L	27.9	Very low	29.9	Very low	151 Å²	151	131.8 Å²	131.8	79%	0.791	71%	0.712	S	S	*	*			trans	-78.8	72.1	177.4	-74.3	176.2	0	0	0	112.1
255	H	27.3	Very low	29.9	Very low	143 Å²	143	130.3 Å²	130.3	66%	0.662	71%	0.71	S	S	*	*			trans	-54.1	134.9	162	-82.9	-105.1	0	0	0	110.7	S253 H257	S253-H255 VanDerWaalsContact C-N 3.25Å; S253-H255 PolarHBondContact O-N 3.13Å; H255-H257 VanDerWaalsContact CB-CD2 3.42Å; H255-H257 WeakPolarHBondContact CB-CD2 3.32Å; H255-H257 PolarHBondContact O-N 3.2Å
256	S	31.3	Very low	29.8	Very low	124 Å²	124	133.2 Å²	133.2	87%	0.867	72%	0.718	S	S	*	*			trans	-76.6	67.9	-179.9	58.2	0	0	0	0	112.4	L258	S256-L258 PolarHBondContact O-N 3.38Å
257	H	28.2	Very low	29.7	Very low	122 Å²	122	135.9 Å²	135.9	57%	0.565	73%	0.734	S	S	*	*			trans	-84.3	90.5	177	-75.1	-67.8	0	0	0	112.3	H255 F259	H255-H257 VanDerWaalsContact CB-CD2 3.42Å; H255-H257 WeakPolarHBondContact CB-CD2 3.32Å; H255-H257 PolarHBondContact O-N 3.2Å; H257-F259 PolarHBondContact O-N 3.47Å
258	L	28.1	Very low	29.5	Very low	162 Å²	162	134.3 Å²	134.3	85%	0.848	73%	0.733	S	S	*	*	S	Bend	trans	-86.5	87	153.5	-71.6	173	0	0	0	108.3	S256	S256-L258 PolarHBondContact O-N 3.38Å
259	F	28.1	Very low	29.2	Very low	182 Å²	182	133.3 Å²	133.3	80%	0.798	75%	0.745	S	S	*	*	S	Bend	trans	75.5	163.7	176.2	-61.7	-73.7	0	0	0	115.6	H257	H257-F259 PolarHBondContact O-N 3.47Å
260	P	26.2	Very low	29.4	Very low	112 Å²	112	133.2 Å²	133.2	73%	0.727	75%	0.751	S	S	*	*			trans	-91.2	156.1	-140.9	34.7	-37.5	0	0	0	115.1
261	P	33	Very low	29.1	Very low	104 Å²	104	134.9 Å²	134.9	68%	0.675	76%	0.762	S	S	*	*			trans	-81.8	141.3	167.7	34.1	-32.1	0	0	0	111.4
262	D	31.1	Very low	28.6	Very low	148 Å²	148	131.2 Å²	131.2	79%	0.791	77%	0.767	S	S	*	*			trans	-134.4	107.9	165.8	-137.2	-19.1	0	0	0	111.3
263	L	29.1	Very low	28.3	Very low	161 Å²	161	133.1 Å²	133.1	84%	0.843	78%	0.778	S	S	*	*			trans	21.9	111.5	157.6	-61.9	168.5	0	0	0	121
264	V	26.5	Very low	28	Very low	128 Å²	128	133 Å²	133	78%	0.776	78%	0.778	S	S	*	*			trans	-143.8	143.7	139.9	-156.1	0	0	0	0	111
265	N	26.8	Very low	28.1	Very low	147 Å²	147	131.3 Å²	131.3	79%	0.786	78%	0.779	S	S	*	*			trans	85.8	92.8	167	-52.8	-57.9	0	0	0	119.5
266	L	26.5	Very low	28.6	Very low	175 Å²	175	129.4 Å²	129.4	92%	0.916	78%	0.779	S	S	*	*			trans	-135.1	159.2	140.1	-83.8	-176.3	0	0	0	109.2
267	P	28.8	Very low	28.3	Very low	117 Å²	117	131.2 Å²	131.2	76%	0.76	78%	0.779	S	S	*	*			trans	-90.1	166.3	-152.5	34.5	-37.8	0	0	0	116.5
268	P	31.9	Very low	28.2	Very low	123 Å²	123	131.3 Å²	131.3	80%	0.799	79%	0.788	S	S	*	*			trans	-98.9	141.3	-173.1	36.9	-33.9	0	0	0	115.5
269	V	24.1	Very low	28.7	Very low	146 Å²	146	128 Å²	128	89%	0.885	78%	0.776	S	S	*	*			trans	-142.1	143.5	163.5	179.5	0	0	0	0	108.5
270	P	34.8	Very low	28.7	Very low	119 Å²	119	129.6 Å²	129.6	77%	0.773	78%	0.777	S	S	*	*			trans	-114.6	155	-154.6	40.5	-33	0	0	0	117.7
271	S	25.9	Very low	28.7	Very low	128 Å²	128	133 Å²	133	90%	0.895	78%	0.78	S	S	*	*			trans	-175.8	163.3	151.8	46.9	0	0	0	0	109.4
272	G	23.7	Very low	28.6	Very low	59 Å²	59	133.1 Å²	133.1	61%	0.608	78%	0.781	S	S	*	*			cis	160.2	77.2	-9.2	0	0	0	0	0	114.4
273	T	24.3	Very low	29.1	Very low	147 Å²	147	131.4 Å²	131.4	90%	0.902	78%	0.778	S	S	*	*			trans	68.4	164.2	175.7	81.3	0	0	0	0	115.1
274	S	24.7	Very low	28.9	Very low	96 Å²	96	129 Å²	129	67%	0.671	77%	0.774	S	S	*	*			cis	-153.8	154.2	8.7	63.6	0	0	0	0	114.9
275	S	29.1	Very low	29.3	Very low	115 Å²	115	128.4 Å²	128.4	80%	0.804	77%	0.773	S	S	*	*			trans	74.4	156.3	150.6	79.2	0	0	0	0	121.6
276	P	39	Very low	29.1	Very low	102 Å²	102	127.7 Å²	127.7	66%	0.662	78%	0.778	S	S	*	*			trans	-132.9	178.9	-157.8	43.3	-26.6	0	0	0	116.3
277	N	25.2	Very low	29	Very low	163 Å²	163	124.6 Å²	124.6	87%	0.872	77%	0.771	S	S	*	*			trans	-160	161	135.8	-105.2	-41.2	0	0	0	113.8
278	V	25.9	Very low	29.4	Very low	123 Å²	123	124.7 Å²	124.7	75%	0.745	77%	0.771	S	S	*	*			trans	-151.7	-175.1	-167.9	-133.2	0	0	0	0	106.8
279	P	38.3	Very low	28.9	Very low	92 Å²	92	130.2 Å²	130.2	60%	0.597	78%	0.776	S	S	*	*			cis	-146.7	-168.5	-11.8	43.6	-23.9	0	0	0	117.3
280	R	27.2	Very low	28.9	Very low	217 Å²	217	127.6 Å²	127.6	82%	0.819	77%	0.765	S	S	*	*			trans	76.1	151.7	154.4	-66.6	170.1	-176.1	176.2	-0.2	117.6
281	K	26.8	Very low	28.5	Very low	183 Å²	183	127.4 Å²	127.4	80%	0.796	77%	0.766	S	S	*	*			cis	-156	173.9	-6.9	-117.7	179	173.8	-165.5	0	110.9
282	P	30.7	Very low	28.6	Very low	107 Å²	107	127.4 Å²	127.4	70%	0.695	76%	0.763	S	S	*	*			trans	-118.1	-150.4	-170	43.8	-31	0	0	0	112.9
283	P	42.1	Very low	28.6	Very low	112 Å²	112	130 Å²	130	73%	0.727	77%	0.772	S	S	*	*				-127.6	-159.8	-53.8	30.4	-8.7	0	0	0	112.9
284	S	25.2	Very low	28.8	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	77%	0.768	S	S	*	*			trans	104.2	165.9	153.8	90	0	0	0	0	116.9
285	P	33.9	Very low	29	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	77%	0.768	S	S	*	*				-137.2	162	-105.8	36.4	-15.4	0	0	0	117.8
286	C	23.3	Very low	29.2	Very low	132 Å²	132	129.4 Å²	129.4	89%	0.892	77%	0.766	S	S	*	*			trans	-160.8	169.8	154.5	-111.8	0	0	0	0	112.7
287	S	24.9	Very low	28.9	Very low	111 Å²	111	134.8 Å²	134.8	78%	0.776	78%	0.778	S	S	*	*			trans	-140.4	-173.2	-171	-54.3	0	0	0	0	111.1
288	P	35.8	Very low	29.4	Very low	118 Å²	118	134.3 Å²	134.3	77%	0.766	78%	0.775	S	S	*	*				-131	153.3	-67.7	37.3	-23.6	0	0	0	113.9
289	R	22.9	Very low	30	Very low	239 Å²	239	131.5 Å²	131.5	90%	0.902	77%	0.771	S	S	*	*			trans	179.8	152.2	158.9	-105.1	165.4	173.3	-100.2	3	109.8
290	S	23.5	Very low	30.5	Very low	91 Å²	91	136.2 Å²	136.2	64%	0.636	78%	0.777	S	S	*	*			cis	-173.9	103.1	-26.8	48.3	0	0	0	0	110.7
291	S	25.6	Very low	32.1	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	76%	0.761	S	S	*	*			trans	-166.6	155.5	166	43.8	0	0	0	0	109.2
292	P	29.4	Very low	34.4	Very low	129 Å²	129	120.5 Å²	120.5	84%	0.838	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76.3	137.9	-163.2	28.9	-35.1	0	0	0	113.6
293	S	23.8	Very low	36.7	Very low	112 Å²	112	115.5 Å²	115.5	78%	0.783	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-70.9	128.8	171.9	53.4	0	0	0	0	111.5	S295	S293-S295 PolarHBondContact O-N 3.3Å; S293-S295 VanDerWaalsContact O-N 3.14Å
294	T	27	Very low	38.5	Very low	136 Å²	136	111.1 Å²	111.1	83%	0.834	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-53.9	116.7	164.7	-46.3	0	0	0	0	109.6
295	S	28.9	Very low	41.3	Very low	94 Å²	94	110.4 Å²	110.4	66%	0.657	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-64.1	130.7	173.7	52.5	0	0	0	0	109.7	S293 K297	S293-S295 PolarHBondContact O-N 3.3Å; S293-S295 VanDerWaalsContact O-N 3.14Å; S295-K297 PolarHBondContact O-N 3.4Å
296	P	34	Very low	43.9	Very low	117 Å²	117	105.4 Å²	105.4	76%	0.76	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-60.9	137.9	172.2	27	-33.6	0	0	0	109.2	L298	P296-L298 VanDerWaalsContact C-N 3.25Å; P296-L298 PolarHBondContact O-N 2.99Å
297	K	32.5	Very low	47.1	Very low	214 Å²	214	99.6 Å²	99.6	93%	0.93	58%	0.582	S	S	*	*			trans	-70.4	85.1	173.8	-72.1	-176.2	178.7	179.9	0	109.1	S295 G299	S295-K297 PolarHBondContact O-N 3.4Å; K297-G299 PolarHBondContact O-N 2.92Å
298	L	36.2	Very low	50.3	Low	153 Å²	153	97.5 Å²	97.5	80%	0.801	57%	0.565	S	S	*	*			trans	-63.2	107.6	168.7	-177	68.1	0	0	0	107.9	P296 R300	P296-L298 VanDerWaalsContact C-N 3.25Å; P296-L298 PolarHBondContact O-N 2.99Å; L298-R300 PolarHBondContact O-N 3.3Å
299	G	38.7	Very low	53	Low	64 Å²	64	92.2 Å²	92.2	66%	0.66	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-58.5	121.3	163	0	0	0	0	0	107.6	K297 A301	K297-G299 PolarHBondContact O-N 2.92Å; G299-A301 PolarHBondContact O-N 3.26Å
300	R	48.5	Very low	56.3	Low	191 Å²	191	82.5 Å²	82.5	72%	0.721	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-66.3	117.9	176.4	-67	-171.2	179.4	-161.1	0.5	107.7	L298 S302 T370	L298-R300 PolarHBondContact O-N 3.3Å; R300-S302 PolarHBondContact O-N 3.4Å; R300-T370 HydrophobicContact CB-CG2 3.86Å; R300-T370 PolarHBondContact NH1-OG1 2.96Å
301	A	61.4	Low	59.6	Low	58 Å²	58	78.6 Å²	78.6	48%	0.479	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-59.5	136.3	165.3	0	0	0	0	0	108.7	G299	G299-A301 PolarHBondContact O-N 3.26Å
302	S	74.3	Confident	62.7	Low	12 Å²	12	73.1 Å²	73.1	8%	0.084	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-80.3	149.3	172.8	-177.4	0	0	0	0	109.9	R300 A304 D305 L366 Q367	R300-S302 PolarHBondContact O-N 3.4Å; S302-A304 PolarHBondContact O-N 2.9Å; S302-A304 PolarHBondContact OG-N 2.9Å; S302-D305 VanDerWaalsContact CB-OD2 3.3Å; S302-D305 WeakPolarHBondContact CB-OD2 3.3Å; S302-D305 PolarHBondContact N-OD2 2.91Å; S302-D305 WeakPolarHBondContact O-CB 3.47Å; S302-D305 PolarHBondContact O-N 3Å; S302-L366 PolarHBondContact OG-O 2.9Å; S302-L366 VanDerWaalsContact OG-O 3.13Å; S302-Q367 VanDerWaalsContact OG-C 3.25Å; S302-Q367 WeakPolarHBondContact OG-CA 3.39Å; S302-Q367 PolarHBondContact OG-O 3.46Å
303	L	78.9	Confident	65.7	Low	2 Å²	2	69.2 Å²	69.2	1%	0.01	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-60.7	-27.7	170.1	-176.1	50.6	0	0	0	111.6	D305 D306 I307 A328 L333 L366 W369 P372 L375	L303-D305 PolarHBondContact O-N 3.37Å; L303-D306 PolarHBondContact O-N 3Å; L303-I307 HydrophobicContact CD1-CD1 4.33Å; L303-I307 HydrophobicContact CD1-CG1 4.44Å; L303-I307 HydrophobicContact CG-CD1 4.26Å; L303-I307 HydrophobicContact CG-CG1 4.49Å; L303-I307 WeakPolarHBondContact O-CG1 3.3Å; L303-I307 PolarHBondContact O-N 2.81Å; L303-A328 HydrophobicContact CD1-CB 3.77Å; L303-L333 HydrophobicContact CD1-CD1 4.34Å; L303-L366 HydrophobicContact CD2-CD2 3.74Å; L303-L366 HydrophobicContact CG-CD2 4.12Å; L303-W369 PolarHBondContact N-O 2.9Å; L303-P372 HydrophobicContact CD1-CB 4.08Å; L303-P372 HydrophobicContact CD1-CG 4.15Å; L303-P372 HydrophobicContact CD2-CB 4.36Å; L303-L375 HydrophobicContact CD2-CD2 3.78Å
304	A	79.1	Confident	68.9	Low	21 Å²	21	68.6 Å²	68.6	17%	0.174	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-67.7	-17.1	172.1	0	0	0	0	0	114.4	S302 D306 L366 Q367	S302-A304 PolarHBondContact O-N 2.9Å; S302-A304 PolarHBondContact OG-N 2.9Å; A304-D306 VanDerWaalsContact C-N 3.31Å; A304-L366 HydrophobicContact CB-CB 4.43Å; A304-Q367 HydrophobicContact CB-CB 4.1Å; A304-Q367 HydrophobicContact CB-CG 4.46Å
305	D	84.3	Confident	72	Confident	95 Å²	95	63.7 Å²	63.7	51%	0.508	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-84.1	-9.1	175.2	-53.9	-37.6	0	0	0	112.6	S302 L303 K323	S302-D305 VanDerWaalsContact CB-OD2 3.3Å; S302-D305 WeakPolarHBondContact CB-OD2 3.3Å; S302-D305 PolarHBondContact N-OD2 2.91Å; S302-D305 WeakPolarHBondContact O-CB 3.47Å; S302-D305 PolarHBondContact O-N 3Å; L303-D305 PolarHBondContact O-N 3.37Å; D305-K323 VanDerWaalsContact O-CD 3.28Å; D305-K323 WeakPolarHBondContact O-CD 3.34Å; D305-K323 PolarHBondContact O-NZ 3.38Å
306	D	88.1	Confident	75	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.053	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-23.8	-174.8	-73.9	-20.5	0	0	0	113.8	L303 A304 K323 S326 P327 A328	L303-D306 PolarHBondContact O-N 3Å; A304-D306 VanDerWaalsContact C-N 3.31Å; D306-K323 WeakPolarHBondContact O-CB 3.44Å; D306-K323 PolarHBondContact O-N 2.82Å; D306-K323 WeakPolarHBondContact OD1-CD 3.29Å; D306-K323 IonicContact OD1-NZ 3.67Å; D306-K323 PolarHBondContact OD1-NZ 3.4Å; D306-S326 VanDerWaalsContact CG-CB 3.43Å; D306-P327 WeakPolarHBondContact OD2-CD 3.42Å; D306-A328 HydrophobicContact CB-CB 3.86Å
307	I	91.1	Very high	77.8	Confident	9 Å²	9	54 Å²	54	5%	0.046	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.6	177	67.8	176.8	0	0	0	112.9	L303 I309 V319 H321 V322 A328 L333 L339 L366	L303-I307 HydrophobicContact CD1-CD1 4.33Å; L303-I307 HydrophobicContact CD1-CG1 4.44Å; L303-I307 HydrophobicContact CG-CD1 4.26Å; L303-I307 HydrophobicContact CG-CG1 4.49Å; L303-I307 WeakPolarHBondContact O-CG1 3.3Å; L303-I307 PolarHBondContact O-N 2.81Å; I307-I309 HydrophobicContact CD1-CG2 4.17Å; I307-I309 HydrophobicContact CG1-CG2 4.37Å; I307-V319 HydrophobicContact CB-CG1 4.41Å; I307-V319 HydrophobicContact CD1-CG2 4.29Å; I307-H321 WeakPolarHBondContact CA-O 3.04Å; I307-V322 HydrophobicContact CG2-CB 4.48Å; I307-V322 HydrophobicContact CG2-CG1 4.21Å; I307-V322 HydrophobicContact CG2-CG2 4.03Å; I307-A328 HydrophobicContact CG2-CB 3.6Å; I307-L333 HydrophobicContact CG2-CD1 4.36Å; I307-L339 HydrophobicContact CD1-CD1 4.2Å; I307-L366 HydrophobicContact CD1-CD1 4.21Å
308	T	91.5	Very high	80.8	Confident	68 Å²	68	44 Å²	44	42%	0.417	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	133	165.7	-52.7	0	0	0	0	109.4	S320 H321	T308-S320 WeakPolarHBondContact CB-OG 3.25Å; T308-S320 WeakPolarHBondContact CG2-OG 3.22Å; T308-S320 PolarHBondContact O-N 3.44Å; T308-S320 PolarHBondContact O-OG 2.87Å; T308-H321 PolarHBondContact N-O 3.09Å
309	I	92.8	Very high	83.6	Confident	6 Å²	6	36.7 Å²	36.7	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	147.1	175.6	66.3	160.8	0	0	0	112.9	I307 I317 F318 L339 A362 H363 L366 R433	I307-I309 HydrophobicContact CD1-CG2 4.17Å; I307-I309 HydrophobicContact CG1-CG2 4.37Å; I309-I317 HydrophobicContact CB-CG2 4.26Å; I309-I317 HydrophobicContact CD1-CG2 3.93Å; I309-I317 HydrophobicContact CG2-CG2 4.38Å; I309-F318 CarbonylContact C-O 3.56Å; I309-F318 VanDerWaalsContact CA-O 3.28Å; I309-F318 WeakPolarHBondContact CA-O 3.28Å; I309-L339 HydrophobicContact CG2-CD1 3.98Å; I309-A362 HydrophobicContact CD1-CB 3.8Å; I309-H363 HydrophobicContact CD1-CB 4.16Å; I309-L366 HydrophobicContact CD1-CD1 4.05Å; I309-L366 HydrophobicContact CG2-CD1 3.82Å; I309-R433 PolarHBondContact O-NH2 3.32Å
310	V	92.8	Very high	86.2	Confident	36 Å²	36	34.5 Å²	34.5	22%	0.218	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	166.7	171.4	-62.6	0	0	0	0	109.9	F318 Y384 L387 L391	V310-F318 HydrophobicContact CG2-CB 4.29Å; V310-F318 PolarHBondContact N-O 2.98Å; V310-F318 PolarHBondContact O-N 2.81Å; V310-Y384 HydrophobicContact CG2-CE2 3.77Å; V310-L387 HydrophobicContact CG2-CD2 4.15Å; V310-L391 HydrophobicContact CB-CD1 4.4Å
311	G	92.4	Very high	88.4	Confident	8 Å²	8	30.4 Å²	30.4	8%	0.082	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.6	-168.6	-174.3	0	0	0	0	0	112.4	T315 G316 A359	G311-T315 WeakPolarHBondContact CA-OG1 3.49Å; G311-G316 CarbonylContact C-O 3.5Å; G311-G316 VanDerWaalsContact CA-O 3.27Å; G311-G316 WeakPolarHBondContact CA-O 3.43Å; G311-A359 WeakPolarHBondContact O-CB 3.43Å
312	G	91.6	Very high	89.9	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.5	-174.2	-170.6	0	0	0	0	0	112.2	R314 T315 G316 C357 A399 D400	G312-R314 PolarHBondContact O-N 3.21Å; G312-T315 PolarHBondContact N-OG1 2.85Å; G312-T315 PolarHBondContact O-N 3.46Å; G312-T315 PolarHBondContact O-OG1 3.27Å; G312-G316 PolarHBondContact N-O 2.81Å; G312-G316 VanDerWaalsContact N-O 3.08Å; G312-G316 PolarHBondContact O-N 2.71Å; G312-C357 CarbonylContact C-O 3.58Å; G312-A399 CarbonylContact C-O 3.44Å; G312-A399 WeakPolarHBondContact CA-O 3.44Å; G312-D400 WeakPolarHBondContact CA-OD1 3.4Å
313	N	90.9	Very high	90.8	Very high	48 Å²	48	32.6 Å²	32.6	26%	0.257	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.6	-168.6	83.1	-55.2	0	0	0	114.8	Q356 C357 T358 D400 S401	N313-Q356 WeakPolarHBondContact CB-O 3.37Å; N313-C357 WeakPolarHBondContact CA-O 3.41Å; N313-C357 WeakPolarHBondContact CB-O 3.46Å; N313-C357 PolarHBondContact N-O 3.14Å; N313-C357 VanDerWaalsContact N-O 3.14Å; N313-T358 HydrophobicContact CB-CG2 4.06Å; N313-D400 PolarHBondContact N-OD1 3.14Å; N313-D400 WeakPolarHBondContact OD1-CA 3.33Å; N313-D400 WeakPolarHBondContact OD1-CB 3.31Å; N313-D400 PolarHBondContact OD1-OD1 2.93Å; N313-S401 PolarHBondContact ND2-O 3.4Å; N313-S401 PolarHBondContact OD1-N 2.93Å
314	R	92.4	Very high	91.3	Very high	99 Å²	99	36.6 Å²	36.6	37%	0.374	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-25.5	171.5	-163.5	-174.6	73.4	-125	7.6	112.8	G312 A397 G398 A399 D400	G312-R314 PolarHBondContact O-N 3.21Å; R314-A397 PolarHBondContact NH1-O 2.86Å; R314-G398 PolarHBondContact NH1-O 2.78Å; R314-G398 PolarHBondContact NH2-O 3.05Å; R314-A399 PolarHBondContact N-O 2.76Å; R314-D400 PolarHBondContact NH1-O 2.72Å
315	T	91.3	Very high	91.7	Very high	32 Å²	32	38.1 Å²	38.1	20%	0.196	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-15.8	-164.2	46.8	0	0	0	0	114.1	G311 G312 F318 L387 A399	G311-T315 WeakPolarHBondContact CA-OG1 3.49Å; G312-T315 PolarHBondContact N-OG1 2.85Å; G312-T315 PolarHBondContact O-N 3.46Å; G312-T315 PolarHBondContact O-OG1 3.27Å; T315-F318 WeakPolarHBondContact O-CE2 3.33Å; T315-L387 HydrophobicContact CG2-CD1 3.94Å; T315-A399 PolarHBondContact OG1-O 3.31Å
316	G	91.8	Very high	92	Very high	7 Å²	7	33.9 Å²	33.9	7%	0.072	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	87.4	159.7	-166	0	0	0	0	0	111.1	G311 G312	G311-G316 CarbonylContact C-O 3.5Å; G311-G316 VanDerWaalsContact CA-O 3.27Å; G311-G316 WeakPolarHBondContact CA-O 3.43Å; G312-G316 PolarHBondContact N-O 2.81Å; G312-G316 VanDerWaalsContact N-O 3.08Å; G312-G316 PolarHBondContact O-N 2.71Å
317	I	94.1	Very high	91.9	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	120.6	179.5	-60.4	-63.3	0	0	0	108.9	I309 E338 L339 L354 A362	I309-I317 HydrophobicContact CB-CG2 4.26Å; I309-I317 HydrophobicContact CD1-CG2 3.93Å; I309-I317 HydrophobicContact CG2-CG2 4.38Å; I317-E338 CarbonylContact O-C 3.58Å; I317-E338 WeakPolarHBondContact O-CA 3.45Å; I317-L339 HydrophobicContact CB-CB 4.35Å; I317-L339 HydrophobicContact CG2-CB 4.09Å; I317-L339 HydrophobicContact CG2-CD1 3.96Å; I317-L339 HydrophobicContact CG2-CG 4.2Å; I317-L339 PolarHBondContact O-N 2.79Å; I317-L354 WeakPolarHBondContact CG1-O 3.41Å; I317-A362 HydrophobicContact CD1-CB 3.64Å; I317-A362 HydrophobicContact CG1-CB 3.78Å; I317-A362 HydrophobicContact CG2-CB 4.08Å
318	F	95.1	Very high	91.8	Very high	4 Å²	4	36 Å²	36	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	145	-176.7	-68.8	-98.8	0	0	0	112.8	I309 V310 T315 C337 E338 N380 Y384 L387	I309-F318 CarbonylContact C-O 3.56Å; I309-F318 VanDerWaalsContact CA-O 3.28Å; I309-F318 WeakPolarHBondContact CA-O 3.28Å; V310-F318 HydrophobicContact CG2-CB 4.29Å; V310-F318 PolarHBondContact N-O 2.98Å; V310-F318 PolarHBondContact O-N 2.81Å; T315-F318 WeakPolarHBondContact O-CE2 3.33Å; F318-C337 CarbonylContact C-O 3.59Å; F318-C337 WeakPolarHBondContact CA-O 3.4Å; F318-E338 HydrophobicContact CD1-CB 3.97Å; F318-E338 HydrophobicContact CD1-CG 4.41Å; F318-E338 HydrophobicContact CE1-CB 3.71Å; F318-E338 HydrophobicContact CE1-CG 4.01Å; F318-E338 HydrophobicContact CE2-CG 4.28Å; F318-E338 HydrophobicContact CZ-CB 4.15Å; F318-E338 HydrophobicContact CZ-CG 3.92Å; F318-N380 HydrophobicContact CE1-CB 4.03Å; F318-Y384 HydrophobicContact CB-CD2 3.57Å; F318-Y384 HydrophobicContact CB-CE2 4.02Å; F318-Y384 AromaticContact CD1-CD2 3.93Å; F318-Y384 HydrophobicContact CD1-CD2 3.93Å; F318-Y384 HydrophobicContact CD1-CG 4.33Å; F318-Y384 AromaticContact CG-CD2 3.91Å; F318-Y384 HydrophobicContact CG-CD2 3.91Å; F318-L387 HydrophobicContact CB-CD2 4.38Å; F318-L387 HydrophobicContact CD2-CD2 3.56Å; F318-L387 HydrophobicContact CE2-CD2 4.18Å; F318-L387 HydrophobicContact CG-CD2 4.22Å
319	V	94.8	Very high	91.8	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	119.2	170.7	-179.8	0	0	0	0	109.7	I307 V322 L333 K334 G336 C337 L339	I307-V319 HydrophobicContact CB-CG1 4.41Å; I307-V319 HydrophobicContact CD1-CG2 4.29Å; V319-V322 HydrophobicContact CG1-CG2 3.4Å; V319-V322 VanDerWaalsContact CG1-CG2 3.4Å; V319-L333 HydrophobicContact CG2-CD2 4.3Å; V319-K334 WeakPolarHBondContact CB-O 3.5Å; V319-K334 WeakPolarHBondContact CG1-O 3.48Å; V319-G336 PolarHBondContact O-N 2.69Å; V319-C337 HydrophobicContact CB-CB 4.38Å; V319-C337 HydrophobicContact CG2-CB 4.2Å; V319-C337 PolarHBondContact N-O 3.06Å; V319-L339 HydrophobicContact CG2-CD1 4.37Å; V319-L339 HydrophobicContact CG2-CD2 3.72Å; V319-L339 HydrophobicContact CG2-CG 4.12Å
320	S	93.6	Very high	91.5	Very high	18 Å²	18	43.9 Å²	43.9	13%	0.126	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	-21.6	176.4	59.8	0	0	0	0	114.4	T308 Y384	T308-S320 WeakPolarHBondContact CB-OG 3.25Å; T308-S320 WeakPolarHBondContact CG2-OG 3.22Å; T308-S320 PolarHBondContact O-N 3.44Å; T308-S320 PolarHBondContact O-OG 2.87Å; S320-Y384 VanDerWaalsContact CA-OH 3.29Å; S320-Y384 WeakPolarHBondContact CA-OH 3.18Å; S320-Y384 VanDerWaalsContact CB-OH 3.25Å; S320-Y384 WeakPolarHBondContact CB-OH 3.38Å
321	H	93.4	Very high	91.2	Very high	106 Å²	106	44.8 Å²	44.8	49%	0.491	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	146.3	174.9	-178.7	65.2	0	0	0	110	I307 T308	I307-H321 WeakPolarHBondContact CA-O 3.04Å; T308-H321 PolarHBondContact N-O 3.09Å
322	V	93.8	Very high	91	Very high	21 Å²	21	46 Å²	46	13%	0.127	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.8	171.3	-175.7	0	0	0	0	108	I307 V319 A328 E329 L333	I307-V322 HydrophobicContact CG2-CB 4.48Å; I307-V322 HydrophobicContact CG2-CG1 4.21Å; I307-V322 HydrophobicContact CG2-CG2 4.03Å; V319-V322 HydrophobicContact CG1-CG2 3.4Å; V319-V322 VanDerWaalsContact CG1-CG2 3.4Å; V322-A328 HydrophobicContact CG1-CB 4.25Å; V322-E329 HydrophobicContact CG1-CB 3.83Å; V322-L333 HydrophobicContact CG2-CB 4.32Å
323	K	92.5	Very high	90.9	Very high	95 Å²	95	46.1 Å²	46.1	41%	0.413	27%	0.268	S	S	.	.			trans	-72.5	123.9	179.5	178.8	177.6	165.8	-160.6	0	110.5	D305 D306 G325 S326	D305-K323 VanDerWaalsContact O-CD 3.28Å; D305-K323 WeakPolarHBondContact O-CD 3.34Å; D305-K323 PolarHBondContact O-NZ 3.38Å; D306-K323 WeakPolarHBondContact O-CB 3.44Å; D306-K323 PolarHBondContact O-N 2.82Å; D306-K323 WeakPolarHBondContact OD1-CD 3.29Å; D306-K323 IonicContact OD1-NZ 3.67Å; D306-K323 PolarHBondContact OD1-NZ 3.4Å; K323-G325 PolarHBondContact O-N 3.4Å; K323-S326 WeakPolarHBondContact O-CB 3.34Å; K323-S326 PolarHBondContact O-N 2.95Å; K323-S326 PolarHBondContact O-OG 2.9Å
324	A	91.1	Very high	91	Very high	85 Å²	85	50.3 Å²	50.3	70%	0.702	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	136.3	-178.2	0	0	0	0	0	112	S326 E329	A324-S326 VanDerWaalsContact C-N 3.25Å; A324-S326 PolarHBondContact O-N 2.82Å; A324-E329 WeakPolarHBondContact CA-OE2 3.28Å
325	G	86.7	Confident	91.1	Very high	54 Å²	54	50.4 Å²	50.4	56%	0.557	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.1	-3.2	-177.1	0	0	0	0	0	115.2	K323 E329 Q330	K323-G325 PolarHBondContact O-N 3.4Å; G325-E329 PolarHBondContact N-OE2 2.74Å; G325-Q330 PolarHBondContact O-NE2 2.78Å
326	S	89.9	Confident	91.2	Very high	5 Å²	5	49 Å²	49	4%	0.035	28%	0.281	C	S	.	.			trans	-66.6	155.2	-178.3	60.6	0	0	0	0	113.7	D306 K323 A324 A328 E329 Q330	D306-S326 VanDerWaalsContact CG-CB 3.43Å; K323-S326 WeakPolarHBondContact O-CB 3.34Å; K323-S326 PolarHBondContact O-N 2.95Å; K323-S326 PolarHBondContact O-OG 2.9Å; A324-S326 VanDerWaalsContact C-N 3.25Å; A324-S326 PolarHBondContact O-N 2.82Å; S326-A328 PolarHBondContact O-N 3.3Å; S326-E329 PolarHBondContact O-N 2.81Å; S326-E329 PolarHBondContact OG-N 2.69Å; S326-E329 VanDerWaalsContact OG-N 3.09Å; S326-Q330 WeakPolarHBondContact O-CG 3.3Å; S326-Q330 PolarHBondContact O-N 2.84Å; S326-Q330 PolarHBondContact O-NE2 3.21Å
327	P	87.3	Confident	91.3	Very high	65 Å²	65	48.9 Å²	48.9	42%	0.422	28%	0.279	S	S	.	.	H	α-helix	trans	-49.7	-33.2	162.7	-29.7	35.9	0	0	0	114	D306 Q330 C331 P372	D306-P327 WeakPolarHBondContact OD2-CD 3.42Å; P327-Q330 PolarHBondContact O-N 3.01Å; P327-C331 PolarHBondContact O-N 3.39Å; P327-C331 PolarHBondContact O-SG 2.85Å; P327-P372 HydrophobicContact CB-CG 3.92Å
328	A	88.5	Confident	91.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-64.7	-48.2	176.2	0	0	0	0	0	112.6	L303 D306 I307 V322 S326 Q330 C331 G332 L333	L303-A328 HydrophobicContact CD1-CB 3.77Å; D306-A328 HydrophobicContact CB-CB 3.86Å; I307-A328 HydrophobicContact CG2-CB 3.6Å; V322-A328 HydrophobicContact CG1-CB 4.25Å; S326-A328 PolarHBondContact O-N 3.3Å; A328-Q330 VanDerWaalsContact C-N 3.32Å; A328-Q330 PolarHBondContact O-N 3.26Å; A328-C331 PolarHBondContact O-N 2.68Å; A328-G332 PolarHBondContact O-N 3.17Å; A328-L333 HydrophobicContact CB-CD1 3.83Å; A328-L333 WeakPolarHBondContact O-CB 3.23Å; A328-L333 PolarHBondContact O-N 2.84Å; A328-L333 VanDerWaalsContact O-N 3.15Å
329	E	90.4	Very high	91.2	Very high	90 Å²	90	50.3 Å²	50.3	42%	0.421	29%	0.286	S	S	.	.	H	α-helix	trans	-62.1	-40.7	175.1	-173.3	176.6	-139.6	0	0	111.4	V322 A324 G325 S326 C331 G332	V322-E329 HydrophobicContact CG1-CB 3.83Å; A324-E329 WeakPolarHBondContact CA-OE2 3.28Å; G325-E329 PolarHBondContact N-OE2 2.74Å; S326-E329 PolarHBondContact O-N 2.81Å; S326-E329 PolarHBondContact OG-N 2.69Å; S326-E329 VanDerWaalsContact OG-N 3.09Å; E329-C331 VanDerWaalsContact C-N 3.28Å; E329-C331 PolarHBondContact O-N 3.28Å; E329-G332 WeakPolarHBondContact O-CA 3.1Å; E329-G332 PolarHBondContact O-N 2.83Å
330	Q	88.3	Confident	91	Very high	149 Å²	149	52.7 Å²	52.7	70%	0.696	30%	0.298	S	S	*	.	H	α-helix	trans	-63.5	-31.7	177.3	-67	171.7	46.4	0	0	112.6	G325 S326 P327 A328 G332	G325-Q330 PolarHBondContact O-NE2 2.78Å; S326-Q330 WeakPolarHBondContact O-CG 3.3Å; S326-Q330 PolarHBondContact O-N 2.84Å; S326-Q330 PolarHBondContact O-NE2 3.21Å; P327-Q330 PolarHBondContact O-N 3.01Å; A328-Q330 VanDerWaalsContact C-N 3.32Å; A328-Q330 PolarHBondContact O-N 3.26Å; Q330-G332 PolarHBondContact O-N 2.88Å
331	C	85.4	Confident	90.8	Very high	54 Å²	54	53.8 Å²	53.8	37%	0.365	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	7.2	171.1	-64.7	0	0	0	0	113.6	P327 A328 E329 P372 H377	P327-C331 PolarHBondContact O-N 3.39Å; P327-C331 PolarHBondContact O-SG 2.85Å; A328-C331 PolarHBondContact O-N 2.68Å; E329-C331 VanDerWaalsContact C-N 3.28Å; E329-C331 PolarHBondContact O-N 3.28Å; C331-P372 HydrophobicContact CB-CB 4.12Å; C331-H377 PolarHBondContact O-CE1 2.93Å
332	G	87.5	Confident	90.3	Very high	35 Å²	35	48.8 Å²	48.8	36%	0.361	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	19.2	174.1	0	0	0	0	0	115	A328 E329 Q330 H377	A328-G332 PolarHBondContact O-N 3.17Å; E329-G332 WeakPolarHBondContact O-CA 3.1Å; E329-G332 PolarHBondContact O-N 2.83Å; Q330-G332 PolarHBondContact O-N 2.88Å; G332-H377 PolarHBondContact O-NE2 3.41Å; G332-H377 VanDerWaalsContact O-NE2 3.09Å
333	L	91	Very high	89.3	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	29%	0.286	C	S	.	.			trans	-72.6	138.2	167.2	-69.5	159.4	0	0	0	109.6	L303 I307 V319 V322 A328 L339 L375 H377	L303-L333 HydrophobicContact CD1-CD1 4.34Å; I307-L333 HydrophobicContact CG2-CD1 4.36Å; V319-L333 HydrophobicContact CG2-CD2 4.3Å; V322-L333 HydrophobicContact CG2-CB 4.32Å; A328-L333 HydrophobicContact CB-CD1 3.83Å; A328-L333 WeakPolarHBondContact O-CB 3.23Å; A328-L333 PolarHBondContact O-N 2.84Å; A328-L333 VanDerWaalsContact O-N 3.15Å; L333-L339 HydrophobicContact CD2-CD2 3.86Å; L333-L375 HydrophobicContact CD1-CD2 4.19Å; L333-L375 HydrophobicContact CD2-CD2 4.3Å; L333-H377 HydrophobicContact CD2-CB 3.9Å
334	K	92.7	Very high	87.8	Confident	136 Å²	136	54.2 Å²	54.2	59%	0.591	30%	0.298	S	S	*	.			trans	-145	164.9	-179.6	-62.7	-172.8	-179.2	-177.9	0	110	V319 G336 C337	V319-K334 WeakPolarHBondContact CB-O 3.5Å; V319-K334 WeakPolarHBondContact CG1-O 3.48Å; K334-G336 PolarHBondContact O-N 2.79Å; K334-C337 PolarHBondContact N-SG 3.42Å; K334-C337 VanDerWaalsContact O-CB 3.32Å; K334-C337 WeakPolarHBondContact O-CB 3.43Å; K334-C337 PolarHBondContact O-N 3.31Å; K334-C337 VanDerWaalsContact O-N 3.08Å; K334-C337 PolarHBondContact O-SG 3.1Å
335	E	94.4	Very high	86	Confident	102 Å²	102	51.5 Å²	51.5	48%	0.477	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	132.6	168.5	-175.7	177.3	175.5	0	0	110.4	Y384 R388	E335-Y384 HydrophobicContact CG-CE1 3.78Å; E335-R388 IonicContact OE1-CZ 2.79Å; E335-R388 IonicContact OE1-NH1 3.67Å; E335-R388 PolarHBondContact OE1-NH1 2.83Å; E335-R388 IonicContact OE1-NH2 3.01Å; E335-R388 PolarHBondContact OE1-NH2 2.73Å
336	G	92.4	Very high	84.2	Confident	2 Å²	2	54 Å²	54	2%	0.021	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	10.6	-174.6	0	0	0	0	0	115.5	V319 K334 N380	V319-G336 PolarHBondContact O-N 2.69Å; K334-G336 PolarHBondContact O-N 2.79Å; G336-N380 CarbonylContact O-C 3.6Å; G336-N380 PolarHBondContact O-N 2.87Å
337	C	94.4	Very high	82	Confident	5 Å²	5	64.2 Å²	64.2	3%	0.034	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	131.8	161.8	-71.6	0	0	0	0	110.9	F318 V319 K334 Q378	F318-C337 CarbonylContact C-O 3.59Å; F318-C337 WeakPolarHBondContact CA-O 3.4Å; V319-C337 HydrophobicContact CB-CB 4.38Å; V319-C337 HydrophobicContact CG2-CB 4.2Å; V319-C337 PolarHBondContact N-O 3.06Å; K334-C337 PolarHBondContact N-SG 3.42Å; K334-C337 VanDerWaalsContact O-CB 3.32Å; K334-C337 WeakPolarHBondContact O-CB 3.43Å; K334-C337 PolarHBondContact O-N 3.31Å; K334-C337 VanDerWaalsContact O-N 3.08Å; K334-C337 PolarHBondContact O-SG 3.1Å; C337-Q378 CarbonylContact C-O 3.51Å; C337-Q378 VanDerWaalsContact CA-O 3.3Å; C337-Q378 WeakPolarHBondContact CA-O 3.41Å
338	E	95.1	Very high	79.9	Confident	34 Å²	34	64.4 Å²	64.4	16%	0.159	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	136.2	169.4	-170.8	175	175.4	0	0	109.7	I317 F318 L340 H377 Q378 N380	I317-E338 CarbonylContact O-C 3.58Å; I317-E338 WeakPolarHBondContact O-CA 3.45Å; F318-E338 HydrophobicContact CD1-CB 3.97Å; F318-E338 HydrophobicContact CD1-CG 4.41Å; F318-E338 HydrophobicContact CE1-CB 3.71Å; F318-E338 HydrophobicContact CE1-CG 4.01Å; F318-E338 HydrophobicContact CE2-CG 4.28Å; F318-E338 HydrophobicContact CZ-CB 4.15Å; F318-E338 HydrophobicContact CZ-CG 3.92Å; E338-L340 HydrophobicContact CG-CD2 4.17Å; E338-H377 CarbonylContact O-C 3.18Å; E338-H377 VanDerWaalsContact O-CA 3.22Å; E338-H377 WeakPolarHBondContact O-CA 3.38Å; E338-H377 WeakPolarHBondContact O-CB 3.32Å; E338-Q378 PolarHBondContact N-O 3.14Å; E338-Q378 PolarHBondContact O-N 3.05Å; E338-N380 HydrophobicContact CB-CB 4.13Å; E338-N380 PolarHBondContact OE2-ND2 2.74Å
339	L	92.9	Very high	78	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	118.5	-179	-56.6	-168.7	0	0	0	109.8	I307 I309 I317 V319 L333 L354 L366 L375 H377	I307-L339 HydrophobicContact CD1-CD1 4.2Å; I309-L339 HydrophobicContact CG2-CD1 3.98Å; I317-L339 HydrophobicContact CB-CB 4.35Å; I317-L339 HydrophobicContact CG2-CB 4.09Å; I317-L339 HydrophobicContact CG2-CD1 3.96Å; I317-L339 HydrophobicContact CG2-CG 4.2Å; I317-L339 PolarHBondContact O-N 2.79Å; V319-L339 HydrophobicContact CG2-CD1 4.37Å; V319-L339 HydrophobicContact CG2-CD2 3.72Å; V319-L339 HydrophobicContact CG2-CG 4.12Å; L333-L339 HydrophobicContact CD2-CD2 3.86Å; L339-L354 HydrophobicContact CB-CB 4.29Å; L339-L354 HydrophobicContact CB-CD1 3.84Å; L339-L354 HydrophobicContact CD1-CD1 4.44Å; L339-L354 WeakPolarHBondContact O-CB 3.49Å; L339-L366 HydrophobicContact CD1-CD1 3.95Å; L339-L366 HydrophobicContact CD1-CD2 4.47Å; L339-L375 HydrophobicContact CB-CD1 4.38Å; L339-L375 HydrophobicContact CD1-CD2 4.23Å; L339-L375 HydrophobicContact CD2-CD1 4.36Å; L339-L375 HydrophobicContact CD2-CD2 3.91Å; L339-L375 HydrophobicContact CD2-CG 4.31Å; L339-H377 HydrophobicContact CD2-CB 3.86Å
