A0A3B3UN18_9TELE Loading...

Pre-mRNA-processing factor 19

Ubiquitin-protein ligase which is mainly involved pre-mRNA splicing and DNA repair. Required for pre-mRNA splicing as component of the spliceosome.

AlphaFold DB , UniProt , Accession A0A3B3UN18, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 505 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	51.3	Low	76.1	Confident	244 Å²	244	83.1 Å²	83.1	100%	1.202	46%	0.463	S	S	*	.				0	116	0	-76.1	-172.8	-111.9	0	0	107
2	S	63.3	Low	76.3	Confident	90 Å²	90	76.6 Å²	76.6	63%	0.629	43%	0.427	S	S	*	.			trans	-65.1	136.9	173	43.9	0	0	0	0	108.9	V4	S2-V4 PolarHBondContact O-N 3.34Å
3	L	73.9	Confident	76.3	Confident	67 Å²	67	79.8 Å²	79.8	35%	0.351	44%	0.437	S	S	.	.			trans	-64.5	124.7	164.3	-75.2	158.3	0	0	0	107.1	P12 V24 V57	L3-P12 HydrophobicContact CB-CG 4.4Å; L3-P12 VanDerWaalsContact O-CD 3.29Å; L3-P12 WeakPolarHBondContact O-CD 3.46Å; L3-V24 HydrophobicContact CD2-CG1 4.29Å; L3-V24 HydrophobicContact CD2-CG2 4.04Å; L3-V57 HydrophobicContact CD1-CG1 4.15Å; L3-V57 HydrophobicContact CD1-CG2 3.66Å
4	V	81.3	Confident	76.8	Confident	51 Å²	51	82.8 Å²	82.8	31%	0.309	45%	0.446	S	S	.	.			trans	-125.8	133.4	-179.9	-179	0	0	0	0	107.9	S2 N9	S2-V4 PolarHBondContact O-N 3.34Å; V4-N9 VanDerWaalsContact CG1-CA 3.44Å; V4-N9 HydrophobicContact CG1-CB 4.26Å; V4-N9 VanDerWaalsContact CG1-O 3.28Å; V4-N9 WeakPolarHBondContact CG1-O 3.42Å; V4-N9 WeakPolarHBondContact CG1-OD1 3.49Å
5	C	82.2	Confident	77.3	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	42%	0.422	C	S	.	.			trans	-70.9	128.6	176.3	173.6	0	0