340	L	90.8	Very high	76.5	Confident	49 Å²	49	66 Å²	66	26%	0.257	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-51.3	-169.2	-55.9	179.7	0	0	0	112.4	E338 Q353 L354 T355 K376 Q378	E338-L340 HydrophobicContact CG-CD2 4.17Å; L340-Q353 CarbonylContact O-C 3.22Å; L340-L354 PolarHBondContact O-N 3.16Å; L340-T355 HydrophobicContact CB-CG2 4.32Å; L340-T355 HydrophobicContact CD2-CG2 3.71Å; L340-T355 PolarHBondContact O-N 3.33Å; L340-K376 WeakPolarHBondContact CB-O 3.25Å; L340-K376 PolarHBondContact N-O 2.89Å; L340-Q378 HydrophobicContact CD1-CB 3.98Å
341	E	89.1	Confident	75.6	Confident	42 Å²	42	61.2 Å²	61.2	20%	0.196	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	137.6	-169.5	-168.3	-169.1	148.6	0	0	111	S351 V352 K376	E341-S351 WeakPolarHBondContact OE1-CB 3.44Å; E341-S351 PolarHBondContact OE1-OG 3.44Å; E341-V352 CarbonylContact C-O 3.52Å; E341-V352 VanDerWaalsContact CA-O 3.29Å; E341-V352 WeakPolarHBondContact CA-O 3.46Å; E341-K376 HydrophobicContact CB-CB 4.2Å; E341-K376 HydrophobicContact CB-CD 4.08Å; E341-K376 HydrophobicContact CB-CG 4.34Å; E341-K376 PolarHBondContact N-O 3.42Å; E341-K376 PolarHBondContact O-N 3.06Å; E341-K376 IonicContact OE1-NZ 3.58Å; E341-K376 PolarHBondContact OE1-NZ 3.08Å; E341-K376 WeakPolarHBondContact OE2-CD 3.43Å; E341-K376 WeakPolarHBondContact OE2-CE 3.37Å; E341-K376 IonicContact OE2-NZ 3.85Å; E341-K376 PolarHBondContact OE2-NZ 3.21Å
342	L	82.4	Confident	75.2	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	115.5	171	-173.3	63.5	0	0	0	109.1	V345 S351 V352 L354 W369 L375	L342-V345 HydrophobicContact CB-CG2 4.18Å; L342-V345 HydrophobicContact CD2-CG2 3.84Å; L342-V345 HydrophobicContact CG-CG2 3.92Å; L342-S351 CarbonylContact O-C 3.53Å; L342-S351 VanDerWaalsContact O-CA 3.25Å; L342-S351 WeakPolarHBondContact O-CA 3.38Å; L342-S351 WeakPolarHBondContact O-CB 2.97Å; L342-V352 PolarHBondContact N-O 2.96Å; L342-V352 PolarHBondContact O-N 2.73Å; L342-L354 HydrophobicContact CB-CD1 4.22Å; L342-L354 HydrophobicContact CB-CG 4.5Å; L342-W369 HydrophobicContact CD1-CG 4.12Å; L342-W369 HydrophobicContact CD2-CB 4.28Å; L342-W369 HydrophobicContact CD2-CD2 4.46Å; L342-W369 HydrophobicContact CD2-CG 4.18Å; L342-L375 HydrophobicContact CD1-CB 4.11Å; L342-L375 HydrophobicContact CD1-CD1 4.34Å
343	D	73.4	Confident	75.1	Confident	54 Å²	54	63.9 Å²	63.9	29%	0.289	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	147.4	-178.1	-168.1	27.1	0	0	0	112.7	V345 S374	D343-V345 PolarHBondContact O-N 2.75Å; D343-S374 PolarHBondContact N-O 2.82Å; D343-S374 VanDerWaalsContact N-O 3.16Å
344	R	60.5	Low	74.8	Confident	176 Å²	176	63.9 Å²	63.9	66%	0.664	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	47.5	172.2	-64.4	167	-177.2	-101.9	-4.8	116.6	W369	R344-W369 WeakPolarHBondContact O-CH2 3.45Å
345	V	53.8	Low	74.3	Confident	28 Å²	28	59.7 Å²	59.7	17%	0.17	33%	0.333	C	S	.	.			trans	-62.1	145.2	178.1	-179.3	0	0	0	0	111.6	L342 D343 G349 A350 V352	L342-V345 HydrophobicContact CB-CG2 4.18Å; L342-V345 HydrophobicContact CD2-CG2 3.84Å; L342-V345 HydrophobicContact CG-CG2 3.92Å; D343-V345 PolarHBondContact O-N 2.75Å; V345-G349 PolarHBondContact O-N 2.91Å; V345-A350 PolarHBondContact N-O 3.24Å; V345-A350 VanDerWaalsContact N-O 3.11Å; V345-V352 HydrophobicContact CB-CG2 3.82Å; V345-V352 HydrophobicContact CG1-CG2 4.13Å; V345-V352 HydrophobicContact CG2-CB 3.9Å; V345-V352 HydrophobicContact CG2-CG2 3.51Å
346	L	48	Very low	73.7	Confident	107 Å²	107	61.4 Å²	61.4	56%	0.56	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	150.5	176.5	-75.3	161	0	0	0	111.8	G348 W369	L346-G348 PolarHBondContact O-N 3.43Å; L346-W369 HydrophobicContact CG-CZ3 4.34Å
347	F	43.6	Very low	73.4	Confident	220 Å²	220	62 Å²	62	97%	0.965	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	16.9	-179.4	-49.2	-77.4	0	0	0	117.2
348	G	44.2	Very low	73.3	Confident	68 Å²	68	62.6 Å²	62.6	70%	0.701	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-166	-25	166.8	0	0	0	0	0	117	L346 A350	L346-G348 PolarHBondContact O-N 3.43Å; G348-A350 PolarHBondContact O-N 2.83Å
349	G	47.8	Very low	73	Confident	57 Å²	57	61.3 Å²	61.3	59%	0.588	34%	0.344	S	S	*	.	S	Bend	trans	72.1	4.6	-173.7	0	0	0	0	0	114.2	V345	V345-G349 PolarHBondContact O-N 2.91Å
350	A	58.1	Low	72.9	Confident	67 Å²	67	62.3 Å²	62.3	55%	0.554	35%	0.348	S	S	*	.	P	Polyproline II helix	trans	-80.7	157	165	0	0	0	0	0	110.5	V345 G348	V345-A350 PolarHBondContact N-O 3.24Å; V345-A350 VanDerWaalsContact N-O 3.11Å; G348-A350 PolarHBondContact O-N 2.83Å
351	S	70.2	Confident	72.7	Confident	48 Å²	48	62.9 Å²	62.9	34%	0.336	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-86.5	148.4	170.9	61.8	0	0	0	0	111.6	E341 L342	E341-S351 WeakPolarHBondContact OE1-CB 3.44Å; E341-S351 PolarHBondContact OE1-OG 3.44Å; L342-S351 CarbonylContact O-C 3.53Å; L342-S351 VanDerWaalsContact O-CA 3.25Å; L342-S351 WeakPolarHBondContact O-CA 3.38Å; L342-S351 WeakPolarHBondContact O-CB 2.97Å
352	V	77.4	Confident	72.6	Confident	37 Å²	37	60.9 Å²	60.9	22%	0.224	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-101.3	120.4	179.8	168.8	0	0	0	0	109.4	E341 L342 V345 L354 C357	E341-V352 CarbonylContact C-O 3.52Å; E341-V352 VanDerWaalsContact CA-O 3.29Å; E341-V352 WeakPolarHBondContact CA-O 3.46Å; L342-V352 PolarHBondContact N-O 2.96Å; L342-V352 PolarHBondContact O-N 2.73Å; V345-V352 HydrophobicContact CB-CG2 3.82Å; V345-V352 HydrophobicContact CG1-CG2 4.13Å; V345-V352 HydrophobicContact CG2-CB 3.9Å; V345-V352 HydrophobicContact CG2-CG2 3.51Å; V352-L354 HydrophobicContact CG1-CD2 4.15Å; V352-L354 PolarHBondContact O-N 2.61Å; V352-L354 VanDerWaalsContact O-N 3.15Å; V352-C357 WeakPolarHBondContact CG1-SG 3.46Å
353	Q	84.1	Confident	72.8	Confident	109 Å²	109	63.1 Å²	63.1	51%	0.509	36%	0.355	S	S	.	.			trans	-79.9	92.3	177.8	-67.1	-174.1	0.6	0	0	110.8	L340 T355 Q356 C357	L340-Q353 CarbonylContact O-C 3.22Å; Q353-T355 PolarHBondContact O-N 2.68Å; Q353-Q356 PolarHBondContact O-N 2.67Å; Q353-Q356 VanDerWaalsContact O-N 3.11Å; Q353-C357 PolarHBondContact O-N 2.98Å; Q353-C357 PolarHBondContact O-SG 3.44Å; Q353-C357 VanDerWaalsContact O-SG 3.38Å
354	L	85.4	Confident	73.3	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-61.5	-25.3	-177.7	-66.9	174.6	0	0	0	113	I317 L339 L340 L342 V352 Q356 C357 A362 L375	I317-L354 WeakPolarHBondContact CG1-O 3.41Å; L339-L354 HydrophobicContact CB-CB 4.29Å; L339-L354 HydrophobicContact CB-CD1 3.84Å; L339-L354 HydrophobicContact CD1-CD1 4.44Å; L339-L354 WeakPolarHBondContact O-CB 3.49Å; L340-L354 PolarHBondContact O-N 3.16Å; L342-L354 HydrophobicContact CB-CD1 4.22Å; L342-L354 HydrophobicContact CB-CG 4.5Å; V352-L354 HydrophobicContact CG1-CD2 4.15Å; V352-L354 PolarHBondContact O-N 2.61Å; V352-L354 VanDerWaalsContact O-N 3.15Å; L354-Q356 PolarHBondContact O-N 3.3Å; L354-Q356 VanDerWaalsContact O-N 3.13Å; L354-C357 HydrophobicContact CD2-CB 4.43Å; L354-C357 PolarHBondContact O-N 3.42Å; L354-C357 VanDerWaalsContact O-N 3.16Å; L354-A362 HydrophobicContact CD2-CB 4.13Å; L354-L375 HydrophobicContact CD1-CD1 3.49Å; L354-L375 VanDerWaalsContact CD1-CD1 3.49Å
355	T	82.8	Confident	74.3	Confident	49 Å²	49	58.5 Å²	58.5	30%	0.301	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-57.7	-23.7	173.7	57.8	0	0	0	0	114.4	L340 Q353	L340-T355 HydrophobicContact CB-CG2 4.32Å; L340-T355 HydrophobicContact CD2-CG2 3.71Å; L340-T355 PolarHBondContact O-N 3.33Å; Q353-T355 PolarHBondContact O-N 2.68Å
356	Q	81	Confident	75.7	Confident	138 Å²	138	57.2 Å²	57.2	65%	0.645	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-115.2	1.9	179.7	-59.8	-176.7	28.7	0	0	112.9	N313 Q353 L354	N313-Q356 WeakPolarHBondContact CB-O 3.37Å; Q353-Q356 PolarHBondContact O-N 2.67Å; Q353-Q356 VanDerWaalsContact O-N 3.11Å; L354-Q356 PolarHBondContact O-N 3.3Å; L354-Q356 VanDerWaalsContact O-N 3.13Å
357	C	87.2	Confident	77.3	Confident	14 Å²	14	56.5 Å²	56.5	10%	0.095	33%	0.325	C	S	.	.			trans	-75.5	146.8	177.4	-72.4	0	0	0	0	111.8	G312 N313 V352 Q353 L354 V361 A362	G312-C357 CarbonylContact C-O 3.58Å; N313-C357 WeakPolarHBondContact CA-O 3.41Å; N313-C357 WeakPolarHBondContact CB-O 3.46Å; N313-C357 PolarHBondContact N-O 3.14Å; N313-C357 VanDerWaalsContact N-O 3.14Å; V352-C357 WeakPolarHBondContact CG1-SG 3.46Å; Q353-C357 PolarHBondContact O-N 2.98Å; Q353-C357 PolarHBondContact O-SG 3.44Å; Q353-C357 VanDerWaalsContact O-SG 3.38Å; L354-C357 HydrophobicContact CD2-CB 4.43Å; L354-C357 PolarHBondContact O-N 3.42Å; L354-C357 VanDerWaalsContact O-N 3.16Å; C357-V361 HydrophobicContact CB-CB 4.3Å; C357-V361 HydrophobicContact CB-CG1 4.1Å; C357-A362 HydrophobicContact CB-CB 4.16Å
358	T	90.7	Very high	78.5	Confident	18 Å²	18	49 Å²	49	11%	0.11	30%	0.299	C	S	.	.			trans	-72	159.5	167.9	53.3	0	0	0	0	111.2	N313 E360 V361 A362 D400 F402 T432	N313-T358 HydrophobicContact CB-CG2 4.06Å; T358-E360 PolarHBondContact O-N 3Å; T358-V361 PolarHBondContact O-N 3.05Å; T358-V361 VanDerWaalsContact OG1-CG2 3.3Å; T358-V361 WeakPolarHBondContact OG1-CG2 3.49Å; T358-A362 PolarHBondContact O-N 3.2Å; T358-D400 WeakPolarHBondContact CA-OD1 3.48Å; T358-F402 HydrophobicContact CG2-CD1 3.97Å; T358-F402 HydrophobicContact CG2-CE1 3.64Å; T358-T432 HydrophobicContact CG2-CG2 4.1Å
359	A	90.5	Very high	79.7	Confident	7 Å²	7	47.6 Å²	47.6	6%	0.058	27%	0.273	C	S	.	.	H	α-helix	trans	-54.4	-37.2	-179.4	0	0	0	0	0	113.5	G311 H363 D400 T432 R433	G311-A359 WeakPolarHBondContact O-CB 3.43Å; A359-H363 VanDerWaalsContact O-CB 3.29Å; A359-H363 WeakPolarHBondContact O-CB 3.33Å; A359-H363 PolarHBondContact O-N 2.97Å; A359-D400 PolarHBondContact N-OD1 2.94Å; A359-D400 PolarHBondContact N-OD2 3.43Å; A359-T432 PolarHBondContact N-OG1 3Å; A359-R433 HydrophobicContact CB-CB 4.14Å
360	E	89.5	Confident	80.9	Confident	20 Å²	20	47.2 Å²	47.2	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-68.4	-43.8	174.8	76	-173.1	149.9	0	0	112.8	T358 H363 F364 T432 Y438 W440	T358-E360 PolarHBondContact O-N 3Å; E360-H363 PolarHBondContact O-N 3.09Å; E360-F364 VanDerWaalsContact O-CB 3.31Å; E360-F364 WeakPolarHBondContact O-CB 3.27Å; E360-F364 PolarHBondContact O-N 2.86Å; E360-T432 HydrophobicContact CG-CG2 4.37Å; E360-T432 PolarHBondContact N-OG1 3.14Å; E360-Y438 HydrophobicContact CB-CD1 3.97Å; E360-Y438 HydrophobicContact CB-CE1 4.13Å; E360-W440 VanDerWaalsContact OE1-CZ2 3.31Å; E360-W440 WeakPolarHBondContact OE1-CZ2 3.42Å; E360-W440 PolarHBondContact OE1-NE1 2.89Å; E360-W440 PolarHBondContact OE2-NE1 2.96Å
361	V	87.1	Confident	81.7	Confident	61 Å²	61	49.3 Å²	49.3	37%	0.37	26%	0.257	S	S	.	.	H	α-helix	trans	-70.4	-41	-176.2	170.9	0	0	0	0	110.4	C357 T358 S365	C357-V361 HydrophobicContact CB-CB 4.3Å; C357-V361 HydrophobicContact CB-CG1 4.1Å; T358-V361 PolarHBondContact O-N 3.05Å; T358-V361 VanDerWaalsContact OG1-CG2 3.3Å; T358-V361 WeakPolarHBondContact OG1-CG2 3.49Å; V361-S365 VanDerWaalsContact O-CB 3.23Å; V361-S365 WeakPolarHBondContact O-CB 3.34Å; V361-S365 PolarHBondContact O-N 2.91Å; V361-S365 PolarHBondContact O-OG 3.15Å
362	A	87.3	Confident	81.8	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-45.2	174.8	0	0	0	0	0	111.2	I309 I317 L354 C357 T358 S365 L366	I309-A362 HydrophobicContact CD1-CB 3.8Å; I317-A362 HydrophobicContact CD1-CB 3.64Å; I317-A362 HydrophobicContact CG1-CB 3.78Å; I317-A362 HydrophobicContact CG2-CB 4.08Å; L354-A362 HydrophobicContact CD2-CB 4.13Å; C357-A362 HydrophobicContact CB-CB 4.16Å; T358-A362 PolarHBondContact O-N 3.2Å; A362-S365 PolarHBondContact O-N 3.07Å; A362-L366 VanDerWaalsContact O-CG 3.28Å; A362-L366 WeakPolarHBondContact O-CG 3.22Å; A362-L366 PolarHBondContact O-N 3.35Å; A362-L366 VanDerWaalsContact O-N 3.12Å
363	H	87.1	Confident	81.6	Confident	48 Å²	48	50.8 Å²	50.8	22%	0.222	27%	0.269	C	S	.	.	H	α-helix	trans	-64.6	-46.5	179	-174.5	42.4	0	0	0	112.3	I309 A359 E360 L366 Q367 Y438	I309-H363 HydrophobicContact CD1-CB 4.16Å; A359-H363 VanDerWaalsContact O-CB 3.29Å; A359-H363 WeakPolarHBondContact O-CB 3.33Å; A359-H363 PolarHBondContact O-N 2.97Å; E360-H363 PolarHBondContact O-N 3.09Å; H363-L366 PolarHBondContact O-N 2.81Å; H363-Q367 WeakPolarHBondContact O-CB 3.46Å; H363-Q367 PolarHBondContact O-N 3.11Å; H363-Y438 AromaticContact CD2-CZ 3.77Å; H363-Y438 PolarHBondContact CD2-OH 2.85Å; H363-Y438 VanDerWaalsContact CD2-OH 3.28Å
364	F	82.3	Confident	81.4	Confident	119 Å²	119	46.7 Å²	46.7	52%	0.522	25%	0.252	S	S	.	.	H	α-helix	trans	-65.2	-39.9	178.7	-175.1	-97.8	0	0	0	112.2	E360 L366 Q367 C368	E360-F364 VanDerWaalsContact O-CB 3.31Å; E360-F364 WeakPolarHBondContact O-CB 3.27Å; E360-F364 PolarHBondContact O-N 2.86Å; F364-L366 VanDerWaalsContact C-N 3.35Å; F364-L366 PolarHBondContact O-N 3.16Å; F364-Q367 WeakPolarHBondContact O-CB 3.37Å; F364-Q367 PolarHBondContact O-N 3.27Å; F364-Q367 VanDerWaalsContact O-N 3.13Å; F364-C368 PolarHBondContact O-N 3.08Å
365	S	82.4	Confident	81.4	Confident	13 Å²	13	47.1 Å²	47.1	9%	0.091	25%	0.254	C	S	.	.	H	α-helix	trans	-61.7	-42.2	176.6	-60.8	0	0	0	0	111.8	V361 A362 W369	V361-S365 VanDerWaalsContact O-CB 3.23Å; V361-S365 WeakPolarHBondContact O-CB 3.34Å; V361-S365 PolarHBondContact O-N 2.91Å; V361-S365 PolarHBondContact O-OG 3.15Å; A362-S365 PolarHBondContact O-N 3.07Å; S365-W369 WeakPolarHBondContact O-CB 3.4Å
366	L	84	Confident	81.8	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-68.5	-35.8	173.5	-65.3	167.1	0	0	0	111.8	S302 L303 A304 I307 I309 L339 A362 H363 F364 C368 W369 L375	S302-L366 PolarHBondContact OG-O 2.9Å; S302-L366 VanDerWaalsContact OG-O 3.13Å; L303-L366 HydrophobicContact CD2-CD2 3.74Å; L303-L366 HydrophobicContact CG-CD2 4.12Å; A304-L366 HydrophobicContact CB-CB 4.43Å; I307-L366 HydrophobicContact CD1-CD1 4.21Å; I309-L366 HydrophobicContact CD1-CD1 4.05Å; I309-L366 HydrophobicContact CG2-CD1 3.82Å; L339-L366 HydrophobicContact CD1-CD1 3.95Å; L339-L366 HydrophobicContact CD1-CD2 4.47Å; A362-L366 VanDerWaalsContact O-CG 3.28Å; A362-L366 WeakPolarHBondContact O-CG 3.22Å; A362-L366 PolarHBondContact O-N 3.35Å; A362-L366 VanDerWaalsContact O-N 3.12Å; H363-L366 PolarHBondContact O-N 2.81Å; F364-L366 VanDerWaalsContact C-N 3.35Å; F364-L366 PolarHBondContact O-N 3.16Å; L366-C368 VanDerWaalsContact C-N 3.31Å; L366-C368 PolarHBondContact O-N 2.85Å; L366-W369 PolarHBondContact O-N 2.83Å; L366-W369 VanDerWaalsContact O-N 3.11Å; L366-L375 HydrophobicContact CD2-CD2 4.04Å
367	Q	81	Confident	82.3	Confident	92 Å²	92	45.6 Å²	45.6	43%	0.43	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-38.8	178	-166.9	174.6	11.6	0	0	111.9	S302 A304 H363 F364 W369 Y438	S302-Q367 VanDerWaalsContact OG-C 3.25Å; S302-Q367 WeakPolarHBondContact OG-CA 3.39Å; S302-Q367 PolarHBondContact OG-O 3.46Å; A304-Q367 HydrophobicContact CB-CB 4.1Å; A304-Q367 HydrophobicContact CB-CG 4.46Å; H363-Q367 WeakPolarHBondContact O-CB 3.46Å; H363-Q367 PolarHBondContact O-N 3.11Å; F364-Q367 WeakPolarHBondContact O-CB 3.37Å; F364-Q367 PolarHBondContact O-N 3.27Å; F364-Q367 VanDerWaalsContact O-N 3.13Å; Q367-W369 VanDerWaalsContact C-N 3.28Å; Q367-W369 PolarHBondContact O-N 3.15Å; Q367-Y438 PolarHBondContact OE1-OH 3.46Å
368	C	67.8	Low	82.6	Confident	63 Å²	63	50.5 Å²	50.5	43%	0.426	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	2.8	175.9	-65.8	0	0	0	0	114.6	F364 L366	F364-C368 PolarHBondContact O-N 3.08Å; L366-C368 VanDerWaalsContact C-N 3.31Å; L366-C368 PolarHBondContact O-N 2.85Å
369	W	71.1	Confident	82.8	Confident	37 Å²	37	53.5 Å²	53.5	14%	0.14	29%	0.285	C	S	.	.			trans	-117.5	147.1	-172.6	-151.4	-107.6	0	0	0	114.8	L303 L342 R344 L346 S365 L366 Q367 E371 S374	L303-W369 PolarHBondContact N-O 2.9Å; L342-W369 HydrophobicContact CD1-CG 4.12Å; L342-W369 HydrophobicContact CD2-CB 4.28Å; L342-W369 HydrophobicContact CD2-CD2 4.46Å; L342-W369 HydrophobicContact CD2-CG 4.18Å; R344-W369 WeakPolarHBondContact O-CH2 3.45Å; L346-W369 HydrophobicContact CG-CZ3 4.34Å; S365-W369 WeakPolarHBondContact O-CB 3.4Å; L366-W369 PolarHBondContact O-N 2.83Å; L366-W369 VanDerWaalsContact O-N 3.11Å; Q367-W369 VanDerWaalsContact C-N 3.28Å; Q367-W369 PolarHBondContact O-N 3.15Å; W369-E371 VanDerWaalsContact CD1-O 3.27Å; W369-E371 PolarHBondContact NE1-O 3.32Å; W369-E371 VanDerWaalsContact NE1-O 3.13Å; W369-S374 PolarHBondContact NE1-OG 2.96Å
370	T	71.1	Confident	82.9	Confident	49 Å²	49	55.4 Å²	55.4	30%	0.301	30%	0.295	S	S	.	.			trans	-136	3.6	-169.3	64.8	0	0	0	0	114.8	R300	R300-T370 HydrophobicContact CB-CG2 3.86Å; R300-T370 PolarHBondContact NH1-OG1 2.96Å
371	E	75.8	Confident	83	Confident	112 Å²	112	57.9 Å²	57.9	52%	0.523	31%	0.313	S	S	.	.			trans	-119.9	101.7	174.3	-69.3	-169.4	170.2	0	0	109.8	W369 S373 S374	W369-E371 VanDerWaalsContact CD1-O 3.27Å; W369-E371 PolarHBondContact NE1-O 3.32Å; W369-E371 VanDerWaalsContact NE1-O 3.13Å; E371-S373 PolarHBondContact O-N 2.68Å; E371-S374 PolarHBondContact O-N 2.83Å; E371-S374 PolarHBondContact O-OG 2.87Å
372	P	72	Confident	83.3	Confident	19 Å²	19	62.8 Å²	62.8	12%	0.123	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-70.1	-20.1	-177.2	-14.6	27.8	0	0	0	113.5	L303 P327 C331 S374 L375	L303-P372 HydrophobicContact CD1-CB 4.08Å; L303-P372 HydrophobicContact CD1-CG 4.15Å; L303-P372 HydrophobicContact CD2-CB 4.36Å; P327-P372 HydrophobicContact CB-CG 3.92Å; C331-P372 HydrophobicContact CB-CB 4.12Å; P372-S374 PolarHBondContact O-N 3.16Å; P372-L375 WeakPolarHBondContact O-CB 3.38Å; P372-L375 PolarHBondContact O-N 3.16Å
373	S	74.1	Confident	83.5	Confident	96 Å²	96	63.8 Å²	63.8	67%	0.671	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-70.4	-13	179.1	47.7	0	0	0	0	114.7	E371	E371-S373 PolarHBondContact O-N 2.68Å
374	S	78.6	Confident	83.8	Confident	24 Å²	24	62 Å²	62	17%	0.168	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-96.7	-1.1	174.7	72.7	0	0	0	0	113.9	D343 W369 E371 P372	D343-S374 PolarHBondContact N-O 2.82Å; D343-S374 VanDerWaalsContact N-O 3.16Å; W369-S374 PolarHBondContact NE1-OG 2.96Å; E371-S374 PolarHBondContact O-N 2.83Å; E371-S374 PolarHBondContact O-OG 2.87Å; P372-S374 PolarHBondContact O-N 3.16Å
375	L	86.8	Confident	84.3	Confident	8 Å²	8	60 Å²	60	4%	0.042	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	119.1	172.6	175.2	57.6	0	0	0	109.3	L303 L333 L339 L342 L354 L366 P372	L303-L375 HydrophobicContact CD2-CD2 3.78Å; L333-L375 HydrophobicContact CD1-CD2 4.19Å; L333-L375 HydrophobicContact CD2-CD2 4.3Å; L339-L375 HydrophobicContact CB-CD1 4.38Å; L339-L375 HydrophobicContact CD1-CD2 4.23Å; L339-L375 HydrophobicContact CD2-CD1 4.36Å; L339-L375 HydrophobicContact CD2-CD2 3.91Å; L339-L375 HydrophobicContact CD2-CG 4.31Å; L342-L375 HydrophobicContact CD1-CB 4.11Å; L342-L375 HydrophobicContact CD1-CD1 4.34Å; L354-L375 HydrophobicContact CD1-CD1 3.49Å; L354-L375 VanDerWaalsContact CD1-CD1 3.49Å; L366-L375 HydrophobicContact CD2-CD2 4.04Å; P372-L375 WeakPolarHBondContact O-CB 3.38Å; P372-L375 PolarHBondContact O-N 3.16Å
376	K	89.7	Confident	84.8	Confident	98 Å²	98	65.6 Å²	65.6	43%	0.426	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.1	174.1	-52.3	-176.5	-157.8	166.3	0	108.6	L340 E341	L340-K376 WeakPolarHBondContact CB-O 3.25Å; L340-K376 PolarHBondContact N-O 2.89Å; E341-K376 HydrophobicContact CB-CB 4.2Å; E341-K376 HydrophobicContact CB-CD 4.08Å; E341-K376 HydrophobicContact CB-CG 4.34Å; E341-K376 PolarHBondContact N-O 3.42Å; E341-K376 PolarHBondContact O-N 3.06Å; E341-K376 IonicContact OE1-NZ 3.58Å; E341-K376 PolarHBondContact OE1-NZ 3.08Å; E341-K376 WeakPolarHBondContact OE2-CD 3.43Å; E341-K376 WeakPolarHBondContact OE2-CE 3.37Å; E341-K376 IonicContact OE2-NZ 3.85Å; E341-K376 PolarHBondContact OE2-NZ 3.21Å
377	H	92.6	Very high	85.2	Confident	57 Å²	57	65.7 Å²	65.7	26%	0.264	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	160.5	177.7	66.7	-81.8	0	0	0	112	C331 G332 L333 E338 L339	C331-H377 PolarHBondContact O-CE1 2.93Å; G332-H377 PolarHBondContact O-NE2 3.41Å; G332-H377 VanDerWaalsContact O-NE2 3.09Å; L333-H377 HydrophobicContact CD2-CB 3.9Å; E338-H377 CarbonylContact O-C 3.18Å; E338-H377 VanDerWaalsContact O-CA 3.22Å; E338-H377 WeakPolarHBondContact O-CA 3.38Å; E338-H377 WeakPolarHBondContact O-CB 3.32Å; L339-H377 HydrophobicContact CD2-CB 3.86Å
378	Q	93.9	Very high	85.7	Confident	117 Å²	117	66.7 Å²	66.7	55%	0.547	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	147	175.2	178.4	170.8	-12	0	0	109.7	C337 E338 L340 N380	C337-Q378 CarbonylContact C-O 3.51Å; C337-Q378 VanDerWaalsContact CA-O 3.3Å; C337-Q378 WeakPolarHBondContact CA-O 3.41Å; E338-Q378 PolarHBondContact N-O 3.14Å; E338-Q378 PolarHBondContact O-N 3.05Å; L340-Q378 HydrophobicContact CD1-CB 3.98Å; Q378-N380 PolarHBondContact O-N 3.35Å
379	S	93.3	Very high	86.7	Confident	81 Å²	81	67.8 Å²	67.8	57%	0.566	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	119.7	170.7	-169.2	0	0	0	0	109.6
380	N	93.3	Very high	87.6	Confident	47 Å²	47	68.6 Å²	68.6	25%	0.251	37%	0.37	S	S	.	.			trans	-136.5	70.7	178	-177.4	3.7	0	0	0	109.9	F318 G336 E338 Q378 E382 G383 Y384	F318-N380 HydrophobicContact CE1-CB 4.03Å; G336-N380 CarbonylContact O-C 3.6Å; G336-N380 PolarHBondContact O-N 2.87Å; E338-N380 HydrophobicContact CB-CB 4.13Å; E338-N380 PolarHBondContact OE2-ND2 2.74Å; Q378-N380 PolarHBondContact O-N 3.35Å; N380-E382 PolarHBondContact O-N 2.86Å; N380-G383 PolarHBondContact O-N 2.96Å; N380-G383 PolarHBondContact OD1-N 2.62Å; N380-Y384 WeakPolarHBondContact O-CB 3.29Å; N380-Y384 PolarHBondContact O-N 2.84Å
381	P	91.9	Very high	88.4	Confident	73 Å²	73	69.8 Å²	69.8	47%	0.474	37%	0.374	S	S	.	.	H	α-helix	trans	-67.5	-24.5	-177.1	28.5	-35.5	0	0	0	112.7	S385	P381-S385 VanDerWaalsContact O-CB 3.25Å; P381-S385 WeakPolarHBondContact O-CB 3.47Å; P381-S385 PolarHBondContact O-N 2.83Å; P381-S385 PolarHBondContact O-OG 3.09Å
382	E	93.1	Very high	88.9	Confident	164 Å²	164	69.3 Å²	69.3	77%	0.766	38%	0.383	S	S	*	.	H	α-helix	trans	-70.8	-51.3	177.1	-64	-178.2	-171.5	0	0	111.3	N380 Y384 S385 K386	N380-E382 PolarHBondContact O-N 2.86Å; E382-Y384 VanDerWaalsContact C-N 3.3Å; E382-Y384 PolarHBondContact O-N 3.48Å; E382-S385 PolarHBondContact O-N 2.88Å; E382-K386 PolarHBondContact O-N 3.14Å
383	G	91.4	Very high	89.7	Confident	20 Å²	20	70.3 Å²	70.3	21%	0.206	39%	0.391	C	S	.	.	H	α-helix	trans	-59	-42	173.3	0	0	0	0	0	112	N380 K386 L387	N380-G383 PolarHBondContact O-N 2.96Å; N380-G383 PolarHBondContact OD1-N 2.62Å; G383-K386 PolarHBondContact O-N 2.93Å; G383-L387 WeakPolarHBondContact O-CB 3.21Å; G383-L387 PolarHBondContact O-N 3.16Å
384	Y	94	Very high	89.9	Confident	12 Å²	12	72.6 Å²	72.6	5%	0.047	40%	0.403	C	S	.	.	H	α-helix	trans	-63.2	-43.4	175.9	-173.2	-116.1	0	0	0	113.3	V310 F318 S320 E335 N380 E382 L387 R388	V310-Y384 HydrophobicContact CG2-CE2 3.77Å; F318-Y384 HydrophobicContact CB-CD2 3.57Å; F318-Y384 HydrophobicContact CB-CE2 4.02Å; F318-Y384 AromaticContact CD1-CD2 3.93Å; F318-Y384 HydrophobicContact CD1-CD2 3.93Å; F318-Y384 HydrophobicContact CD1-CG 4.33Å; F318-Y384 AromaticContact CG-CD2 3.91Å; F318-Y384 HydrophobicContact CG-CD2 3.91Å; S320-Y384 VanDerWaalsContact CA-OH 3.29Å; S320-Y384 WeakPolarHBondContact CA-OH 3.18Å; S320-Y384 VanDerWaalsContact CB-OH 3.25Å; S320-Y384 WeakPolarHBondContact CB-OH 3.38Å; E335-Y384 HydrophobicContact CG-CE1 3.78Å; N380-Y384 WeakPolarHBondContact O-CB 3.29Å; N380-Y384 PolarHBondContact O-N 2.84Å; E382-Y384 VanDerWaalsContact C-N 3.3Å; E382-Y384 PolarHBondContact O-N 3.48Å; Y384-L387 PolarHBondContact O-N 2.89Å; Y384-R388 HydrophobicContact CE1-CG 4.29Å; Y384-R388 PolarHBondContact O-N 3.21Å; Y384-R388 PolarHBondContact OH-NE 3.01Å; Y384-R388 VanDerWaalsContact OH-NE 3.08Å; Y384-R388 PolarHBondContact OH-NH2 2.93Å
385	S	93.4	Very high	90	Very high	75 Å²	75	76.3 Å²	76.3	52%	0.524	43%	0.43	S	S	.	.	H	α-helix	trans	-65.9	-39.8	178.5	-61	0	0	0	0	111.5	P381 E382 R388 S389	P381-S385 VanDerWaalsContact O-CB 3.25Å; P381-S385 WeakPolarHBondContact O-CB 3.47Å; P381-S385 PolarHBondContact O-N 2.83Å; P381-S385 PolarHBondContact O-OG 3.09Å; E382-S385 PolarHBondContact O-N 2.88Å; S385-R388 PolarHBondContact O-N 3.08Å; S385-S389 PolarHBondContact O-N 3.1Å
386	K	92.5	Very high	89.8	Confident	131 Å²	131	78.2 Å²	78.2	57%	0.57	44%	0.438	S	S	*	.	H	α-helix	trans	-60.2	-48.9	171.6	-174.5	-179.1	-177	-89.1	0	111.2	E382 G383 R388 S389 E390	E382-K386 PolarHBondContact O-N 3.14Å; G383-K386 PolarHBondContact O-N 2.93Å; K386-R388 VanDerWaalsContact C-N 3.34Å; K386-R388 PolarHBondContact O-N 3.42Å; K386-S389 WeakPolarHBondContact O-CB 3.42Å; K386-S389 PolarHBondContact O-N 2.85Å; K386-S389 VanDerWaalsContact O-N 3.14Å; K386-E390 WeakPolarHBondContact CE-OE1 3.49Å; K386-E390 IonicContact NZ-OE1 3.2Å; K386-E390 PolarHBondContact NZ-OE1 2.89Å; K386-E390 PolarHBondContact O-N 3.05Å
387	L	91.8	Very high	89.3	Confident	5 Å²	5	76.2 Å²	76.2	3%	0.026	44%	0.439	C	S	.	.	H	α-helix	trans	-60.4	-40.7	177.7	177.1	57.4	0	0	0	112	V310 T315 F318 G383 Y384 E390 L391 F396	V310-L387 HydrophobicContact CG2-CD2 4.15Å; T315-L387 HydrophobicContact CG2-CD1 3.94Å; F318-L387 HydrophobicContact CB-CD2 4.38Å; F318-L387 HydrophobicContact CD2-CD2 3.56Å; F318-L387 HydrophobicContact CE2-CD2 4.18Å; F318-L387 HydrophobicContact CG-CD2 4.22Å; G383-L387 WeakPolarHBondContact O-CB 3.21Å; G383-L387 PolarHBondContact O-N 3.16Å; Y384-L387 PolarHBondContact O-N 2.89Å; L387-E390 PolarHBondContact O-N 2.85Å; L387-L391 HydrophobicContact CD1-CD1 3.96Å; L387-L391 HydrophobicContact CD1-CG 4.02Å; L387-L391 HydrophobicContact CG-CD1 3.83Å; L387-L391 HydrophobicContact CG-CG 4.39Å; L387-L391 WeakPolarHBondContact O-CB 3.41Å; L387-L391 VanDerWaalsContact O-CG 3.28Å; L387-L391 WeakPolarHBondContact O-CG 3.39Å; L387-L391 PolarHBondContact O-N 2.99Å; L387-F396 HydrophobicContact CD1-CZ 4.29Å
388	R	91	Very high	89.1	Confident	112 Å²	112	74 Å²	74	42%	0.423	43%	0.432	S	S	.	.	H	α-helix	trans	-63.5	-40.4	173.1	-94.4	-168.3	170	156.4	8	113	E335 Y384 S385 K386 E390 S392	E335-R388 IonicContact OE1-CZ 2.79Å; E335-R388 IonicContact OE1-NH1 3.67Å; E335-R388 PolarHBondContact OE1-NH1 2.83Å; E335-R388 IonicContact OE1-NH2 3.01Å; E335-R388 PolarHBondContact OE1-NH2 2.73Å; Y384-R388 HydrophobicContact CE1-CG 4.29Å; Y384-R388 PolarHBondContact O-N 3.21Å; Y384-R388 PolarHBondContact OH-NE 3.01Å; Y384-R388 VanDerWaalsContact OH-NE 3.08Å; Y384-R388 PolarHBondContact OH-NH2 2.93Å; S385-R388 PolarHBondContact O-N 3.08Å; K386-R388 VanDerWaalsContact C-N 3.34Å; K386-R388 PolarHBondContact O-N 3.42Å; R388-E390 VanDerWaalsContact C-N 3.33Å; R388-S392 WeakPolarHBondContact O-CB 3.27Å; R388-S392 PolarHBondContact O-N 3Å; R388-S392 VanDerWaalsContact O-N 3.09Å; R388-S392 PolarHBondContact O-OG 2.86Å
389	S	90.4	Very high	88.9	Confident	87 Å²	87	68.9 Å²	68.9	61%	0.608	41%	0.41	S	S	*	.	H	α-helix	trans	-66	-36.6	175.3	-170.1	0	0	0	0	112	S385 K386	S385-S389 PolarHBondContact O-N 3.1Å; K386-S389 WeakPolarHBondContact O-CB 3.42Å; K386-S389 PolarHBondContact O-N 2.85Å; K386-S389 VanDerWaalsContact O-N 3.14Å
390	E	89.8	Confident	88.9	Confident	53 Å²	53	65 Å²	65	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-69.5	-48.4	174.9	-75.1	-175.1	-148.5	0	0	111.3	K386 L387 R388 S392 S393 F396	K386-E390 WeakPolarHBondContact CE-OE1 3.49Å; K386-E390 IonicContact NZ-OE1 3.2Å; K386-E390 PolarHBondContact NZ-OE1 2.89Å; K386-E390 PolarHBondContact O-N 3.05Å; L387-E390 PolarHBondContact O-N 2.85Å; R388-E390 VanDerWaalsContact C-N 3.33Å; E390-S392 PolarHBondContact O-N 2.89Å; E390-S392 VanDerWaalsContact O-N 3.16Å; E390-S393 WeakPolarHBondContact O-CB 3.16Å; E390-S393 PolarHBondContact O-N 2.82Å; E390-F396 HydrophobicContact CB-CD2 3.72Å; E390-F396 HydrophobicContact CB-CE2 3.68Å; E390-F396 WeakPolarHBondContact O-CB 3.11Å
391	L	86.9	Confident	88.9	Confident	74 Å²	74	64.5 Å²	64.5	39%	0.387	38%	0.383	S	S	.	.	H	α-helix	trans	-58.2	-26.5	176.1	-77.6	164.4	0	0	0	113.7	V310 L387 S393 F396	V310-L391 HydrophobicContact CB-CD1 4.4Å; L387-L391 HydrophobicContact CD1-CD1 3.96Å; L387-L391 HydrophobicContact CD1-CG 4.02Å; L387-L391 HydrophobicContact CG-CD1 3.83Å; L387-L391 HydrophobicContact CG-CG 4.39Å; L387-L391 WeakPolarHBondContact O-CB 3.41Å; L387-L391 VanDerWaalsContact O-CG 3.28Å; L387-L391 WeakPolarHBondContact O-CG 3.39Å; L387-L391 PolarHBondContact O-N 2.99Å; L391-S393 VanDerWaalsContact C-N 3.34Å; L391-F396 HydrophobicContact CD2-CD1 4.05Å; L391-F396 HydrophobicContact CD2-CE1 3.42Å; L391-F396 VanDerWaalsContact CD2-CE1 3.42Å; L391-F396 HydrophobicContact CD2-CZ 3.94Å; L391-F396 HydrophobicContact CG-CE1 4.12Å; L391-F396 HydrophobicContact CG-CZ 4.22Å
392	S	85.7	Confident	89.1	Confident	102 Å²	102	62.4 Å²	62.4	71%	0.713	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-7.1	176.9	-55.1	0	0	0	0	113.3	R388 E390	R388-S392 WeakPolarHBondContact O-CB 3.27Å; R388-S392 PolarHBondContact O-N 3Å; R388-S392 VanDerWaalsContact O-N 3.09Å; R388-S392 PolarHBondContact O-OG 2.86Å; E390-S392 PolarHBondContact O-N 2.89Å; E390-S392 VanDerWaalsContact O-N 3.16Å
393	S	88.7	Confident	89.2	Confident	41 Å²	41	57.2 Å²	57.2	29%	0.287	34%	0.34	S	S	.	.	S	Bend	trans	-89.1	133.7	-179.9	-175.5	0	0	0	0	111.8	E390 L391 S395 F396	E390-S393 WeakPolarHBondContact O-CB 3.16Å; E390-S393 PolarHBondContact O-N 2.82Å; L391-S393 VanDerWaalsContact C-N 3.34Å; S393-S395 PolarHBondContact O-N 2.82Å; S393-S395 VanDerWaalsContact O-N 3.1Å; S393-S395 PolarHBondContact OG-N 3.04Å; S393-S395 VanDerWaalsContact OG-N 3.17Å; S393-S395 PolarHBondContact OG-OG 3.43Å; S393-F396 VanDerWaalsContact O-CB 3.32Å; S393-F396 WeakPolarHBondContact O-CB 3.3Å; S393-F396 PolarHBondContact O-N 2.8Å; S393-F396 VanDerWaalsContact O-N 3.14Å
394	P	78.9	Confident	89.4	Confident	143 Å²	143	56.3 Å²	56.3	93%	0.929	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-9.5	170.4	30	-36	0	0	0	113.2
395	S	80.6	Confident	89.5	Confident	103 Å²	103	55.9 Å²	55.9	72%	0.72	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	9	174.5	77.6	0	0	0	0	113.9	S393 A397	S393-S395 PolarHBondContact O-N 2.82Å; S393-S395 VanDerWaalsContact O-N 3.1Å; S393-S395 PolarHBondContact OG-N 3.04Å; S393-S395 VanDerWaalsContact OG-N 3.17Å; S393-S395 PolarHBondContact OG-OG 3.43Å; S395-A397 PolarHBondContact O-N 2.91Å
396	F	83.8	Confident	89.6	Confident	47 Å²	47	52.3 Å²	52.3	21%	0.206	30%	0.304	C	S	.	.			trans	-75.1	113.7	-173.5	-172.6	-121	0	0	0	112.4	L387 E390 L391 S393 G398 A399	L387-F396 HydrophobicContact CD1-CZ 4.29Å; E390-F396 HydrophobicContact CB-CD2 3.72Å; E390-F396 HydrophobicContact CB-CE2 3.68Å; E390-F396 WeakPolarHBondContact O-CB 3.11Å; L391-F396 HydrophobicContact CD2-CD1 4.05Å; L391-F396 HydrophobicContact CD2-CE1 3.42Å; L391-F396 VanDerWaalsContact CD2-CE1 3.42Å; L391-F396 HydrophobicContact CD2-CZ 3.94Å; L391-F396 HydrophobicContact CG-CE1 4.12Å; L391-F396 HydrophobicContact CG-CZ 4.22Å; S393-F396 VanDerWaalsContact O-CB 3.32Å; S393-F396 WeakPolarHBondContact O-CB 3.3Å; S393-F396 PolarHBondContact O-N 2.8Å; S393-F396 VanDerWaalsContact O-N 3.14Å; F396-G398 VanDerWaalsContact CE1-O 3.29Å; F396-G398 WeakPolarHBondContact CE1-O 3.4Å; F396-G398 WeakPolarHBondContact CE2-O 3.34Å; F396-G398 WeakPolarHBondContact CZ-O 3.41Å; F396-G398 PolarHBondContact O-N 3.35Å; F396-A399 HydrophobicContact CE1-CB 4.17Å; F396-A399 HydrophobicContact CZ-CB 4.02Å
397	A	78.6	Confident	89.6	Confident	56 Å²	56	46 Å²	46	46%	0.463	28%	0.277	S	S	.	.			trans	-77.2	42.8	178.1	0	0	0	0	0	113.2	R314 S395 T430	R314-A397 PolarHBondContact NH1-O 2.86Å; S395-A397 PolarHBondContact O-N 2.91Å; A397-T430 WeakPolarHBondContact O-CB 3.28Å; A397-T430 WeakPolarHBondContact O-CG2 3.04Å
398	G	87.4	Confident	89.6	Confident	11 Å²	11	46.1 Å²	46.1	11%	0.113	28%	0.277	C	S	.	.			trans	64.5	176.3	-175.7	0	0	0	0	0	114.4	R314 F396 T430	R314-G398 PolarHBondContact NH1-O 2.78Å; R314-G398 PolarHBondContact NH2-O 3.05Å; F396-G398 VanDerWaalsContact CE1-O 3.29Å; F396-G398 WeakPolarHBondContact CE1-O 3.4Å; F396-G398 WeakPolarHBondContact CE2-O 3.34Å; F396-G398 WeakPolarHBondContact CZ-O 3.41Å; F396-G398 PolarHBondContact O-N 3.35Å; G398-T430 CarbonylContact C-O 3.56Å; G398-T430 WeakPolarHBondContact CA-O 3.49Å
399	A	90.9	Very high	89.5	Confident	10 Å²	10	43 Å²	43	8%	0.083	27%	0.269	C	S	.	.	S	Bend	trans	-96.4	-21.5	-175.4	0	0	0	0	0	114.4	G312 R314 T315 F396 T430	G312-A399 CarbonylContact C-O 3.44Å; G312-A399 WeakPolarHBondContact CA-O 3.44Å; R314-A399 PolarHBondContact N-O 2.76Å; T315-A399 PolarHBondContact OG1-O 3.31Å; F396-A399 HydrophobicContact CE1-CB 4.17Å; F396-A399 HydrophobicContact CZ-CB 4.02Å; A399-T430 PolarHBondContact N-O 3.18Å
400	D	93.2	Very high	89.4	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.245	C	C	.	.			trans	-91.9	172.8	170.2	-66.5	-49.9	0	0	0	110.4	G312 N313 R314 T358 A359 T430 T432	G312-D400 WeakPolarHBondContact CA-OD1 3.4Å; N313-D400 PolarHBondContact N-OD1 3.14Å; N313-D400 WeakPolarHBondContact OD1-CA 3.33Å; N313-D400 WeakPolarHBondContact OD1-CB 3.31Å; N313-D400 PolarHBondContact OD1-OD1 2.93Å; R314-D400 PolarHBondContact NH1-O 2.72Å; T358-D400 WeakPolarHBondContact CA-OD1 3.48Å; A359-D400 PolarHBondContact N-OD1 2.94Å; A359-D400 PolarHBondContact N-OD2 3.43Å; D400-T430 CarbonylContact C-O 3.56Å; D400-T430 WeakPolarHBondContact CA-O 3.34Å; D400-T430 PolarHBondContact N-O 2.9Å; D400-T432 WeakPolarHBondContact OD2-CB 3.45Å; D400-T432 WeakPolarHBondContact OD2-CG2 3.27Å; D400-T432 PolarHBondContact OD2-N 3.26Å; D400-T432 PolarHBondContact OD2-OG1 3.23Å
401	S	93.9	Very high	89	Confident	35 Å²	35	42 Å²	42	25%	0.245	26%	0.255	C	S	.	.			trans	-165.3	112	164.4	172.7	0	0	0	0	110.5	N313 H428 V429	N313-S401 PolarHBondContact ND2-O 3.4Å; N313-S401 PolarHBondContact OD1-N 2.93Å; S401-H428 PolarHBondContact OG-NE2 2.69Å; S401-V429 VanDerWaalsContact CA-O 3.28Å; S401-V429 WeakPolarHBondContact CA-O 3.36Å
402	F	94.8	Very high	88.5	Confident	30 Å²	30	41.8 Å²	41.8	13%	0.132	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	159	165.6	61.7	-89.4	0	0	0	111.8	T358 H428 V429 T432 W440 L531	T358-F402 HydrophobicContact CG2-CD1 3.97Å; T358-F402 HydrophobicContact CG2-CE1 3.64Å; F402-H428 CarbonylContact O-C 3.49Å; F402-H428 PolarHBondContact O-CD2 2.92Å; F402-V429 HydrophobicContact CD1-CB 4.18Å; F402-V429 HydrophobicContact CD1-CG1 4.48Å; F402-V429 HydrophobicContact CD2-CB 4.14Å; F402-V429 HydrophobicContact CD2-CG2 4.26Å; F402-V429 HydrophobicContact CE1-CB 3.76Å; F402-V429 HydrophobicContact CE1-CG1 3.68Å; F402-V429 HydrophobicContact CE2-CB 3.74Å; F402-V429 HydrophobicContact CE2-CG1 4.27Å; F402-V429 HydrophobicContact CE2-CG2 3.64Å; F402-V429 HydrophobicContact CG-CB 4.36Å; F402-V429 HydrophobicContact CZ-CB 3.54Å; F402-V429 HydrophobicContact CZ-CG1 3.57Å; F402-V429 HydrophobicContact CZ-CG2 3.8Å; F402-V429 PolarHBondContact N-O 3.46Å; F402-V429 VanDerWaalsContact N-O 3.09Å; F402-V429 PolarHBondContact O-N 2.99Å; F402-T432 HydrophobicContact CE1-CG2 3.67Å; F402-T432 HydrophobicContact CZ-CG2 4.01Å; F402-W440 HydrophobicContact CE2-CH2 4.03Å; F402-W440 HydrophobicContact CE2-CZ3 4.1Å; F402-W440 AromaticContact CZ-CH2 3.93Å; F402-W440 HydrophobicContact CZ-CH2 3.93Å; F402-W440 HydrophobicContact CZ-CZ2 4.05Å; F402-W440 HydrophobicContact CZ-CZ3 4.18Å; F402-L531 HydrophobicContact CB-CD1 4.01Å; F402-L531 HydrophobicContact CD2-CD1 3.59Å; F402-L531 HydrophobicContact CE2-CD1 4.42Å; F402-L531 HydrophobicContact CG-CD1 4.11Å
403	Y	96.4	Very high	87.7	Confident	54 Å²	54	41.8 Å²	41.8	21%	0.212	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	140.2	177.3	-62.3	-94.6	0	0	0	110.9	I426 I427 H428 V445 V532 P534 W711	Y403-I426 HydrophobicContact CD1-CG2 4.34Å; Y403-I427 CarbonylContact C-O 3.38Å; Y403-I427 VanDerWaalsContact CA-O 3.28Å; Y403-I427 WeakPolarHBondContact CA-O 3.49Å; Y403-H428 HydrophobicContact CD1-CB 3.7Å; Y403-H428 HydrophobicContact CE1-CB 3.54Å; Y403-H428 AromaticContact CE1-CD2 3.84Å; Y403-H428 AromaticContact CE1-CG 3.66Å; Y403-H428 AromaticContact CZ-CD2 3.78Å; Y403-H428 AromaticContact CZ-CG 3.92Å; Y403-V445 HydrophobicContact CD1-CG2 4.24Å; Y403-V445 HydrophobicContact CE1-CG2 4.09Å; Y403-V532 PolarHBondContact O-N 3.48Å; Y403-P534 HydrophobicContact CD2-CG 4.15Å; Y403-P534 HydrophobicContact CE2-CG 4.01Å; Y403-W711 AromaticContact CD1-CH2 3.62Å; Y403-W711 HydrophobicContact CD1-CH2 3.62Å; Y403-W711 AromaticContact CD1-CZ3 3.56Å; Y403-W711 HydrophobicContact CD1-CZ3 3.56Å; Y403-W711 HydrophobicContact CD2-CZ3 4.35Å; Y403-W711 AromaticContact CE1-CH2 3.84Å; Y403-W711 HydrophobicContact CE1-CH2 3.84Å; Y403-W711 HydrophobicContact CE1-CZ3 4.17Å; Y403-W711 HydrophobicContact CG-CH2 4.19Å; Y403-W711 AromaticContact CG-CZ3 3.67Å; Y403-W711 HydrophobicContact CG-CZ3 3.67Å
404	A	95.6	Very high	86.4	Confident	2 Å²	2	42.2 Å²	42.2	2%	0.017	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	140.7	177.2	0	0	0	0	0	111.8	I426 I427 S530	A404-I426 WeakPolarHBondContact O-CA 3.27Å; A404-I427 HydrophobicContact CB-CG1 4.05Å; A404-I427 PolarHBondContact N-O 3.22Å; A404-I427 PolarHBondContact O-N 3.5Å; A404-S530 CarbonylContact C-O 3.59Å; A404-S530 VanDerWaalsContact CA-O 3.3Å; A404-S530 WeakPolarHBondContact CA-O 3.43Å
405	R	95.3	Very high	84.9	Confident	2 Å²	2	43 Å²	43	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	126.1	166.4	176.7	176.9	173.6	-175.2	4.5	108.5	D424 D425 I426 R496 Y529 S530 V532 L676 E713	R405-D424 IonicContact CZ-OD1 3.66Å; R405-D424 IonicContact NE-OD1 3.14Å; R405-D424 PolarHBondContact NE-OD1 3.02Å; R405-D424 IonicContact NH2-OD1 3.12Å; R405-D424 PolarHBondContact NH2-OD1 2.67Å; R405-D424 IonicContact NH2-OD2 3.38Å; R405-D425 WeakPolarHBondContact CA-O 3.32Å; R405-I426 HydrophobicContact CB-CD1 3.67Å; R405-I426 HydrophobicContact CG-CD1 4.05Å; R405-R496 VanDerWaalsContact CZ-NE 3.3Å; R405-R496 VanDerWaalsContact NH1-CZ 3.25Å; R405-R496 VanDerWaalsContact NH1-NH2 3.17Å; R405-Y529 WeakPolarHBondContact O-CA 3.33Å; R405-S530 PolarHBondContact N-O 3.26Å; R405-S530 PolarHBondContact O-N 3.22Å; R405-V532 HydrophobicContact CB-CG1 3.87Å; R405-L676 PolarHBondContact NH1-O 2.93Å; R405-E713 IonicContact NH1-OE1 2.68Å
406	V	94.5	Very high	83.9	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	129.6	179.9	-170.4	0	0	0	0	109.6	L408 V421 C423 D424 D425 I427 M458 Y529	V406-L408 WeakPolarHBondContact CG1-O 3.19Å; V406-V421 HydrophobicContact CG1-CG2 4.01Å; V406-V421 HydrophobicContact CG2-CG2 4.26Å; V406-C423 WeakPolarHBondContact O-CA 3.35Å; V406-D424 PolarHBondContact O-N 3.39Å; V406-D425 PolarHBondContact N-O 3.19Å; V406-I427 HydrophobicContact CG2-CD1 4.23Å; V406-I427 HydrophobicContact CG2-CG1 4.2Å; V406-I427 HydrophobicContact CG2-CG2 4.1Å; V406-M458 HydrophobicContact CG2-CE 4.36Å; V406-Y529 HydrophobicContact CB-CD1 4.48Å; V406-Y529 HydrophobicContact CG1-CD1 4.27Å; V406-Y529 HydrophobicContact CG1-CE1 3.98Å; V406-Y529 HydrophobicContact CG2-CD1 4.21Å; V406-Y529 HydrophobicContact CG2-CE1 4.13Å
407	N	93.2	Very high	83	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.266	C	S	.	.			trans	-102.4	8.1	-174.9	-65.1	-30.1	0	0	0	113.9	V495 R496 I527 P528 S530	N407-V495 CarbonylContact O-C 3.05Å; N407-V495 WeakPolarHBondContact O-CA 3.41Å; N407-R496 HydrophobicContact CB-CB 4.18Å; N407-R496 PolarHBondContact O-N 3.04Å; N407-R496 WeakPolarHBondContact OD1-CD 3.46Å; N407-R496 PolarHBondContact OD1-NH1 2.88Å; N407-I527 WeakPolarHBondContact CB-O 3.43Å; N407-I527 PolarHBondContact ND2-O 2.9Å; N407-P528 WeakPolarHBondContact CB-O 3.46Å; N407-P528 PolarHBondContact N-O 3.14Å; N407-S530 PolarHBondContact ND2-OG 3.41Å
408	L	91.1	Very high	83.1	Confident	6 Å²	6	43.3 Å²	43.3	3%	0.031	25%	0.253	C	S	.	.	B	Isolated β-bridge	trans	-149.3	152.3	174.7	63.8	161.2	0	0	0	110.8	V406 M410 L467 L468 V495 P528	V406-L408 WeakPolarHBondContact CG1-O 3.19Å; L408-M410 HydrophobicContact CD1-CE 3.92Å; L408-M410 HydrophobicContact CD2-CE 3.66Å; L408-M410 HydrophobicContact CG-CE 3.76Å; L408-M410 HydrophobicContact CG-CG 4.36Å; L408-L467 HydrophobicContact CD1-CB 4.44Å; L408-L468 HydrophobicContact CB-CD1 4.41Å; L408-L468 HydrophobicContact CD1-CB 3.99Å; L408-L468 HydrophobicContact CD2-CB 4.37Å; L408-V495 HydrophobicContact CB-CG2 4.24Å; L408-P528 HydrophobicContact CD2-CB 3.71Å
409	N	90.3	Very high	83	Confident	48 Å²	48	42.9 Å²	42.9	26%	0.257	25%	0.248	S	C	.	.			trans	-66.7	141.7	168.3	-62.4	-6.7	0	0	0	110.4	C423 S492 R494	N409-C423 PolarHBondContact OD1-N 3.43Å; N409-S492 PolarHBondContact ND2-O 3.48Å; N409-R494 PolarHBondContact N-O 3.42Å; N409-R494 PolarHBondContact ND2-N 3.33Å; N409-R494 PolarHBondContact OD1-O 3.46Å
410	M	87.3	Confident	83	Confident	21 Å²	21	44.7 Å²	44.7	10%	0.103	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-131.4	125.7	169.8	-58.3	-169.5	179.7	0	0	109.9	L408 V421 M458 P459 A464 Y529	L408-M410 HydrophobicContact CD1-CE 3.92Å; L408-M410 HydrophobicContact CD2-CE 3.66Å; L408-M410 HydrophobicContact CG-CE 3.76Å; L408-M410 HydrophobicContact CG-CG 4.36Å; M410-V421 HydrophobicContact CB-CG2 3.85Å; M410-V421 HydrophobicContact CG-CG2 4.17Å; M410-V421 PolarHBondContact N-O 3.47Å; M410-V421 PolarHBondContact O-N 3.24Å; M410-M458 HydrophobicContact SD-CE 3.7Å; M410-M458 HydrophobicContact SD-SD 4.12Å; M410-P459 HydrophobicContact CE-CG 4.11Å; M410-P459 HydrophobicContact SD-CG 3.72Å; M410-A464 HydrophobicContact CE-CB 3.83Å; M410-Y529 HydrophobicContact CE-CE1 4.11Å; M410-Y529 VanDerWaalsContact CE-OH 3.32Å; M410-Y529 WeakPolarHBondContact CE-OH 3.31Å
411	E	81.6	Confident	82.9	Confident	96 Å²	96	45 Å²	45	45%	0.449	27%	0.265	S	S	.	.			trans	-88.3	154.8	176.4	-74	167.8	-174.9	0	0	110	H413 T418	E411-H413 PolarHBondContact O-CD2 2.97Å; E411-H413 PolarHBondContact O-N 3.32Å; E411-T418 PolarHBondContact O-OG1 3.28Å
412	P	77.6	Confident	82.8	Confident	71 Å²	71	46.3 Å²	46.3	46%	0.461	27%	0.274	S	S	.	.			trans	-72.1	124.8	179.8	29.2	-32.4	0	0	0	110.1	P417 T418 A420	P412-P417 HydrophobicContact CB-CB 4.23Å; P412-T418 WeakPolarHBondContact CB-O 3.36Å; P412-A420 HydrophobicContact CB-CB 4.39Å; P412-A420 HydrophobicContact CG-CB 4.25Å
413	H	68.1	Low	82.7	Confident	101 Å²	101	45.1 Å²	45.1	47%	0.468	27%	0.27	S	S	.	.			trans	-136.7	152.1	-176.5	-59.2	-33.8	0	0	0	111.3	E411 T418	E411-H413 PolarHBondContact O-CD2 2.97Å; E411-H413 PolarHBondContact O-N 3.32Å; H413-T418 PolarHBondContact N-OG1 3.18Å; H413-T418 PolarHBondContact O-N 3.15Å; H413-T418 VanDerWaalsContact O-N 3.07Å; H413-T418 PolarHBondContact O-OG1 2.86Å
414	G	61.3	Low	82.5	Confident	50 Å²	50	42.8 Å²	42.8	52%	0.515	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-179.9	178.5	0	0	0	0	0	114.8	P416 P417	G414-P416 CarbonylContact O-C 3.59Å; G414-P417 VanDerWaalsContact O-CA 3.31Å; G414-P417 WeakPolarHBondContact O-CA 3.49Å
415	D	47.7	Very low	82.4	Confident	160 Å²	160	44.2 Å²	44.2	86%	0.856	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.9	120.8	173.8	-177.4	26	0	0	0	109.4
416	P	59.8	Low	82.5	Confident	97 Å²	97	44.1 Å²	44.1	63%	0.63	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	cis	-65.5	151.2	-8.9	30.2	-36.1	0	0	0	111.8	G414	G414-P416 CarbonylContact O-C 3.59Å
417	P	65.3	Low	82.6	Confident	84 Å²	84	44.1 Å²	44.1	55%	0.545	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	138.1	-175.1	24.5	-34.3	0	0	0	112.9	P412 G414	P412-P417 HydrophobicContact CB-CB 4.23Å; G414-P417 VanDerWaalsContact O-CA 3.31Å; G414-P417 WeakPolarHBondContact O-CA 3.49Å
418	T	79.3	Confident	82.7	Confident	31 Å²	31	45.4 Å²	45.4	19%	0.19	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-62.9	157.3	171.1	52.1	0	0	0	0	112.5	E411 P412 H413 A420 T457	E411-T418 PolarHBondContact O-OG1 3.28Å; P412-T418 WeakPolarHBondContact CB-O 3.36Å; H413-T418 PolarHBondContact N-OG1 3.18Å; H413-T418 PolarHBondContact O-N 3.15Å; H413-T418 VanDerWaalsContact O-N 3.07Å; H413-T418 PolarHBondContact O-OG1 2.86Å; T418-A420 PolarHBondContact O-N 3.45Å; T418-T457 WeakPolarHBondContact CA-O 3.16Å; T418-T457 WeakPolarHBondContact CB-O 3.31Å
419	L	86.9	Confident	83	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-64.1	122.3	176.4	-172.1	66.1	0	0	0	110.4	V421 I427 L444 Q454 T457 M458	L419-V421 HydrophobicContact CD2-CG1 4.02Å; L419-V421 HydrophobicContact CG-CG1 3.97Å; L419-I427 HydrophobicContact CD2-CG2 4.36Å; L419-L444 HydrophobicContact CD2-CB 4.16Å; L419-Q454 HydrophobicContact CD1-CB 4.18Å; L419-Q454 HydrophobicContact CD1-CG 3.77Å; L419-T457 PolarHBondContact N-O 3.47Å; L419-M458 HydrophobicContact CB-CG 4.15Å; L419-M458 HydrophobicContact CB-SD 4.13Å; L419-M458 HydrophobicContact CD2-CG 4.37Å
420	A	89.5	Confident	83.1	Confident	47 Å²	47	43.5 Å²	43.5	39%	0.388	26%	0.264	S	S	.	.	P	Polyproline II helix	trans	-73.8	125.8	173	0	0	0	0	0	110	P412 T418	P412-A420 HydrophobicContact CB-CB 4.39Å; P412-A420 HydrophobicContact CG-CB 4.25Å; T418-A420 PolarHBondContact O-N 3.45Å
421	V	91.7	Very high	83.4	Confident	7 Å²	7	44.2 Å²	44.2	4%	0.042	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-142.1	149.9	-179.3	-63.7	0	0	0	0	112.2	V406 M410 L419 I427 L444 M458	V406-V421 HydrophobicContact CG1-CG2 4.01Å; V406-V421 HydrophobicContact CG2-CG2 4.26Å; M410-V421 HydrophobicContact CB-CG2 3.85Å; M410-V421 HydrophobicContact CG-CG2 4.17Å; M410-V421 PolarHBondContact N-O 3.47Å; M410-V421 PolarHBondContact O-N 3.24Å; L419-V421 HydrophobicContact CD2-CG1 4.02Å; L419-V421 HydrophobicContact CG-CG1 3.97Å; V421-I427 HydrophobicContact CG1-CG2 4.18Å; V421-L444 HydrophobicContact CG1-CD1 4.43Å; V421-M458 HydrophobicContact CG1-CE 4.3Å; V421-M458 HydrophobicContact CG1-SD 4.45Å; V421-M458 HydrophobicContact CG2-CE 3.47Å; V421-M458 VanDerWaalsContact CG2-CE 3.47Å; V421-M458 HydrophobicContact CG2-SD 4.06Å
422	S	91.9	Very high	83.9	Confident	63 Å²	63	39.7 Å²	39.7	44%	0.441	25%	0.247	S	C	.	.			trans	-103.7	160.7	174.2	-58.2	0	0	0	0	112	D424 D425	S422-D424 PolarHBondContact O-N 2.69Å; S422-D425 WeakPolarHBondContact CA-OD2 3.21Å; S422-D425 WeakPolarHBondContact CB-OD2 3.09Å; S422-D425 PolarHBondContact N-OD2 3.39Å; S422-D425 VanDerWaalsContact O-CB 3.31Å; S422-D425 WeakPolarHBondContact O-CB 3.36Å; S422-D425 PolarHBondContact O-N 2.89Å
423	C	91.6	Very high	84.4	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.034	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	133.8	168.6	-172.4	0	0	0	0	111.4	V406 N409 R494 R496	V406-C423 WeakPolarHBondContact O-CA 3.35Å; N409-C423 PolarHBondContact OD1-N 3.43Å; C423-R494 HydrophobicContact CB-CB 4.17Å; C423-R494 HydrophobicContact CB-CG 4.02Å; C423-R494 WeakPolarHBondContact CB-O 3.33Å; C423-R494 PolarHBondContact O-NH1 3.3Å; C423-R496 WeakPolarHBondContact SG-CB 3.42Å
424	D	92.4	Very high	85.3	Confident	4 Å²	4	35.7 Å²	35.7	2%	0.021	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	1.5	-167.2	-59.4	-30.2	0	0	0	117.6	R405 V406 S422 R447 R494 L679	R405-D424 IonicContact CZ-OD1 3.66Å; R405-D424 IonicContact NE-OD1 3.14Å; R405-D424 PolarHBondContact NE-OD1 3.02Å; R405-D424 IonicContact NH2-OD1 3.12Å; R405-D424 PolarHBondContact NH2-OD1 2.67Å; R405-D424 IonicContact NH2-OD2 3.38Å; V406-D424 PolarHBondContact O-N 3.39Å; S422-D424 PolarHBondContact O-N 2.69Å; D424-R447 PolarHBondContact O-NE 3.03Å; D424-R447 PolarHBondContact O-NH1 3.46Å; D424-R447 VanDerWaalsContact O-NH1 3.16Å; D424-R494 IonicContact OD1-NH2 2.75Å; D424-R494 IonicContact OD2-CZ 3.27Å; D424-R494 IonicContact OD2-NH1 3.37Å; D424-R494 PolarHBondContact OD2-NH1 2.86Å; D424-R494 IonicContact OD2-NH2 3.98Å; D424-R494 PolarHBondContact OD2-NH2 3.41Å; D424-L679 HydrophobicContact CB-CD2 4.2Å
425	D	94.9	Very high	86.4	Confident	32 Å²	32	39.8 Å²	39.8	17%	0.171	23%	0.23	C	C	.	.			trans	-68.5	151.5	168.1	-71.7	-25.1	0	0	0	111.4	R405 V406 S422 L444 R447	R405-D425 WeakPolarHBondContact CA-O 3.32Å; V406-D425 PolarHBondContact N-O 3.19Å; S422-D425 WeakPolarHBondContact CA-OD2 3.21Å; S422-D425 WeakPolarHBondContact CB-OD2 3.09Å; S422-D425 PolarHBondContact N-OD2 3.39Å; S422-D425 VanDerWaalsContact O-CB 3.31Å; S422-D425 WeakPolarHBondContact O-CB 3.36Å; S422-D425 PolarHBondContact O-N 2.89Å; D425-L444 HydrophobicContact CB-CD1 3.82Å; D425-R447 IonicContact OD1-NH1 2.75Å
426	I	96.7	Very high	88	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	125.5	-179.1	-55.6	-55.4	0	0	0	108.7	Y403 A404 R405 V445 R447 V532 L679 W711	Y403-I426 HydrophobicContact CD1-CG2 4.34Å; A404-I426 WeakPolarHBondContact O-CA 3.27Å; R405-I426 HydrophobicContact CB-CD1 3.67Å; R405-I426 HydrophobicContact CG-CD1 4.05Å; I426-V445 HydrophobicContact CB-CB 4.4Å; I426-V445 HydrophobicContact CG2-CB 4.27Å; I426-V445 WeakPolarHBondContact O-CB 3.34Å; I426-V445 PolarHBondContact O-N 3.18Å; I426-R447 HydrophobicContact CG1-CG 4.12Å; I426-V532 HydrophobicContact CD1-CG2 4.26Å; I426-V532 HydrophobicContact CG2-CG2 4.32Å; I426-L679 HydrophobicContact CD1-CD1 4.2Å; I426-L679 HydrophobicContact CG1-CD1 4.3Å; I426-W711 HydrophobicContact CD1-CB 4.48Å; I426-W711 HydrophobicContact CD1-CD2 4.47Å; I426-W711 HydrophobicContact CD1-CG 4.38Å; I426-W711 HydrophobicContact CG1-CD2 4.07Å; I426-W711 HydrophobicContact CG1-CG 4.2Å; I426-W711 HydrophobicContact CG2-CD2 4.1Å; I426-W711 HydrophobicContact CG2-CE3 3.81Å; I426-W711 HydrophobicContact CG2-CH2 3.74Å; I426-W711 HydrophobicContact CG2-CZ2 4.04Å; I426-W711 HydrophobicContact CG2-CZ3 3.62Å
427	I	96.4	Very high	89.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	143.5	172.5	59.8	173.9	0	0	0	110.7	Y403 A404 V406 L419 V421 V429 C442 S443 M458 Y529	Y403-I427 CarbonylContact C-O 3.38Å; Y403-I427 VanDerWaalsContact CA-O 3.28Å; Y403-I427 WeakPolarHBondContact CA-O 3.49Å; A404-I427 HydrophobicContact CB-CG1 4.05Å; A404-I427 PolarHBondContact N-O 3.22Å; A404-I427 PolarHBondContact O-N 3.5Å; V406-I427 HydrophobicContact CG2-CD1 4.23Å; V406-I427 HydrophobicContact CG2-CG1 4.2Å; V406-I427 HydrophobicContact CG2-CG2 4.1Å; L419-I427 HydrophobicContact CD2-CG2 4.36Å; V421-I427 HydrophobicContact CG1-CG2 4.18Å; I427-V429 HydrophobicContact CD1-CG2 4.04Å; I427-V429 HydrophobicContact CG1-CG2 4.32Å; I427-C442 HydrophobicContact CB-CB 4.4Å; I427-S443 CarbonylContact C-O 3.55Å; I427-S443 VanDerWaalsContact CA-O 3.27Å; I427-S443 WeakPolarHBondContact CA-O 3.44Å; I427-M458 HydrophobicContact CD1-CE 4.11Å; I427-Y529 HydrophobicContact CD1-CD1 4.38Å; I427-Y529 HydrophobicContact CD1-CE1 4.15Å
428	H	96.4	Very high	90.1	Very high	28 Å²	28	38.4 Å²	38.4	13%	0.13	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	108.1	166.9	179.7	-147.5	0	0	0	108.1	S401 F402 Y403 C442 S443 V445	S401-H428 PolarHBondContact OG-NE2 2.69Å; F402-H428 CarbonylContact O-C 3.49Å; F402-H428 PolarHBondContact O-CD2 2.92Å; Y403-H428 HydrophobicContact CD1-CB 3.7Å; Y403-H428 HydrophobicContact CE1-CB 3.54Å; Y403-H428 AromaticContact CE1-CD2 3.84Å; Y403-H428 AromaticContact CE1-CG 3.66Å; Y403-H428 AromaticContact CZ-CD2 3.78Å; Y403-H428 AromaticContact CZ-CG 3.92Å; H428-C442 CarbonylContact O-C 3.53Å; H428-C442 WeakPolarHBondContact O-CA 3.24Å; H428-C442 WeakPolarHBondContact O-CB 3.45Å; H428-S443 PolarHBondContact N-O 2.94Å; H428-S443 PolarHBondContact O-N 2.87Å; H428-V445 HydrophobicContact CB-CG2 3.69Å
429	V	95.4	Very high	90.6	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	128.6	177.6	-177.1	0	0	0	0	108.8	S401 F402 I427 T432 W440 C442	S401-V429 VanDerWaalsContact CA-O 3.28Å; S401-V429 WeakPolarHBondContact CA-O 3.36Å; F402-V429 HydrophobicContact CD1-CB 4.18Å; F402-V429 HydrophobicContact CD1-CG1 4.48Å; F402-V429 HydrophobicContact CD2-CB 4.14Å; F402-V429 HydrophobicContact CD2-CG2 4.26Å; F402-V429 HydrophobicContact CE1-CB 3.76Å; F402-V429 HydrophobicContact CE1-CG1 3.68Å; F402-V429 HydrophobicContact CE2-CB 3.74Å; F402-V429 HydrophobicContact CE2-CG1 4.27Å; F402-V429 HydrophobicContact CE2-CG2 3.64Å; F402-V429 HydrophobicContact CG-CB 4.36Å; F402-V429 HydrophobicContact CZ-CB 3.54Å; F402-V429 HydrophobicContact CZ-CG1 3.57Å; F402-V429 HydrophobicContact CZ-CG2 3.8Å; F402-V429 PolarHBondContact N-O 3.46Å; F402-V429 VanDerWaalsContact N-O 3.09Å; F402-V429 PolarHBondContact O-N 2.99Å; I427-V429 HydrophobicContact CD1-CG2 4.04Å; I427-V429 HydrophobicContact CG1-CG2 4.32Å; V429-T432 HydrophobicContact CG1-CG2 3.87Å; V429-W440 HydrophobicContact CG1-CB 4.08Å; V429-W440 HydrophobicContact CG1-CD2 4.12Å; V429-W440 HydrophobicContact CG1-CE3 4.29Å; V429-W440 HydrophobicContact CG1-CG 4.08Å; V429-W440 HydrophobicContact CG2-CD2 4.31Å; V429-W440 HydrophobicContact CG2-CE3 3.64Å; V429-W440 HydrophobicContact CG2-CZ3 4.04Å; V429-C442 HydrophobicContact CB-CB 4.47Å; V429-C442 HydrophobicContact CG2-CB 4.11Å
430	T	94.3	Very high	90.8	Very high	14 Å²	14	39.9 Å²	39.9	9%	0.086	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	-21.7	-172	48.7	0	0	0	0	113.2	A397 G398 A399 D400 C441	A397-T430 WeakPolarHBondContact O-CB 3.28Å; A397-T430 WeakPolarHBondContact O-CG2 3.04Å; G398-T430 CarbonylContact C-O 3.56Å; G398-T430 WeakPolarHBondContact CA-O 3.49Å; A399-T430 PolarHBondContact N-O 3.18Å; D400-T430 CarbonylContact C-O 3.56Å; D400-T430 WeakPolarHBondContact CA-O 3.34Å; D400-T430 PolarHBondContact N-O 2.9Å; T430-C441 PolarHBondContact N-O 2.91Å; T430-C441 PolarHBondContact OG1-O 3Å
431	D	92.9	Very high	91	Very high	36 Å²	36	39 Å²	39	19%	0.193	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	115.3	177.1	165.9	17.4	0	0	0	108.5	R433 H434 W440 C441	D431-R433 PolarHBondContact OD1-N 3.08Å; D431-H434 PolarHBondContact OD1-N 2.96Å; D431-H434 VanDerWaalsContact OD2-CA 3.24Å; D431-H434 WeakPolarHBondContact OD2-CA 3.44Å; D431-H434 IonicContact OD2-CG 3.06Å; D431-H434 IonicContact OD2-ND1 2.95Å; D431-H434 PolarHBondContact OD2-ND1 2.96Å; D431-W440 CarbonylContact O-C 3.58Å; D431-W440 WeakPolarHBondContact O-CA 3.48Å; D431-C441 HydrophobicContact CB-CB 3.98Å; D431-C441 PolarHBondContact N-O 3.18Å; D431-C441 PolarHBondContact O-N 2.79Å
432	T	91	Very high	91.1	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.201	C	C	.	.	S	Bend	trans	-87.1	-9.7	-179.2	54.3	0	0	0	0	114.2	T358 A359 E360 D400 F402 V429 Q439 W440	T358-T432 HydrophobicContact CG2-CG2 4.1Å; A359-T432 PolarHBondContact N-OG1 3Å; E360-T432 HydrophobicContact CG-CG2 4.37Å; E360-T432 PolarHBondContact N-OG1 3.14Å; D400-T432 WeakPolarHBondContact OD2-CB 3.45Å; D400-T432 WeakPolarHBondContact OD2-CG2 3.27Å; D400-T432 PolarHBondContact OD2-N 3.26Å; D400-T432 PolarHBondContact OD2-OG1 3.23Å; F402-T432 HydrophobicContact CE1-CG2 3.67Å; F402-T432 HydrophobicContact CZ-CG2 4.01Å; V429-T432 HydrophobicContact CG1-CG2 3.87Å; T432-Q439 CarbonylContact C-O 3.52Å; T432-W440 HydrophobicContact CG2-CG 4.47Å
433	R	88.9	Confident	91.2	Very high	48 Å²	48	36.3 Å²	36.3	18%	0.181	18%	0.184	C	C	.	.	S	Bend	trans	-123.3	47	-178.6	-155.2	-174.5	71.6	-149.2	2.4	111.6	I309 A359 D431 N435 G436 R437	I309-R433 PolarHBondContact O-NH2 3.32Å; A359-R433 HydrophobicContact CB-CB 4.14Å; D431-R433 PolarHBondContact OD1-N 3.08Å; R433-N435 PolarHBondContact O-N 3.06Å; R433-G436 WeakPolarHBondContact O-CA 3.31Å; R433-G436 PolarHBondContact O-N 3.17Å; R433-R437 CarbonylContact C-O 3.53Å; R433-R437 WeakPolarHBondContact CA-O 3.37Å
434	H	86.6	Confident	91.4	Very high	41 Å²	41	37.4 Å²	37.4	19%	0.19	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-59.5	128.1	-167.3	-168.2	56	0	0	0	113.5	D431 G436 R437 Q439 C441	D431-H434 PolarHBondContact OD1-N 2.96Å; D431-H434 VanDerWaalsContact OD2-CA 3.24Å; D431-H434 WeakPolarHBondContact OD2-CA 3.44Å; D431-H434 IonicContact OD2-CG 3.06Å; D431-H434 IonicContact OD2-ND1 2.95Å; D431-H434 PolarHBondContact OD2-ND1 2.96Å; H434-G436 PolarHBondContact O-N 3.43Å; H434-G436 VanDerWaalsContact O-N 3.13Å; H434-R437 PolarHBondContact N-O 2.97Å; H434-R437 VanDerWaalsContact N-O 3.17Å; H434-R437 WeakPolarHBondContact O-CB 3.48Å; H434-R437 PolarHBondContact O-N 3.36Å; H434-Q439 WeakPolarHBondContact CB-O 3.37Å; H434-Q439 PolarHBondContact N-O 3.2Å; H434-C441 HydrophobicContact CB-CB 4.17Å
435	N	84.9	Confident	91.5	Very high	135 Å²	135	37.4 Å²	37.4	72%	0.722	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	49.9	32.3	-172.8	-58.2	-33.9	0	0	0	113.5	R433 R437	R433-N435 PolarHBondContact O-N 3.06Å; N435-R437 VanDerWaalsContact C-N 3.27Å; N435-R437 PolarHBondContact O-N 2.94Å
436	G	82	Confident	91.5	Very high	55 Å²	55	38.3 Å²	38.3	57%	0.567	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	78.9	0	-177.5	0	0	0	0	0	115	R433 H434	R433-G436 WeakPolarHBondContact O-CA 3.31Å; R433-G436 PolarHBondContact O-N 3.17Å; H434-G436 PolarHBondContact O-N 3.43Å; H434-G436 VanDerWaalsContact O-N 3.13Å
437	R	84.8	Confident	91.3	Very high	174 Å²	174	42.2 Å²	42.2	66%	0.657	21%	0.209	S	C	*	.	S	Bend	trans	-96.7	154.6	179.1	-58.6	-179	178.5	-175.5	-1.5	110.7	R433 H434 N435 Q439	R433-R437 CarbonylContact C-O 3.53Å; R433-R437 WeakPolarHBondContact CA-O 3.37Å; H434-R437 PolarHBondContact N-O 2.97Å; H434-R437 VanDerWaalsContact N-O 3.17Å; H434-R437 WeakPolarHBondContact O-CB 3.48Å; H434-R437 PolarHBondContact O-N 3.36Å; N435-R437 VanDerWaalsContact C-N 3.27Å; N435-R437 PolarHBondContact O-N 2.94Å; R437-Q439 HydrophobicContact CB-CB 4.37Å; R437-Q439 PolarHBondContact O-N 2.9Å
438	Y	84.5	Confident	91.1	Very high	84 Å²	84	45.3 Å²	45.3	33%	0.329	22%	0.223	S	C	.	.	S	Bend	trans	-74.9	64.2	171.6	-71.8	-73.2	0	0	0	111.4	E360 H363 Q367	E360-Y438 HydrophobicContact CB-CD1 3.97Å; E360-Y438 HydrophobicContact CB-CE1 4.13Å; H363-Y438 AromaticContact CD2-CZ 3.77Å; H363-Y438 PolarHBondContact CD2-OH 2.85Å; H363-Y438 VanDerWaalsContact CD2-OH 3.28Å; Q367-Y438 PolarHBondContact OE1-OH 3.46Å
439	Q	88.1	Confident	90.9	Very high	56 Å²	56	47.4 Å²	47.4	26%	0.262	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136.4	-176.2	-173.9	173.6	5.4	0	0	108.1	T432 H434 R437 T457 M458	T432-Q439 CarbonylContact C-O 3.52Å; H434-Q439 WeakPolarHBondContact CB-O 3.37Å; H434-Q439 PolarHBondContact N-O 3.2Å; R437-Q439 HydrophobicContact CB-CB 4.37Å; R437-Q439 PolarHBondContact O-N 2.9Å; Q439-T457 VanDerWaalsContact NE2-CB 3.32Å; Q439-T457 PolarHBondContact NE2-OG1 3.47Å; Q439-M458 WeakPolarHBondContact CG-O 3.46Å
440	W	92.6	Very high	90.7	Very high	9 Å²	9	48.3 Å²	48.3	3%	0.034	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124	-174	-68.8	0.6	0	0	0	110.5	E360 F402 V429 D431 T432 T457 M458 N460 Y529	E360-W440 VanDerWaalsContact OE1-CZ2 3.31Å; E360-W440 WeakPolarHBondContact OE1-CZ2 3.42Å; E360-W440 PolarHBondContact OE1-NE1 2.89Å; E360-W440 PolarHBondContact OE2-NE1 2.96Å; F402-W440 HydrophobicContact CE2-CH2 4.03Å; F402-W440 HydrophobicContact CE2-CZ3 4.1Å; F402-W440 AromaticContact CZ-CH2 3.93Å; F402-W440 HydrophobicContact CZ-CH2 3.93Å; F402-W440 HydrophobicContact CZ-CZ2 4.05Å; F402-W440 HydrophobicContact CZ-CZ3 4.18Å; V429-W440 HydrophobicContact CG1-CB 4.08Å; V429-W440 HydrophobicContact CG1-CD2 4.12Å; V429-W440 HydrophobicContact CG1-CE3 4.29Å; V429-W440 HydrophobicContact CG1-CG 4.08Å; V429-W440 HydrophobicContact CG2-CD2 4.31Å; V429-W440 HydrophobicContact CG2-CE3 3.64Å; V429-W440 HydrophobicContact CG2-CZ3 4.04Å; D431-W440 CarbonylContact O-C 3.58Å; D431-W440 WeakPolarHBondContact O-CA 3.48Å; T432-W440 HydrophobicContact CG2-CG 4.47Å; W440-T457 CarbonylContact O-C 3.58Å; W440-T457 VanDerWaalsContact O-CA 3.31Å; W440-T457 WeakPolarHBondContact O-CA 3.29Å; W440-M458 HydrophobicContact CB-CB 4.35Å; W440-M458 PolarHBondContact N-O 3.42Å; W440-M458 PolarHBondContact O-N 3.41Å; W440-N460 HydrophobicContact CG-CB 4.45Å; W440-Y529 HydrophobicContact CE3-CD2 4.29Å; W440-Y529 HydrophobicContact CE3-CE2 4.05Å; W440-Y529 AromaticContact CH2-CD2 3.75Å; W440-Y529 HydrophobicContact CH2-CD2 3.75Å; W440-Y529 HydrophobicContact CH2-CE2 4.2Å; W440-Y529 AromaticContact CZ3-CD2 3.4Å; W440-Y529 HydrophobicContact CZ3-CD2 3.4Å; W440-Y529 VanDerWaalsContact CZ3-CD2 3.4Å; W440-Y529 AromaticContact CZ3-CE2 3.61Å; W440-Y529 HydrophobicContact CZ3-CE2 3.61Å; W440-Y529 HydrophobicContact CZ3-CG 4.04Å
441	C	92.6	Very high	90.7	Very high	28 Å²	28	51.5 Å²	51.5	19%	0.189	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.6	160	-159.6	0	0	0	0	108.6	T430 D431 H434	T430-C441 PolarHBondContact N-O 2.91Å; T430-C441 PolarHBondContact OG1-O 3Å; D431-C441 HydrophobicContact CB-CB 3.98Å; D431-C441 PolarHBondContact N-O 3.18Å; D431-C441 PolarHBondContact O-N 2.79Å; H434-C441 HydrophobicContact CB-CB 4.17Å
442	C	94.3	Very high	90.6	Very high	1 Å²	1	53.6 Å²	53.6	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	168	-177.3	70.3	0	0	0	0	112.5	I427 H428 V429 T455 G456 M458	I427-C442 HydrophobicContact CB-CB 4.4Å; H428-C442 CarbonylContact O-C 3.53Å; H428-C442 WeakPolarHBondContact O-CA 3.24Å; H428-C442 WeakPolarHBondContact O-CB 3.45Å; V429-C442 HydrophobicContact CB-CB 4.47Å; V429-C442 HydrophobicContact CG2-CB 4.11Å; C442-T455 CarbonylContact O-C 3.57Å; C442-T455 WeakPolarHBondContact O-CA 3.39Å; C442-G456 PolarHBondContact N-O 2.91Å; C442-G456 PolarHBondContact O-N 2.81Å; C442-G456 VanDerWaalsContact O-O 3.04Å; C442-M458 WeakPolarHBondContact SG-CG 3.49Å
443	S	93.7	Very high	90.7	Very high	12 Å²	12	58.8 Å²	58.8	8%	0.084	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.1	168.3	-55.4	0	0	0	0	110.5	I427 H428 V445 Q454	I427-S443 CarbonylContact C-O 3.55Å; I427-S443 VanDerWaalsContact CA-O 3.27Å; I427-S443 WeakPolarHBondContact CA-O 3.44Å; H428-S443 PolarHBondContact N-O 2.94Å; H428-S443 PolarHBondContact O-N 2.87Å; S443-V445 WeakPolarHBondContact O-CG2 3.43Å; S443-Q454 CarbonylContact C-O 3.57Å; S443-Q454 WeakPolarHBondContact CA-O 3.18Å
444	L	95.1	Very high	90.8	Very high	28 Å²	28	61.8 Å²	61.8	15%	0.147	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	134.9	158.6	178.1	61.7	0	0	0	108.6	L419 V421 D425 L453 Q454	L419-L444 HydrophobicContact CD2-CB 4.16Å; V421-L444 HydrophobicContact CG1-CD1 4.43Å; D425-L444 HydrophobicContact CB-CD1 3.82Å; L444-L453 PolarHBondContact O-N 3.2Å; L444-Q454 PolarHBondContact N-O 3.06Å
445	V	95.2	Very high	91	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.024	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	136.5	-173.1	-177.3	0	0	0	0	110.8	Y403 I426 H428 S443 R447 A450 W711	Y403-V445 HydrophobicContact CD1-CG2 4.24Å; Y403-V445 HydrophobicContact CE1-CG2 4.09Å; I426-V445 HydrophobicContact CB-CB 4.4Å; I426-V445 HydrophobicContact CG2-CB 4.27Å; I426-V445 WeakPolarHBondContact O-CB 3.34Å; I426-V445 PolarHBondContact O-N 3.18Å; H428-V445 HydrophobicContact CB-CG2 3.69Å; S443-V445 WeakPolarHBondContact O-CG2 3.43Å; V445-R447 PolarHBondContact O-N 2.86Å; V445-A450 HydrophobicContact CG1-CB 4.33Å; V445-W711 HydrophobicContact CG1-CH2 3.99Å; V445-W711 HydrophobicContact CG1-CZ2 3.9Å
446	N	94.4	Very high	91.2	Very high	51 Å²	51	59.3 Å²	59.3	27%	0.273	32%	0.32	S	S	.	.			trans	-62.5	118.5	171.4	-176.3	-63.9	0	0	0	110.3	E448 T449 A450 V451 L453	N446-E448 PolarHBondContact O-N 3.31Å; N446-E448 PolarHBondContact OD1-N 2.93Å; N446-T449 WeakPolarHBondContact CB-OG1 3.29Å; N446-T449 PolarHBondContact O-N 2.9Å; N446-T449 PolarHBondContact OD1-N 2.87Å; N446-T449 PolarHBondContact OD1-OG1 3.33Å; N446-A450 WeakPolarHBondContact O-CA 3.28Å; N446-A450 PolarHBondContact O-N 3.04Å; N446-V451 WeakPolarHBondContact CB-O 3.25Å; N446-V451 PolarHBondContact N-O 3.36Å; N446-L453 HydrophobicContact CB-CD1 3.98Å; N446-L453 HydrophobicContact CB-CD2 4.14Å; N446-L453 HydrophobicContact CB-CG 4.06Å
447	R	92.4	Very high	91.7	Very high	82 Å²	82	57.5 Å²	57.5	31%	0.309	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.9	-174.5	-67	170.3	64.9	166	-2.2	113.6	D424 D425 I426 V445 W711	D424-R447 PolarHBondContact O-NE 3.03Å; D424-R447 PolarHBondContact O-NH1 3.46Å; D424-R447 VanDerWaalsContact O-NH1 3.16Å; D425-R447 IonicContact OD1-NH1 2.75Å; I426-R447 HydrophobicContact CG1-CG 4.12Å; V445-R447 PolarHBondContact O-N 2.86Å; R447-W711 PolarHBondContact O-NE1 2.78Å
448	E	92	Very high	92	Very high	66 Å²	66	49.2 Å²	49.2	31%	0.308	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	-42.1	178.5	-59	-165.5	148.3	0	0	112.5	N446 R704 Q705 A708 V709	N446-E448 PolarHBondContact O-N 3.31Å; N446-E448 PolarHBondContact OD1-N 2.93Å; E448-R704 WeakPolarHBondContact OE1-CD 3.42Å; E448-R704 WeakPolarHBondContact OE1-CG 3.41Å; E448-R704 WeakPolarHBondContact OE2-CD 3.49Å; E448-Q705 PolarHBondContact OE1-NE2 3.34Å; E448-Q705 VanDerWaalsContact OE1-NE2 3.09Å; E448-A708 HydrophobicContact CB-CB 3.99Å; E448-A708 HydrophobicContact CG-CB 4.14Å; E448-A708 CarbonylContact O-C 3.4Å; E448-A708 WeakPolarHBondContact O-CA 3.28Å; E448-V709 PolarHBondContact O-N 3.31Å
449	T	92.6	Very high	92.3	Very high	71 Å²	71	46.3 Å²	46.3	44%	0.436	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-15.9	-171.3	64.9	0	0	0	0	115.3	N446 V451	N446-T449 WeakPolarHBondContact CB-OG1 3.29Å; N446-T449 PolarHBondContact O-N 2.9Å; N446-T449 PolarHBondContact OD1-N 2.87Å; N446-T449 PolarHBondContact OD1-OG1 3.33Å; T449-V451 PolarHBondContact O-N 2.95Å; T449-V451 WeakPolarHBondContact OG1-CB 3.23Å; T449-V451 WeakPolarHBondContact OG1-CG2 3.36Å; T449-V451 PolarHBondContact OG1-N 3.06Å
450	A	92.7	Very high	92.3	Very high	20 Å²	20	44.5 Å²	44.5	17%	0.165	25%	0.25	C	S	.	.			trans	60.4	20.6	-167.1	0	0	0	0	0	115.7	V445 N446 V709 W711	V445-A450 HydrophobicContact CG1-CB 4.33Å; N446-A450 WeakPolarHBondContact O-CA 3.28Å; N446-A450 PolarHBondContact O-N 3.04Å; A450-V709 HydrophobicContact CB-CG1 4.45Å; A450-V709 HydrophobicContact CB-CG2 3.91Å; A450-W711 HydrophobicContact CB-CH2 3.89Å; A450-W711 HydrophobicContact CB-CZ2 3.61Å
451	V	93.1	Very high	92.1	Very high	80 Å²	80	47.6 Å²	47.6	49%	0.485	26%	0.263	S	S	.	.			trans	-84.1	135.5	174	177.9	0	0	0	0	110	N446 T449	N446-V451 WeakPolarHBondContact CB-O 3.25Å; N446-V451 PolarHBondContact N-O 3.36Å; T449-V451 PolarHBondContact O-N 2.95Å; T449-V451 WeakPolarHBondContact OG1-CB 3.23Å; T449-V451 WeakPolarHBondContact OG1-CG2 3.36Å; T449-V451 PolarHBondContact OG1-N 3.06Å
452	P	91.9	Very high	91.7	Very high	81 Å²	81	51.1 Å²	51.1	53%	0.526	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	143.1	174.1	28.1	-35.3	0	0	0	111.6
453	L	92.2	Very high	91.3	Very high	108 Å²	108	56.1 Å²	56.1	57%	0.565	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.8	-51.5	-175.9	-66.1	176	0	0	0	112.4	L444 N446	L444-L453 PolarHBondContact O-N 3.2Å; N446-L453 HydrophobicContact CB-CD1 3.98Å; N446-L453 HydrophobicContact CB-CD2 4.14Å; N446-L453 HydrophobicContact CB-CG 4.06Å
454	Q	91.1	Very high	91.1	Very high	112 Å²	112	55.6 Å²	55.6	52%	0.523	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	124.9	-177.4	-178	179.5	-1.7	0	0	109.8	L419 S443 L444	L419-Q454 HydrophobicContact CD1-CB 4.18Å; L419-Q454 HydrophobicContact CD1-CG 3.77Å; S443-Q454 CarbonylContact C-O 3.57Å; S443-Q454 WeakPolarHBondContact CA-O 3.18Å; L444-Q454 PolarHBondContact N-O 3.06Å
455	T	90.3	Very high	90.6	Very high	106 Å²	106	55.5 Å²	55.5	65%	0.65	29%	0.293	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	141.3	170.9	49.2	0	0	0	0	110.9	C442	C442-T455 CarbonylContact O-C 3.57Å; C442-T455 WeakPolarHBondContact O-CA 3.39Å
456	G	90.5	Very high	90.1	Very high	18 Å²	18	59.5 Å²	59.5	19%	0.186	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	177.3	173.3	0	0	0	0	0	112.7	C442	C442-G456 PolarHBondContact N-O 2.91Å; C442-G456 PolarHBondContact O-N 2.81Å; C442-G456 VanDerWaalsContact O-O 3.04Å
457	T	91.8	Very high	89.7	Confident	17 Å²	17	59 Å²	59	10%	0.104	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	146.5	177.9	67.5	0	0	0	0	111.9	T418 L419 Q439 W440	T418-T457 WeakPolarHBondContact CA-O 3.16Å; T418-T457 WeakPolarHBondContact CB-O 3.31Å; L419-T457 PolarHBondContact N-O 3.47Å; Q439-T457 VanDerWaalsContact NE2-CB 3.32Å; Q439-T457 PolarHBondContact NE2-OG1 3.47Å; W440-T457 CarbonylContact O-C 3.58Å; W440-T457 VanDerWaalsContact O-CA 3.31Å; W440-T457 WeakPolarHBondContact O-CA 3.29Å
458	M	91.4	Very high	89.3	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.1	177.8	-77.4	-73.1	-86.7	0	0	110.1	V406 M410 L419 V421 I427 Q439 W440 C442 Y529	V406-M458 HydrophobicContact CG2-CE 4.36Å; M410-M458 HydrophobicContact SD-CE 3.7Å; M410-M458 HydrophobicContact SD-SD 4.12Å; L419-M458 HydrophobicContact CB-CG 4.15Å; L419-M458 HydrophobicContact CB-SD 4.13Å; L419-M458 HydrophobicContact CD2-CG 4.37Å; V421-M458 HydrophobicContact CG1-CE 4.3Å; V421-M458 HydrophobicContact CG1-SD 4.45Å; V421-M458 HydrophobicContact CG2-CE 3.47Å; V421-M458 VanDerWaalsContact CG2-CE 3.47Å; V421-M458 HydrophobicContact CG2-SD 4.06Å; I427-M458 HydrophobicContact CD1-CE 4.11Å; Q439-M458 WeakPolarHBondContact CG-O 3.46Å; W440-M458 HydrophobicContact CB-CB 4.35Å; W440-M458 PolarHBondContact N-O 3.42Å; W440-M458 PolarHBondContact O-N 3.41Å; C442-M458 WeakPolarHBondContact SG-CG 3.49Å; M458-Y529 HydrophobicContact CE-CE1 3.84Å; M458-Y529 WeakPolarHBondContact CE-OH 3.36Å
459	P	90.8	Very high	88.9	Confident	23 Å²	23	52.2 Å²	52.2	15%	0.149	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	147.2	170.2	26	-31.1	0	0	0	110.4	M410 R463 A464 L467 Y529	M410-P459 HydrophobicContact CE-CG 4.11Å; M410-P459 HydrophobicContact SD-CG 3.72Å; P459-R463 HydrophobicContact CB-CB 3.86Å; P459-R463 HydrophobicContact CB-CG 3.62Å; P459-A464 HydrophobicContact CG-CB 4.23Å; P459-L467 HydrophobicContact CB-CD1 4.45Å; P459-L467 HydrophobicContact CG-CD1 4.1Å; P459-Y529 PolarHBondContact O-OH 3.27Å
460	N	88.8	Confident	88.4	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.091	28%	0.277	C	S	.	.			trans	-67.1	168.6	172.2	78.4	-12.7	0	0	0	111.8	W440 N462 R463 A464	W440-N460 HydrophobicContact CG-CB 4.45Å; N460-N462 VanDerWaalsContact C-N 3.28Å; N460-N462 PolarHBondContact O-N 3.11Å; N460-N462 VanDerWaalsContact O-N 3.17Å; N460-R463 PolarHBondContact O-N 3.26Å; N460-R463 VanDerWaalsContact O-N 3.13Å; N460-R463 WeakPolarHBondContact OD1-CB 3.38Å; N460-R463 PolarHBondContact OD1-N 3.23Å; N460-A464 WeakPolarHBondContact O-CB 3.32Å; N460-A464 PolarHBondContact O-N 2.75Å
461	Y	88	Confident	87.9	Confident	75 Å²	75	54.6 Å²	54.6	29%	0.294	28%	0.282	S	S	.	.	H	α-helix	trans	-49.1	-46.4	-177.2	-171.8	-83.8	0	0	0	113.2	A464 Q465 L526 P528 Y529	Y461-A464 PolarHBondContact O-N 3.01Å; Y461-Q465 WeakPolarHBondContact O-CB 3.24Å; Y461-Q465 PolarHBondContact O-N 3.37Å; Y461-L526 PolarHBondContact OH-O 2.96Å; Y461-P528 HydrophobicContact CD2-CG 4.12Å; Y461-P528 HydrophobicContact CE1-CG 4.49Å; Y461-P528 HydrophobicContact CE2-CG 4.05Å; Y461-P528 HydrophobicContact CG-CG 4.38Å; Y461-Y529 HydrophobicContact CD2-CD2 4.2Å
462	N	83.4	Confident	87.4	Confident	102 Å²	102	52 Å²	52	55%	0.545	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-45.7	-178.6	-67	-39.5	0	0	0	112.4	N460 Q465 Q466	N460-N462 VanDerWaalsContact C-N 3.28Å; N460-N462 PolarHBondContact O-N 3.11Å; N460-N462 VanDerWaalsContact O-N 3.17Å; N462-Q465 PolarHBondContact O-N 3.01Å; N462-Q466 WeakPolarHBondContact O-CG 3.38Å; N462-Q466 PolarHBondContact O-N 3.45Å; N462-Q466 VanDerWaalsContact O-N 3.15Å
463	R	85.9	Confident	86.8	Confident	106 Å²	106	53.7 Å²	53.7	40%	0.4	26%	0.261	S	S	.	.	H	α-helix	trans	-65.8	-39.4	176.4	178.6	57.8	171.5	175.9	-3.7	111.4	P459 N460 Q466 L467	P459-R463 HydrophobicContact CB-CB 3.86Å; P459-R463 HydrophobicContact CB-CG 3.62Å; N460-R463 PolarHBondContact O-N 3.26Å; N460-R463 VanDerWaalsContact O-N 3.13Å; N460-R463 WeakPolarHBondContact OD1-CB 3.38Å; N460-R463 PolarHBondContact OD1-N 3.23Å; R463-Q466 PolarHBondContact O-N 2.91Å; R463-L467 HydrophobicContact CG-CD1 4.43Å; R463-L467 WeakPolarHBondContact O-CG 3.4Å; R463-L467 PolarHBondContact O-N 3.03Å
464	A	88.8	Confident	86.1	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-64.9	-36.7	175.9	0	0	0	0	0	112.7	M410 P459 N460 Y461 L467 L468 P528 Y529	M410-A464 HydrophobicContact CE-CB 3.83Å; P459-A464 HydrophobicContact CG-CB 4.23Å; N460-A464 WeakPolarHBondContact O-CB 3.32Å; N460-A464 PolarHBondContact O-N 2.75Å; Y461-A464 PolarHBondContact O-N 3.01Å; A464-L467 PolarHBondContact O-N 3.21Å; A464-L468 WeakPolarHBondContact O-CB 3.43Å; A464-L468 PolarHBondContact O-N 2.91Å; A464-P528 HydrophobicContact CB-CB 3.65Å; A464-P528 HydrophobicContact CB-CG 3.81Å; A464-Y529 HydrophobicContact CB-CD2 4.07Å; A464-Y529 HydrophobicContact CB-CE2 3.29Å
465	Q	85.9	Confident	85.4	Confident	27 Å²	27	50.6 Å²	50.6	13%	0.126	24%	0.243	C	C	.	.	H	α-helix	trans	-65.2	-41.1	175.9	-171.2	-174.7	58.8	0	0	111.1	Y461 N462 L468 L469 D524 L526 P528	Y461-Q465 WeakPolarHBondContact O-CB 3.24Å; Y461-Q465 PolarHBondContact O-N 3.37Å; N462-Q465 PolarHBondContact O-N 3.01Å; Q465-L468 WeakPolarHBondContact O-CB 3.41Å; Q465-L468 PolarHBondContact O-N 3.21Å; Q465-L469 WeakPolarHBondContact O-CB 3.43Å; Q465-L469 PolarHBondContact O-N 3.09Å; Q465-D524 PolarHBondContact NE2-O 2.73Å; Q465-L526 HydrophobicContact CG-CB 3.85Å; Q465-L526 PolarHBondContact NE2-O 3.48Å; Q465-P528 HydrophobicContact CB-CG 4.06Å
466	Q	83.6	Confident	84.4	Confident	87 Å²	87	48 Å²	48	41%	0.407	23%	0.23	S	C	.	.	H	α-helix	trans	-66.7	-39	174.4	-66.4	-61.2	-34.7	0	0	112.3	N462 R463 L469 I470	N462-Q466 WeakPolarHBondContact O-CG 3.38Å; N462-Q466 PolarHBondContact O-N 3.45Å; N462-Q466 VanDerWaalsContact O-N 3.15Å; R463-Q466 PolarHBondContact O-N 2.91Å; Q466-L469 PolarHBondContact O-N 3.34Å; Q466-I470 WeakPolarHBondContact O-CB 3.44Å; Q466-I470 WeakPolarHBondContact O-CD1 3.29Å; Q466-I470 VanDerWaalsContact O-CG1 3.24Å; Q466-I470 WeakPolarHBondContact O-CG1 3.32Å; Q466-I470 PolarHBondContact O-N 3.19Å
467	L	85.8	Confident	83.4	Confident	42 Å²	42	51.2 Å²	51.2	22%	0.22	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-43	172.9	-69.9	169.9	0	0	0	111.8	W251 L408 P459 R463 A464 I470 R471	W251-L467 HydrophobicContact CZ3-CD2 4.25Å; L408-L467 HydrophobicContact CD1-CB 4.44Å; P459-L467 HydrophobicContact CB-CD1 4.45Å; P459-L467 HydrophobicContact CG-CD1 4.1Å; R463-L467 HydrophobicContact CG-CD1 4.43Å; R463-L467 WeakPolarHBondContact O-CG 3.4Å; R463-L467 PolarHBondContact O-N 3.03Å; A464-L467 PolarHBondContact O-N 3.21Å; L467-I470 PolarHBondContact O-N 3.11Å; L467-R471 WeakPolarHBondContact O-CB 3.31Å; L467-R471 PolarHBondContact O-N 3.13Å
468	L	85.6	Confident	82.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-59.6	-46.2	173.8	173.5	57	0	0	0	112	L408 A464 Q465 R471 L472 V495 L526 P528	L408-L468 HydrophobicContact CB-CD1 4.41Å; L408-L468 HydrophobicContact CD1-CB 3.99Å; L408-L468 HydrophobicContact CD2-CB 4.37Å; A464-L468 WeakPolarHBondContact O-CB 3.43Å; A464-L468 PolarHBondContact O-N 2.91Å; Q465-L468 WeakPolarHBondContact O-CB 3.41Å; Q465-L468 PolarHBondContact O-N 3.21Å; L468-R471 PolarHBondContact O-N 3.23Å; L468-L472 HydrophobicContact CD1-CD1 3.83Å; L468-L472 HydrophobicContact CD1-CG 4.08Å; L468-L472 HydrophobicContact CG-CD1 4.11Å; L468-L472 WeakPolarHBondContact O-CG 3.16Å; L468-L472 PolarHBondContact O-N 3.25Å; L468-V495 HydrophobicContact CD1-CG1 3.35Å; L468-V495 HydrophobicContact CD1-CG2 4.5Å; L468-L526 HydrophobicContact CD2-CB 4Å; L468-L526 HydrophobicContact CD2-CD2 4.36Å; L468-L526 HydrophobicContact CG-CD2 4.46Å; L468-P528 HydrophobicContact CD2-CB 4.25Å
469	L	83.4	Confident	80.6	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-46.2	176.2	178.2	59.9	0	0	0	112.2	Q465 Q466 R471 L472 R473 L518 E523 L526	Q465-L469 WeakPolarHBondContact O-CB 3.43Å; Q465-L469 PolarHBondContact O-N 3.09Å; Q466-L469 PolarHBondContact O-N 3.34Å; L469-R471 VanDerWaalsContact C-N 3.35Å; L469-L472 PolarHBondContact O-N 3.21Å; L469-R473 HydrophobicContact CD1-CG 4.45Å; L469-R473 WeakPolarHBondContact O-CB 3.42Å; L469-R473 VanDerWaalsContact O-CG 3.28Å; L469-R473 WeakPolarHBondContact O-CG 3.37Å; L469-R473 PolarHBondContact O-N 2.99Å; L469-L518 HydrophobicContact CD1-CD2 3.84Å; L469-E523 HydrophobicContact CD1-CG 4.37Å; L469-E523 HydrophobicContact CD2-CB 4.37Å; L469-E523 WeakPolarHBondContact CD2-OE2 3.37Å; L469-L526 HydrophobicContact CB-CD1 3.72Å; L469-L526 HydrophobicContact CD1-CD1 3.84Å; L469-L526 HydrophobicContact CG-CD1 4.32Å
470	I	81.9	Confident	78.9	Confident	71 Å²	71	66.7 Å²	66.7	36%	0.364	31%	0.312	S	S	.	.	H	α-helix	trans	-62.2	-42.8	176.5	-69.1	164.4	0	0	0	110.6	Q466 L467 R473 K474	Q466-I470 WeakPolarHBondContact O-CB 3.44Å; Q466-I470 WeakPolarHBondContact O-CD1 3.29Å; Q466-I470 VanDerWaalsContact O-CG1 3.24Å; Q466-I470 WeakPolarHBondContact O-CG1 3.32Å; Q466-I470 PolarHBondContact O-N 3.19Å; L467-I470 PolarHBondContact O-N 3.11Å; I470-R473 PolarHBondContact O-N 3.41Å; I470-K474 WeakPolarHBondContact O-CB 3.5Å; I470-K474 PolarHBondContact O-N 3.44Å
471	R	82.8	Confident	77.1	Confident	71 Å²	71	70.6 Å²	70.6	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-61.7	-48	178.4	-158.9	76.1	-150.4	-165.9	-1.1	111.7	L467 L468 L469 R473 K474 M475 D493 V495	L467-R471 WeakPolarHBondContact O-CB 3.31Å; L467-R471 PolarHBondContact O-N 3.13Å; L468-R471 PolarHBondContact O-N 3.23Å; L469-R471 VanDerWaalsContact C-N 3.35Å; R471-R473 PolarHBondContact O-N 3Å; R471-K474 WeakPolarHBondContact O-CB 3.38Å; R471-K474 PolarHBondContact O-N 3.13Å; R471-M475 HydrophobicContact CG-SD 4.37Å; R471-M475 VanDerWaalsContact O-CG 3.3Å; R471-M475 WeakPolarHBondContact O-CG 3.42Å; R471-M475 PolarHBondContact O-N 3.45Å; R471-D493 IonicContact CZ-OD1 3.42Å; R471-D493 VanDerWaalsContact CZ-OD1 3.27Å; R471-D493 IonicContact CZ-OD2 2.71Å; R471-D493 IonicContact NE-OD1 2.66Å; R471-D493 PolarHBondContact NE-OD1 3.15Å; R471-D493 IonicContact NE-OD2 3.9Å; R471-D493 PolarHBondContact NE-OD2 3.17Å; R471-D493 IonicContact NH2-OD1 3.33Å; R471-D493 PolarHBondContact NH2-OD1 3.34Å; R471-D493 IonicContact NH2-OD2 3.83Å; R471-D493 PolarHBondContact NH2-OD2 3.37Å; R471-V495 HydrophobicContact CG-CG2 4.36Å
472	L	80.8	Confident	75.3	Confident	25 Å²	25	72.8 Å²	72.8	13%	0.131	34%	0.344	C	S	.	.	H	α-helix	trans	-63.5	-39.5	177.7	-68.2	169.1	0	0	0	112.4	L468 L469 M475 S476 V495 L497 L518 L526	L468-L472 HydrophobicContact CD1-CD1 3.83Å; L468-L472 HydrophobicContact CD1-CG 4.08Å; L468-L472 HydrophobicContact CG-CD1 4.11Å; L468-L472 WeakPolarHBondContact O-CG 3.16Å; L468-L472 PolarHBondContact O-N 3.25Å; L469-L472 PolarHBondContact O-N 3.21Å; L472-M475 HydrophobicContact CD2-SD 4.37Å; L472-S476 WeakPolarHBondContact O-CB 3.42Å; L472-S476 PolarHBondContact O-N 3.3Å; L472-V495 HydrophobicContact CD2-CG1 4.08Å; L472-L497 HydrophobicContact CD1-CD2 3.85Å; L472-L497 HydrophobicContact CD2-CD2 4.02Å; L472-L518 HydrophobicContact CB-CD1 4.07Å; L472-L526 HydrophobicContact CD1-CD1 4.43Å; L472-L526 HydrophobicContact CD1-CD2 3.71Å
473	R	79.9	Confident	73.6	Confident	116 Å²	116	77.1 Å²	77.1	44%	0.438	36%	0.358	S	S	.	.	H	α-helix	trans	-60.7	-45.5	172.4	-73.6	172.3	178.9	-179.1	2.4	111.2	L469 I470 R471 S476 V477 L518 E523	L469-R473 HydrophobicContact CD1-CG 4.45Å; L469-R473 WeakPolarHBondContact O-CB 3.42Å; L469-R473 VanDerWaalsContact O-CG 3.28Å; L469-R473 WeakPolarHBondContact O-CG 3.37Å; L469-R473 PolarHBondContact O-N 2.99Å; I470-R473 PolarHBondContact O-N 3.41Å; R471-R473 PolarHBondContact O-N 3Å; R473-S476 PolarHBondContact O-N 2.83Å; R473-V477 PolarHBondContact O-N 3.36Å; R473-V477 VanDerWaalsContact O-N 3.13Å; R473-L518 HydrophobicContact CG-CD1 4.08Å; R473-E523 IonicContact CZ-OE1 2.62Å; R473-E523 IonicContact NE-OE1 3.6Å; R473-E523 IonicContact NH2-OE1 2.72Å; R473-E523 PolarHBondContact NH2-OE1 3.12Å; R473-E523 IonicContact NH2-OE2 3.03Å; R473-E523 PolarHBondContact NH2-OE2 3.13Å
474	K	78.8	Confident	71.8	Confident	99 Å²	99	81.2 Å²	81.2	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-60.1	-50.9	176.3	177.2	170.3	174.6	170.6	0	112.1	I470 R471 S476 V477 E478	I470-K474 WeakPolarHBondContact O-CB 3.5Å; I470-K474 PolarHBondContact O-N 3.44Å; R471-K474 WeakPolarHBondContact O-CB 3.38Å; R471-K474 PolarHBondContact O-N 3.13Å; K474-S476 PolarHBondContact O-N 3.08Å; K474-V477 PolarHBondContact O-N 2.94Å; K474-E478 WeakPolarHBondContact CE-OE1 3.49Å; K474-E478 HydrophobicContact CG-CG 4.44Å; K474-E478 WeakPolarHBondContact CG-OE1 3.33Å; K474-E478 IonicContact NZ-OE1 2.78Å; K474-E478 WeakPolarHBondContact O-CG 3.41Å; K474-E478 PolarHBondContact O-N 3.36Å
475	M	75	Confident	69.5	Low	56 Å²	56	89 Å²	89	28%	0.276	41%	0.412	S	S	.	.	H	α-helix	trans	-56.9	-36.4	176.2	-65	168.4	83.9	0	0	112.2	R471 L472 Q479 V495	R471-M475 HydrophobicContact CG-SD 4.37Å; R471-M475 VanDerWaalsContact O-CG 3.3Å; R471-M475 WeakPolarHBondContact O-CG 3.42Å; R471-M475 PolarHBondContact O-N 3.45Å; L472-M475 HydrophobicContact CD2-SD 4.37Å; M475-Q479 WeakPolarHBondContact O-CG 3.31Å; M475-Q479 PolarHBondContact O-N 3.28Å; M475-V495 HydrophobicContact SD-CG2 4.19Å
476	S	70.4	Confident	67.5	Low	53 Å²	53	96.2 Å²	96.2	37%	0.371	45%	0.448	S	S	.	.	H	α-helix	trans	-73.4	-21.7	177.2	-175.5	0	0	0	0	114.4	L472 R473 K474	L472-S476 WeakPolarHBondContact O-CB 3.42Å; L472-S476 PolarHBondContact O-N 3.3Å; R473-S476 PolarHBondContact O-N 2.83Å; K474-S476 PolarHBondContact O-N 3.08Å
477	V	69.1	Low	65.4	Low	84 Å²	84	101.3 Å²	101.3	51%	0.509	47%	0.469	S	S	.	.	H	α-helix	trans	-79.1	-51.5	169.7	174.3	0	0	0	0	109.2	R473 K474 Q479 K480 D481	R473-V477 PolarHBondContact O-N 3.36Å; R473-V477 VanDerWaalsContact O-N 3.13Å; K474-V477 PolarHBondContact O-N 2.94Å; V477-Q479 VanDerWaalsContact C-N 3.25Å; V477-Q479 PolarHBondContact O-N 3.4Å; V477-K480 WeakPolarHBondContact O-CB 3.47Å; V477-K480 PolarHBondContact O-N 2.92Å; V477-D481 PolarHBondContact O-N 3.13Å
478	E	65.3	Low	63.3	Low	69 Å²	69	104.6 Å²	104.6	32%	0.322	49%	0.491	S	S	.	.	H	α-helix	trans	-55.4	-38.2	-179.8	-68.4	174.5	175.3	0	0	112.4	K474 K480 D481 F482	K474-E478 WeakPolarHBondContact CE-OE1 3.49Å; K474-E478 HydrophobicContact CG-CG 4.44Å; K474-E478 WeakPolarHBondContact CG-OE1 3.33Å; K474-E478 IonicContact NZ-OE1 2.78Å; K474-E478 WeakPolarHBondContact O-CG 3.41Å; K474-E478 PolarHBondContact O-N 3.36Å; E478-K480 PolarHBondContact O-N 2.93Å; E478-K480 VanDerWaalsContact O-N 3.17Å; E478-D481 PolarHBondContact O-N 2.87Å; E478-D481 VanDerWaalsContact O-N 3.09Å; E478-F482 HydrophobicContact CB-CD2 4.24Å; E478-F482 HydrophobicContact CB-CE2 3.93Å; E478-F482 WeakPolarHBondContact O-CD2 3.43Å; E478-F482 PolarHBondContact O-N 2.9Å
479	Q	58.1	Low	61.2	Low	145 Å²	145	114.2 Å²	114.2	68%	0.678	53%	0.533	S	S	*	.	H	α-helix	trans	-58.1	-25.2	173.7	-83.3	-169.5	10.1	0	0	115	M475 V477	M475-Q479 WeakPolarHBondContact O-CG 3.31Å; M475-Q479 PolarHBondContact O-N 3.28Å; V477-Q479 VanDerWaalsContact C-N 3.25Å; V477-Q479 PolarHBondContact O-N 3.4Å
480	K	54.8	Low	59.2	Low	151 Å²	151	123.2 Å²	123.2	66%	0.657	57%	0.572	S	S	*	*	H	α-helix	trans	-78.2	-39.6	175.4	-61.3	175.9	-176.4	175.5	0	110.8	V477 E478	V477-K480 WeakPolarHBondContact O-CB 3.47Å; V477-K480 PolarHBondContact O-N 2.92Å; E478-K480 PolarHBondContact O-N 2.93Å; E478-K480 VanDerWaalsContact O-N 3.17Å
481	D	52.7	Low	57.3	Low	99 Å²	99	125 Å²	125	53%	0.529	59%	0.587	S	S	.	*	H	α-helix	trans	-81.4	-21.6	-178.2	-64.4	-47.1	0	0	0	113.9	V477 E478 K483 K484	V477-D481 PolarHBondContact O-N 3.13Å; E478-D481 PolarHBondContact O-N 2.87Å; E478-D481 VanDerWaalsContact O-N 3.09Å; D481-K483 PolarHBondContact O-N 3.37Å; D481-K484 PolarHBondContact O-N 2.84Å
482	F	49	Very low	56	Low	122 Å²	122	126 Å²	126	54%	0.535	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-59	-14.1	171.5	-86.6	-59.3	0	0	0	113.8	E478 K484	E478-F482 HydrophobicContact CB-CD2 4.24Å; E478-F482 HydrophobicContact CB-CE2 3.93Å; E478-F482 WeakPolarHBondContact O-CD2 3.43Å; E478-F482 PolarHBondContact O-N 2.9Å; F482-K484 PolarHBondContact O-N 3.13Å
483	K	48.6	Very low	55.3	Low	193 Å²	193	126.6 Å²	126.6	84%	0.839	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.9	-8.8	167.8	-69.6	-170.8	176.5	-176	0	114.4	D481	D481-K483 PolarHBondContact O-N 3.37Å
484	K	47.4	Very low	55.3	Low	191 Å²	191	124.2 Å²	124.2	83%	0.83	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	-19.3	-176.9	-77.3	-175.8	174	179.1	0	116.1	D481 F482	D481-K484 PolarHBondContact O-N 2.84Å; F482-K484 PolarHBondContact O-N 3.13Å
485	K	40.7	Very low	55.6	Low	163 Å²	163	120.5 Å²	120.5	71%	0.709	58%	0.584	S	S	*	*			trans	-136.9	117.7	-179.8	-66	-173.8	-179.6	179.4	0	111.8
486	M	43.4	Very low	56.1	Low	179 Å²	179	117.9 Å²	117.9	88%	0.882	57%	0.571	S	S	*	*			trans	-99.6	8.4	-171.4	-150.7	-174	-67.2	0	0	114.6
487	F	40.8	Very low	56.7	Low	194 Å²	194	117.4 Å²	117.4	85%	0.851	56%	0.564	S	S	*	*			trans	-135.1	81.2	-175.7	-71.3	-82.8	0	0	0	112.2
488	V	41.8	Very low	57	Low	112 Å²	112	114 Å²	114	68%	0.679	54%	0.543	S	S	*	.			trans	-130.5	131.6	160.6	-178.8	0	0	0	0	108.2	K490	V488-K490 PolarHBondContact O-N 3.17Å; V488-K490 VanDerWaalsContact O-N 3.13Å
489	K	40.8	Very low	57.1	Low	203 Å²	203	117.2 Å²	117.2	88%	0.883	56%	0.557	S	S	*	*			trans	-73.1	103.7	-176.2	-172.5	179.6	180	-175.8	0	109.4	T491	K489-T491 PolarHBondContact O-N 3Å
490	K	41.3	Very low	57.3	Low	192 Å²	192	111.5 Å²	111.5	84%	0.835	53%	0.534	S	S	*	.			trans	-61.6	99.9	-173.7	-170.5	175.5	-174.6	179.2	0	112.2	V488	V488-K490 PolarHBondContact O-N 3.17Å; V488-K490 VanDerWaalsContact O-N 3.13Å
491	T	41.9	Very low	57.2	Low	109 Å²	109	109.5 Å²	109.5	67%	0.669	53%	0.534	S	S	*	.			trans	-61.4	136	153.8	44.2	0	0	0	0	107.7	K489 D493	K489-T491 PolarHBondContact O-N 3Å; T491-D493 PolarHBondContact O-N 3.13Å
492	S	54.7	Low	56.9	Low	92 Å²	92	108.1 Å²	108.1	64%	0.643	53%	0.527	S	S	*	.			trans	-83.8	63.8	-169.2	-171.6	0	0	0	0	111.9	N409 R494	N409-S492 PolarHBondContact ND2-O 3.48Å; S492-R494 PolarHBondContact O-N 2.86Å
493	D	67	Low	56.5	Low	36 Å²	36	107.8 Å²	107.8	19%	0.193	54%	0.537	C	S	.	.			trans	-59	90.2	172.4	-173.8	38.3	0	0	0	110.7	R471 T491	R471-D493 IonicContact CZ-OD1 3.42Å; R471-D493 VanDerWaalsContact CZ-OD1 3.27Å; R471-D493 IonicContact CZ-OD2 2.71Å; R471-D493 IonicContact NE-OD1 2.66Å; R471-D493 PolarHBondContact NE-OD1 3.15Å; R471-D493 IonicContact NE-OD2 3.9Å; R471-D493 PolarHBondContact NE-OD2 3.17Å; R471-D493 IonicContact NH2-OD1 3.33Å; R471-D493 PolarHBondContact NH2-OD1 3.34Å; R471-D493 IonicContact NH2-OD2 3.83Å; R471-D493 PolarHBondContact NH2-OD2 3.37Å; T491-D493 PolarHBondContact O-N 3.13Å
494	R	79.9	Confident	56	Low	66 Å²	66	104 Å²	104	25%	0.249	53%	0.53	C	S	.	.			trans	-104.3	132.4	-175.1	-177.3	171.3	169.2	-124	0.4	109.7	N409 C423 D424 S492 E674 Y680	N409-R494 PolarHBondContact N-O 3.42Å; N409-R494 PolarHBondContact ND2-N 3.33Å; N409-R494 PolarHBondContact OD1-O 3.46Å; C423-R494 HydrophobicContact CB-CB 4.17Å; C423-R494 HydrophobicContact CB-CG 4.02Å; C423-R494 WeakPolarHBondContact CB-O 3.33Å; C423-R494 PolarHBondContact O-NH1 3.3Å; D424-R494 IonicContact OD1-NH2 2.75Å; D424-R494 IonicContact OD2-CZ 3.27Å; D424-R494 IonicContact OD2-NH1 3.37Å; D424-R494 PolarHBondContact OD2-NH1 2.86Å; D424-R494 IonicContact OD2-NH2 3.98Å; D424-R494 PolarHBondContact OD2-NH2 3.41Å; S492-R494 PolarHBondContact O-N 2.86Å; R494-E674 IonicContact CZ-OE1 2.67Å; R494-E674 VanDerWaalsContact CZ-OE1 3.25Å; R494-E674 IonicContact CZ-OE2 2.69Å; R494-E674 IonicContact NE-OE1 3.7Å; R494-E674 PolarHBondContact NE-OE1 2.84Å; R494-E674 IonicContact NE-OE2 2.67Å; R494-E674 IonicContact NH2-OE1 3.93Å; R494-E674 PolarHBondContact NH2-OE1 2.79Å; R494-E674 IonicContact NH2-OE2 2.96Å; R494-E674 PolarHBondContact NH2-OE2 3.46Å; R494-Y680 PolarHBondContact NH2-OH 2.89Å
495	V	84.4	Confident	55.5	Low	21 Å²	21	99.2 Å²	99.2	13%	0.127	52%	0.519	C	S	.	.	B	Isolated β-bridge	trans	-130.3	129.2	175.9	176	0	0	0	0	107.8	N407 L408 L468 R471 L472 M475 L497	N407-V495 CarbonylContact O-C 3.05Å; N407-V495 WeakPolarHBondContact O-CA 3.41Å; L408-V495 HydrophobicContact CB-CG2 4.24Å; L468-V495 HydrophobicContact CD1-CG1 3.35Å; L468-V495 HydrophobicContact CD1-CG2 4.5Å; R471-V495 HydrophobicContact CG-CG2 4.36Å; L472-V495 HydrophobicContact CD2-CG1 4.08Å; M475-V495 HydrophobicContact SD-CG2 4.19Å; V495-L497 HydrophobicContact CG1-CD2 4.05Å; V495-L497 HydrophobicContact CG1-CG 4.4Å
496	R	86.6	Confident	55.2	Low	1 Å²	1	102.9 Å²	102.9	0%	0.004	53%	0.529	C	S	.	.			trans	-96.5	122.3	174.3	171.8	177	173.4	-117.1	2.7	108.8	R405 N407 C423 V498 S530 E674 L676 E713	R405-R496 VanDerWaalsContact CZ-NE 3.3Å; R405-R496 VanDerWaalsContact NH1-CZ 3.25Å; R405-R496 VanDerWaalsContact NH1-NH2 3.17Å; N407-R496 HydrophobicContact CB-CB 4.18Å; N407-R496 PolarHBondContact O-N 3.04Å; N407-R496 WeakPolarHBondContact OD1-CD 3.46Å; N407-R496 PolarHBondContact OD1-NH1 2.88Å; C423-R496 WeakPolarHBondContact SG-CB 3.42Å; R496-V498 HydrophobicContact CG-CG2 4.07Å; R496-V498 VanDerWaalsContact CZ-CG2 3.48Å; R496-S530 PolarHBondContact NH1-OG 3.01Å; R496-E674 WeakPolarHBondContact CD-O 3.48Å; R496-E674 HydrophobicContact CG-CB 4.42Å; R496-E674 WeakPolarHBondContact CG-O 3.48Å; R496-E674 PolarHBondContact NE-O 2.94Å; R496-L676 PolarHBondContact NH2-O 2.71Å; R496-E713 IonicContact CZ-OE1 3.3Å; R496-E713 IonicContact CZ-OE2 3.77Å; R496-E713 IonicContact NH1-OE1 2.86Å; R496-E713 PolarHBondContact NH1-OE1 2.93Å; R496-E713 IonicContact NH1-OE2 3.06Å; R496-E713 VanDerWaalsContact NH2-CD 3.29Å; R496-E713 IonicContact NH2-OE1 3.25Å; R496-E713 PolarHBondContact NH2-OE1 2.84Å; R496-E713 IonicContact NH2-OE2 2.78Å; R496-E713 PolarHBondContact NH2-OE2 3.3Å
497	L	82.3	Confident	54.9	Low	44 Å²	44	97.8 Å²	97.8	23%	0.23	52%	0.523	C	S	.	.			trans	-98.3	103.8	-177.8	-66.6	171.9	0	0	0	110.1	L472 V495 Y516	L472-L497 HydrophobicContact CD1-CD2 3.85Å; L472-L497 HydrophobicContact CD2-CD2 4.02Å; V495-L497 HydrophobicContact CG1-CD2 4.05Å; V495-L497 HydrophobicContact CG1-CG 4.4Å; L497-Y516 HydrophobicContact CB-CD1 3.69Å; L497-Y516 HydrophobicContact CB-CD2 4.41Å; L497-Y516 HydrophobicContact CB-CE1 3.77Å; L497-Y516 HydrophobicContact CB-CE2 4.48Å; L497-Y516 HydrophobicContact CB-CG 4.04Å; L497-Y516 HydrophobicContact CD1-CD1 4.3Å; L497-Y516 HydrophobicContact CD1-CD2 4.12Å; L497-Y516 HydrophobicContact CD1-CG 3.83Å
498	V	75.8	Confident	54.4	Low	11 Å²	11	93.5 Å²	93.5	7%	0.067	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-94.7	129	177.6	-172.7	0	0	0	0	109.3	R496 A500 I527	R496-V498 HydrophobicContact CG-CG2 4.07Å; R496-V498 VanDerWaalsContact CZ-CG2 3.48Å; V498-A500 PolarHBondContact O-N 3.36Å; V498-I527 HydrophobicContact CB-CB 4.31Å; V498-I527 HydrophobicContact CB-CD1 4.2Å; V498-I527 HydrophobicContact CG1-CD1 3.97Å
499	K	67.5	Low	54.1	Low	138 Å²	138	93.6 Å²	93.6	60%	0.6	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-74.7	122.1	175.2	-178.2	-174.9	172.8	-170.4	0	110.2
500	A	61.3	Low	53.8	Low	24 Å²	24	88.4 Å²	88.4	20%	0.198	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-60.8	141.1	169.2	0	0	0	0	0	111.7	V498 D502 H525 I527	V498-A500 PolarHBondContact O-N 3.36Å; A500-D502 PolarHBondContact O-N 3.37Å; A500-H525 HydrophobicContact CB-CB 3.79Å; A500-I527 HydrophobicContact CB-CD1 4.33Å
501	V	53.6	Low	53.7	Low	109 Å²	109	85 Å²	85	66%	0.661	52%	0.518	S	S	*	.			trans	-81.3	107.4	174.1	-178.4	0	0	0	0	108.1	P503	V501-P503 WeakPolarHBondContact O-CD 3.45Å
502	D	46.7	Very low	53.3	Low	70 Å²	70	87.9 Å²	87.9	37%	0.374	52%	0.522	S	S	.	.			trans	-72.3	115.6	171.9	174.2	-8	0	0	0	109.3	A500 T504 C505	A500-D502 PolarHBondContact O-N 3.37Å; D502-T504 PolarHBondContact O-N 3.34Å; D502-T504 VanDerWaalsContact O-N 3.16Å; D502-T504 WeakPolarHBondContact OD1-CA 3.35Å; D502-T504 WeakPolarHBondContact OD1-CB 3.38Å; D502-T504 PolarHBondContact OD1-N 2.93Å; D502-T504 PolarHBondContact OD1-OG1 3.36Å; D502-T504 PolarHBondContact OD2-OG1 3.28Å; D502-C505 HydrophobicContact CB-CB 4.06Å; D502-C505 PolarHBondContact O-N 2.96Å; D502-C505 PolarHBondContact OD2-SG 2.92Å
503	P	40.4	Very low	52	Low	115 Å²	115	90.9 Å²	90.9	75%	0.747	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-13.7	-176.6	28.7	-35.5	0	0	0	113.6	V501	V501-P503 WeakPolarHBondContact O-CD 3.45Å
504	T	37.1	Very low	50.4	Low	113 Å²	113	93.3 Å²	93.3	69%	0.693	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-25.7	179.5	74	0	0	0	0	113.2	D502 R506	D502-T504 PolarHBondContact O-N 3.34Å; D502-T504 VanDerWaalsContact O-N 3.16Å; D502-T504 WeakPolarHBondContact OD1-CA 3.35Å; D502-T504 WeakPolarHBondContact OD1-CB 3.38Å; D502-T504 PolarHBondContact OD1-N 2.93Å; D502-T504 PolarHBondContact OD1-OG1 3.36Å; D502-T504 PolarHBondContact OD2-OG1 3.28Å; T504-R506 VanDerWaalsContact C-N 3.27Å; T504-R506 PolarHBondContact O-N 3Å
505	C	37	Very low	48.1	Very low	91 Å²	91	97.1 Å²	97.1	62%	0.615	56%	0.557	S	S	*	*			trans	-80.9	55.5	-169.3	-90.4	0	0	0	0	114.7	D502 G507	D502-C505 HydrophobicContact CB-CB 4.06Å; D502-C505 PolarHBondContact O-N 2.96Å; D502-C505 PolarHBondContact OD2-SG 2.92Å; C505-G507 PolarHBondContact O-N 2.89Å
506	R	35.4	Very low	45.8	Very low	240 Å²	240	101 Å²	101	91%	0.906	57%	0.569	S	S	*	*			trans	-79.4	78.7	179.5	-151.5	-179.2	-65	-134	1.6	112.8	T504	T504-R506 VanDerWaalsContact C-N 3.27Å; T504-R506 PolarHBondContact O-N 3Å
507	G	35.8	Very low	43.1	Very low	73 Å²	73	104.6 Å²	104.6	75%	0.753	59%	0.592	S	S	*	*			trans	110.7	110.4	156	0	0	0	0	0	117.6	C505	C505-G507 PolarHBondContact O-N 2.89Å
508	S	30.3	Very low	41	Very low	104 Å²	104	106.2 Å²	106.2	73%	0.727	60%	0.6	S	S	*	*			trans	-166.1	121.6	139.7	-176.2	0	0	0	0	109.5	S510	S508-S510 PolarHBondContact O-N 3.43Å
509	A	36.1	Very low	38.9	Very low	113 Å²	113	109.5 Å²	109.5	93%	0.934	62%	0.624	S	S	*	*			trans	-87.4	91.8	177.6	0	0	0	0	0	109.9
510	S	34.8	Very low	37.4	Very low	94 Å²	94	112 Å²	112	66%	0.657	64%	0.635	S	S	*	*	S	Bend	trans	-148.6	148.1	168.9	-179.4	0	0	0	0	108.8	S508 K512	S508-S510 PolarHBondContact O-N 3.43Å; S510-K512 PolarHBondContact O-N 2.97Å
511	S	38.7	Very low	36.3	Very low	120 Å²	120	119.2 Å²	119.2	84%	0.839	66%	0.657	S	S	*	*			trans	-67.1	88.7	-173.3	-169.7	0	0	0	0	111.6	Q513	S511-Q513 PolarHBondContact O-N 3.49Å
512	K	33	Very low	36	Very low	170 Å²	170	120.4 Å²	120.4	74%	0.739	66%	0.655	S	S	*	*			trans	-83.1	94.5	169.1	-71.7	-172.8	177.9	-177.3	0	108.4	S510 I514	S510-K512 PolarHBondContact O-N 2.97Å; K512-I514 WeakPolarHBondContact O-CG1 3.17Å; K512-I514 PolarHBondContact O-N 3.07Å; K512-I514 VanDerWaalsContact O-N 3.08Å
513	Q	29.3	Very low	36.1	Very low	155 Å²	155	120.9 Å²	120.9	72%	0.724	66%	0.655	S	S	*	*			trans	-45	113.5	170.7	-162.8	172.5	26.4	0	0	109.3	S511 F515	S511-Q513 PolarHBondContact O-N 3.49Å; Q513-F515 VanDerWaalsContact C-N 3.34Å; Q513-F515 HydrophobicContact CB-CE2 4.33Å; Q513-F515 HydrophobicContact CG-CE2 4.16Å; Q513-F515 WeakPolarHBondContact O-CD2 3.47Å; Q513-F515 PolarHBondContact O-N 3.42Å
514	I	33.3	Very low	36.6	Very low	88 Å²	88	121 Å²	121	45%	0.451	65%	0.649	S	S	.	*			trans	-79.5	85.4	-166.6	-52	179.9	0	0	0	109.6	K512 Y516	K512-I514 WeakPolarHBondContact O-CG1 3.17Å; K512-I514 PolarHBondContact O-N 3.07Å; K512-I514 VanDerWaalsContact O-N 3.08Å; I514-Y516 HydrophobicContact CB-CE2 4.24Å; I514-Y516 HydrophobicContact CG2-CD1 3.95Å; I514-Y516 HydrophobicContact CG2-CD2 4.25Å; I514-Y516 HydrophobicContact CG2-CE1 3.55Å; I514-Y516 HydrophobicContact CG2-CE2 3.88Å; I514-Y516 HydrophobicContact CG2-CG 4.28Å; I514-Y516 WeakPolarHBondContact O-CD2 3.45Å; I514-Y516 PolarHBondContact O-N 3.5Å
515	F	30.2	Very low	38.1	Very low	146 Å²	146	120.8 Å²	120.8	64%	0.64	64%	0.64	S	S	*	*			trans	-68.6	97.2	167.3	-80.4	-83.8	0	0	0	109.6	Q513 T517	Q513-F515 VanDerWaalsContact C-N 3.34Å; Q513-F515 HydrophobicContact CB-CE2 4.33Å; Q513-F515 HydrophobicContact CG-CE2 4.16Å; Q513-F515 WeakPolarHBondContact O-CD2 3.47Å; Q513-F515 PolarHBondContact O-N 3.42Å; F515-T517 HydrophobicContact CB-CG2 3.96Å; F515-T517 HydrophobicContact CD1-CG2 3.85Å; F515-T517 HydrophobicContact CG-CG2 4.37Å; F515-T517 PolarHBondContact O-N 2.75Å
516	Y	37.2	Very low	40.3	Very low	101 Å²	101	117.5 Å²	117.5	40%	0.396	62%	0.616	S	S	.	*			trans	-73	53.6	166.5	-55.3	-79.4	0	0	0	111	L497 I514 T675	L497-Y516 HydrophobicContact CB-CD1 3.69Å; L497-Y516 HydrophobicContact CB-CD2 4.41Å; L497-Y516 HydrophobicContact CB-CE1 3.77Å; L497-Y516 HydrophobicContact CB-CE2 4.48Å; L497-Y516 HydrophobicContact CB-CG 4.04Å; L497-Y516 HydrophobicContact CD1-CD1 4.3Å; L497-Y516 HydrophobicContact CD1-CD2 4.12Å; L497-Y516 HydrophobicContact CD1-CG 3.83Å; I514-Y516 HydrophobicContact CB-CE2 4.24Å; I514-Y516 HydrophobicContact CG2-CD1 3.95Å; I514-Y516 HydrophobicContact CG2-CD2 4.25Å; I514-Y516 HydrophobicContact CG2-CE1 3.55Å; I514-Y516 HydrophobicContact CG2-CE2 3.88Å; I514-Y516 HydrophobicContact CG2-CG 4.28Å; I514-Y516 WeakPolarHBondContact O-CD2 3.45Å; I514-Y516 PolarHBondContact O-N 3.5Å; Y516-T675 VanDerWaalsContact OH-CG2 3.23Å; Y516-T675 WeakPolarHBondContact OH-CG2 3.42Å
517	T	29.8	Very low	42.7	Very low	78 Å²	78	107.7 Å²	107.7	48%	0.479	58%	0.581	S	S	.	*			trans	-87.3	132.9	-172.1	42.3	0	0	0	0	112	F515 S519	F515-T517 HydrophobicContact CB-CG2 3.96Å; F515-T517 HydrophobicContact CD1-CG2 3.85Å; F515-T517 HydrophobicContact CG-CG2 4.37Å; F515-T517 PolarHBondContact O-N 2.75Å; T517-S519 WeakPolarHBondContact CB-OG 3.37Å; T517-S519 PolarHBondContact O-N 2.75Å; T517-S519 PolarHBondContact O-OG 3.37Å; T517-S519 PolarHBondContact OG1-OG 3.04Å
518	L	37.7	Very low	45.4	Very low	77 Å²	77	104.2 Å²	104.2	40%	0.403	55%	0.545	S	S	.	.			trans	-68.9	44.1	164.3	-65.6	169.8	0	0	0	111.6	L469 L472 R473 K520	L469-L518 HydrophobicContact CD1-CD2 3.84Å; L472-L518 HydrophobicContact CB-CD1 4.07Å; R473-L518 HydrophobicContact CG-CD1 4.08Å; L518-K520 PolarHBondContact O-N 2.99Å
519	S	32	Very low	48.3	Very low	80 Å²	80	99.7 Å²	99.7	56%	0.559	51%	0.512	S	S	*	.			trans	-96.1	72.7	-173	54.7	0	0	0	0	111.1	T517	T517-S519 WeakPolarHBondContact CB-OG 3.37Å; T517-S519 PolarHBondContact O-N 2.75Å; T517-S519 PolarHBondContact O-OG 3.37Å; T517-S519 PolarHBondContact OG1-OG 3.04Å
520	K	36.7	Very low	51	Low	191 Å²	191	94.7 Å²	94.7	83%	0.83	47%	0.471	S	S	*	.	S	Bend	trans	44.4	103.3	161.4	-65.4	-178.8	171.9	-178.4	0	116.5	L518	L518-K520 PolarHBondContact O-N 2.99Å
521	R	37.2	Very low	53.8	Low	176 Å²	176	93.7 Å²	93.7	66%	0.664	46%	0.458	S	S	*	.	S	Bend	trans	100.7	24.7	169.5	-55.1	-178.4	-65.9	-164.3	-0.1	118.7
522	H	47.3	Very low	56.5	Low	134 Å²	134	88.2 Å²	88.2	62%	0.62	42%	0.419	S	S	*	.			trans	-142.3	56.3	169.6	-68.7	-75.6	0	0	0	111.9	D524 H525	H522-D524 VanDerWaalsContact C-N 3.34Å; H522-H525 AromaticContact CG-CD2 3.97Å; H522-H525 AromaticContact ND1-CD2 3.54Å
523	E	49.6	Very low	59.4	Low	80 Å²	80	84.1 Å²	84.1	37%	0.374	40%	0.401	S	S	.	.			trans	-80.4	-22	176.2	-54.1	-159.7	139.9	0	0	111.5	L469 R473 H525 L526	L469-E523 HydrophobicContact CD1-CG 4.37Å; L469-E523 HydrophobicContact CD2-CB 4.37Å; L469-E523 WeakPolarHBondContact CD2-OE2 3.37Å; R473-E523 IonicContact CZ-OE1 2.62Å; R473-E523 IonicContact NE-OE1 3.6Å; R473-E523 IonicContact NH2-OE1 2.72Å; R473-E523 PolarHBondContact NH2-OE1 3.12Å; R473-E523 IonicContact NH2-OE2 3.03Å; R473-E523 PolarHBondContact NH2-OE2 3.13Å; E523-H525 PolarHBondContact O-N 3.48Å; E523-L526 PolarHBondContact O-N 2.94Å
524	D	50.5	Low	62.6	Low	116 Å²	116	79.2 Å²	79.2	62%	0.62	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-14.7	-178.8	-38.3	-77	0	0	0	114.1	Q465 H522	Q465-D524 PolarHBondContact NE2-O 2.73Å; H522-D524 VanDerWaalsContact C-N 3.34Å
525	H	68	Low	65.5	Low	109 Å²	109	76.4 Å²	76.4	51%	0.505	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	3.6	-176.4	-62.6	-22.1	0	0	0	114	A500 H522 E523	A500-H525 HydrophobicContact CB-CB 3.79Å; H522-H525 AromaticContact CG-CD2 3.97Å; H522-H525 AromaticContact ND1-CD2 3.54Å; E523-H525 PolarHBondContact O-N 3.48Å
526	L	83.1	Confident	68.6	Low	23 Å²	23	76.5 Å²	76.5	12%	0.12	37%	0.37	C	S	.	.			trans	-75.7	126.4	175.1	-69.7	177	0	0	0	111	Y461 Q465 L468 L469 L472 E523 P528	Y461-L526 PolarHBondContact OH-O 2.96Å; Q465-L526 HydrophobicContact CG-CB 3.85Å; Q465-L526 PolarHBondContact NE2-O 3.48Å; L468-L526 HydrophobicContact CD2-CB 4Å; L468-L526 HydrophobicContact CD2-CD2 4.36Å; L468-L526 HydrophobicContact CG-CD2 4.46Å; L469-L526 HydrophobicContact CB-CD1 3.72Å; L469-L526 HydrophobicContact CD1-CD1 3.84Å; L469-L526 HydrophobicContact CG-CD1 4.32Å; L472-L526 HydrophobicContact CD1-CD1 4.43Å; L472-L526 HydrophobicContact CD1-CD2 3.71Å; E523-L526 PolarHBondContact O-N 2.94Å; L526-P528 WeakPolarHBondContact O-CD 3.48Å
527	I	87.3	Confident	71.3	Confident	33 Å²	33	73 Å²	73	17%	0.169	36%	0.359	C	S	.	.			trans	-112.6	95.4	-178.1	-59.2	172.6	0	0	0	108.9	N407 V498 A500 Y529	N407-I527 WeakPolarHBondContact CB-O 3.43Å; N407-I527 PolarHBondContact ND2-O 2.9Å; V498-I527 HydrophobicContact CB-CB 4.31Å; V498-I527 HydrophobicContact CB-CD1 4.2Å; V498-I527 HydrophobicContact CG1-CD1 3.97Å; A500-I527 HydrophobicContact CB-CD1 4.33Å; I527-Y529 VanDerWaalsContact C-N 3.33Å; I527-Y529 VanDerWaalsContact CG2-O 3.27Å; I527-Y529 WeakPolarHBondContact CG2-O 3.41Å
528	P	90.7	Very high	74.3	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	38%	0.376	C	S	.	.	S	Bend	trans	-72.7	-26.6	177.6	31.7	-38.3	0	0	0	113.2	N407 L408 Y461 A464 Q465 L468 L526	N407-P528 WeakPolarHBondContact CB-O 3.46Å; N407-P528 PolarHBondContact N-O 3.14Å; L408-P528 HydrophobicContact CD2-CB 3.71Å; Y461-P528 HydrophobicContact CD2-CG 4.12Å; Y461-P528 HydrophobicContact CE1-CG 4.49Å; Y461-P528 HydrophobicContact CE2-CG 4.05Å; Y461-P528 HydrophobicContact CG-CG 4.38Å; A464-P528 HydrophobicContact CB-CB 3.65Å; A464-P528 HydrophobicContact CB-CG 3.81Å; Q465-P528 HydrophobicContact CB-CG 4.06Å; L468-P528 HydrophobicContact CD2-CB 4.25Å; L526-P528 WeakPolarHBondContact O-CD 3.48Å
529	Y	93.1	Very high	77	Confident	9 Å²	9	78 Å²	78	4%	0.035	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	119	-178.3	-60.1	-54.2	0	0	0	109	R405 V406 M410 I427 W440 M458 P459 Y461 A464 I527	R405-Y529 WeakPolarHBondContact O-CA 3.33Å; V406-Y529 HydrophobicContact CB-CD1 4.48Å; V406-Y529 HydrophobicContact CG1-CD1 4.27Å; V406-Y529 HydrophobicContact CG1-CE1 3.98Å; V406-Y529 HydrophobicContact CG2-CD1 4.21Å; V406-Y529 HydrophobicContact CG2-CE1 4.13Å; M410-Y529 HydrophobicContact CE-CE1 4.11Å; M410-Y529 VanDerWaalsContact CE-OH 3.32Å; M410-Y529 WeakPolarHBondContact CE-OH 3.31Å; I427-Y529 HydrophobicContact CD1-CD1 4.38Å; I427-Y529 HydrophobicContact CD1-CE1 4.15Å; W440-Y529 HydrophobicContact CE3-CD2 4.29Å; W440-Y529 HydrophobicContact CE3-CE2 4.05Å; W440-Y529 AromaticContact CH2-CD2 3.75Å; W440-Y529 HydrophobicContact CH2-CD2 3.75Å; W440-Y529 HydrophobicContact CH2-CE2 4.2Å; W440-Y529 AromaticContact CZ3-CD2 3.4Å; W440-Y529 HydrophobicContact CZ3-CD2 3.4Å; W440-Y529 VanDerWaalsContact CZ3-CD2 3.4Å; W440-Y529 AromaticContact CZ3-CE2 3.61Å; W440-Y529 HydrophobicContact CZ3-CE2 3.61Å; W440-Y529 HydrophobicContact CZ3-CG 4.04Å; M458-Y529 HydrophobicContact CE-CE1 3.84Å; M458-Y529 WeakPolarHBondContact CE-OH 3.36Å; P459-Y529 PolarHBondContact O-OH 3.27Å; Y461-Y529 HydrophobicContact CD2-CD2 4.2Å; A464-Y529 HydrophobicContact CB-CD2 4.07Å; A464-Y529 HydrophobicContact CB-CE2 3.29Å; I527-Y529 VanDerWaalsContact C-N 3.33Å; I527-Y529 VanDerWaalsContact CG2-O 3.27Å; I527-Y529 WeakPolarHBondContact CG2-O 3.41Å
530	S	92.6	Very high	80	Confident	8 Å²	8	76.6 Å²	76.6	6%	0.056	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	125.1	170.9	-67.8	0	0	0	0	109.8	A404 R405 N407 R496 V532 E713	A404-S530 CarbonylContact C-O 3.59Å; A404-S530 VanDerWaalsContact CA-O 3.3Å; A404-S530 WeakPolarHBondContact CA-O 3.43Å; R405-S530 PolarHBondContact N-O 3.26Å; R405-S530 PolarHBondContact O-N 3.22Å; N407-S530 PolarHBondContact ND2-OG 3.41Å; R496-S530 PolarHBondContact NH1-OG 3.01Å; S530-V532 PolarHBondContact O-N 3.38Å; S530-E713 WeakPolarHBondContact CB-OE1 3.31Å; S530-E713 PolarHBondContact OG-OE1 3.11Å
531	L	93.1	Very high	82.9	Confident	74 Å²	74	67.8 Å²	67.8	39%	0.387	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	131.1	174.2	-160.5	77.6	0	0	0	110.1	F402 E713 D715	F402-L531 HydrophobicContact CB-CD1 4.01Å; F402-L531 HydrophobicContact CD2-CD1 3.59Å; F402-L531 HydrophobicContact CE2-CD1 4.42Å; F402-L531 HydrophobicContact CG-CD1 4.11Å; L531-E713 WeakPolarHBondContact O-CA 3.46Å; L531-D715 VanDerWaalsContact CD2-OD2 3.31Å; L531-D715 WeakPolarHBondContact CD2-OD2 3.4Å
532	V	95.6	Very high	85.8	Confident	5 Å²	5	59.5 Å²	59.5	3%	0.03	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	152.8	178.6	-69.5	0	0	0	0	111.4	Y403 R405 I426 S530 W711 V712 E713	Y403-V532 PolarHBondContact O-N 3.48Å; R405-V532 HydrophobicContact CB-CG1 3.87Å; I426-V532 HydrophobicContact CD1-CG2 4.26Å; I426-V532 HydrophobicContact CG2-CG2 4.32Å; S530-V532 PolarHBondContact O-N 3.38Å; V532-W711 HydrophobicContact CB-CE3 4.35Å; V532-W711 HydrophobicContact CG2-CE3 3.78Å; V532-W711 HydrophobicContact CG2-CZ3 4.35Å; V532-V712 CarbonylContact C-O 3.6Å; V532-V712 WeakPolarHBondContact CA-O 3.39Å; V532-E713 HydrophobicContact CG1-CG 3.68Å
533	K	94.3	Very high	88.2	Confident	83 Å²	83	53.1 Å²	53.1	36%	0.361	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	130.3	173.7	-72.8	154.1	-172.4	164.9	0	109.2	V712 L714 D715	K533-V712 PolarHBondContact N-O 2.65Å; K533-V712 PolarHBondContact O-N 3.4Å; K533-V712 VanDerWaalsContact O-N 3.13Å; K533-L714 HydrophobicContact CB-CD1 4.33Å; K533-L714 HydrophobicContact CD-CB 4.22Å; K533-L714 HydrophobicContact CD-CD1 3.74Å; K533-L714 HydrophobicContact CD-CG 4.15Å; K533-D715 IonicContact NZ-OD1 2.82Å; K533-D715 PolarHBondContact NZ-OD1 2.83Å; K533-D715 IonicContact NZ-OD2 2.61Å; K533-D715 PolarHBondContact NZ-OD2 2.82Å
534	P	95.5	Very high	90.4	Very high	53 Å²	53	49.3 Å²	49.3	34%	0.344	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	121.7	177	27.1	-30.7	0	0	0	111.1	Y403 V709 W711	Y403-P534 HydrophobicContact CD2-CG 4.15Å; Y403-P534 HydrophobicContact CE2-CG 4.01Å; P534-V709 HydrophobicContact CB-CG1 3.49Å; P534-V709 VanDerWaalsContact CB-CG1 3.49Å; P534-W711 HydrophobicContact CB-CD2 4.49Å; P534-W711 HydrophobicContact CB-CE3 3.95Å; P534-W711 HydrophobicContact CB-CH2 3.83Å; P534-W711 HydrophobicContact CB-CZ2 4.37Å; P534-W711 HydrophobicContact CB-CZ3 3.59Å; P534-W711 HydrophobicContact CG-CH2 4.32Å; P534-W711 HydrophobicContact CG-CZ3 3.94Å
535	V	95.2	Very high	92.5	Very high	28 Å²	28	43.9 Å²	43.9	17%	0.17	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.3	178.6	-175.6	0	0	0	0	109.9	V537 Y633 A710 V712	V535-V537 HydrophobicContact CG1-CG2 4.03Å; V535-Y633 HydrophobicContact CG1-CD1 4.45Å; V535-Y633 HydrophobicContact CG1-CD2 4.09Å; V535-Y633 HydrophobicContact CG1-CE1 4.25Å; V535-Y633 HydrophobicContact CG1-CE2 3.85Å; V535-Y633 HydrophobicContact CG1-CG 4.39Å; V535-Y633 HydrophobicContact CG2-CE1 4.12Å; V535-A710 HydrophobicContact CB-CB 4.34Å; V535-A710 PolarHBondContact N-O 3.18Å; V535-A710 PolarHBondContact O-N 2.94Å; V535-V712 HydrophobicContact CG2-CG2 3.96Å
536	K	94	Very high	93.7	Very high	149 Å²	149	38.7 Å²	38.7	65%	0.648	19%	0.194	S	C	*	.			trans	-97.1	110.4	172.4	-72.3	-175.8	178	-176	0	109.4	V709	K536-V709 HydrophobicContact CD-CG2 4.44Å; K536-V709 HydrophobicContact CG-CG2 3.92Å
537	V	94.4	Very high	94	Very high	28 Å²	28	37.7 Å²	37.7	17%	0.17	19%	0.189	C	C	.	.			trans	-96.5	111.2	-173.9	-168.2	0	0	0	0	109.7	V535 R541 Y633 Q706	V535-V537 HydrophobicContact CG1-CG2 4.03Å; V537-R541 HydrophobicContact CB-CG 3.96Å; V537-R541 HydrophobicContact CG1-CG 3.84Å; V537-R541 HydrophobicContact CG2-CG 4.3Å; V537-Y633 HydrophobicContact CG2-CD2 3.94Å; V537-Y633 HydrophobicContact CG2-CG 4.11Å; V537-Q706 PolarHBondContact O-NE2 3.5Å
538	Q	92.4	Very high	94	Very high	178 Å²	178	37.6 Å²	37.6	83%	0.832	19%	0.192	S	C	*	.			trans	-77.6	-29.2	-178.3	-57.6	-63.2	-10.3	0	0	112.9
539	T	94.6	Very high	93.6	Very high	80 Å²	80	41.1 Å²	41.1	49%	0.491	21%	0.21	S	C	.	.	S	Bend	trans	-79.9	161.1	176	51	0	0	0	0	111.4	R541 I609 Q706	T539-R541 PolarHBondContact O-N 3.26Å; T539-I609 HydrophobicContact CG2-CG2 4.13Å; T539-Q706 PolarHBondContact O-NE2 3.49Å
540	K	96	Very high	93.2	Very high	52 Å²	52	41 Å²	41	23%	0.226	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-64.7	123	173.4	-69.5	-51.9	-153.7	154.3	0	110.6	G612 R613 H614 Q706	K540-G612 WeakPolarHBondContact CG-O 3.39Å; K540-R613 VanDerWaalsContact CB-O 3.3Å; K540-R613 WeakPolarHBondContact CB-O 3.5Å; K540-H614 PolarHBondContact NZ-NE2 3.14Å; K540-Q706 HydrophobicContact CD-CG 4.34Å
541	R	97.1	Very high	93	Very high	6 Å²	6	40.9 Å²	40.9	2%	0.023	21%	0.209	C	C	.	.	P	Polyproline II helix	trans	-75.5	136.3	176.7	-63.7	170.7	66.8	-177.4	-1.4	109.8	V537 T539 H614 Y633 P634 I635 Q705	V537-R541 HydrophobicContact CB-CG 3.96Å; V537-R541 HydrophobicContact CG1-CG 3.84Å; V537-R541 HydrophobicContact CG2-CG 4.3Å; T539-R541 PolarHBondContact O-N 3.26Å; R541-H614 PolarHBondContact O-ND1 2.8Å; R541-Y633 WeakPolarHBondContact CB-O 3.48Å; R541-Y633 WeakPolarHBondContact CG-O 3.4Å; R541-Y633 PolarHBondContact NE-O 3.49Å; R541-P634 PolarHBondContact NH2-O 3.47Å; R541-I635 HydrophobicContact CB-CD1 3.87Å; R541-I635 HydrophobicContact CB-CG1 3.75Å; R541-I635 HydrophobicContact CG-CG1 4.44Å; R541-Q705 PolarHBondContact NH1-O 2.95Å
542	P	97.4	Very high	92.8	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.013	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-59.9	162	165.9	-25	36.5	0	0	0	112.1	I605 I609 C615 L617 I632 P634 I635	P542-I605 HydrophobicContact CG-CG2 3.73Å; P542-I609 HydrophobicContact CG-CD1 3.89Å; P542-I609 HydrophobicContact CG-CG1 4.41Å; P542-C615 CarbonylContact C-O 3.59Å; P542-C615 WeakPolarHBondContact CA-O 3.41Å; P542-C615 HydrophobicContact CB-CB 4.09Å; P542-C615 WeakPolarHBondContact CB-O 3.16Å; P542-C615 HydrophobicContact CG-CB 4.25Å; P542-L617 HydrophobicContact CB-CD1 3.61Å; P542-L617 HydrophobicContact CB-CG 4.29Å; P542-I632 HydrophobicContact CG-CG2 3.73Å; P542-P634 CarbonylContact O-C 3.34Å; P542-P634 WeakPolarHBondContact O-CA 3.43Å; P542-I635 PolarHBondContact O-N 2.98Å
543	V	97.9	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.1	-177	-171.8	0	0	0	0	109.9	F545 H614 C615 L616 L617 I635 I637 V702	V543-F545 HydrophobicContact CG1-CD1 4.35Å; V543-F545 HydrophobicContact CG1-CE1 3.7Å; V543-F545 HydrophobicContact CG1-CE2 4.24Å; V543-F545 HydrophobicContact CG1-CZ 3.64Å; V543-H614 HydrophobicContact CG2-CB 4.32Å; V543-C615 PolarHBondContact N-O 3.47Å; V543-L616 HydrophobicContact CB-CD2 3.73Å; V543-L616 HydrophobicContact CG1-CD2 4.33Å; V543-L616 HydrophobicContact CG2-CD2 3.9Å; V543-L617 PolarHBondContact O-N 2.91Å; V543-I635 WeakPolarHBondContact CA-O 3.34Å; V543-I637 HydrophobicContact CG1-CD1 4.05Å; V543-I637 HydrophobicContact CG1-CG1 4.37Å; V543-V702 HydrophobicContact CG1-CG2 3.86Å; V543-V702 HydrophobicContact CG2-CG1 3.89Å; V543-V702 HydrophobicContact CG2-CG2 3.81Å
544	I	96.7	Very high	92.2	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	132.6	175.7	-71.9	168.3	0	0	0	108.1	L617 L621 V624 L627 P634 I635 I637	I544-L617 HydrophobicContact CD1-CD1 4.5Å; I544-L617 HydrophobicContact CG1-CB 4.14Å; I544-L617 HydrophobicContact CG1-CD1 4.27Å; I544-L621 HydrophobicContact CG2-CD2 4.41Å; I544-V624 HydrophobicContact CD1-CG2 3.83Å; I544-L627 HydrophobicContact CD1-CD1 3.65Å; I544-P634 HydrophobicContact CD1-CB 4.07Å; I544-P634 HydrophobicContact CD1-CG 4.29Å; I544-I635 PolarHBondContact N-O 2.86Å; I544-I637 PolarHBondContact O-N 3.16Å
545	F	94.6	Very high	92.1	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.3	178.8	-58.6	-69.1	0	0	0	110.9	V543 L554 I555 L558 L616 I637 I639 L698	V543-F545 HydrophobicContact CG1-CD1 4.35Å; V543-F545 HydrophobicContact CG1-CE1 3.7Å; V543-F545 HydrophobicContact CG1-CE2 4.24Å; V543-F545 HydrophobicContact CG1-CZ 3.64Å; F545-L554 HydrophobicContact CB-CD1 4.29Å; F545-L554 HydrophobicContact CD1-CD1 4.39Å; F545-L554 HydrophobicContact CD2-CB 4.44Å; F545-L554 HydrophobicContact CG-CD1 4.18Å; F545-I555 HydrophobicContact CD2-CG1 4.43Å; F545-I555 HydrophobicContact CE2-CG1 4.17Å; F545-L558 HydrophobicContact CE1-CD1 4.38Å; F545-L558 HydrophobicContact CE2-CD1 4.04Å; F545-L558 HydrophobicContact CZ-CD1 3.51Å; F545-L616 HydrophobicContact CE2-CD2 4.23Å; F545-L616 HydrophobicContact CZ-CD2 4.14Å; F545-I637 WeakPolarHBondContact CA-O 3.49Å; F545-I637 HydrophobicContact CD1-CB 4.19Å; F545-I637 HydrophobicContact CE1-CD1 4.3Å; F545-I639 HydrophobicContact CD1-CD1 4.38Å; F545-L698 HydrophobicContact CD1-CD2 4.22Å; F545-L698 HydrophobicContact CE1-CD1 4.3Å; F545-L698 HydrophobicContact CE1-CD2 3.98Å
546	S	92.3	Very high	91.9	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.7	168.9	174.5	0	0	0	0	109.4	I637 H638 I639 E669	S546-I637 PolarHBondContact N-O 3.33Å; S546-H638 CarbonylContact O-C 3.55Å; S546-H638 WeakPolarHBondContact O-CA 3.44Å; S546-H638 PolarHBondContact OG-ND1 2.98Å; S546-I639 PolarHBondContact O-N 3.4Å; S546-E669 WeakPolarHBondContact CA-OE2 3.47Å; S546-E669 WeakPolarHBondContact CB-OE2 3.48Å; S546-E669 PolarHBondContact OG-OE2 3.29Å
547	P	89.6	Confident	91.7	Very high	2 Å²	2	42.7 Å²	42.7	1%	0.013	20%	0.198	C	C	.	.	S	Bend	cis	-59.8	136.8	-6.9	-24.8	34.5	0	0	0	113.8	L549 L550 C666 E669	P547-L549 PolarHBondContact O-N 2.94Å; P547-L549 VanDerWaalsContact O-N 3.15Å; P547-L550 WeakPolarHBondContact O-CB 3.4Å; P547-L550 PolarHBondContact O-N 3.48Å; P547-C666 HydrophobicContact CG-CB 4.21Å; P547-C666 WeakPolarHBondContact CG-SG 3.28Å; P547-E669 VanDerWaalsContact CA-OE2 3.31Å; P547-E669 WeakPolarHBondContact CA-OE2 3.36Å
548	S	87.4	Confident	91.6	Very high	32 Å²	32	41.5 Å²	41.5	22%	0.224	19%	0.191	C	C	.	.	H	α-helix	trans	-54.2	-33.5	179.5	58.7	0	0	0	0	113	L550 S551 E669	S548-L550 PolarHBondContact O-N 2.66Å; S548-L550 VanDerWaalsContact O-N 3.09Å; S548-S551 VanDerWaalsContact O-CB 3.25Å; S548-S551 WeakPolarHBondContact O-CB 3.21Å; S548-S551 PolarHBondContact O-N 2.91Å; S548-S551 PolarHBondContact O-OG 2.81Å; S548-E669 WeakPolarHBondContact CB-OE1 3.35Å; S548-E669 PolarHBondContact N-OE1 3.06Å; S548-E669 PolarHBondContact N-OE2 3.13Å; S548-E669 VanDerWaalsContact N-OE2 3.14Å; S548-E669 PolarHBondContact OG-OE1 2.79Å
549	L	82	Confident	91.6	Very high	74 Å²	74	35.4 Å²	35.4	39%	0.387	16%	0.164	S	C	.	.	H	α-helix	trans	-56.5	-21.3	174.1	-63.6	178	0	0	0	114.5	P547 V665	P547-L549 PolarHBondContact O-N 2.94Å; P547-L549 VanDerWaalsContact O-N 3.15Å; L549-V665 HydrophobicContact CD1-CB 3.97Å; L549-V665 HydrophobicContact CD1-CG1 3.72Å; L549-V665 HydrophobicContact CD1-CG2 4.34Å; L549-V665 HydrophobicContact CG-CG1 4.04Å
550	L	84.8	Confident	91.3	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.037	17%	0.171	C	C	.	.	H	α-helix	trans	-88.7	-22.7	174.6	-72.7	176.7	0	0	0	113.4	P547 S548 R552 R553 L554 L652 F653	P547-L550 WeakPolarHBondContact O-CB 3.4Å; P547-L550 PolarHBondContact O-N 3.48Å; S548-L550 PolarHBondContact O-N 2.66Å; S548-L550 VanDerWaalsContact O-N 3.09Å; L550-R552 PolarHBondContact O-N 2.71Å; L550-R553 PolarHBondContact O-N 2.99Å; L550-L554 HydrophobicContact CB-CD1 3.76Å; L550-L554 HydrophobicContact CB-CG 4.25Å; L550-L554 WeakPolarHBondContact O-CG 3.24Å; L550-L554 PolarHBondContact O-N 3.49Å; L550-L652 HydrophobicContact CD2-CB 3.98Å; L550-F653 HydrophobicContact CD1-CE1 4.18Å; L550-F653 HydrophobicContact CD2-CD1 3.5Å; L550-F653 VanDerWaalsContact CD2-CD1 3.5Å; L550-F653 HydrophobicContact CD2-CE1 3.46Å; L550-F653 VanDerWaalsContact CD2-CE1 3.46Å; L550-F653 HydrophobicContact CD2-CG 4.37Å; L550-F653 HydrophobicContact CD2-CZ 4.32Å; L550-F653 HydrophobicContact CG-CD1 4.19Å; L550-F653 HydrophobicContact CG-CE1 3.84Å
551	S	89.1	Confident	91	Very high	5 Å²	5	38.4 Å²	38.4	4%	0.035	18%	0.178	C	C	.	.	H	α-helix	trans	-49.5	-59.1	-168.1	62.2	0	0	0	0	112.1	S548 R553 L554 I555	S548-S551 VanDerWaalsContact O-CB 3.25Å; S548-S551 WeakPolarHBondContact O-CB 3.21Å; S548-S551 PolarHBondContact O-N 2.91Å; S548-S551 PolarHBondContact O-OG 2.81Å; S551-R553 PolarHBondContact O-N 2.94Å; S551-L554 PolarHBondContact O-N 3.01Å; S551-L554 VanDerWaalsContact O-N 3.09Å; S551-I555 WeakPolarHBondContact O-CB 3.49Å; S551-I555 WeakPolarHBondContact O-CG1 3.28Å; S551-I555 PolarHBondContact O-N 2.94Å
552	R	88.3	Confident	90	Very high	132 Å²	132	42.8 Å²	42.8	50%	0.498	22%	0.215	S	C	.	.	H	α-helix	trans	-48.3	-51.2	179.3	-166.5	-174.5	-170.1	104.2	-3.3	114	L550 I555 E556 E618	L550-R552 PolarHBondContact O-N 2.71Å; R552-I555 PolarHBondContact O-N 3.37Å; R552-E556 IonicContact NE-OE1 2.73Å; R552-E556 VanDerWaalsContact O-CG 3.32Å; R552-E556 WeakPolarHBondContact O-CG 3.46Å; R552-E556 PolarHBondContact O-N 2.92Å; R552-E618 HydrophobicContact CB-CG 4.17Å; R552-E618 WeakPolarHBondContact CB-OE1 3.33Å; R552-E618 VanDerWaalsContact CD-OE1 3.27Å; R552-E618 WeakPolarHBondContact CD-OE1 3.22Å; R552-E618 WeakPolarHBondContact CG-OE1 3.46Å; R552-E618 IonicContact CZ-OE1 3.73Å; R552-E618 IonicContact NE-OE1 2.83Å; R552-E618 IonicContact NH1-OE1 3.96Å; R552-E618 PolarHBondContact NH1-OE1 3.44Å; R552-E618 IonicContact NH1-OE2 2.79Å; R552-E618 PolarHBondContact NH1-OE2 3.29Å
553	R	86.8	Confident	89.2	Confident	111 Å²	111	49.8 Å²	49.8	42%	0.419	25%	0.248	S	C	.	.	H	α-helix	trans	-73.4	-29	-177.4	-67.6	-53.7	-164.7	-173	-4	112.7	L550 S551 E556 R557 L652	L550-R553 PolarHBondContact O-N 2.99Å; S551-R553 PolarHBondContact O-N 2.94Å; R553-E556 WeakPolarHBondContact CD-OE2 3.48Å; R553-E556 IonicContact CZ-OE1 3.72Å; R553-E556 IonicContact CZ-OE2 3.14Å; R553-E556 IonicContact NE-OE2 3.94Å; R553-E556 VanDerWaalsContact NH1-CD 3.32Å; R553-E556 IonicContact NH1-OE1 3.78Å; R553-E556 PolarHBondContact NH1-OE1 3.46Å; R553-E556 VanDerWaalsContact NH1-OE1 3.14Å; R553-E556 IonicContact NH1-OE2 2.69Å; R553-E556 PolarHBondContact NH1-OE2 2.92Å; R553-R557 WeakPolarHBondContact O-CB 3.48Å; R553-R557 VanDerWaalsContact O-CG 3.3Å; R553-R557 WeakPolarHBondContact O-CG 3.47Å; R553-R557 PolarHBondContact O-N 3.18Å; R553-L652 WeakPolarHBondContact CB-O 3.3Å; R553-L652 VanDerWaalsContact CG-O 3.27Å; R553-L652 WeakPolarHBondContact CG-O 3.47Å
554	L	90.3	Very high	88.4	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.3	-40.3	170.8	-66.5	172.2	0	0	0	111.4	F545 L550 S551 R557 L558 I639 L652 L694 L695 L698	F545-L554 HydrophobicContact CB-CD1 4.29Å; F545-L554 HydrophobicContact CD1-CD1 4.39Å; F545-L554 HydrophobicContact CD2-CB 4.44Å; F545-L554 HydrophobicContact CG-CD1 4.18Å; L550-L554 HydrophobicContact CB-CD1 3.76Å; L550-L554 HydrophobicContact CB-CG 4.25Å; L550-L554 WeakPolarHBondContact O-CG 3.24Å; L550-L554 PolarHBondContact O-N 3.49Å; S551-L554 PolarHBondContact O-N 3.01Å; S551-L554 VanDerWaalsContact O-N 3.09Å; L554-R557 PolarHBondContact O-N 2.71Å; L554-L558 VanDerWaalsContact O-CB 3.29Å; L554-L558 WeakPolarHBondContact O-CB 3.49Å; L554-L558 VanDerWaalsContact O-CG 3.25Å; L554-L558 WeakPolarHBondContact O-CG 3.3Å; L554-L558 PolarHBondContact O-N 3.32Å; L554-I639 HydrophobicContact CD1-CD1 3.26Å; L554-L652 HydrophobicContact CD2-CD1 4.41Å; L554-L694 HydrophobicContact CD2-CD2 4.33Å; L554-L695 HydrophobicContact CD2-CD2 4.35Å; L554-L698 HydrophobicContact CD1-CD1 4.16Å; L554-L698 HydrophobicContact CD2-CD1 3.9Å; L554-L698 HydrophobicContact CG-CD1 4.5Å
555	I	92.6	Very high	87.6	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-61.7	-51.9	176.3	-66.8	165.6	0	0	0	110.4	F545 S551 R552 R557 L558 L559 T570 L616 E618	F545-I555 HydrophobicContact CD2-CG1 4.43Å; F545-I555 HydrophobicContact CE2-CG1 4.17Å; S551-I555 WeakPolarHBondContact O-CB 3.49Å; S551-I555 WeakPolarHBondContact O-CG1 3.28Å; S551-I555 PolarHBondContact O-N 2.94Å; R552-I555 PolarHBondContact O-N 3.37Å; I555-R557 PolarHBondContact O-N 3.46Å; I555-L558 PolarHBondContact O-N 2.98Å; I555-L559 HydrophobicContact CG2-CD1 3.79Å; I555-L559 WeakPolarHBondContact O-CB 3.4Å; I555-L559 WeakPolarHBondContact O-CG 2.81Å; I555-L559 PolarHBondContact O-N 3.36Å; I555-T570 HydrophobicContact CG2-CG2 4.33Å; I555-L616 HydrophobicContact CD1-CB 4.36Å; I555-L616 HydrophobicContact CG1-CB 3.86Å; I555-L616 HydrophobicContact CG1-CD1 4.42Å; I555-L616 HydrophobicContact CG2-CB 4.35Å; I555-L616 HydrophobicContact CG2-CD1 4.45Å; I555-E618 HydrophobicContact CD1-CB 4.1Å
556	E	91.1	Very high	87.2	Confident	83 Å²	83	57.9 Å²	57.9	39%	0.388	30%	0.297	S	S	.	.	H	α-helix	trans	-52.2	-42.1	175	-74.6	171.1	-171.5	0	0	112.2	R552 R553 Q560	R552-E556 IonicContact NE-OE1 2.73Å; R552-E556 VanDerWaalsContact O-CG 3.32Å; R552-E556 WeakPolarHBondContact O-CG 3.46Å; R552-E556 PolarHBondContact O-N 2.92Å; R553-E556 WeakPolarHBondContact CD-OE2 3.48Å; R553-E556 IonicContact CZ-OE1 3.72Å; R553-E556 IonicContact CZ-OE2 3.14Å; R553-E556 IonicContact NE-OE2 3.94Å; R553-E556 VanDerWaalsContact NH1-CD 3.32Å; R553-E556 IonicContact NH1-OE1 3.78Å; R553-E556 PolarHBondContact NH1-OE1 3.46Å; R553-E556 VanDerWaalsContact NH1-OE1 3.14Å; R553-E556 IonicContact NH1-OE2 2.69Å; R553-E556 PolarHBondContact NH1-OE2 2.92Å; E556-Q560 PolarHBondContact O-N 3.19Å
557	R	90.6	Very high	87	Confident	94 Å²	94	61.6 Å²	61.6	36%	0.355	32%	0.317	S	S	.	.	H	α-helix	trans	-80	-35.5	-179.2	-72.4	-56.3	-159.7	96.5	-1.2	114.4	R553 L554 I555 L559 Q560 P561 E692 L695	R553-R557 WeakPolarHBondContact O-CB 3.48Å; R553-R557 VanDerWaalsContact O-CG 3.3Å; R553-R557 WeakPolarHBondContact O-CG 3.47Å; R553-R557 PolarHBondContact O-N 3.18Å; L554-R557 PolarHBondContact O-N 2.71Å; I555-R557 PolarHBondContact O-N 3.46Å; R557-L559 VanDerWaalsContact C-N 3.29Å; R557-L559 PolarHBondContact O-N 3.26Å; R557-Q560 VanDerWaalsContact CD-OE1 3.29Å; R557-Q560 PolarHBondContact O-N 3.02Å; R557-P561 WeakPolarHBondContact O-CD 3.49Å; R557-E692 IonicContact NH1-OE1 2.73Å; R557-E692 PolarHBondContact NH1-OE1 3.37Å; R557-L695 HydrophobicContact CB-CD1 3.88Å; R557-L695 HydrophobicContact CB-CD2 3.79Å
558	L	92	Very high	87.3	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-32.5	177.1	-76.9	170.9	0	0	0	111.7	F545 L554 I555 S564 L616 L695 R699	F545-L558 HydrophobicContact CE1-CD1 4.38Å; F545-L558 HydrophobicContact CE2-CD1 4.04Å; F545-L558 HydrophobicContact CZ-CD1 3.51Å; L554-L558 VanDerWaalsContact O-CB 3.29Å; L554-L558 WeakPolarHBondContact O-CB 3.49Å; L554-L558 VanDerWaalsContact O-CG 3.25Å; L554-L558 WeakPolarHBondContact O-CG 3.3Å; L554-L558 PolarHBondContact O-N 3.32Å; I555-L558 PolarHBondContact O-N 2.98Å; L558-S564 WeakPolarHBondContact O-CB 3.09Å; L558-S564 PolarHBondContact O-OG 3.17Å; L558-L616 HydrophobicContact CB-CD1 3.92Å; L558-L616 HydrophobicContact CD1-CD1 4.05Å; L558-L695 HydrophobicContact CD2-CB 4.33Å; L558-L695 HydrophobicContact CD2-CD2 3.77Å; L558-L695 HydrophobicContact CG-CD2 3.78Å; L558-R699 HydrophobicContact CD2-CG 4.13Å; L558-R699 PolarHBondContact O-NH2 3.08Å
559	L	91.8	Very high	87.7	Confident	49 Å²	49	62.9 Å²	62.9	26%	0.257	32%	0.321	S	S	.	.	S	Bend	trans	-84.6	-13.4	177.4	-63.4	174.3	0	0	0	114	I555 R557 F568 T570 L616	I555-L559 HydrophobicContact CG2-CD1 3.79Å; I555-L559 WeakPolarHBondContact O-CB 3.4Å; I555-L559 WeakPolarHBondContact O-CG 2.81Å; I555-L559 PolarHBondContact O-N 3.36Å; R557-L559 VanDerWaalsContact C-N 3.29Å; R557-L559 PolarHBondContact O-N 3.26Å; L559-F568 HydrophobicContact CD2-CB 3.76Å; L559-T570 HydrophobicContact CD1-CG2 3.68Å; L559-L616 HydrophobicContact CD2-CD1 4.3Å; L559-L616 HydrophobicContact CG-CD1 4.28Å
560	Q	88.9	Confident	88.3	Confident	139 Å²	139	61 Å²	61	65%	0.65	31%	0.313	S	S	*	.	S	Bend	trans	-63.8	-40.7	-174.6	-173.7	176.1	7.7	0	0	114.7	E556 R557	E556-Q560 PolarHBondContact O-N 3.19Å; R557-Q560 VanDerWaalsContact CD-OE1 3.29Å; R557-Q560 PolarHBondContact O-N 3.02Å
561	P	88.6	Confident	88.7	Confident	57 Å²	57	60.9 Å²	60.9	37%	0.37	31%	0.312	S	S	.	.	S	Bend	trans	-78.1	131.6	176	-12.7	29.3	0	0	0	111	R557 E563 S564	R557-P561 WeakPolarHBondContact O-CD 3.49Å; P561-E563 VanDerWaalsContact C-N 3.34Å; P561-E563 PolarHBondContact O-N 3.13Å; P561-S564 WeakPolarHBondContact CB-OG 3.35Å; P561-S564 WeakPolarHBondContact CD-OG 3.39Å; P561-S564 WeakPolarHBondContact O-CB 3.48Å; P561-S564 PolarHBondContact O-N 3.01Å; P561-S564 PolarHBondContact O-OG 3.23Å
562	A	78	Confident	88.5	Confident	97 Å²	97	65 Å²	65	80%	0.802	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	-56	-40	-171.3	0	0	0	0	0	114.8	S564 G565	A562-S564 PolarHBondContact O-N 2.98Å; A562-S564 VanDerWaalsContact O-N 3.12Å; A562-G565 PolarHBondContact O-N 2.86Å; A562-G565 VanDerWaalsContact O-N 3.09Å
563	E	79.6	Confident	88.6	Confident	150 Å²	150	60.3 Å²	60.3	70%	0.701	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-56.3	-28	176.9	-62.4	169.8	-179	0	0	113.3	P561 G565 L566	P561-E563 VanDerWaalsContact C-N 3.34Å; P561-E563 PolarHBondContact O-N 3.13Å; E563-G565 VanDerWaalsContact C-N 3.27Å; E563-G565 PolarHBondContact O-N 3.18Å; E563-L566 WeakPolarHBondContact O-CB 3.47Å; E563-L566 PolarHBondContact O-N 3.04Å
564	S	81.6	Confident	88.7	Confident	3 Å²	3	58.9 Å²	58.9	2%	0.021	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-67.7	-29	-179	-30.2	0	0	0	0	111.9	L558 P561 A562 L566 N567 F568 R699	L558-S564 WeakPolarHBondContact O-CB 3.09Å; L558-S564 PolarHBondContact O-OG 3.17Å; P561-S564 WeakPolarHBondContact CB-OG 3.35Å; P561-S564 WeakPolarHBondContact CD-OG 3.39Å; P561-S564 WeakPolarHBondContact O-CB 3.48Å; P561-S564 PolarHBondContact O-N 3.01Å; P561-S564 PolarHBondContact O-OG 3.23Å; A562-S564 PolarHBondContact O-N 2.98Å; A562-S564 VanDerWaalsContact O-N 3.12Å; S564-L566 PolarHBondContact O-N 3.09Å; S564-L566 VanDerWaalsContact O-N 3.16Å; S564-N567 PolarHBondContact O-N 2.88Å; S564-F568 PolarHBondContact O-N 3.02Å; S564-R699 PolarHBondContact OG-NH2 3.43Å
565	G	79.5	Confident	88.5	Confident	29 Å²	29	63.4 Å²	63.4	30%	0.299	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-64.3	-16.6	179	0	0	0	0	0	114.2	A562 E563 R613	A562-G565 PolarHBondContact O-N 2.86Å; A562-G565 VanDerWaalsContact O-N 3.09Å; E563-G565 VanDerWaalsContact C-N 3.27Å; E563-G565 PolarHBondContact O-N 3.18Å; G565-R613 WeakPolarHBondContact O-CD 3.44Å; G565-R613 PolarHBondContact O-NH1 2.77Å
566	L	85.3	Confident	88.2	Confident	138 Å²	138	63.4 Å²	63.4	72%	0.723	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-76.6	-28.5	171.5	-59.5	176.3	0	0	0	112.6	E563 S564	E563-L566 WeakPolarHBondContact O-CB 3.47Å; E563-L566 PolarHBondContact O-N 3.04Å; S564-L566 PolarHBondContact O-N 3.09Å; S564-L566 VanDerWaalsContact O-N 3.16Å
567	N	89.8	Confident	87.9	Confident	78 Å²	78	65.8 Å²	65.8	42%	0.417	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-28.1	-174.9	-76	-78	0	0	0	113.1	S564 H614	S564-N567 PolarHBondContact O-N 2.88Å; N567-H614 WeakPolarHBondContact O-CB 3.43Å; N567-H614 PolarHBondContact O-CD2 3.49Å; N567-H614 PolarHBondContact O-N 3.04Å
568	F	95.7	Very high	87.4	Confident	15 Å²	15	65.1 Å²	65.1	7%	0.066	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	150.3	-170.1	-60	-78.2	0	0	0	111.6	L559 S564 H614 L616 R699 V702	L559-F568 HydrophobicContact CD2-CB 3.76Å; S564-F568 PolarHBondContact O-N 3.02Å; F568-H614 WeakPolarHBondContact CA-O 3.47Å; F568-H614 HydrophobicContact CD1-CB 3.68Å; F568-H614 HydrophobicContact CE1-CB 4.03Å; F568-L616 HydrophobicContact CB-CD1 4.23Å; F568-L616 HydrophobicContact CB-CG 4.38Å; F568-L616 HydrophobicContact CD1-CD1 4.17Å; F568-L616 HydrophobicContact CD1-CD2 3.57Å; F568-L616 HydrophobicContact CD1-CG 3.98Å; F568-L616 HydrophobicContact CE1-CD2 4.01Å; F568-L616 HydrophobicContact CG-CD1 4.41Å; F568-R699 HydrophobicContact CE2-CG 4.41Å; F568-R699 HydrophobicContact CZ-CG 4.5Å; F568-V702 HydrophobicContact CE1-CB 4.42Å; F568-V702 HydrophobicContact CE1-CG1 4.03Å; F568-V702 HydrophobicContact CE1-CG2 4.45Å; F568-V702 HydrophobicContact CZ-CG1 4.49Å
569	N	95.3	Very high	86.9	Confident	47 Å²	47	69.5 Å²	69.5	25%	0.251	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	171.9	161.4	-164.6	19.9	0	0	0	109	V608 R613 H614 C615 L616	N569-V608 HydrophobicContact CB-CG1 3.79Å; N569-V608 HydrophobicContact CB-CG2 4.27Å; N569-R613 PolarHBondContact ND2-NH2 2.84Å; N569-H614 PolarHBondContact N-O 3.21Å; N569-H614 VanDerWaalsContact O-O 3.11Å; N569-C615 CarbonylContact O-C 3.59Å; N569-C615 WeakPolarHBondContact O-CA 3.08Å; N569-L616 PolarHBondContact O-N 3.37Å
570	T	94.8	Very high	86.4	Confident	35 Å²	35	69.9 Å²	69.9	22%	0.215	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	156.8	171.9	-176.8	0	0	0	0	110.8	I555 L559 L616	I555-T570 HydrophobicContact CG2-CG2 4.33Å; L559-T570 HydrophobicContact CD1-CG2 3.68Å; T570-L616 PolarHBondContact OG1-O 3.37Å
571	C	92.7	Very high	85.9	Confident	4 Å²	4	67 Å²	67	3%	0.027	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-98.6	118.2	160	-65.7	0	0	0	0	108.2	I600 S604 C615	C571-I600 HydrophobicContact CB-CD1 4.2Å; C571-I600 HydrophobicContact CB-CG1 4.34Å; C571-I600 HydrophobicContact CB-CG2 3.54Å; C571-S604 PolarHBondContact SG-O 3.46Å; C571-S604 VanDerWaalsContact SG-O 3.33Å; C571-C615 PolarHBondContact SG-SG 2.87Å
572	P	86.3	Confident	85.4	Confident	91 Å²	91	73.6 Å²	73.6	59%	0.591	42%	0.419	S	S	*	.	P	Polyproline II helix	trans	-65.5	137	173.9	28.7	-33.4	0	0	0	109.9	E574	P572-E574 PolarHBondContact O-N 3.18Å
573	P	88.6	Confident	85.7	Confident	33 Å²	33	72.5 Å²	72.5	21%	0.214	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-64.3	128.8	172.7	-23.3	34.5	0	0	0	112.1	L589 L598 E618	P573-L589 HydrophobicContact CB-CD1 3.92Å; P573-L589 HydrophobicContact CB-CD2 3.9Å; P573-L589 HydrophobicContact CG-CD1 4.11Å; P573-L589 HydrophobicContact CG-CD2 3.62Å; P573-L598 HydrophobicContact CB-CB 3.98Å; P573-L598 HydrophobicContact CB-CD1 4.41Å; P573-E618 HydrophobicContact CG-CB 4.44Å
574	E	89	Confident	86	Confident	81 Å²	81	73.5 Å²	73.5	38%	0.379	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	152.1	178.9	-65.2	-174.7	163.1	0	0	111.4	P572 I576 L598 G599 R601	P572-E574 PolarHBondContact O-N 3.18Å; E574-I576 PolarHBondContact O-N 3.46Å; E574-L598 CarbonylContact O-C 3.54Å; E574-L598 WeakPolarHBondContact O-CA 3.42Å; E574-G599 PolarHBondContact N-O 2.84Å; E574-G599 PolarHBondContact O-N 3.49Å; E574-R601 IonicContact OE2-NE 2.69Å; E574-R601 PolarHBondContact OE2-NE 3.23Å
575	P	87.6	Confident	86.3	Confident	95 Å²	95	79.2 Å²	79.2	62%	0.617	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.7	125.5	172.4	29.2	-33.8	0	0	0	111.6	L598	P575-L598 HydrophobicContact CB-CD2 4.42Å
576	I	85.6	Confident	86.8	Confident	10 Å²	10	78.6 Å²	78.6	5%	0.051	41%	0.413	C	S	.	.			trans	-105.1	127.6	-175.3	-52.1	-56	0	0	0	110.5	E574 E580 Q581 I586 L588 A597	E574-I576 PolarHBondContact O-N 3.46Å; I576-E580 HydrophobicContact CG2-CB 3.79Å; I576-Q581 HydrophobicContact CG2-CG 4.04Å; I576-I586 HydrophobicContact CD1-CD1 4.47Å; I576-I586 HydrophobicContact CD1-CG2 3.73Å; I576-I586 HydrophobicContact CG1-CG2 3.76Å; I576-I586 HydrophobicContact CG2-CD1 3.97Å; I576-I586 HydrophobicContact CG2-CG2 4.04Å; I576-L588 HydrophobicContact CB-CD2 4.14Å; I576-L588 HydrophobicContact CG1-CD2 3.98Å; I576-L588 HydrophobicContact CG2-CD2 4.24Å; I576-A597 PolarHBondContact N-O 3.14Å
577	Q	84.6	Confident	87	Confident	133 Å²	133	72.3 Å²	72.3	62%	0.621	38%	0.38	S	S	*	.			trans	-69.3	148	179.2	-61.1	-169.2	41	0	0	111.6	S579 E580 Q581	Q577-S579 PolarHBondContact O-N 3.39Å; Q577-E580 HydrophobicContact CB-CG 4.31Å; Q577-E580 PolarHBondContact N-OE2 3.12Å; Q577-E580 WeakPolarHBondContact O-CA 3.43Å; Q577-E580 WeakPolarHBondContact O-CB 3.28Å; Q577-E580 PolarHBondContact O-N 3.43Å; Q577-Q581 PolarHBondContact O-N 3.33Å
578	A	81.1	Confident	86.9	Confident	80 Å²	80	72 Å²	72	66%	0.661	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.4	-178.1	0	0	0	0	0	114.5
579	S	80.8	Confident	86.3	Confident	95 Å²	95	72.7 Å²	72.7	66%	0.664	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-35.4	170.1	43.6	0	0	0	0	113.2	Q577	Q577-S579 PolarHBondContact O-N 3.39Å
580	E	81.5	Confident	85	Confident	57 Å²	57	77.2 Å²	77.2	27%	0.266	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-20.2	-176.2	-60.3	-173.9	107.4	0	0	113.3	I576 Q577 K582 D583 I586 R601	I576-E580 HydrophobicContact CG2-CB 3.79Å; Q577-E580 HydrophobicContact CB-CG 4.31Å; Q577-E580 PolarHBondContact N-OE2 3.12Å; Q577-E580 WeakPolarHBondContact O-CA 3.43Å; Q577-E580 WeakPolarHBondContact O-CB 3.28Å; Q577-E580 PolarHBondContact O-N 3.43Å; E580-K582 PolarHBondContact O-N 2.66Å; E580-D583 WeakPolarHBondContact O-CB 3.49Å; E580-D583 PolarHBondContact O-N 2.92Å; E580-I586 HydrophobicContact CB-CD1 3.78Å; E580-R601 IonicContact OE1-CZ 3.98Å; E580-R601 IonicContact OE1-NH1 3.75Å; E580-R601 PolarHBondContact OE1-NH1 3.49Å; E580-R601 IonicContact OE1-NH2 3.01Å; E580-R601 PolarHBondContact OE1-NH2 3.04Å; E580-R601 IonicContact OE2-CZ 3.97Å; E580-R601 IonicContact OE2-NH1 2.75Å; E580-R601 IonicContact OE2-NH2 2.74Å; E580-R601 PolarHBondContact OE2-NH2 3.06Å
581	Q	77.6	Confident	83.2	Confident	79 Å²	79	77.8 Å²	77.8	37%	0.369	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-7.3	-177.8	-72.1	173.2	13.7	0	0	115.5	I576 Q577 L588 A597	I576-Q581 HydrophobicContact CG2-CG 4.04Å; Q577-Q581 PolarHBondContact O-N 3.33Å; Q581-L588 HydrophobicContact CB-CD1 4.37Å; Q581-L588 HydrophobicContact CG-CD1 4.37Å; Q581-L588 HydrophobicContact CG-CD2 4.46Å; Q581-A597 HydrophobicContact CG-CB 4.45Å; Q581-A597 VanDerWaalsContact NE2-CB 3.33Å
582	K	79	Confident	81	Confident	195 Å²	195	84.5 Å²	84.5	85%	0.848	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-2.9	174.7	-64.2	-177.8	-177.8	175.9	0	113.8	E580	E580-K582 PolarHBondContact O-N 2.66Å
583	D	84.7	Confident	79.5	Confident	75 Å²	75	83.2 Å²	83.2	40%	0.401	45%	0.45	S	S	.	.			trans	-73.8	127.9	175.4	-168.6	-12	0	0	0	110.6	E580 R585 I586	E580-D583 WeakPolarHBondContact O-CB 3.49Å; E580-D583 PolarHBondContact O-N 2.92Å; D583-R585 PolarHBondContact O-N 2.96Å; D583-R585 WeakPolarHBondContact OD1-CB 3.47Å; D583-R585 WeakPolarHBondContact OD1-CG 3.49Å; D583-R585 PolarHBondContact OD1-N 3.26Å; D583-I586 HydrophobicContact CB-CD1 4.25Å; D583-I586 HydrophobicContact CB-CG1 4.23Å; D583-I586 PolarHBondContact O-N 3.42Å
584	K	85.4	Confident	78	Confident	170 Å²	170	87.7 Å²	87.7	74%	0.739	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-10	176.4	-60.1	-178.2	179.4	-177.5	0	113	Q630	K584-Q630 VanDerWaalsContact C-NE2 3.33Å; K584-Q630 PolarHBondContact O-NE2 2.96Å
585	R	87.9	Confident	76.5	Confident	123 Å²	123	92.4 Å²	92.4	46%	0.464	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.8	174.9	-62.3	177.8	176.4	-131.8	2.6	113.8	D583 L602 E603	D583-R585 PolarHBondContact O-N 2.96Å; D583-R585 WeakPolarHBondContact OD1-CB 3.47Å; D583-R585 WeakPolarHBondContact OD1-CG 3.49Å; D583-R585 PolarHBondContact OD1-N 3.26Å; R585-L602 HydrophobicContact CB-CB 3.98Å; R585-L602 HydrophobicContact CB-CD2 4.35Å; R585-L602 HydrophobicContact CG-CD2 4Å; R585-L602 VanDerWaalsContact O-CB 3.31Å; R585-L602 WeakPolarHBondContact O-CB 3.35Å; R585-L602 PolarHBondContact O-N 3.01Å; R585-E603 IonicContact CZ-OE1 3.32Å; R585-E603 IonicContact NH1-OE1 3.78Å; R585-E603 PolarHBondContact NH1-OE1 2.86Å
586	I	89.2	Confident	75.6	Confident	16 Å²	16	94.5 Å²	94.5	8%	0.082	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	122.5	-176.9	-55.2	-178.7	0	0	0	109.6	I576 E580 D583 L588 R601	I576-I586 HydrophobicContact CD1-CD1 4.47Å; I576-I586 HydrophobicContact CD1-CG2 3.73Å; I576-I586 HydrophobicContact CG1-CG2 3.76Å; I576-I586 HydrophobicContact CG2-CD1 3.97Å; I576-I586 HydrophobicContact CG2-CG2 4.04Å; E580-I586 HydrophobicContact CB-CD1 3.78Å; D583-I586 HydrophobicContact CB-CD1 4.25Å; D583-I586 HydrophobicContact CB-CG1 4.23Å; D583-I586 PolarHBondContact O-N 3.42Å; I586-L588 HydrophobicContact CG2-CD2 4.08Å; I586-R601 HydrophobicContact CG1-CG 4.43Å
587	F	90.3	Very high	75.4	Confident	7 Å²	7	94.8 Å²	94.8	3%	0.031	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	99.9	179.7	-51.8	-74	0	0	0	109	G599 I600 L602 I605 L619 A626 L627 Q630	F587-G599 CarbonylContact O-C 3.52Å; F587-G599 WeakPolarHBondContact O-CA 3.45Å; F587-I600 WeakPolarHBondContact CD2-O 3.41Å; F587-I600 PolarHBondContact N-O 3.07Å; F587-I600 PolarHBondContact O-N 2.84Å; F587-L602 HydrophobicContact CE2-CB 4.14Å; F587-L602 HydrophobicContact CE2-CD1 4.12Å; F587-L602 HydrophobicContact CZ-CD1 4.22Å; F587-I605 HydrophobicContact CD2-CD1 3.75Å; F587-I605 HydrophobicContact CE2-CD1 3.81Å; F587-L619 HydrophobicContact CB-CD1 3.68Å; F587-L619 HydrophobicContact CB-CD2 4.08Å; F587-L619 HydrophobicContact CG-CD1 4.3Å; F587-A626 HydrophobicContact CD1-CB 3.93Å; F587-A626 HydrophobicContact CE1-CB 3.72Å; F587-L627 HydrophobicContact CD1-CD2 4.24Å; F587-L627 HydrophobicContact CD1-CG 4.15Å; F587-L627 HydrophobicContact CD2-CD2 4.14Å; F587-L627 HydrophobicContact CE1-CD2 3.8Å; F587-L627 HydrophobicContact CE1-CG 3.83Å; F587-L627 HydrophobicContact CE2-CD2 3.68Å; F587-L627 HydrophobicContact CG-CD2 4.4Å; F587-L627 HydrophobicContact CZ-CD2 3.49Å; F587-L627 VanDerWaalsContact CZ-CD2 3.49Å; F587-L627 HydrophobicContact CZ-CG 4.06Å; F587-Q630 HydrophobicContact CZ-CG 4.11Å
588	L	87.4	Confident	75.5	Confident	72 Å²	72	91.1 Å²	91.1	38%	0.377	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	151.6	-179.6	-60	177.1	0	0	0	111.9	I576 Q581 I586 L598	I576-L588 HydrophobicContact CB-CD2 4.14Å; I576-L588 HydrophobicContact CG1-CD2 3.98Å; I576-L588 HydrophobicContact CG2-CD2 4.24Å; Q581-L588 HydrophobicContact CB-CD1 4.37Å; Q581-L588 HydrophobicContact CG-CD1 4.37Å; Q581-L588 HydrophobicContact CG-CD2 4.46Å; I586-L588 HydrophobicContact CG2-CD2 4.08Å; L588-L598 WeakPolarHBondContact CA-O 3.4Å
589	L	83.4	Confident	75.9	Confident	28 Å²	28	87.3 Å²	87.3	15%	0.147	46%	0.46	C	S	.	.			trans	-93.9	146.4	171.1	-79.5	72.9	0	0	0	110.3	P573 S591 L598 I600 E618 L619	P573-L589 HydrophobicContact CB-CD1 3.92Å; P573-L589 HydrophobicContact CB-CD2 3.9Å; P573-L589 HydrophobicContact CG-CD1 4.11Å; P573-L589 HydrophobicContact CG-CD2 3.62Å; L589-S591 PolarHBondContact O-N 3.42Å; L589-L598 PolarHBondContact N-O 2.73Å; L589-I600 HydrophobicContact CD1-CG1 4.47Å; L589-E618 HydrophobicContact CD2-CG 4.31Å; L589-E618 WeakPolarHBondContact CD2-O 3.43Å; L589-E618 VanDerWaalsContact CG-O 3.31Å; L589-E618 WeakPolarHBondContact CG-O 3.46Å; L589-L619 HydrophobicContact CD1-CD2 3.62Å; L589-L619 HydrophobicContact CG-CD2 4.16Å
590	D	67.3	Low	76.5	Confident	143 Å²	143	82.9 Å²	82.9	77%	0.765	43%	0.428	S	S	*	.			trans	-73.7	75.3	170.6	-72.7	-52.5	0	0	0	110.7
591	S	58.2	Low	77.1	Confident	47 Å²	47	83.1 Å²	83.1	33%	0.329	43%	0.427	S	S	.	.			trans	-90	128.3	177.8	56.1	0	0	0	0	112.2	L589 S593	L589-S591 PolarHBondContact O-N 3.42Å; S591-S593 PolarHBondContact O-N 3.13Å
592	C	46.5	Very low	77.9	Confident	144 Å²	144	79.7 Å²	79.7	97%	0.973	41%	0.411	S	S	*	.	S	Bend	trans	-65.4	1.1	-177	-61.6	0	0	0	0	116.5
593	S	53.9	Low	78.6	Confident	65 Å²	65	73.8 Å²	73.8	46%	0.455	39%	0.386	S	S	.	.			trans	-125.7	125.9	178.3	46.5	0	0	0	0	111.3	S591 E595	S591-S593 PolarHBondContact O-N 3.13Å; S593-E595 PolarHBondContact O-N 3.35Å
594	P	56.5	Low	79.1	Confident	126 Å²	126	71.8 Å²	71.8	82%	0.818	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-10	-176.8	31.6	-36.5	0	0	0	113.9
595	E	58.7	Low	79.6	Confident	180 Å²	180	63.7 Å²	63.7	84%	0.841	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-19	-172.7	-59.8	-177.9	160.9	0	0	113.7	S593	S593-E595 PolarHBondContact O-N 3.35Å
596	Q	68	Low	80	Confident	139 Å²	139	62.2 Å²	62.2	65%	0.65	34%	0.341	S	S	*	.	S	Bend	trans	-143	80.3	178.6	-67.4	-173.4	0.9	0	0	110.4	L598	Q596-L598 PolarHBondContact O-N 3.45Å; Q596-L598 VanDerWaalsContact O-N 3.15Å
597	A	80.5	Confident	80.3	Confident	17 Å²	17	66 Å²	66	14%	0.14	36%	0.361	C	S	.	.			trans	-65.3	112.2	171.6	0	0	0	0	0	109.9	I576 Q581	I576-A597 PolarHBondContact N-O 3.14Å; Q581-A597 HydrophobicContact CG-CB 4.45Å; Q581-A597 VanDerWaalsContact NE2-CB 3.33Å
598	L	87.9	Confident	80.6	Confident	56 Å²	56	65.9 Å²	65.9	29%	0.293	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	147.7	172.8	-65.4	176.4	0	0	0	110.2	P573 E574 P575 L588 L589 Q596	P573-L598 HydrophobicContact CB-CB 3.98Å; P573-L598 HydrophobicContact CB-CD1 4.41Å; E574-L598 CarbonylContact O-C 3.54Å; E574-L598 WeakPolarHBondContact O-CA 3.42Å; P575-L598 HydrophobicContact CB-CD2 4.42Å; L588-L598 WeakPolarHBondContact CA-O 3.4Å; L589-L598 PolarHBondContact N-O 2.73Å; Q596-L598 PolarHBondContact O-N 3.45Å; Q596-L598 VanDerWaalsContact O-N 3.15Å
599	G	89.7	Confident	81	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	167.6	176.7	0	0	0	0	0	113.5	E574 F587	E574-G599 PolarHBondContact N-O 2.84Å; E574-G599 PolarHBondContact O-N 3.49Å; F587-G599 CarbonylContact O-C 3.52Å; F587-G599 WeakPolarHBondContact O-CA 3.45Å
600	I	93	Very high	81.5	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.01	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132	175.5	-63.1	173.8	0	0	0	108.1	C571 F587 L589 I605 L617 L619	C571-I600 HydrophobicContact CB-CD1 4.2Å; C571-I600 HydrophobicContact CB-CG1 4.34Å; C571-I600 HydrophobicContact CB-CG2 3.54Å; F587-I600 WeakPolarHBondContact CD2-O 3.41Å; F587-I600 PolarHBondContact N-O 3.07Å; F587-I600 PolarHBondContact O-N 2.84Å; L589-I600 HydrophobicContact CD1-CG1 4.47Å; I600-I605 HydrophobicContact CG2-CD1 3.86Å; I600-I605 HydrophobicContact CG2-CG1 3.65Å; I600-L617 HydrophobicContact CD1-CD2 3.81Å; I600-L617 HydrophobicContact CG2-CD2 4.31Å; I600-L619 HydrophobicContact CD1-CD1 4.45Å; I600-L619 HydrophobicContact CD1-CD2 4.14Å; I600-L619 HydrophobicContact CD1-CG 4.08Å; I600-L619 HydrophobicContact CG1-CD2 4.5Å
601	R	93.4	Very high	82.9	Confident	62 Å²	62	64.9 Å²	64.9	23%	0.234	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	144.7	178.5	-59.1	-177.8	-175.5	-97.9	-4.3	110.9	E574 E580 I586 E603 S604 I605	E574-R601 IonicContact OE2-NE 2.69Å; E574-R601 PolarHBondContact OE2-NE 3.23Å; E580-R601 IonicContact OE1-CZ 3.98Å; E580-R601 IonicContact OE1-NH1 3.75Å; E580-R601 PolarHBondContact OE1-NH1 3.49Å; E580-R601 IonicContact OE1-NH2 3.01Å; E580-R601 PolarHBondContact OE1-NH2 3.04Å; E580-R601 IonicContact OE2-CZ 3.97Å; E580-R601 IonicContact OE2-NH1 2.75Å; E580-R601 IonicContact OE2-NH2 2.74Å; E580-R601 PolarHBondContact OE2-NH2 3.06Å; I586-R601 HydrophobicContact CG1-CG 4.43Å; R601-E603 PolarHBondContact O-N 2.88Å; R601-S604 WeakPolarHBondContact O-CB 3.42Å; R601-S604 PolarHBondContact O-N 3.19Å; R601-I605 PolarHBondContact O-N 2.6Å
602	L	94.4	Very high	84.6	Confident	6 Å²	6	64.6 Å²	64.6	3%	0.031	37%	0.365	C	S	.	.	H	α-helix	trans	-55.2	-41.1	179.2	177.3	63.2	0	0	0	112.2	R585 F587 S604 I605 Q606 Q630 I632	R585-L602 HydrophobicContact CB-CB 3.98Å; R585-L602 HydrophobicContact CB-CD2 4.35Å; R585-L602 HydrophobicContact CG-CD2 4Å; R585-L602 VanDerWaalsContact O-CB 3.31Å; R585-L602 WeakPolarHBondContact O-CB 3.35Å; R585-L602 PolarHBondContact O-N 3.01Å; F587-L602 HydrophobicContact CE2-CB 4.14Å; F587-L602 HydrophobicContact CE2-CD1 4.12Å; F587-L602 HydrophobicContact CZ-CD1 4.22Å; L602-S604 PolarHBondContact O-N 3.37Å; L602-I605 PolarHBondContact O-N 3.09Å; L602-Q606 WeakPolarHBondContact O-CG 3.39Å; L602-Q606 PolarHBondContact O-N 3.46Å; L602-Q630 HydrophobicContact CD1-CB 3.9Å; L602-Q630 HydrophobicContact CD1-CG 4.21Å; L602-Q630 HydrophobicContact CD2-CB 4.19Å; L602-Q630 HydrophobicContact CD2-CG 4.07Å; L602-I632 HydrophobicContact CD1-CD1 3.42Å; L602-I632 VanDerWaalsContact CD1-CD1 3.42Å; L602-I632 HydrophobicContact CD1-CG1 4.41Å
603	E	94	Very high	87	Confident	72 Å²	72	60.4 Å²	60.4	34%	0.336	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-45.9	179.5	-66.8	69.9	-158.1	0	0	110.9	R585 R601 I605 Q606 D607	R585-E603 IonicContact CZ-OE1 3.32Å; R585-E603 IonicContact NH1-OE1 3.78Å; R585-E603 PolarHBondContact NH1-OE1 2.86Å; R601-E603 PolarHBondContact O-N 2.88Å; E603-I605 VanDerWaalsContact C-N 3.3Å; E603-I605 PolarHBondContact O-N 3.45Å; E603-Q606 WeakPolarHBondContact O-CB 3.31Å; E603-Q606 PolarHBondContact O-N 3.22Å; E603-Q606 VanDerWaalsContact O-N 3.09Å; E603-D607 PolarHBondContact O-N 3.07Å
604	S	95.2	Very high	89	Confident	32 Å²	32	57.5 Å²	57.5	22%	0.224	31%	0.308	C	S	.	.	H	α-helix	trans	-60.5	-38	176.7	-43.9	0	0	0	0	112.7	C571 R601 L602 V608	C571-S604 PolarHBondContact SG-O 3.46Å; C571-S604 VanDerWaalsContact SG-O 3.33Å; R601-S604 WeakPolarHBondContact O-CB 3.42Å; R601-S604 PolarHBondContact O-N 3.19Å; L602-S604 PolarHBondContact O-N 3.37Å; S604-V608 PolarHBondContact O-N 2.95Å
605	I	96.1	Very high	90.9	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-67.8	-43	176.1	-55.5	179.5	0	0	0	109.7	P542 F587 I600 R601 L602 E603 D607 V608 I609 C615 L617 L627 I632	P542-I605 HydrophobicContact CG-CG2 3.73Å; F587-I605 HydrophobicContact CD2-CD1 3.75Å; F587-I605 HydrophobicContact CE2-CD1 3.81Å; I600-I605 HydrophobicContact CG2-CD1 3.86Å; I600-I605 HydrophobicContact CG2-CG1 3.65Å; R601-I605 PolarHBondContact O-N 2.6Å; L602-I605 PolarHBondContact O-N 3.09Å; E603-I605 VanDerWaalsContact C-N 3.3Å; E603-I605 PolarHBondContact O-N 3.45Å; I605-D607 VanDerWaalsContact C-N 3.35Å; I605-D607 PolarHBondContact O-N 3.03Å; I605-V608 PolarHBondContact O-N 3Å; I605-I609 HydrophobicContact CG2-CD1 3.91Å; I605-I609 HydrophobicContact CG2-CG1 4.48Å; I605-I609 VanDerWaalsContact O-CG1 3.25Å; I605-I609 WeakPolarHBondContact O-CG1 3.49Å; I605-I609 PolarHBondContact O-N 3.11Å; I605-C615 HydrophobicContact CG2-CB 4.34Å; I605-L617 HydrophobicContact CD1-CD1 4.23Å; I605-L617 HydrophobicContact CD1-CD2 3.96Å; I605-L617 HydrophobicContact CG1-CD2 4.09Å; I605-L627 HydrophobicContact CD1-CD2 3.92Å; I605-I632 HydrophobicContact CG2-CD1 4.07Å
606	Q	95.8	Very high	92.8	Very high	93 Å²	93	42.9 Å²	42.9	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-63.2	-38.5	177.1	-70.4	176.3	-2	0	0	112.2	L602 E603 V608 I609 S610	L602-Q606 WeakPolarHBondContact O-CG 3.39Å; L602-Q606 PolarHBondContact O-N 3.46Å; E603-Q606 WeakPolarHBondContact O-CB 3.31Å; E603-Q606 PolarHBondContact O-N 3.22Å; E603-Q606 VanDerWaalsContact O-N 3.09Å; Q606-V608 PolarHBondContact O-N 3.14Å; Q606-I609 PolarHBondContact O-N 3.34Å; Q606-S610 WeakPolarHBondContact O-CB 3.24Å; Q606-S610 PolarHBondContact O-N 2.99Å
607	D	95.9	Very high	94.1	Very high	94 Å²	94	36.3 Å²	36.3	50%	0.503	20%	0.198	S	C	.	.	H	α-helix	trans	-58.1	-48.3	174.1	-74	-28.8	0	0	0	111.5	E603 I605 I609 S610 Q611	E603-D607 PolarHBondContact O-N 3.07Å; I605-D607 VanDerWaalsContact C-N 3.35Å; I605-D607 PolarHBondContact O-N 3.03Å; D607-I609 VanDerWaalsContact C-N 3.34Å; D607-I609 PolarHBondContact O-N 3.38Å; D607-S610 PolarHBondContact O-N 2.87Å; D607-S610 PolarHBondContact O-OG 3.22Å; D607-Q611 VanDerWaalsContact O-CG 3.28Å; D607-Q611 WeakPolarHBondContact O-CG 3.34Å; D607-Q611 PolarHBondContact O-N 3.14Å; D607-Q611 PolarHBondContact O-NE2 3.26Å
608	V	95.9	Very high	94.6	Very high	6 Å²	6	37.3 Å²	37.3	4%	0.036	20%	0.2	C	C	.	.	H	α-helix	trans	-63.4	-39.4	177.5	175	0	0	0	0	112.1	N569 S604 I605 Q606 Q611 R613 C615	N569-V608 HydrophobicContact CB-CG1 3.79Å; N569-V608 HydrophobicContact CB-CG2 4.27Å; S604-V608 PolarHBondContact O-N 2.95Å; I605-V608 PolarHBondContact O-N 3Å; Q606-V608 PolarHBondContact O-N 3.14Å; V608-Q611 PolarHBondContact O-N 3.44Å; V608-R613 HydrophobicContact CG1-CB 4.22Å; V608-R613 PolarHBondContact O-N 2.75Å; V608-C615 HydrophobicContact CB-CB 4.01Å; V608-C615 HydrophobicContact CG1-CB 3.6Å
609	I	95.7	Very high	94.8	Very high	25 Å²	25	34.7 Å²	34.7	13%	0.128	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-41.3	176.8	-66.3	170.9	0	0	0	110.9	T539 P542 I605 Q606 D607 Q611 G612 I632	T539-I609 HydrophobicContact CG2-CG2 4.13Å; P542-I609 HydrophobicContact CG-CD1 3.89Å; P542-I609 HydrophobicContact CG-CG1 4.41Å; I605-I609 HydrophobicContact CG2-CD1 3.91Å; I605-I609 HydrophobicContact CG2-CG1 4.48Å; I605-I609 VanDerWaalsContact O-CG1 3.25Å; I605-I609 WeakPolarHBondContact O-CG1 3.49Å; I605-I609 PolarHBondContact O-N 3.11Å; Q606-I609 PolarHBondContact O-N 3.34Å; D607-I609 VanDerWaalsContact C-N 3.34Å; D607-I609 PolarHBondContact O-N 3.38Å; I609-Q611 PolarHBondContact O-N 3.04Å; I609-G612 PolarHBondContact O-N 3.44Å; I609-I632 HydrophobicContact CD1-CD1 4.47Å
610	S	95.5	Very high	94.8	Very high	95 Å²	95	35.3 Å²	35.3	66%	0.664	19%	0.192	S	C	*	.	H	α-helix	trans	-63.7	-30.6	179.4	77.2	0	0	0	0	112.9	Q606 D607 G612	Q606-S610 WeakPolarHBondContact O-CB 3.24Å; Q606-S610 PolarHBondContact O-N 2.99Å; D607-S610 PolarHBondContact O-N 2.87Å; D607-S610 PolarHBondContact O-OG 3.22Å; S610-G612 PolarHBondContact O-N 2.98Å
611	Q	95.3	Very high	94.7	Very high	101 Å²	101	35.4 Å²	35.4	47%	0.472	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	2.2	173.3	-64.2	159.7	22.5	0	0	113.2	D607 V608 I609 R613	D607-Q611 VanDerWaalsContact O-CG 3.28Å; D607-Q611 WeakPolarHBondContact O-CG 3.34Å; D607-Q611 PolarHBondContact O-N 3.14Å; D607-Q611 PolarHBondContact O-NE2 3.26Å; V608-Q611 PolarHBondContact O-N 3.44Å; I609-Q611 PolarHBondContact O-N 3.04Å; Q611-R613 VanDerWaalsContact C-N 3.34Å; Q611-R613 PolarHBondContact O-N 3.27Å
612	G	95.1	Very high	94.5	Very high	41 Å²	41	36.2 Å²	36.2	42%	0.423	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	23.3	179.4	0	0	0	0	0	114.2	K540 I609 S610	K540-G612 WeakPolarHBondContact CG-O 3.39Å; I609-G612 PolarHBondContact O-N 3.44Å; S610-G612 PolarHBondContact O-N 2.98Å
613	R	95.9	Very high	94.3	Very high	57 Å²	57	36.6 Å²	36.6	22%	0.215	21%	0.209	C	C	.	.			trans	-116.9	149.3	-175.6	-62.2	-167.5	-70.6	168	-1.1	112.7	K540 G565 N569 V608 Q611 C615	K540-R613 VanDerWaalsContact CB-O 3.3Å; K540-R613 WeakPolarHBondContact CB-O 3.5Å; G565-R613 WeakPolarHBondContact O-CD 3.44Å; G565-R613 PolarHBondContact O-NH1 2.77Å; N569-R613 PolarHBondContact ND2-NH2 2.84Å; V608-R613 HydrophobicContact CG1-CB 4.22Å; V608-R613 PolarHBondContact O-N 2.75Å; Q611-R613 VanDerWaalsContact C-N 3.34Å; Q611-R613 PolarHBondContact O-N 3.27Å; R613-C615 PolarHBondContact O-N 3.1Å
614	H	97	Very high	94.3	Very high	3 Å²	3	33.1 Å²	33.1	1%	0.014	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.3	171.7	-70.5	-79.3	0	0	0	110	K540 R541 V543 N567 F568 N569 L616 Q706	K540-H614 PolarHBondContact NZ-NE2 3.14Å; R541-H614 PolarHBondContact O-ND1 2.8Å; V543-H614 HydrophobicContact CG2-CB 4.32Å; N567-H614 WeakPolarHBondContact O-CB 3.43Å; N567-H614 PolarHBondContact O-CD2 3.49Å; N567-H614 PolarHBondContact O-N 3.04Å; F568-H614 WeakPolarHBondContact CA-O 3.47Å; F568-H614 HydrophobicContact CD1-CB 3.68Å; F568-H614 HydrophobicContact CE1-CB 4.03Å; N569-H614 PolarHBondContact N-O 3.21Å; N569-H614 VanDerWaalsContact O-O 3.11Å; H614-L616 PolarHBondContact O-N 3.25Å; H614-Q706 PolarHBondContact CE1-OE1 3.34Å
615	C	96.8	Very high	94.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	108.3	172.5	-167.9	0	0	0	0	110.1	P542 V543 N569 C571 I605 V608 R613	P542-C615 CarbonylContact C-O 3.59Å; P542-C615 WeakPolarHBondContact CA-O 3.41Å; P542-C615 HydrophobicContact CB-CB 4.09Å; P542-C615 WeakPolarHBondContact CB-O 3.16Å; P542-C615 HydrophobicContact CG-CB 4.25Å; V543-C615 PolarHBondContact N-O 3.47Å; N569-C615 CarbonylContact O-C 3.59Å; N569-C615 WeakPolarHBondContact O-CA 3.08Å; C571-C615 PolarHBondContact SG-SG 2.87Å; I605-C615 HydrophobicContact CG2-CB 4.34Å; V608-C615 HydrophobicContact CB-CB 4.01Å; V608-C615 HydrophobicContact CG1-CB 3.6Å; R613-C615 PolarHBondContact O-N 3.1Å
616	L	96.9	Very high	94	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	128.2	171.2	-51.3	179.5	0	0	0	108.9	V543 F545 I555 L558 L559 F568 N569 T570 H614	V543-L616 HydrophobicContact CB-CD2 3.73Å; V543-L616 HydrophobicContact CG1-CD2 4.33Å; V543-L616 HydrophobicContact CG2-CD2 3.9Å; F545-L616 HydrophobicContact CE2-CD2 4.23Å; F545-L616 HydrophobicContact CZ-CD2 4.14Å; I555-L616 HydrophobicContact CD1-CB 4.36Å; I555-L616 HydrophobicContact CG1-CB 3.86Å; I555-L616 HydrophobicContact CG1-CD1 4.42Å; I555-L616 HydrophobicContact CG2-CB 4.35Å; I555-L616 HydrophobicContact CG2-CD1 4.45Å; L558-L616 HydrophobicContact CB-CD1 3.92Å; L558-L616 HydrophobicContact CD1-CD1 4.05Å; L559-L616 HydrophobicContact CD2-CD1 4.3Å; L559-L616 HydrophobicContact CG-CD1 4.28Å; F568-L616 HydrophobicContact CB-CD1 4.23Å; F568-L616 HydrophobicContact CB-CG 4.38Å; F568-L616 HydrophobicContact CD1-CD1 4.17Å; F568-L616 HydrophobicContact CD1-CD2 3.57Å; F568-L616 HydrophobicContact CD1-CG 3.98Å; F568-L616 HydrophobicContact CE1-CD2 4.01Å; F568-L616 HydrophobicContact CG-CD1 4.41Å; N569-L616 PolarHBondContact O-N 3.37Å; T570-L616 PolarHBondContact OG1-O 3.37Å; H614-L616 PolarHBondContact O-N 3.25Å
617	L	95.2	Very high	93.9	Very high	0 Å²	0	32 Å²	32	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.8	-170.8	-65.8	170.9	0	0	0	111.9	P542 V543 I544 I600 I605 L619 L627	P542-L617 HydrophobicContact CB-CD1 3.61Å; P542-L617 HydrophobicContact CB-CG 4.29Å; V543-L617 PolarHBondContact O-N 2.91Å; I544-L617 HydrophobicContact CD1-CD1 4.5Å; I544-L617 HydrophobicContact CG1-CB 4.14Å; I544-L617 HydrophobicContact CG1-CD1 4.27Å; I600-L617 HydrophobicContact CD1-CD2 3.81Å; I600-L617 HydrophobicContact CG2-CD2 4.31Å; I605-L617 HydrophobicContact CD1-CD1 4.23Å; I605-L617 HydrophobicContact CD1-CD2 3.96Å; I605-L617 HydrophobicContact CG1-CD2 4.09Å; L617-L619 HydrophobicContact CB-CB 4.34Å; L617-L619 HydrophobicContact CB-CD1 4.16Å; L617-L619 HydrophobicContact CB-CG 4.11Å; L617-L619 HydrophobicContact CD1-CD1 4.12Å; L617-L619 HydrophobicContact CD2-CD1 4.4Å; L617-L619 HydrophobicContact CG-CD1 4.46Å; L617-L619 PolarHBondContact O-N 3Å; L617-L627 HydrophobicContact CD1-CD1 4.24Å
618	E	92.1	Very high	93.8	Very high	39 Å²	39	27.8 Å²	27.8	18%	0.182	17%	0.168	C	C	.	.			trans	-80.1	52.2	169.9	-164	174.9	169.7	0	0	109.9	R552 I555 P573 L589	R552-E618 HydrophobicContact CB-CG 4.17Å; R552-E618 WeakPolarHBondContact CB-OE1 3.33Å; R552-E618 VanDerWaalsContact CD-OE1 3.27Å; R552-E618 WeakPolarHBondContact CD-OE1 3.22Å; R552-E618 WeakPolarHBondContact CG-OE1 3.46Å; R552-E618 IonicContact CZ-OE1 3.73Å; R552-E618 IonicContact NE-OE1 2.83Å; R552-E618 IonicContact NH1-OE1 3.96Å; R552-E618 PolarHBondContact NH1-OE1 3.44Å; R552-E618 IonicContact NH1-OE2 2.79Å; R552-E618 PolarHBondContact NH1-OE2 3.29Å; I555-E618 HydrophobicContact CD1-CB 4.1Å; P573-E618 HydrophobicContact CG-CB 4.44Å; L589-E618 HydrophobicContact CD2-CG 4.31Å; L589-E618 WeakPolarHBondContact CD2-O 3.43Å; L589-E618 VanDerWaalsContact CG-O 3.31Å; L589-E618 WeakPolarHBondContact CG-O 3.46Å
619	L	91.3	Very high	93.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.005	19%	0.187	C	C	.	.			trans	-120.1	146.9	-177.6	-63.3	177.3	0	0	0	111.7	F587 L589 I600 L617 S623	F587-L619 HydrophobicContact CB-CD1 3.68Å; F587-L619 HydrophobicContact CB-CD2 4.08Å; F587-L619 HydrophobicContact CG-CD1 4.3Å; L589-L619 HydrophobicContact CD1-CD2 3.62Å; L589-L619 HydrophobicContact CG-CD2 4.16Å; I600-L619 HydrophobicContact CD1-CD1 4.45Å; I600-L619 HydrophobicContact CD1-CD2 4.14Å; I600-L619 HydrophobicContact CD1-CG 4.08Å; I600-L619 HydrophobicContact CG1-CD2 4.5Å; L617-L619 HydrophobicContact CB-CB 4.34Å; L617-L619 HydrophobicContact CB-CD1 4.16Å; L617-L619 HydrophobicContact CB-CG 4.11Å; L617-L619 HydrophobicContact CD1-CD1 4.12Å; L617-L619 HydrophobicContact CD2-CD1 4.4Å; L617-L619 HydrophobicContact CG-CD1 4.46Å; L617-L619 PolarHBondContact O-N 3Å; L619-S623 WeakPolarHBondContact CB-OG 3.21Å
620	G	89.3	Confident	93.6	Very high	12 Å²	12	35 Å²	35	12%	0.124	20%	0.195	C	C	.	.			trans	-78.7	167.8	173.1	0	0	0	0	0	113.7	P622 S623	G620-P622 VanDerWaalsContact C-N 3.33Å; G620-S623 WeakPolarHBondContact O-CB 3.37Å; G620-S623 PolarHBondContact O-N 3.15Å; G620-S623 VanDerWaalsContact O-N 3.1Å; G620-S623 PolarHBondContact O-OG 3.48Å
621	L	91.5	Very high	93.5	Very high	4 Å²	4	32.5 Å²	32.5	2%	0.021	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-34.2	178	-63	179.6	0	0	0	115.5	I544 S623 V624 V636 E669 Q672 L673 L676	I544-L621 HydrophobicContact CG2-CD2 4.41Å; L621-S623 PolarHBondContact O-N 3.39Å; L621-S623 VanDerWaalsContact O-N 3.12Å; L621-V624 WeakPolarHBondContact O-CB 3.27Å; L621-V624 WeakPolarHBondContact O-CG2 3.31Å; L621-V624 PolarHBondContact O-N 3.05Å; L621-V624 VanDerWaalsContact O-N 3.08Å; L621-V636 HydrophobicContact CD2-CG1 3.71Å; L621-E669 HydrophobicContact CD1-CB 3.95Å; L621-E669 HydrophobicContact CD1-CG 4.04Å; L621-Q672 HydrophobicContact CD1-CB 3.91Å; L621-L673 HydrophobicContact CD1-CD2 3.63Å; L621-L673 HydrophobicContact CD1-CG 3.73Å; L621-L673 HydrophobicContact CD2-CD2 3.77Å; L621-L673 HydrophobicContact CG-CD2 4.37Å; L621-L676 HydrophobicContact CD2-CD1 4.36Å
622	P	89.2	Confident	93.4	Very high	80 Å²	80	28.3 Å²	28.3	52%	0.519	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-26.3	175.7	-28.3	37.2	0	0	0	114.5	G620 V624	G620-P622 VanDerWaalsContact C-N 3.33Å; P622-V624 VanDerWaalsContact C-N 3.26Å; P622-V624 PolarHBondContact O-N 3.18Å
623	S	91.1	Very high	93.5	Very high	13 Å²	13	28.7 Å²	28.7	9%	0.091	16%	0.155	C	C	.	.	H	α-helix	trans	-66.7	-23.5	177.9	69.2	0	0	0	0	114	L619 G620 L621 E625 A626 L627	L619-S623 WeakPolarHBondContact CB-OG 3.21Å; G620-S623 WeakPolarHBondContact O-CB 3.37Å; G620-S623 PolarHBondContact O-N 3.15Å; G620-S623 VanDerWaalsContact O-N 3.1Å; G620-S623 PolarHBondContact O-OG 3.48Å; L621-S623 PolarHBondContact O-N 3.39Å; L621-S623 VanDerWaalsContact O-N 3.12Å; S623-E625 VanDerWaalsContact C-N 3.33Å; S623-E625 PolarHBondContact O-N 3.12Å; S623-A626 PolarHBondContact O-N 2.92Å; S623-A626 VanDerWaalsContact O-N 3.12Å; S623-L627 WeakPolarHBondContact O-CG 3.36Å; S623-L627 PolarHBondContact O-N 2.82Å
624	V	93.7	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.6	-41.9	-175.1	175.6	0	0	0	0	111.2	I544 L621 P622 A626 L627 L628 P634 V636 L676 L678	I544-V624 HydrophobicContact CD1-CG2 3.83Å; L621-V624 WeakPolarHBondContact O-CB 3.27Å; L621-V624 WeakPolarHBondContact O-CG2 3.31Å; L621-V624 PolarHBondContact O-N 3.05Å; L621-V624 VanDerWaalsContact O-N 3.08Å; P622-V624 VanDerWaalsContact C-N 3.26Å; P622-V624 PolarHBondContact O-N 3.18Å; V624-A626 VanDerWaalsContact C-N 3.31Å; V624-A626 PolarHBondContact O-N 3.37Å; V624-L627 PolarHBondContact O-N 3.44Å; V624-L628 HydrophobicContact CG1-CD1 3.86Å; V624-L628 HydrophobicContact CG1-CG 4.45Å; V624-L628 WeakPolarHBondContact O-CB 3.47Å; V624-L628 WeakPolarHBondContact O-CD1 3.5Å; V624-L628 WeakPolarHBondContact O-CG 3.24Å; V624-L628 PolarHBondContact O-N 2.69Å; V624-P634 HydrophobicContact CG1-CG 4.16Å; V624-P634 HydrophobicContact CG2-CG 4.45Å; V624-V636 HydrophobicContact CG1-CG2 4.29Å; V624-V636 HydrophobicContact CG2-CG2 3.7Å; V624-L676 HydrophobicContact CB-CD2 4.02Å; V624-L676 HydrophobicContact CG1-CD2 4.16Å; V624-L676 HydrophobicContact CG2-CD2 4.35Å; V624-L678 HydrophobicContact CG1-CB 4.44Å; V624-L678 HydrophobicContact CG1-CD2 3.94Å
625	E	92.3	Very high	93.6	Very high	65 Å²	65	25.9 Å²	25.9	30%	0.304	14%	0.144	S	C	.	.	H	α-helix	trans	-69.3	-29.7	179.8	-155.2	-172.7	102.7	0	0	112.4	S623 R629 P677 L717	S623-E625 VanDerWaalsContact C-N 3.33Å; S623-E625 PolarHBondContact O-N 3.12Å; E625-R629 WeakPolarHBondContact O-CG 3.4Å; E625-R629 PolarHBondContact O-N 3.25Å; E625-R629 PolarHBondContact O-NH1 3.49Å; E625-R629 IonicContact OE1-CZ 3.45Å; E625-R629 IonicContact OE1-NH1 3.48Å; E625-R629 PolarHBondContact OE1-NH1 3.42Å; E625-R629 IonicContact OE1-NH2 3.65Å; E625-R629 PolarHBondContact OE1-NH2 3.14Å; E625-P677 HydrophobicContact CG-CG 4.2Å; E625-L717 HydrophobicContact CG-CD2 3.59Å
626	A	91.6	Very high	93.6	Very high	35 Å²	35	26 Å²	26	29%	0.289	15%	0.145	S	C	.	.	H	α-helix	trans	-75.2	-43.1	174.5	0	0	0	0	0	111.6	F587 S623 V624 L628 R629 Q630	F587-A626 HydrophobicContact CD1-CB 3.93Å; F587-A626 HydrophobicContact CE1-CB 3.72Å; S623-A626 PolarHBondContact O-N 2.92Å; S623-A626 VanDerWaalsContact O-N 3.12Å; V624-A626 VanDerWaalsContact C-N 3.31Å; V624-A626 PolarHBondContact O-N 3.37Å; A626-L628 VanDerWaalsContact C-N 3.35Å; A626-L628 PolarHBondContact O-N 3.27Å; A626-R629 PolarHBondContact O-N 3.25Å; A626-Q630 PolarHBondContact O-N 3.48Å
627	L	94.5	Very high	93.6	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-59.4	-44.5	175.9	-74	163.2	0	0	0	111.5	I544 F587 I605 L617 S623 V624 R629 Q630 G631 I632 P634	I544-L627 HydrophobicContact CD1-CD1 3.65Å; F587-L627 HydrophobicContact CD1-CD2 4.24Å; F587-L627 HydrophobicContact CD1-CG 4.15Å; F587-L627 HydrophobicContact CD2-CD2 4.14Å; F587-L627 HydrophobicContact CE1-CD2 3.8Å; F587-L627 HydrophobicContact CE1-CG 3.83Å; F587-L627 HydrophobicContact CE2-CD2 3.68Å; F587-L627 HydrophobicContact CG-CD2 4.4Å; F587-L627 HydrophobicContact CZ-CD2 3.49Å; F587-L627 VanDerWaalsContact CZ-CD2 3.49Å; F587-L627 HydrophobicContact CZ-CG 4.06Å; I605-L627 HydrophobicContact CD1-CD2 3.92Å; L617-L627 HydrophobicContact CD1-CD1 4.24Å; S623-L627 WeakPolarHBondContact O-CG 3.36Å; S623-L627 PolarHBondContact O-N 2.82Å; V624-L627 PolarHBondContact O-N 3.44Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.09Å; L627-Q630 CarbonylContact O-C 3.56Å; L627-Q630 WeakPolarHBondContact O-CA 3.48Å; L627-Q630 PolarHBondContact O-N 3.24Å; L627-G631 PolarHBondContact O-N 3.32Å; L627-I632 CarbonylContact C-O 3.55Å; L627-I632 VanDerWaalsContact C-O 3.22Å; L627-I632 HydrophobicContact CB-CB 4.27Å; L627-I632 HydrophobicContact CB-CG2 4.36Å; L627-I632 HydrophobicContact CD2-CB 4.27Å; L627-I632 HydrophobicContact CD2-CD1 4.38Å; L627-I632 HydrophobicContact CD2-CG2 4.04Å; L627-I632 PolarHBondContact O-N 2.98Å; L627-P634 HydrophobicContact CD1-CG 4.22Å
628	L	94.7	Very high	93.6	Very high	6 Å²	6	26.2 Å²	26.2	3%	0.031	15%	0.146	C	C	.	.	H	α-helix	trans	-63	-35.1	178.5	-69.4	165.7	0	0	0	112.6	V624 A626 Q630 G631 I632 Y633 P677 L678 V712 L717	V624-L628 HydrophobicContact CG1-CD1 3.86Å; V624-L628 HydrophobicContact CG1-CG 4.45Å; V624-L628 WeakPolarHBondContact O-CB 3.47Å; V624-L628 WeakPolarHBondContact O-CD1 3.5Å; V624-L628 WeakPolarHBondContact O-CG 3.24Å; V624-L628 PolarHBondContact O-N 2.69Å; A626-L628 VanDerWaalsContact C-N 3.35Å; A626-L628 PolarHBondContact O-N 3.27Å; L628-Q630 VanDerWaalsContact C-N 3.25Å; L628-Q630 PolarHBondContact O-N 2.83Å; L628-G631 PolarHBondContact O-N 2.88Å; L628-I632 WeakPolarHBondContact CA-O 3.32Å; L628-I632 PolarHBondContact N-O 3.25Å; L628-Y633 HydrophobicContact CD2-CD1 3.41Å; L628-Y633 VanDerWaalsContact CD2-CD1 3.41Å; L628-Y633 HydrophobicContact CD2-CE1 3.93Å; L628-Y633 HydrophobicContact CD2-CG 4.26Å; L628-P677 HydrophobicContact CD1-CG 3.93Å; L628-L678 HydrophobicContact CD1-CB 4.01Å; L628-L678 HydrophobicContact CD1-CD2 4.42Å; L628-L678 HydrophobicContact CD2-CD2 4.4Å; L628-V712 HydrophobicContact CD1-CG1 4.3Å; L628-V712 HydrophobicContact CD2-CG1 3.98Å; L628-L717 HydrophobicContact CB-CD1 3.67Å; L628-L717 HydrophobicContact CB-CD2 4.21Å
629	R	92.9	Very high	93.5	Very high	118 Å²	118	24.7 Å²	24.7	45%	0.445	14%	0.138	S	C	.	.	H	α-helix	trans	-67	-23.3	172.5	-75.5	-175.3	-177.6	99.3	1.8	113.7	E625 A626 L627 G631 L717	E625-R629 WeakPolarHBondContact O-CG 3.4Å; E625-R629 PolarHBondContact O-N 3.25Å; E625-R629 PolarHBondContact O-NH1 3.49Å; E625-R629 IonicContact OE1-CZ 3.45Å; E625-R629 IonicContact OE1-NH1 3.48Å; E625-R629 PolarHBondContact OE1-NH1 3.42Å; E625-R629 IonicContact OE1-NH2 3.65Å; E625-R629 PolarHBondContact OE1-NH2 3.14Å; A626-R629 PolarHBondContact O-N 3.25Å; L627-R629 VanDerWaalsContact C-N 3.31Å; L627-R629 PolarHBondContact O-N 3.09Å; R629-G631 VanDerWaalsContact C-N 3.3Å; R629-L717 HydrophobicContact CG-CB 4.12Å; R629-L717 PolarHBondContact NE-O 2.88Å
630	Q	93.5	Very high	93.1	Very high	64 Å²	64	29.5 Å²	29.5	30%	0.299	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	11.1	171.5	-56.2	-63.1	-4	0	0	112.8	K584 F587 L602 A626 L627 L628 I632	K584-Q630 VanDerWaalsContact C-NE2 3.33Å; K584-Q630 PolarHBondContact O-NE2 2.96Å; F587-Q630 HydrophobicContact CZ-CG 4.11Å; L602-Q630 HydrophobicContact CD1-CB 3.9Å; L602-Q630 HydrophobicContact CD1-CG 4.21Å; L602-Q630 HydrophobicContact CD2-CB 4.19Å; L602-Q630 HydrophobicContact CD2-CG 4.07Å; A626-Q630 PolarHBondContact O-N 3.48Å; L627-Q630 CarbonylContact O-C 3.56Å; L627-Q630 WeakPolarHBondContact O-CA 3.48Å; L627-Q630 PolarHBondContact O-N 3.24Å; L628-Q630 VanDerWaalsContact C-N 3.25Å; L628-Q630 PolarHBondContact O-N 2.83Å; Q630-I632 VanDerWaalsContact C-N 3.26Å; Q630-I632 PolarHBondContact O-N 3.38Å
631	G	92.8	Very high	92.3	Very high	43 Å²	43	31.1 Å²	31.1	44%	0.443	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	14.3	-177.6	0	0	0	0	0	114.5	L627 L628 R629 Y633	L627-G631 PolarHBondContact O-N 3.32Å; L628-G631 PolarHBondContact O-N 2.88Å; R629-G631 VanDerWaalsContact C-N 3.3Å; G631-Y633 VanDerWaalsContact O-CD2 3.32Å; G631-Y633 WeakPolarHBondContact O-CD2 3.41Å; G631-Y633 WeakPolarHBondContact O-CE2 3.45Å
632	I	95	Very high	91.1	Very high	14 Å²	14	33.6 Å²	33.6	7%	0.072	18%	0.175	C	C	.	.			trans	-97.3	123.7	177.1	-64.3	-176.3	0	0	0	109.6	P542 L602 I605 I609 L627 L628 Q630 P634	P542-I632 HydrophobicContact CG-CG2 3.73Å; L602-I632 HydrophobicContact CD1-CD1 3.42Å; L602-I632 VanDerWaalsContact CD1-CD1 3.42Å; L602-I632 HydrophobicContact CD1-CG1 4.41Å; I605-I632 HydrophobicContact CG2-CD1 4.07Å; I609-I632 HydrophobicContact CD1-CD1 4.47Å; L627-I632 CarbonylContact C-O 3.55Å; L627-I632 VanDerWaalsContact C-O 3.22Å; L627-I632 HydrophobicContact CB-CB 4.27Å; L627-I632 HydrophobicContact CB-CG2 4.36Å; L627-I632 HydrophobicContact CD2-CB 4.27Å; L627-I632 HydrophobicContact CD2-CD1 4.38Å; L627-I632 HydrophobicContact CD2-CG2 4.04Å; L627-I632 PolarHBondContact O-N 2.98Å; L628-I632 WeakPolarHBondContact CA-O 3.32Å; L628-I632 PolarHBondContact N-O 3.25Å; Q630-I632 VanDerWaalsContact C-N 3.26Å; Q630-I632 PolarHBondContact O-N 3.38Å; I632-P634 WeakPolarHBondContact O-CD 3.36Å
633	Y	96.4	Very high	89.6	Confident	49 Å²	49	36.7 Å²	36.7	19%	0.192	19%	0.188	C	C	.	.			trans	-107.8	83.5	-176.2	-57	-81.1	0	0	0	110.6	V535 V537 R541 L628 G631 V712	V535-Y633 HydrophobicContact CG1-CD1 4.45Å; V535-Y633 HydrophobicContact CG1-CD2 4.09Å; V535-Y633 HydrophobicContact CG1-CE1 4.25Å; V535-Y633 HydrophobicContact CG1-CE2 3.85Å; V535-Y633 HydrophobicContact CG1-CG 4.39Å; V535-Y633 HydrophobicContact CG2-CE1 4.12Å; V537-Y633 HydrophobicContact CG2-CD2 3.94Å; V537-Y633 HydrophobicContact CG2-CG 4.11Å; R541-Y633 WeakPolarHBondContact CB-O 3.48Å; R541-Y633 WeakPolarHBondContact CG-O 3.4Å; R541-Y633 PolarHBondContact NE-O 3.49Å; L628-Y633 HydrophobicContact CD2-CD1 3.41Å; L628-Y633 VanDerWaalsContact CD2-CD1 3.41Å; L628-Y633 HydrophobicContact CD2-CE1 3.93Å; L628-Y633 HydrophobicContact CD2-CG 4.26Å; G631-Y633 VanDerWaalsContact O-CD2 3.32Å; G631-Y633 WeakPolarHBondContact O-CD2 3.41Å; G631-Y633 WeakPolarHBondContact O-CE2 3.45Å; Y633-V712 HydrophobicContact CD1-CG2 3.8Å; Y633-V712 HydrophobicContact CE1-CG1 4.48Å; Y633-V712 HydrophobicContact CE1-CG2 3.88Å
634	P	97.1	Very high	87.9	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.218	C	C	.	.			trans	-63.3	160.3	-177.4	28	-36.1	0	0	0	112.2	R541 P542 I544 V624 L627 I632 V636 L678	R541-P634 PolarHBondContact NH2-O 3.47Å; P542-P634 CarbonylContact O-C 3.34Å; P542-P634 WeakPolarHBondContact O-CA 3.43Å; I544-P634 HydrophobicContact CD1-CB 4.07Å; I544-P634 HydrophobicContact CD1-CG 4.29Å; V624-P634 HydrophobicContact CG1-CG 4.16Å; V624-P634 HydrophobicContact CG2-CG 4.45Å; L627-P634 HydrophobicContact CD1-CG 4.22Å; I632-P634 WeakPolarHBondContact O-CD 3.36Å; P634-V636 HydrophobicContact CG-CG2 4.49Å; P634-L678 HydrophobicContact CG-CD2 4.13Å
635	I	97.9	Very high	85.9	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	110.6	163	-61.4	167.2	0	0	0	106.3	R541 P542 V543 I544 I637 V702 Q705 Q706	R541-I635 HydrophobicContact CB-CD1 3.87Å; R541-I635 HydrophobicContact CB-CG1 3.75Å; R541-I635 HydrophobicContact CG-CG1 4.44Å; P542-I635 PolarHBondContact O-N 2.98Å; V543-I635 WeakPolarHBondContact CA-O 3.34Å; I544-I635 PolarHBondContact N-O 2.86Å; I635-I637 HydrophobicContact CG2-CD1 4.07Å; I635-I637 HydrophobicContact CG2-CG1 3.77Å; I635-V702 HydrophobicContact CD1-CG1 4.07Å; I635-Q705 HydrophobicContact CD1-CB 4.06Å; I635-Q705 HydrophobicContact CG1-CB 4.14Å; I635-Q705 HydrophobicContact CG2-CB 3.61Å; I635-Q705 HydrophobicContact CG2-CG 4.22Å; I635-Q706 HydrophobicContact CD1-CB 4.44Å
636	V	97.5	Very high	84	Confident	2 Å²	2	55.6 Å²	55.6	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	117.9	175.1	-178.1	0	0	0	0	108.3	L621 V624 P634 L673 L676 L678 Y680 Y681	L621-V636 HydrophobicContact CD2-CG1 3.71Å; V624-V636 HydrophobicContact CG1-CG2 4.29Å; V624-V636 HydrophobicContact CG2-CG2 3.7Å; P634-V636 HydrophobicContact CG-CG2 4.49Å; V636-L673 HydrophobicContact CG1-CD2 3.98Å; V636-L676 HydrophobicContact CG1-CD1 4.2Å; V636-L678 HydrophobicContact CG2-CD2 4.26Å; V636-Y680 WeakPolarHBondContact O-CA 3.33Å; V636-Y681 PolarHBondContact O-N 2.92Å
637	I	96.8	Very high	82.1	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	114.2	178.4	-54.8	-176	0	0	0	109.2	V543 I544 F545 S546 I635 I639 Y681 V683 L698 A701 V702	V543-I637 HydrophobicContact CG1-CD1 4.05Å; V543-I637 HydrophobicContact CG1-CG1 4.37Å; I544-I637 PolarHBondContact O-N 3.16Å; F545-I637 WeakPolarHBondContact CA-O 3.49Å; F545-I637 HydrophobicContact CD1-CB 4.19Å; F545-I637 HydrophobicContact CE1-CD1 4.3Å; S546-I637 PolarHBondContact N-O 3.33Å; I635-I637 HydrophobicContact CG2-CD1 4.07Å; I635-I637 HydrophobicContact CG2-CG1 3.77Å; I637-I639 HydrophobicContact CG2-CG1 4.42Å; I637-Y681 WeakPolarHBondContact CA-O 3.23Å; I637-V683 HydrophobicContact CG2-CG2 3.65Å; I637-L698 HydrophobicContact CD1-CD2 4.49Å; I637-L698 HydrophobicContact CG2-CD2 3.7Å; I637-A701 HydrophobicContact CD1-CB 4Å; I637-V702 HydrophobicContact CD1-CG2 3.54Å
638	H	93.9	Very high	80.1	Confident	5 Å²	5	69.7 Å²	69.7	2%	0.023	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.2	170.8	177.2	70.1	0	0	0	110.5	S546 E670 L673 Y680 Y681 T682 V683	S546-H638 CarbonylContact O-C 3.55Å; S546-H638 WeakPolarHBondContact O-CA 3.44Å; S546-H638 PolarHBondContact OG-ND1 2.98Å; H638-E670 IonicContact NE2-OE1 2.74Å; H638-L673 HydrophobicContact CB-CD1 3.57Å; H638-L673 VanDerWaalsContact CG-CD1 3.4Å; H638-L673 WeakPolarHBondContact ND1-CD1 3.39Å; H638-Y680 HydrophobicContact CB-CD2 4.04Å; H638-Y680 HydrophobicContact CB-CE2 4.34Å; H638-Y681 PolarHBondContact N-O 3.32Å; H638-T682 CarbonylContact O-C 3.6Å; H638-T682 WeakPolarHBondContact O-CA 3.49Å; H638-V683 PolarHBondContact O-N 2.99Å
639	I	90.3	Very high	78.2	Confident	6 Å²	6	70.6 Å²	70.6	3%	0.031	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	100.5	-178	-59	169.5	0	0	0	107.4	F545 S546 L554 I637 P641 L694 L698	F545-I639 HydrophobicContact CD1-CD1 4.38Å; S546-I639 PolarHBondContact O-N 3.4Å; L554-I639 HydrophobicContact CD1-CD1 3.26Å; I637-I639 HydrophobicContact CG2-CG1 4.42Å; I639-P641 WeakPolarHBondContact O-CD 3.5Å; I639-L694 HydrophobicContact CG2-CD1 3.95Å; I639-L694 HydrophobicContact CG2-CD2 4.42Å; I639-L698 HydrophobicContact CD1-CD1 4.04Å; I639-L698 HydrophobicContact CD1-CD2 3.81Å; I639-L698 HydrophobicContact CD1-CG 4.5Å; I639-L698 HydrophobicContact CG1-CD2 3.98Å
640	R	83.4	Confident	76.5	Confident	102 Å²	102	72.2 Å²	72.2	39%	0.385	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.8	125.4	-173	-170.8	165.3	-143.4	157.7	14.4	111	E670 T682 V683 P685	R640-E670 IonicContact CZ-OE1 2.89Å; R640-E670 IonicContact NE-OE1 2.66Å; R640-E670 IonicContact NH2-OE1 2.7Å; R640-E670 PolarHBondContact NH2-OE1 2.96Å; R640-E670 IonicContact NH2-OE2 3.19Å; R640-T682 HydrophobicContact CB-CG2 4.24Å; R640-V683 PolarHBondContact N-O 3.19Å; R640-P685 HydrophobicContact CB-CG 3.91Å; R640-P685 HydrophobicContact CG-CG 3.9Å
641	P	72.5	Confident	74.9	Confident	46 Å²	46	78 Å²	78	30%	0.299	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-61.8	147.2	179.8	-25	35.1	0	0	0	113.1	I639 C666	I639-P641 WeakPolarHBondContact O-CD 3.5Å; P641-C666 HydrophobicContact CG-CB 4.34Å
642	K	66.6	Low	73.2	Confident	56 Å²	56	76.1 Å²	76.1	24%	0.243	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-79.5	138.3	165.8	-79.3	-174	-174.9	-152.6	0	110.6	H646 P685 W688	K642-H646 HydrophobicContact CB-CB 4.33Å; K642-P685 WeakPolarHBondContact CE-O 3.3Å; K642-P685 HydrophobicContact CG-CB 3.72Å; K642-P685 PolarHBondContact NZ-O 3.15Å; K642-W688 HydrophobicContact CB-CH2 4.24Å; K642-W688 HydrophobicContact CD-CH2 3.58Å; K642-W688 HydrophobicContact CD-CZ2 4.15Å; K642-W688 HydrophobicContact CD-CZ3 3.85Å; K642-W688 VanDerWaalsContact CE-O 3.3Å; K642-W688 WeakPolarHBondContact CE-O 3.48Å; K642-W688 HydrophobicContact CG-CH2 3.58Å; K642-W688 HydrophobicContact CG-CZ2 3.89Å; K642-W688 HydrophobicContact CG-CZ3 4.36Å; K642-W688 PolarHBondContact NZ-O 3.45Å
643	N	57.4	Low	71.5	Confident	146 Å²	146	77.2 Å²	77.2	78%	0.781	34%	0.343	S	S	*	.			trans	-44.5	148.7	171.4	-74.6	-23.1	0	0	0	112.6	K645	N643-K645 PolarHBondContact O-N 3.49Å
644	K	55.6	Low	69.5	Low	166 Å²	166	78 Å²	78	72%	0.722	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	3.1	-160.9	-46.5	-166.7	-172.6	-158.2	0	119	E663	K644-E663 WeakPolarHBondContact CE-OE1 3.28Å; K644-E663 WeakPolarHBondContact CE-OE2 3.31Å; K644-E663 IonicContact NZ-OE1 2.66Å; K644-E663 PolarHBondContact NZ-OE1 3.2Å; K644-E663 IonicContact NZ-OE2 3.04Å; K644-E663 PolarHBondContact NZ-OE2 2.97Å
645	K	50.8	Low	67.2	Low	192 Å²	192	90.6 Å²	90.6	84%	0.835	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-17.4	-178.8	-62.7	-174	178.1	-178.4	0	114.3	N643 K647	N643-K645 PolarHBondContact O-N 3.49Å; K645-K647 PolarHBondContact O-N 2.9Å
646	H	52.5	Low	64.6	Low	117 Å²	117	94.9 Å²	94.9	54%	0.542	43%	0.431	S	S	.	.			trans	-95.1	80	-173	-68.4	-78.5	0	0	0	114.6	K642 K648	K642-H646 HydrophobicContact CB-CB 4.33Å; H646-K648 PolarHBondContact O-N 2.97Å
647	K	52.7	Low	62.4	Low	179 Å²	179	97.2 Å²	97.2	78%	0.778	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-55	-6.6	177.3	-61.9	-179.3	179.8	178.9	0	116.2	K645	K645-K647 PolarHBondContact O-N 2.9Å
648	K	52.3	Low	60.5	Low	152 Å²	152	104.3 Å²	104.3	66%	0.661	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-71.5	-31.3	-176.6	-68.8	-172.8	179.6	-179.1	0	114	H646 R650	H646-K648 PolarHBondContact O-N 2.97Å; K648-R650 PolarHBondContact O-N 3.15Å
649	L	53.3	Low	59	Low	24 Å²	24	107.9 Å²	107.9	13%	0.126	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-68.7	-17.6	-179.7	-77.8	-175.6	0	0	0	114.2	K651 L652 F653 W688	L649-K651 PolarHBondContact O-N 3.48Å; L649-L652 HydrophobicContact CD2-CD1 4.08Å; L649-L652 PolarHBondContact O-N 3.01Å; L649-F653 HydrophobicContact CB-CD2 4.11Å; L649-F653 HydrophobicContact CB-CE2 3.5Å; L649-F653 HydrophobicContact CB-CZ 4.25Å; L649-F653 HydrophobicContact CD1-CE2 4.14Å; L649-F653 HydrophobicContact CD1-CZ 4.14Å; L649-F653 HydrophobicContact CG-CE2 4.47Å; L649-F653 VanDerWaalsContact O-CD2 3.31Å; L649-F653 WeakPolarHBondContact O-CD2 3.46Å; L649-F653 PolarHBondContact O-N 2.72Å; L649-W688 HydrophobicContact CD1-CH2 3.74Å; L649-W688 HydrophobicContact CD1-CZ3 4.4Å; L649-W688 HydrophobicContact CD2-CH2 3.96Å; L649-W688 HydrophobicContact CD2-CZ3 3.87Å; L649-W688 HydrophobicContact CG-CH2 4.02Å; L649-W688 HydrophobicContact CG-CZ3 4.17Å
650	R	58	Low	57.8	Low	152 Å²	152	111.5 Å²	111.5	57%	0.574	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-59.6	-2.3	175.3	-74.3	-171.6	174.9	175.8	0	115	K648 D659	K648-R650 PolarHBondContact O-N 3.15Å; R650-D659 IonicContact CZ-OD1 3.53Å; R650-D659 IonicContact CZ-OD2 3.9Å; R650-D659 IonicContact NE-OD1 3.44Å; R650-D659 PolarHBondContact NE-OD1 3Å; R650-D659 IonicContact NH2-OD1 3.6Å; R650-D659 PolarHBondContact NH2-OD1 3.38Å; R650-D659 IonicContact NH2-OD2 2.75Å; R650-D659 PolarHBondContact NH2-OD2 3.13Å
651	K	60.4	Low	57	Low	185 Å²	185	110.3 Å²	110.3	80%	0.804	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-89.4	-18.3	169.2	-68.9	-173.2	175.5	-172.3	0	114.3	L649	L649-K651 PolarHBondContact O-N 3.48Å
652	L	57.1	Low	56.9	Low	5 Å²	5	110.5 Å²	110.5	3%	0.026	53%	0.531	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-28.4	176.8	-70.1	175	0	0	0	112.3	L550 R553 L554 L649 T691 L694	L550-L652 HydrophobicContact CD2-CB 3.98Å; R553-L652 WeakPolarHBondContact CB-O 3.3Å; R553-L652 VanDerWaalsContact CG-O 3.27Å; R553-L652 WeakPolarHBondContact CG-O 3.47Å; L554-L652 HydrophobicContact CD2-CD1 4.41Å; L649-L652 HydrophobicContact CD2-CD1 4.08Å; L649-L652 PolarHBondContact O-N 3.01Å; L652-T691 HydrophobicContact CD1-CG2 4.22Å; L652-T691 HydrophobicContact CD2-CG2 4.01Å; L652-T691 HydrophobicContact CG-CG2 4.42Å; L652-L694 HydrophobicContact CD1-CD2 4.03Å
653	F	59.6	Low	57.2	Low	36 Å²	36	112 Å²	112	16%	0.158	54%	0.539	C	S	.	.	S	Bend	trans	-71.3	148.8	172.6	-60.9	-59.8	0	0	0	111.8	L550 L649 M662	L550-F653 HydrophobicContact CD1-CE1 4.18Å; L550-F653 HydrophobicContact CD2-CD1 3.5Å; L550-F653 VanDerWaalsContact CD2-CD1 3.5Å; L550-F653 HydrophobicContact CD2-CE1 3.46Å; L550-F653 VanDerWaalsContact CD2-CE1 3.46Å; L550-F653 HydrophobicContact CD2-CG 4.37Å; L550-F653 HydrophobicContact CD2-CZ 4.32Å; L550-F653 HydrophobicContact CG-CD1 4.19Å; L550-F653 HydrophobicContact CG-CE1 3.84Å; L649-F653 HydrophobicContact CB-CD2 4.11Å; L649-F653 HydrophobicContact CB-CE2 3.5Å; L649-F653 HydrophobicContact CB-CZ 4.25Å; L649-F653 HydrophobicContact CD1-CE2 4.14Å; L649-F653 HydrophobicContact CD1-CZ 4.14Å; L649-F653 HydrophobicContact CG-CE2 4.47Å; L649-F653 VanDerWaalsContact O-CD2 3.31Å; L649-F653 WeakPolarHBondContact O-CD2 3.46Å; L649-F653 PolarHBondContact O-N 2.72Å; F653-M662 HydrophobicContact CD1-CG 4.42Å; F653-M662 HydrophobicContact CD1-SD 3.68Å; F653-M662 HydrophobicContact CD2-SD 3.58Å; F653-M662 VanDerWaalsContact CD2-SD 3.58Å; F653-M662 HydrophobicContact CE1-CG 4.24Å; F653-M662 HydrophobicContact CE1-SD 3.57Å; F653-M662 VanDerWaalsContact CE1-SD 3.57Å; F653-M662 HydrophobicContact CE2-CE 4.24Å; F653-M662 HydrophobicContact CE2-SD 3.46Å; F653-M662 WeakPolarHBondContact CE2-SD 3.4Å; F653-M662 HydrophobicContact CG-SD 3.69Å; F653-M662 HydrophobicContact CZ-CE 4.42Å; F653-M662 HydrophobicContact CZ-SD 3.47Å; F653-M662 WeakPolarHBondContact CZ-SD 3.33Å
654	P	53.9	Low	58.1	Low	67 Å²	67	111.5 Å²	111.5	44%	0.435	53%	0.532	S	S	.	.			trans	-56.3	161.3	165.5	-23.2	34.1	0	0	0	112.1	C656	P654-C656 PolarHBondContact O-N 3.48Å
655	R	49.6	Very low	59.1	Low	263 Å²	263	105.8 Å²	105.8	99%	0.992	51%	0.511	S	S	*	.	S	Bend	trans	-75	44.8	167	-68.8	-171.6	179.7	-178	1.2	111.9
656	C	42.8	Very low	60.4	Low	92 Å²	92	97.2 Å²	97.2	62%	0.622	48%	0.475	S	S	*	.			trans	-67.2	138.4	165.4	-167.3	0	0	0	0	108.1	P654	P654-C656 PolarHBondContact O-N 3.48Å
657	G	51.6	Low	61.7	Low	51 Å²	51	97.6 Å²	97.6	53%	0.526	48%	0.477	S	S	.	.	S	Bend	trans	-64.2	156.5	167.9	0	0	0	0	0	110.6
658	E	56.5	Low	63.1	Low	149 Å²	149	91.1 Å²	91.1	70%	0.696	46%	0.457	S	S	*	.			trans	65.7	104.1	167.2	-58.8	173	-160.4	0	0	115.6	S660 I661	E658-S660 PolarHBondContact O-N 3.15Å; E658-I661 HydrophobicContact CB-CD1 4.32Å; E658-I661 HydrophobicContact CB-CG1 4.38Å; E658-I661 PolarHBondContact O-N 3.05Å
659	D	62.2	Low	64.7	Low	80 Å²	80	84.4 Å²	84.4	43%	0.428	43%	0.428	S	S	.	.	H	α-helix	trans	-59.1	-13.8	175.4	-50.8	-88.3	0	0	0	112.8	R650 M662 E663	R650-D659 IonicContact CZ-OD1 3.53Å; R650-D659 IonicContact CZ-OD2 3.9Å; R650-D659 IonicContact NE-OD1 3.44Å; R650-D659 PolarHBondContact NE-OD1 3Å; R650-D659 IonicContact NH2-OD1 3.6Å; R650-D659 PolarHBondContact NH2-OD1 3.38Å; R650-D659 IonicContact NH2-OD2 2.75Å; R650-D659 PolarHBondContact NH2-OD2 3.13Å; D659-M662 HydrophobicContact CB-CE 4.27Å; D659-E663 PolarHBondContact O-N 2.93Å
660	S	64.3	Low	66.2	Low	81 Å²	81	86.2 Å²	86.2	57%	0.566	44%	0.436	S	S	*	.	H	α-helix	trans	-70.7	-43	178.4	-163.1	0	0	0	0	113.3	E658 M662 E663 E664	E658-S660 PolarHBondContact O-N 3.15Å; S660-M662 VanDerWaalsContact C-N 3.26Å; S660-M662 PolarHBondContact O-N 3.45Å; S660-E663 PolarHBondContact O-N 3.45Å; S660-E663 VanDerWaalsContact O-N 3.16Å; S660-E664 PolarHBondContact O-N 2.95Å
661	I	68.3	Low	67.4	Low	77 Å²	77	84.4 Å²	84.4	40%	0.395	44%	0.437	S	S	.	.	H	α-helix	trans	-65.3	-37.7	179.8	-58.3	173.5	0	0	0	109.6	E658 E664 V665	E658-I661 HydrophobicContact CB-CD1 4.32Å; E658-I661 HydrophobicContact CB-CG1 4.38Å; E658-I661 PolarHBondContact O-N 3.05Å; I661-E664 PolarHBondContact O-N 3.34Å; I661-V665 WeakPolarHBondContact O-CG2 3.49Å; I661-V665 PolarHBondContact O-N 3.13Å
662	M	69.2	Low	68.6	Low	51 Å²	51	79.1 Å²	79.1	25%	0.251	42%	0.415	S	S	.	.	H	α-helix	trans	-62.2	-43.1	173.5	179.4	-169.7	69.1	0	0	111.9	F653 D659 S660 V665 C666	F653-M662 HydrophobicContact CD1-CG 4.42Å; F653-M662 HydrophobicContact CD1-SD 3.68Å; F653-M662 HydrophobicContact CD2-SD 3.58Å; F653-M662 VanDerWaalsContact CD2-SD 3.58Å; F653-M662 HydrophobicContact CE1-CG 4.24Å; F653-M662 HydrophobicContact CE1-SD 3.57Å; F653-M662 VanDerWaalsContact CE1-SD 3.57Å; F653-M662 HydrophobicContact CE2-CE 4.24Å; F653-M662 HydrophobicContact CE2-SD 3.46Å; F653-M662 WeakPolarHBondContact CE2-SD 3.4Å; F653-M662 HydrophobicContact CG-SD 3.69Å; F653-M662 HydrophobicContact CZ-CE 4.42Å; F653-M662 HydrophobicContact CZ-SD 3.47Å; F653-M662 WeakPolarHBondContact CZ-SD 3.33Å; D659-M662 HydrophobicContact CB-CE 4.27Å; S660-M662 VanDerWaalsContact C-N 3.26Å; S660-M662 PolarHBondContact O-N 3.45Å; M662-V665 PolarHBondContact O-N 2.93Å; M662-C666 WeakPolarHBondContact O-CB 3.43Å; M662-C666 PolarHBondContact O-N 3.29Å; M662-C666 PolarHBondContact O-SG 3.37Å
663	E	73.5	Confident	70.1	Confident	88 Å²	88	79 Å²	79	41%	0.411	41%	0.414	S	S	.	.	H	α-helix	trans	-65	-40.5	177.7	-168.5	168	-171.5	0	0	111.6	K644 D659 S660 C666 Q667	K644-E663 WeakPolarHBondContact CE-OE1 3.28Å; K644-E663 WeakPolarHBondContact CE-OE2 3.31Å; K644-E663 IonicContact NZ-OE1 2.66Å; K644-E663 PolarHBondContact NZ-OE1 3.2Å; K644-E663 IonicContact NZ-OE2 3.04Å; K644-E663 PolarHBondContact NZ-OE2 2.97Å; D659-E663 PolarHBondContact O-N 2.93Å; S660-E663 PolarHBondContact O-N 3.45Å; S660-E663 VanDerWaalsContact O-N 3.16Å; E663-C666 PolarHBondContact O-N 3.44Å; E663-Q667 WeakPolarHBondContact O-CB 3.48Å; E663-Q667 PolarHBondContact O-N 2.95Å
664	E	76.4	Confident	71.3	Confident	135 Å²	135	79 Å²	79	63%	0.631	42%	0.415	S	S	*	.	H	α-helix	trans	-61.9	-47.9	174	-176.3	174.3	-168.9	0	0	112.4	S660 I661 C666 Q667 A668	S660-E664 PolarHBondContact O-N 2.95Å; I661-E664 PolarHBondContact O-N 3.34Å; E664-C666 VanDerWaalsContact C-N 3.34Å; E664-C666 PolarHBondContact O-N 3.47Å; E664-Q667 PolarHBondContact O-N 3.08Å; E664-A668 WeakPolarHBondContact O-CB 3.3Å; E664-A668 PolarHBondContact O-N 2.94Å
665	V	75.2	Confident	72.9	Confident	45 Å²	45	77.7 Å²	77.7	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-64.5	-38.6	177.3	173.6	0	0	0	0	111.6	L549 I661 M662 A668 E669	L549-V665 HydrophobicContact CD1-CB 3.97Å; L549-V665 HydrophobicContact CD1-CG1 3.72Å; L549-V665 HydrophobicContact CD1-CG2 4.34Å; L549-V665 HydrophobicContact CG-CG1 4.04Å; I661-V665 WeakPolarHBondContact O-CG2 3.49Å; I661-V665 PolarHBondContact O-N 3.13Å; M662-V665 PolarHBondContact O-N 2.93Å; V665-A668 PolarHBondContact O-N 3.19Å; V665-E669 PolarHBondContact O-N 2.95Å
666	C	78.9	Confident	74.8	Confident	12 Å²	12	65.7 Å²	65.7	8%	0.081	36%	0.361	C	S	.	.	H	α-helix	trans	-62.4	-43.1	174.7	-67.1	0	0	0	0	111.5	P547 P641 M662 E663 E664 E669 E670	P547-C666 HydrophobicContact CG-CB 4.21Å; P547-C666 WeakPolarHBondContact CG-SG 3.28Å; P641-C666 HydrophobicContact CG-CB 4.34Å; M662-C666 WeakPolarHBondContact O-CB 3.43Å; M662-C666 PolarHBondContact O-N 3.29Å; M662-C666 PolarHBondContact O-SG 3.37Å; E663-C666 PolarHBondContact O-N 3.44Å; E664-C666 VanDerWaalsContact C-N 3.34Å; E664-C666 PolarHBondContact O-N 3.47Å; C666-E669 PolarHBondContact O-N 3.05Å; C666-E670 PolarHBondContact O-N 3.28Å
667	Q	79.3	Confident	77.1	Confident	125 Å²	125	61.4 Å²	61.4	58%	0.584	33%	0.332	S	S	*	.	H	α-helix	trans	-68.5	-38.2	177.3	-172.3	175	6.6	0	0	112.2	E663 E664 E670 L671	E663-Q667 WeakPolarHBondContact O-CB 3.48Å; E663-Q667 PolarHBondContact O-N 2.95Å; E664-Q667 PolarHBondContact O-N 3.08Å; Q667-E670 PolarHBondContact O-N 3.11Å; Q667-L671 WeakPolarHBondContact O-CG 3.34Å; Q667-L671 PolarHBondContact O-N 3.19Å; Q667-L671 VanDerWaalsContact O-N 3.1Å
668	A	82.8	Confident	79.2	Confident	43 Å²	43	59 Å²	59	36%	0.355	31%	0.307	S	S	.	.	H	α-helix	trans	-63.3	-42.2	175	0	0	0	0	0	111.8	E664 V665 L671 Q672	E664-A668 WeakPolarHBondContact O-CB 3.3Å; E664-A668 PolarHBondContact O-N 2.94Å; V665-A668 PolarHBondContact O-N 3.19Å; A668-L671 PolarHBondContact O-N 2.85Å; A668-Q672 WeakPolarHBondContact O-CG 3.24Å; A668-Q672 PolarHBondContact O-N 2.96Å
669	E	85.1	Confident	80.9	Confident	11 Å²	11	52.9 Å²	52.9	5%	0.051	28%	0.279	C	S	.	.	H	α-helix	trans	-71	-38.8	174	-79.2	-168.4	-132.7	0	0	113.3	S546 P547 S548 L621 V665 C666 L671 Q672 L673	S546-E669 WeakPolarHBondContact CA-OE2 3.47Å; S546-E669 WeakPolarHBondContact CB-OE2 3.48Å; S546-E669 PolarHBondContact OG-OE2 3.29Å; P547-E669 VanDerWaalsContact CA-OE2 3.31Å; P547-E669 WeakPolarHBondContact CA-OE2 3.36Å; S548-E669 WeakPolarHBondContact CB-OE1 3.35Å; S548-E669 PolarHBondContact N-OE1 3.06Å; S548-E669 PolarHBondContact N-OE2 3.13Å; S548-E669 VanDerWaalsContact N-OE2 3.14Å; S548-E669 PolarHBondContact OG-OE1 2.79Å; L621-E669 HydrophobicContact CD1-CB 3.95Å; L621-E669 HydrophobicContact CD1-CG 4.04Å; V665-E669 PolarHBondContact O-N 2.95Å; C666-E669 PolarHBondContact O-N 3.05Å; E669-L671 PolarHBondContact O-N 3.49Å; E669-Q672 PolarHBondContact O-N 3.3Å; E669-L673 WeakPolarHBondContact O-CG 3.45Å; E669-L673 PolarHBondContact O-N 3.21Å
670	E	84.5	Confident	82.4	Confident	63 Å²	63	50.7 Å²	50.7	29%	0.294	27%	0.265	S	S	.	.	H	α-helix	trans	-54.6	-38.9	171.8	-81.8	-165.3	177.7	0	0	111	H638 R640 C666 Q667	H638-E670 IonicContact NE2-OE1 2.74Å; R640-E670 IonicContact CZ-OE1 2.89Å; R640-E670 IonicContact NE-OE1 2.66Å; R640-E670 IonicContact NH2-OE1 2.7Å; R640-E670 PolarHBondContact NH2-OE1 2.96Å; R640-E670 IonicContact NH2-OE2 3.19Å; C666-E670 PolarHBondContact O-N 3.28Å; Q667-E670 PolarHBondContact O-N 3.11Å
671	L	83.8	Confident	83.9	Confident	114 Å²	114	49.8 Å²	49.8	60%	0.597	25%	0.25	S	C	*	.	H	α-helix	trans	-72.6	-32.3	174.6	-68	170.7	0	0	0	113.8	Q667 A668 E669	Q667-L671 WeakPolarHBondContact O-CG 3.34Å; Q667-L671 PolarHBondContact O-N 3.19Å; Q667-L671 VanDerWaalsContact O-N 3.1Å; A668-L671 PolarHBondContact O-N 2.85Å; E669-L671 PolarHBondContact O-N 3.49Å
672	Q	86.1	Confident	85	Confident	73 Å²	73	48 Å²	48	34%	0.341	24%	0.243	S	C	.	.	H	α-helix	trans	-70.2	-36.1	175.1	-73.6	177.4	22.5	0	0	112.4	L621 A668 E669 E674 T675 L676	L621-Q672 HydrophobicContact CD1-CB 3.91Å; A668-Q672 WeakPolarHBondContact O-CG 3.24Å; A668-Q672 PolarHBondContact O-N 2.96Å; E669-Q672 PolarHBondContact O-N 3.3Å; Q672-E674 VanDerWaalsContact C-N 3.27Å; Q672-E674 PolarHBondContact O-N 3.42Å; Q672-T675 WeakPolarHBondContact O-CA 3.28Å; Q672-T675 PolarHBondContact O-N 3.16Å; Q672-T675 PolarHBondContact O-OG1 2.95Å; Q672-L676 PolarHBondContact O-N 3.12Å
673	L	88.6	Confident	86.1	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-55.9	-40.3	177.1	-71.8	171.7	0	0	0	112.7	L621 V636 H638 E669 T675 L676 Y680	L621-L673 HydrophobicContact CD1-CD2 3.63Å; L621-L673 HydrophobicContact CD1-CG 3.73Å; L621-L673 HydrophobicContact CD2-CD2 3.77Å; L621-L673 HydrophobicContact CG-CD2 4.37Å; V636-L673 HydrophobicContact CG1-CD2 3.98Å; H638-L673 HydrophobicContact CB-CD1 3.57Å; H638-L673 VanDerWaalsContact CG-CD1 3.4Å; H638-L673 WeakPolarHBondContact ND1-CD1 3.39Å; E669-L673 WeakPolarHBondContact O-CG 3.45Å; E669-L673 PolarHBondContact O-N 3.21Å; L673-T675 PolarHBondContact O-N 2.94Å; L673-L676 HydrophobicContact CD2-CD1 3.81Å; L673-L676 WeakPolarHBondContact O-CB 3.26Å; L673-L676 PolarHBondContact O-N 3.14Å; L673-Y680 HydrophobicContact CB-CD1 4.06Å; L673-Y680 HydrophobicContact CB-CE1 3.72Å; L673-Y680 HydrophobicContact CB-CE2 4.29Å; L673-Y680 HydrophobicContact CD1-CD2 4.13Å; L673-Y680 HydrophobicContact CD1-CE2 3.88Å; L673-Y680 HydrophobicContact CD2-CD1 4.15Å; L673-Y680 HydrophobicContact CD2-CD2 4.1Å; L673-Y680 HydrophobicContact CD2-CG 3.9Å; L673-Y680 HydrophobicContact CG-CE2 4.47Å
674	E	85.4	Confident	86.8	Confident	38 Å²	38	45.3 Å²	45.3	18%	0.178	23%	0.23	C	C	.	.	H	α-helix	trans	-61.8	-29	175.7	-64.7	-69.7	-169.6	0	0	111.9	R494 R496 Q672	R494-E674 IonicContact CZ-OE1 2.67Å; R494-E674 VanDerWaalsContact CZ-OE1 3.25Å; R494-E674 IonicContact CZ-OE2 2.69Å; R494-E674 IonicContact NE-OE1 3.7Å; R494-E674 PolarHBondContact NE-OE1 2.84Å; R494-E674 IonicContact NE-OE2 2.67Å; R494-E674 IonicContact NH2-OE1 3.93Å; R494-E674 PolarHBondContact NH2-OE1 2.79Å; R494-E674 IonicContact NH2-OE2 2.96Å; R494-E674 PolarHBondContact NH2-OE2 3.46Å; R496-E674 WeakPolarHBondContact CD-O 3.48Å; R496-E674 HydrophobicContact CG-CB 4.42Å; R496-E674 WeakPolarHBondContact CG-O 3.48Å; R496-E674 PolarHBondContact NE-O 2.94Å; Q672-E674 VanDerWaalsContact C-N 3.27Å; Q672-E674 PolarHBondContact O-N 3.42Å
675	T	86	Confident	87.1	Confident	39 Å²	39	40.2 Å²	40.2	24%	0.239	21%	0.208	C	C	.	.	H	α-helix	trans	-83.4	-13.3	179.5	70.2	0	0	0	0	114.6	Y516 Q672 L673 R716	Y516-T675 VanDerWaalsContact OH-CG2 3.23Å; Y516-T675 WeakPolarHBondContact OH-CG2 3.42Å; Q672-T675 WeakPolarHBondContact O-CA 3.28Å; Q672-T675 PolarHBondContact O-N 3.16Å; Q672-T675 PolarHBondContact O-OG1 2.95Å; L673-T675 PolarHBondContact O-N 2.94Å; T675-R716 VanDerWaalsContact O-CZ 3.31Å; T675-R716 PolarHBondContact O-NH1 3.27Å; T675-R716 PolarHBondContact O-NH2 3.48Å
676	L	90.8	Very high	87.4	Confident	10 Å²	10	43.2 Å²	43.2	5%	0.052	23%	0.231	C	C	.	.			trans	-61.4	139.1	-174.3	-70.7	179.3	0	0	0	112.4	R405 R496 L621 V624 V636 Q672 L673 L678	R405-L676 PolarHBondContact NH1-O 2.93Å; R496-L676 PolarHBondContact NH2-O 2.71Å; L621-L676 HydrophobicContact CD2-CD1 4.36Å; V624-L676 HydrophobicContact CB-CD2 4.02Å; V624-L676 HydrophobicContact CG1-CD2 4.16Å; V624-L676 HydrophobicContact CG2-CD2 4.35Å; V636-L676 HydrophobicContact CG1-CD1 4.2Å; Q672-L676 PolarHBondContact O-N 3.12Å; L673-L676 HydrophobicContact CD2-CD1 3.81Å; L673-L676 WeakPolarHBondContact O-CB 3.26Å; L673-L676 PolarHBondContact O-N 3.14Å; L676-L678 PolarHBondContact O-N 3.48Å
677	P	91.8	Very high	87.6	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.013	25%	0.249	C	C	.	.	S	Bend	trans	-80.9	21.7	173.6	35.5	-36.4	0	0	0	113.1	E625 L628 V712 E713 L717	E625-P677 HydrophobicContact CG-CG 4.2Å; L628-P677 HydrophobicContact CD1-CG 3.93Å; P677-V712 WeakPolarHBondContact O-CA 3.21Å; P677-E713 HydrophobicContact CB-CB 3.88Å; P677-E713 PolarHBondContact O-N 2.72Å; P677-L717 HydrophobicContact CB-CD2 4.32Å; P677-L717 HydrophobicContact CG-CD2 3.88Å
678	L	93.6	Very high	87.8	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.223	C	C	.	.	B	Isolated β-bridge	trans	-145.5	146	-175.4	176	69.5	0	0	0	108.5	V624 L628 P634 V636 L676 A710 V712	V624-L678 HydrophobicContact CG1-CB 4.44Å; V624-L678 HydrophobicContact CG1-CD2 3.94Å; L628-L678 HydrophobicContact CD1-CB 4.01Å; L628-L678 HydrophobicContact CD1-CD2 4.42Å; L628-L678 HydrophobicContact CD2-CD2 4.4Å; P634-L678 HydrophobicContact CG-CD2 4.13Å; V636-L678 HydrophobicContact CG2-CD2 4.26Å; L676-L678 PolarHBondContact O-N 3.48Å; L678-A710 HydrophobicContact CD1-CB 4.28Å; L678-V712 HydrophobicContact CD1-CG2 4Å
679	L	92.9	Very high	87.7	Confident	20 Å²	20	42 Å²	42	11%	0.105	23%	0.23	C	C	.	.			trans	-71.8	133.4	169.5	-74.6	-174.5	0	0	0	111.7	D424 I426 W711	D424-L679 HydrophobicContact CB-CD2 4.2Å; I426-L679 HydrophobicContact CD1-CD1 4.2Å; I426-L679 HydrophobicContact CG1-CD1 4.3Å; L679-W711 HydrophobicContact CD1-CB 4.02Å; L679-W711 HydrophobicContact CD1-CG 4.12Å; L679-W711 HydrophobicContact CG-CB 4.15Å; L679-W711 PolarHBondContact N-O 2.99Å
680	Y	94.2	Very high	87.5	Confident	34 Å²	34	43.6 Å²	43.6	13%	0.133	24%	0.242	C	C	.	.			trans	-102.9	164.3	170.1	66.3	-84.3	0	0	0	110.9	R494 V636 H638 L673 T682	R494-Y680 PolarHBondContact NH2-OH 2.89Å; V636-Y680 WeakPolarHBondContact O-CA 3.33Å; H638-Y680 HydrophobicContact CB-CD2 4.04Å; H638-Y680 HydrophobicContact CB-CE2 4.34Å; L673-Y680 HydrophobicContact CB-CD1 4.06Å; L673-Y680 HydrophobicContact CB-CE1 3.72Å; L673-Y680 HydrophobicContact CB-CE2 4.29Å; L673-Y680 HydrophobicContact CD1-CD2 4.13Å; L673-Y680 HydrophobicContact CD1-CE2 3.88Å; L673-Y680 HydrophobicContact CD2-CD1 4.15Å; L673-Y680 HydrophobicContact CD2-CD2 4.1Å; L673-Y680 HydrophobicContact CD2-CG 3.9Å; L673-Y680 HydrophobicContact CG-CE2 4.47Å; Y680-T682 WeakPolarHBondContact CE2-OG1 3.41Å
681	Y	94.9	Very high	87.5	Confident	62 Å²	62	42 Å²	42	24%	0.243	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	133.7	176.1	-179	-85.6	0	0	0	110.6	V636 I637 H638 V683 A701 R704 Q705	V636-Y681 PolarHBondContact O-N 2.92Å; I637-Y681 WeakPolarHBondContact CA-O 3.23Å; H638-Y681 PolarHBondContact N-O 3.32Å; Y681-V683 HydrophobicContact CD1-CG2 4.29Å; Y681-V683 HydrophobicContact CE1-CG2 4.05Å; Y681-A701 HydrophobicContact CD1-CB 3.93Å; Y681-A701 HydrophobicContact CE1-CB 3.72Å; Y681-R704 PolarHBondContact OH-NH1 2.97Å; Y681-R704 VanDerWaalsContact OH-NH1 3.07Å; Y681-Q705 HydrophobicContact CD2-CG 4.04Å; Y681-Q705 HydrophobicContact CG-CG 4.1Å
682	T	93	Very high	87.6	Confident	41 Å²	41	41.9 Å²	41.9	25%	0.252	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	125.9	177.2	-58.8	0	0	0	0	111.6	H638 R640 Y680 E684	H638-T682 CarbonylContact O-C 3.6Å; H638-T682 WeakPolarHBondContact O-CA 3.49Å; R640-T682 HydrophobicContact CB-CG2 4.24Å; Y680-T682 WeakPolarHBondContact CE2-OG1 3.41Å; T682-E684 HydrophobicContact CG2-CG 4.31Å; T682-E684 VanDerWaalsContact CG2-OE1 3.29Å; T682-E684 WeakPolarHBondContact CG2-OE1 3.3Å; T682-E684 PolarHBondContact O-N 3.39Å
683	V	92.2	Very high	87.8	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	97.4	164.9	178.4	0	0	0	0	108.2	I637 H638 R640 Y681 T687 L694 A697 L698	I637-V683 HydrophobicContact CG2-CG2 3.65Å; H638-V683 PolarHBondContact O-N 2.99Å; R640-V683 PolarHBondContact N-O 3.19Å; Y681-V683 HydrophobicContact CD1-CG2 4.29Å; Y681-V683 HydrophobicContact CE1-CG2 4.05Å; V683-T687 WeakPolarHBondContact CG1-OG1 3.45Å; V683-L694 HydrophobicContact CG1-CD1 4.11Å; V683-A697 HydrophobicContact CG1-CB 4.32Å; V683-L698 HydrophobicContact CG2-CD2 4.01Å
684	E	87.8	Confident	87.8	Confident	77 Å²	77	42.2 Å²	42.2	36%	0.36	23%	0.234	S	C	.	.			trans	-65	145.9	-178.2	-78.4	-61.2	146.6	0	0	112.4	T682 S686 T687	T682-E684 HydrophobicContact CG2-CG 4.31Å; T682-E684 VanDerWaalsContact CG2-OE1 3.29Å; T682-E684 WeakPolarHBondContact CG2-OE1 3.3Å; T682-E684 PolarHBondContact O-N 3.39Å; E684-S686 PolarHBondContact O-N 3.26Å; E684-T687 HydrophobicContact CB-CG2 4.43Å; E684-T687 WeakPolarHBondContact O-CB 3.21Å; E684-T687 PolarHBondContact O-N 3.42Å; E684-T687 PolarHBondContact O-OG1 3.16Å
685	P	82.1	Confident	88.1	Confident	28 Å²	28	41 Å²	41	18%	0.182	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-66.1	-15.4	-174.1	-16.5	29.8	0	0	0	113.9	R640 K642 T687	R640-P685 HydrophobicContact CB-CG 3.91Å; R640-P685 HydrophobicContact CG-CG 3.9Å; K642-P685 WeakPolarHBondContact CE-O 3.3Å; K642-P685 HydrophobicContact CG-CB 3.72Å; K642-P685 PolarHBondContact NZ-O 3.15Å; P685-T687 PolarHBondContact O-N 2.92Å
686	S	82	Confident	88.3	Confident	108 Å²	108	43.7 Å²	43.7	76%	0.755	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-66.5	-23.1	172.4	48.5	0	0	0	0	113.3	E684	E684-S686 PolarHBondContact O-N 3.26Å
687	T	82.8	Confident	88.5	Confident	74 Å²	74	44.3 Å²	44.3	45%	0.454	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-84.2	-9.4	-167.5	62.3	0	0	0	0	115.7	V683 E684 P685	V683-T687 WeakPolarHBondContact CG1-OG1 3.45Å; E684-T687 HydrophobicContact CB-CG2 4.43Å; E684-T687 WeakPolarHBondContact O-CB 3.21Å; E684-T687 PolarHBondContact O-N 3.42Å; E684-T687 PolarHBondContact O-OG1 3.16Å; P685-T687 PolarHBondContact O-N 2.92Å
688	W	84.1	Confident	88.6	Confident	11 Å²	11	44.3 Å²	44.3	4%	0.042	25%	0.245	C	C	.	.			trans	-147.8	143.4	-177.7	56.4	-91	0	0	0	112.3	K642 L649 E693 L694	K642-W688 HydrophobicContact CB-CH2 4.24Å; K642-W688 HydrophobicContact CD-CH2 3.58Å; K642-W688 HydrophobicContact CD-CZ2 4.15Å; K642-W688 HydrophobicContact CD-CZ3 3.85Å; K642-W688 VanDerWaalsContact CE-O 3.3Å; K642-W688 WeakPolarHBondContact CE-O 3.48Å; K642-W688 HydrophobicContact CG-CH2 3.58Å; K642-W688 HydrophobicContact CG-CZ2 3.89Å; K642-W688 HydrophobicContact CG-CZ3 4.36Å; K642-W688 PolarHBondContact NZ-O 3.45Å; L649-W688 HydrophobicContact CD1-CH2 3.74Å; L649-W688 HydrophobicContact CD1-CZ3 4.4Å; L649-W688 HydrophobicContact CD2-CH2 3.96Å; L649-W688 HydrophobicContact CD2-CZ3 3.87Å; L649-W688 HydrophobicContact CG-CH2 4.02Å; L649-W688 HydrophobicContact CG-CZ3 4.17Å; W688-E693 HydrophobicContact CB-CB 4.04Å; W688-L694 HydrophobicContact CB-CB 4.02Å; W688-L694 HydrophobicContact CD2-CB 4.27Å; W688-L694 HydrophobicContact CD2-CD1 4.3Å; W688-L694 HydrophobicContact CG-CB 4.02Å; W688-L694 HydrophobicContact CG-CD1 4.01Å
689	S	80.1	Confident	88.6	Confident	70 Å²	70	47 Å²	47	49%	0.49	26%	0.255	S	S	.	.	S	Bend	trans	-115.3	-25.8	178.7	100.6	0	0	0	0	113.3	E693	S689-E693 WeakPolarHBondContact CA-OE2 3.26Å; S689-E693 WeakPolarHBondContact CB-OE2 3.26Å; S689-E693 PolarHBondContact N-OE2 3.31Å; S689-E693 PolarHBondContact OG-OE1 3.01Å; S689-E693 PolarHBondContact OG-OE2 3.38Å
690	C	81.5	Confident	88.7	Confident	45 Å²	45	49.5 Å²	49.5	30%	0.304	27%	0.269	S	S	.	.	S	Bend	trans	-134.3	178.7	179.2	78.2	0	0	0	0	112	E693 L694	C690-E693 PolarHBondContact SG-OE1 3.01Å; C690-L694 PolarHBondContact O-N 3.01Å
691	T	83.5	Confident	88.7	Confident	28 Å²	28	48 Å²	48	17%	0.172	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-41.4	179.6	-61.8	0	0	0	0	112.5	L652 L694 L695	L652-T691 HydrophobicContact CD1-CG2 4.22Å; L652-T691 HydrophobicContact CD2-CG2 4.01Å; L652-T691 HydrophobicContact CG-CG2 4.42Å; T691-L694 WeakPolarHBondContact O-CB 3.43Å; T691-L694 PolarHBondContact O-N 2.91Å; T691-L695 HydrophobicContact CG2-CD1 4.01Å; T691-L695 HydrophobicContact CG2-CG 4.42Å; T691-L695 WeakPolarHBondContact O-CG 3.37Å; T691-L695 PolarHBondContact O-N 3.14Å
692	E	86.3	Confident	88.8	Confident	112 Å²	112	45.1 Å²	45.1	52%	0.523	25%	0.252	S	S	.	.	H	α-helix	trans	-72.3	-39	-174.8	-45.2	-47.9	131.1	0	0	111.3	R557 L694 L695 E696	R557-E692 IonicContact NH1-OE1 2.73Å; R557-E692 PolarHBondContact NH1-OE1 3.37Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 3.32Å; E692-L695 PolarHBondContact O-N 3.35Å; E692-E696 PolarHBondContact O-N 2.84Å
693	E	89.4	Confident	88.9	Confident	81 Å²	81	50.1 Å²	50.1	38%	0.379	27%	0.272	S	S	.	.	H	α-helix	trans	-60	-38	169.5	-70.2	163.9	-117.9	0	0	112.5	W688 S689 C690 E696 A697	W688-E693 HydrophobicContact CB-CB 4.04Å; S689-E693 WeakPolarHBondContact CA-OE2 3.26Å; S689-E693 WeakPolarHBondContact CB-OE2 3.26Å; S689-E693 PolarHBondContact N-OE2 3.31Å; S689-E693 PolarHBondContact OG-OE1 3.01Å; S689-E693 PolarHBondContact OG-OE2 3.38Å; C690-E693 PolarHBondContact SG-OE1 3.01Å; E693-E696 PolarHBondContact O-N 3.19Å; E693-A697 WeakPolarHBondContact O-CB 3.49Å; E693-A697 PolarHBondContact O-N 2.69Å
694	L	89.4	Confident	89	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-66.7	-43.8	174.7	174.3	62	0	0	0	111.2	L554 I639 L652 V683 W688 C690 T691 E692 E696 A697 L698	L554-L694 HydrophobicContact CD2-CD2 4.33Å; I639-L694 HydrophobicContact CG2-CD1 3.95Å; I639-L694 HydrophobicContact CG2-CD2 4.42Å; L652-L694 HydrophobicContact CD1-CD2 4.03Å; V683-L694 HydrophobicContact CG1-CD1 4.11Å; W688-L694 HydrophobicContact CB-CB 4.02Å; W688-L694 HydrophobicContact CD2-CB 4.27Å; W688-L694 HydrophobicContact CD2-CD1 4.3Å; W688-L694 HydrophobicContact CG-CB 4.02Å; W688-L694 HydrophobicContact CG-CD1 4.01Å; C690-L694 PolarHBondContact O-N 3.01Å; T691-L694 WeakPolarHBondContact O-CB 3.43Å; T691-L694 PolarHBondContact O-N 2.91Å; E692-L694 VanDerWaalsContact C-N 3.31Å; E692-L694 PolarHBondContact O-N 3.32Å; L694-E696 VanDerWaalsContact C-N 3.29Å; L694-E696 PolarHBondContact O-N 2.96Å; L694-A697 PolarHBondContact O-N 2.87Å; L694-L698 HydrophobicContact CD1-CD1 4.29Å; L694-L698 HydrophobicContact CD1-CG 4.2Å; L694-L698 HydrophobicContact CG-CD1 4.19Å; L694-L698 WeakPolarHBondContact O-CB 3.4Å; L694-L698 VanDerWaalsContact O-CG 3.23Å; L694-L698 WeakPolarHBondContact O-CG 3.43Å; L694-L698 PolarHBondContact O-N 3Å
695	L	90.7	Very high	89.4	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	28%	0.279	C	S	.	.	H	α-helix	trans	-62	-38.2	177.4	-67.7	167.1	0	0	0	111.5	L554 R557 L558 T691 E692 L698 R699	L554-L695 HydrophobicContact CD2-CD2 4.35Å; R557-L695 HydrophobicContact CB-CD1 3.88Å; R557-L695 HydrophobicContact CB-CD2 3.79Å; L558-L695 HydrophobicContact CD2-CB 4.33Å; L558-L695 HydrophobicContact CD2-CD2 3.77Å; L558-L695 HydrophobicContact CG-CD2 3.78Å; T691-L695 HydrophobicContact CG2-CD1 4.01Å; T691-L695 HydrophobicContact CG2-CG 4.42Å; T691-L695 WeakPolarHBondContact O-CG 3.37Å; T691-L695 PolarHBondContact O-N 3.14Å; E692-L695 PolarHBondContact O-N 3.35Å; L695-L698 PolarHBondContact O-N 3.48Å; L695-R699 VanDerWaalsContact O-CG 3.3Å; L695-R699 WeakPolarHBondContact O-CG 3.27Å; L695-R699 PolarHBondContact O-N 2.97Å
696	E	91.9	Very high	90	Very high	96 Å²	96	52.8 Å²	52.8	45%	0.449	28%	0.277	S	S	.	.	H	α-helix	trans	-72	-39.8	175.5	-171.5	53.2	-151.2	0	0	112.4	E692 E693 L694 L698 R699 N700	E692-E696 PolarHBondContact O-N 2.84Å; E693-E696 PolarHBondContact O-N 3.19Å; L694-E696 VanDerWaalsContact C-N 3.29Å; L694-E696 PolarHBondContact O-N 2.96Å; E696-L698 VanDerWaalsContact C-N 3.27Å; E696-L698 PolarHBondContact O-N 2.94Å; E696-R699 PolarHBondContact O-N 3.44Å; E696-R699 VanDerWaalsContact OE2-CD 3.28Å; E696-R699 WeakPolarHBondContact OE2-CD 3.47Å; E696-N700 PolarHBondContact O-N 3Å; E696-N700 PolarHBondContact O-ND2 3.11Å; E696-N700 PolarHBondContact OE1-ND2 2.72Å
697	A	93.6	Very high	90.5	Very high	24 Å²	24	51 Å²	51	20%	0.198	28%	0.276	C	S	.	.	H	α-helix	trans	-59.5	-38.7	171.1	0	0	0	0	0	111.9	V683 E693 L694 A701	V683-A697 HydrophobicContact CG1-CB 4.32Å; E693-A697 WeakPolarHBondContact O-CB 3.49Å; E693-A697 PolarHBondContact O-N 2.69Å; L694-A697 PolarHBondContact O-N 2.87Å; A697-A701 VanDerWaalsContact O-CB 3.26Å; A697-A701 WeakPolarHBondContact O-CB 3.31Å; A697-A701 PolarHBondContact O-N 3.48Å
698	L	94.6	Very high	91.1	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-67.6	-41.6	175.1	-68.9	172	0	0	0	112.5	F545 L554 I637 I639 V683 L694 L695 E696 A701 V702	F545-L698 HydrophobicContact CD1-CD2 4.22Å; F545-L698 HydrophobicContact CE1-CD1 4.3Å; F545-L698 HydrophobicContact CE1-CD2 3.98Å; L554-L698 HydrophobicContact CD1-CD1 4.16Å; L554-L698 HydrophobicContact CD2-CD1 3.9Å; L554-L698 HydrophobicContact CG-CD1 4.5Å; I637-L698 HydrophobicContact CD1-CD2 4.49Å; I637-L698 HydrophobicContact CG2-CD2 3.7Å; I639-L698 HydrophobicContact CD1-CD1 4.04Å; I639-L698 HydrophobicContact CD1-CD2 3.81Å; I639-L698 HydrophobicContact CD1-CG 4.5Å; I639-L698 HydrophobicContact CG1-CD2 3.98Å; V683-L698 HydrophobicContact CG2-CD2 4.01Å; L694-L698 HydrophobicContact CD1-CD1 4.29Å; L694-L698 HydrophobicContact CD1-CG 4.2Å; L694-L698 HydrophobicContact CG-CD1 4.19Å; L694-L698 WeakPolarHBondContact O-CB 3.4Å; L694-L698 VanDerWaalsContact O-CG 3.23Å; L694-L698 WeakPolarHBondContact O-CG 3.43Å; L694-L698 PolarHBondContact O-N 3Å; L695-L698 PolarHBondContact O-N 3.48Å; E696-L698 VanDerWaalsContact C-N 3.27Å; E696-L698 PolarHBondContact O-N 2.94Å; L698-A701 PolarHBondContact O-N 3.29Å; L698-V702 WeakPolarHBondContact O-CG2 3.4Å; L698-V702 PolarHBondContact O-N 3.07Å
699	R	94.3	Very high	91.7	Very high	59 Å²	59	47.7 Å²	47.7	22%	0.223	26%	0.257	C	S	.	.	H	α-helix	trans	-58.4	-49.2	174.5	-74.1	163.3	178.9	-127.2	-13.3	111.5	L558 S564 F568 L695 E696 V702 H703	L558-R699 HydrophobicContact CD2-CG 4.13Å; L558-R699 PolarHBondContact O-NH2 3.08Å; S564-R699 PolarHBondContact OG-NH2 3.43Å; F568-R699 HydrophobicContact CE2-CG 4.41Å; F568-R699 HydrophobicContact CZ-CG 4.5Å; L695-R699 VanDerWaalsContact O-CG 3.3Å; L695-R699 WeakPolarHBondContact O-CG 3.27Å; L695-R699 PolarHBondContact O-N 2.97Å; E696-R699 PolarHBondContact O-N 3.44Å; E696-R699 VanDerWaalsContact OE2-CD 3.28Å; E696-R699 WeakPolarHBondContact OE2-CD 3.47Å; R699-V702 PolarHBondContact O-N 3.05Å; R699-H703 WeakPolarHBondContact O-CB 3.37Å; R699-H703 PolarHBondContact O-N 3.47Å
700	N	94	Very high	92.4	Very high	72 Å²	72	44.5 Å²	44.5	39%	0.385	24%	0.235	S	C	.	.	H	α-helix	trans	-66.2	-36.6	178	-74.2	-74.9	0	0	0	112.5	E696 H703 R704	E696-N700 PolarHBondContact O-N 3Å; E696-N700 PolarHBondContact O-ND2 3.11Å; E696-N700 PolarHBondContact OE1-ND2 2.72Å; N700-H703 PolarHBondContact O-N 3.35Å; N700-R704 WeakPolarHBondContact O-CB 3.44Å; N700-R704 PolarHBondContact O-N 3.28Å
701	A	95.6	Very high	93.1	Very high	2 Å²	2	42.5 Å²	42.5	2%	0.017	22%	0.222	C	C	.	.	H	α-helix	trans	-63.7	-47.7	173.9	0	0	0	0	0	111.9	I637 Y681 A697 L698 H703 R704 Q705	I637-A701 HydrophobicContact CD1-CB 4Å; Y681-A701 HydrophobicContact CD1-CB 3.93Å; Y681-A701 HydrophobicContact CE1-CB 3.72Å; A697-A701 VanDerWaalsContact O-CB 3.26Å; A697-A701 WeakPolarHBondContact O-CB 3.31Å; A697-A701 PolarHBondContact O-N 3.48Å; L698-A701 PolarHBondContact O-N 3.29Å; A701-H703 PolarHBondContact O-N 2.88Å; A701-R704 PolarHBondContact O-N 3.28Å; A701-Q705 VanDerWaalsContact O-CB 3.25Å; A701-Q705 WeakPolarHBondContact O-CB 3.42Å; A701-Q705 VanDerWaalsContact O-CG 3.24Å; A701-Q705 WeakPolarHBondContact O-CG 3.36Å; A701-Q705 PolarHBondContact O-N 2.88Å
702	V	96.1	Very high	93.7	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.012	21%	0.213	C	C	.	.	H	α-helix	trans	-61.4	-44	175.7	175.2	0	0	0	0	111.1	V543 F568 I635 I637 L698 R699 Q705 Q706	V543-V702 HydrophobicContact CG1-CG2 3.86Å; V543-V702 HydrophobicContact CG2-CG1 3.89Å; V543-V702 HydrophobicContact CG2-CG2 3.81Å; F568-V702 HydrophobicContact CE1-CB 4.42Å; F568-V702 HydrophobicContact CE1-CG1 4.03Å; F568-V702 HydrophobicContact CE1-CG2 4.45Å; F568-V702 HydrophobicContact CZ-CG1 4.49Å; I635-V702 HydrophobicContact CD1-CG1 4.07Å; I637-V702 HydrophobicContact CD1-CG2 3.54Å; L698-V702 WeakPolarHBondContact O-CG2 3.4Å; L698-V702 PolarHBondContact O-N 3.07Å; R699-V702 PolarHBondContact O-N 3.05Å; V702-Q705 PolarHBondContact O-N 2.93Å; V702-Q706 WeakPolarHBondContact O-CB 3.41Å; V702-Q706 PolarHBondContact O-N 3.33Å
703	H	94.6	Very high	94	Very high	145 Å²	145	36 Å²	36	67%	0.671	19%	0.189	S	C	*	.	H	α-helix	trans	-60.9	-48.9	179.1	-175.1	89.3	0	0	0	111.9	R699 N700 A701 Q706 G707	R699-H703 WeakPolarHBondContact O-CB 3.37Å; R699-H703 PolarHBondContact O-N 3.47Å; N700-H703 PolarHBondContact O-N 3.35Å; A701-H703 PolarHBondContact O-N 2.88Å; H703-Q706 PolarHBondContact O-N 3.3Å; H703-G707 PolarHBondContact O-N 3.22Å
704	R	94.8	Very high	93.8	Very high	110 Å²	110	34.6 Å²	34.6	42%	0.415	18%	0.184	S	C	.	.	H	α-helix	trans	-62.4	-46.3	177.4	-166.8	-178.4	-57.3	127	3.8	111.6	E448 Y681 N700 A701 Q706 G707 A708	E448-R704 WeakPolarHBondContact OE1-CD 3.42Å; E448-R704 WeakPolarHBondContact OE1-CG 3.41Å; E448-R704 WeakPolarHBondContact OE2-CD 3.49Å; Y681-R704 PolarHBondContact OH-NH1 2.97Å; Y681-R704 VanDerWaalsContact OH-NH1 3.07Å; N700-R704 WeakPolarHBondContact O-CB 3.44Å; N700-R704 PolarHBondContact O-N 3.28Å; A701-R704 PolarHBondContact O-N 3.28Å; R704-Q706 VanDerWaalsContact C-N 3.26Å; R704-Q706 PolarHBondContact O-N 2.86Å; R704-G707 PolarHBondContact O-N 3.39Å; R704-G707 VanDerWaalsContact O-N 3.12Å; R704-A708 PolarHBondContact O-N 2.86Å
705	Q	96	Very high	93.3	Very high	26 Å²	26	37.8 Å²	37.8	12%	0.121	20%	0.201	C	C	.	.	H	α-helix	trans	-72.4	-15.1	-178.6	-66.9	-65.3	-57.6	0	0	113.8	E448 R541 I635 Y681 A701 V702	E448-Q705 PolarHBondContact OE1-NE2 3.34Å; E448-Q705 VanDerWaalsContact OE1-NE2 3.09Å; R541-Q705 PolarHBondContact NH1-O 2.95Å; I635-Q705 HydrophobicContact CD1-CB 4.06Å; I635-Q705 HydrophobicContact CG1-CB 4.14Å; I635-Q705 HydrophobicContact CG2-CB 3.61Å; I635-Q705 HydrophobicContact CG2-CG 4.22Å; Y681-Q705 HydrophobicContact CD2-CG 4.04Å; Y681-Q705 HydrophobicContact CG-CG 4.1Å; A701-Q705 VanDerWaalsContact O-CB 3.25Å; A701-Q705 WeakPolarHBondContact O-CB 3.42Å; A701-Q705 VanDerWaalsContact O-CG 3.24Å; A701-Q705 WeakPolarHBondContact O-CG 3.36Å; A701-Q705 PolarHBondContact O-N 2.88Å; V702-Q705 PolarHBondContact O-N 2.93Å
706	Q	95.8	Very high	92.8	Very high	29 Å²	29	39.7 Å²	39.7	14%	0.136	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-35.5	167.7	-179.3	57.4	58.5	0	0	112.6	V537 T539 K540 H614 I635 V702 H703 R704	V537-Q706 PolarHBondContact O-NE2 3.5Å; T539-Q706 PolarHBondContact O-NE2 3.49Å; K540-Q706 HydrophobicContact CD-CG 4.34Å; H614-Q706 PolarHBondContact CE1-OE1 3.34Å; I635-Q706 HydrophobicContact CD1-CB 4.44Å; V702-Q706 WeakPolarHBondContact O-CB 3.41Å; V702-Q706 PolarHBondContact O-N 3.33Å; H703-Q706 PolarHBondContact O-N 3.3Å; R704-Q706 VanDerWaalsContact C-N 3.26Å; R704-Q706 PolarHBondContact O-N 2.86Å
707	G	92.6	Very high	92.1	Very high	71 Å²	71	35.9 Å²	35.9	73%	0.732	19%	0.19	S	C	*	.	H	α-helix	trans	-78.7	-22.9	173.7	0	0	0	0	0	113.4	H703 R704	H703-G707 PolarHBondContact O-N 3.22Å; R704-G707 PolarHBondContact O-N 3.39Å; R704-G707 VanDerWaalsContact O-N 3.12Å
708	A	95	Very high	90.6	Very high	7 Å²	7	44.7 Å²	44.7	6%	0.058	23%	0.227	C	C	.	.	S	Bend	trans	-72.7	146.3	-178.8	0	0	0	0	0	113.7	E448 R704 A710	E448-A708 HydrophobicContact CB-CB 3.99Å; E448-A708 HydrophobicContact CG-CB 4.14Å; E448-A708 CarbonylContact O-C 3.4Å; E448-A708 WeakPolarHBondContact O-CA 3.28Å; R704-A708 PolarHBondContact O-N 2.86Å; A708-A710 PolarHBondContact O-N 2.83Å
709	V	95.6	Very high	90.4	Very high	8 Å²	8	46.9 Å²	46.9	5%	0.048	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-63.8	128.8	170.2	174.1	0	0	0	0	110.6	E448 A450 P534 K536 W711	E448-V709 PolarHBondContact O-N 3.31Å; A450-V709 HydrophobicContact CB-CG1 4.45Å; A450-V709 HydrophobicContact CB-CG2 3.91Å; P534-V709 HydrophobicContact CB-CG1 3.49Å; P534-V709 VanDerWaalsContact CB-CG1 3.49Å; K536-V709 HydrophobicContact CD-CG2 4.44Å; K536-V709 HydrophobicContact CG-CG2 3.92Å; V709-W711 HydrophobicContact CG1-CD2 4.17Å; V709-W711 HydrophobicContact CG1-CG 4.48Å; V709-W711 HydrophobicContact CG1-CZ2 4.1Å
710	A	95.8	Very high	90.2	Very high	3 Å²	3	46.3 Å²	46.3	3%	0.025	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	117.1	170.4	0	0	0	0	0	109.5	V535 L678 A708 V712	V535-A710 HydrophobicContact CB-CB 4.34Å; V535-A710 PolarHBondContact N-O 3.18Å; V535-A710 PolarHBondContact O-N 2.94Å; L678-A710 HydrophobicContact CD1-CB 4.28Å; A708-A710 PolarHBondContact O-N 2.83Å; A710-V712 HydrophobicContact CB-CG2 4.4Å
711	W	96.3	Very high	89.9	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.015	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.4	177.8	-64.2	91.6	0	0	0	110.2	Y403 I426 V445 R447 A450 V532 P534 L679 V709	Y403-W711 AromaticContact CD1-CH2 3.62Å; Y403-W711 HydrophobicContact CD1-CH2 3.62Å; Y403-W711 AromaticContact CD1-CZ3 3.56Å; Y403-W711 HydrophobicContact CD1-CZ3 3.56Å; Y403-W711 HydrophobicContact CD2-CZ3 4.35Å; Y403-W711 AromaticContact CE1-CH2 3.84Å; Y403-W711 HydrophobicContact CE1-CH2 3.84Å; Y403-W711 HydrophobicContact CE1-CZ3 4.17Å; Y403-W711 HydrophobicContact CG-CH2 4.19Å; Y403-W711 AromaticContact CG-CZ3 3.67Å; Y403-W711 HydrophobicContact CG-CZ3 3.67Å; I426-W711 HydrophobicContact CD1-CB 4.48Å; I426-W711 HydrophobicContact CD1-CD2 4.47Å; I426-W711 HydrophobicContact CD1-CG 4.38Å; I426-W711 HydrophobicContact CG1-CD2 4.07Å; I426-W711 HydrophobicContact CG1-CG 4.2Å; I426-W711 HydrophobicContact CG2-CD2 4.1Å; I426-W711 HydrophobicContact CG2-CE3 3.81Å; I426-W711 HydrophobicContact CG2-CH2 3.74Å; I426-W711 HydrophobicContact CG2-CZ2 4.04Å; I426-W711 HydrophobicContact CG2-CZ3 3.62Å; V445-W711 HydrophobicContact CG1-CH2 3.99Å; V445-W711 HydrophobicContact CG1-CZ2 3.9Å; R447-W711 PolarHBondContact O-NE1 2.78Å; A450-W711 HydrophobicContact CB-CH2 3.89Å; A450-W711 HydrophobicContact CB-CZ2 3.61Å; V532-W711 HydrophobicContact CB-CE3 4.35Å; V532-W711 HydrophobicContact CG2-CE3 3.78Å; V532-W711 HydrophobicContact CG2-CZ3 4.35Å; P534-W711 HydrophobicContact CB-CD2 4.49Å; P534-W711 HydrophobicContact CB-CE3 3.95Å; P534-W711 HydrophobicContact CB-CH2 3.83Å; P534-W711 HydrophobicContact CB-CZ2 4.37Å; P534-W711 HydrophobicContact CB-CZ3 3.59Å; P534-W711 HydrophobicContact CG-CH2 4.32Å; P534-W711 HydrophobicContact CG-CZ3 3.94Å; L679-W711 HydrophobicContact CD1-CB 4.02Å; L679-W711 HydrophobicContact CD1-CG 4.12Å; L679-W711 HydrophobicContact CG-CB 4.15Å; L679-W711 PolarHBondContact N-O 2.99Å; V709-W711 HydrophobicContact CG1-CD2 4.17Å; V709-W711 HydrophobicContact CG1-CG 4.48Å; V709-W711 HydrophobicContact CG1-CZ2 4.1Å
712	V	95.4	Very high	89.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	130.6	-167.1	-159.4	0	0	0	0	112.1	V532 K533 V535 L628 Y633 P677 L678 A710 L714 L717	V532-V712 CarbonylContact C-O 3.6Å; V532-V712 WeakPolarHBondContact CA-O 3.39Å; K533-V712 PolarHBondContact N-O 2.65Å; K533-V712 PolarHBondContact O-N 3.4Å; K533-V712 VanDerWaalsContact O-N 3.13Å; V535-V712 HydrophobicContact CG2-CG2 3.96Å; L628-V712 HydrophobicContact CD1-CG1 4.3Å; L628-V712 HydrophobicContact CD2-CG1 3.98Å; Y633-V712 HydrophobicContact CD1-CG2 3.8Å; Y633-V712 HydrophobicContact CE1-CG1 4.48Å; Y633-V712 HydrophobicContact CE1-CG2 3.88Å; P677-V712 WeakPolarHBondContact O-CA 3.21Å; L678-V712 HydrophobicContact CD1-CG2 4Å; A710-V712 HydrophobicContact CB-CG2 4.4Å; V712-L714 HydrophobicContact CB-CD2 3.97Å; V712-L714 HydrophobicContact CB-CG 4.36Å; V712-L714 HydrophobicContact CG1-CD2 3.61Å; V712-L714 HydrophobicContact CG1-CG 4.38Å; V712-L714 PolarHBondContact O-N 3.43Å; V712-L717 HydrophobicContact CG1-CD1 4.3Å
713	E	93.1	Very high	89.2	Confident	3 Å²	3	50.2 Å²	50.2	1%	0.014	26%	0.258	C	S	.	.			trans	-83.2	63	175.4	-59.2	175.3	177.1	0	0	109.7	R405 R496 S530 L531 V532 P677 D715 R716	R405-E713 IonicContact NH1-OE1 2.68Å; R496-E713 IonicContact CZ-OE1 3.3Å; R496-E713 IonicContact CZ-OE2 3.77Å; R496-E713 IonicContact NH1-OE1 2.86Å; R496-E713 PolarHBondContact NH1-OE1 2.93Å; R496-E713 IonicContact NH1-OE2 3.06Å; R496-E713 VanDerWaalsContact NH2-CD 3.29Å; R496-E713 IonicContact NH2-OE1 3.25Å; R496-E713 PolarHBondContact NH2-OE1 2.84Å; R496-E713 IonicContact NH2-OE2 2.78Å; R496-E713 PolarHBondContact NH2-OE2 3.3Å; S530-E713 WeakPolarHBondContact CB-OE1 3.31Å; S530-E713 PolarHBondContact OG-OE1 3.11Å; L531-E713 WeakPolarHBondContact O-CA 3.46Å; V532-E713 HydrophobicContact CG1-CG 3.68Å; P677-E713 HydrophobicContact CB-CB 3.88Å; P677-E713 PolarHBondContact O-N 2.72Å; E713-D715 PolarHBondContact O-N 3.35Å; E713-R716 HydrophobicContact CB-CG 4.4Å; E713-R716 WeakPolarHBondContact O-CB 3.36Å; E713-R716 PolarHBondContact O-N 3.1Å; E713-R716 VanDerWaalsContact OE2-CD 3.22Å; E713-R716 WeakPolarHBondContact OE2-CD 3.36Å; E713-R716 IonicContact OE2-CZ 2.68Å; E713-R716 IonicContact OE2-NE 3.73Å; E713-R716 IonicContact OE2-NH1 3.95Å; E713-R716 PolarHBondContact OE2-NH1 3.32Å
714	L	83.8	Confident	88.8	Confident	51 Å²	51	43.9 Å²	43.9	27%	0.267	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-53.9	-29.9	-171.2	-66.8	-172.8	0	0	0	113.9	K533 V712 R716 L717	K533-L714 HydrophobicContact CB-CD1 4.33Å; K533-L714 HydrophobicContact CD-CB 4.22Å; K533-L714 HydrophobicContact CD-CD1 3.74Å; K533-L714 HydrophobicContact CD-CG 4.15Å; V712-L714 HydrophobicContact CB-CD2 3.97Å; V712-L714 HydrophobicContact CB-CG 4.36Å; V712-L714 HydrophobicContact CG1-CD2 3.61Å; V712-L714 HydrophobicContact CG1-CG 4.38Å; V712-L714 PolarHBondContact O-N 3.43Å; L714-R716 PolarHBondContact O-N 2.85Å; L714-L717 HydrophobicContact CD2-CD1 3.88Å; L714-L717 WeakPolarHBondContact O-CB 3.38Å; L714-L717 PolarHBondContact O-N 3.43Å
715	D	79.6	Confident	88.4	Confident	68 Å²	68	39.1 Å²	39.1	36%	0.364	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-75.4	-13.2	-173.6	-52.3	-12.2	0	0	0	111.7	L531 K533 E713 Q718	L531-D715 VanDerWaalsContact CD2-OD2 3.31Å; L531-D715 WeakPolarHBondContact CD2-OD2 3.4Å; K533-D715 IonicContact NZ-OD1 2.82Å; K533-D715 PolarHBondContact NZ-OD1 2.83Å; K533-D715 IonicContact NZ-OD2 2.61Å; K533-D715 PolarHBondContact NZ-OD2 2.82Å; E713-D715 PolarHBondContact O-N 3.35Å; D715-Q718 PolarHBondContact OD1-NE2 2.91Å
716	R	79.8	Confident	87.8	Confident	52 Å²	52	40.2 Å²	40.2	20%	0.196	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-83.9	-6.6	167.8	-66.9	179.2	58.8	-152.4	-8.8	113.8	T675 E713 L714	T675-R716 VanDerWaalsContact O-CZ 3.31Å; T675-R716 PolarHBondContact O-NH1 3.27Å; T675-R716 PolarHBondContact O-NH2 3.48Å; E713-R716 HydrophobicContact CB-CG 4.4Å; E713-R716 WeakPolarHBondContact O-CB 3.36Å; E713-R716 PolarHBondContact O-N 3.1Å; E713-R716 VanDerWaalsContact OE2-CD 3.22Å; E713-R716 WeakPolarHBondContact OE2-CD 3.36Å; E713-R716 IonicContact OE2-CZ 2.68Å; E713-R716 IonicContact OE2-NE 3.73Å; E713-R716 IonicContact OE2-NH1 3.95Å; E713-R716 PolarHBondContact OE2-NH1 3.32Å; L714-R716 PolarHBondContact O-N 2.85Å
717	L	78.2	Confident	87.2	Confident	17 Å²	17	41.1 Å²	41.1	9%	0.089	23%	0.232	C	C	.	.			trans	-96.9	-10.3	-177.6	-55.7	177.2	0	0	0	113.4	E625 L628 R629 P677 V712 L714	E625-L717 HydrophobicContact CG-CD2 3.59Å; L628-L717 HydrophobicContact CB-CD1 3.67Å; L628-L717 HydrophobicContact CB-CD2 4.21Å; R629-L717 HydrophobicContact CG-CB 4.12Å; R629-L717 PolarHBondContact NE-O 2.88Å; P677-L717 HydrophobicContact CB-CD2 4.32Å; P677-L717 HydrophobicContact CG-CD2 3.88Å; V712-L717 HydrophobicContact CG1-CD1 4.3Å; L714-L717 HydrophobicContact CD2-CD1 3.88Å; L714-L717 WeakPolarHBondContact O-CB 3.38Å; L714-L717 PolarHBondContact O-N 3.43Å
718	Q	60.9	Low	86.7	Confident	209 Å²	209	38.4 Å²	38.4	98%	0.977	19%	0.187	S	C	*	.			trans	-72.2	0	-175.1	-58.1	-176	17	0	0	112.8	D715	D715-Q718 PolarHBondContact OD1-NE2 2.91Å

Retrieved 718 of 718 residues in 425.6 ms (Link to these results)

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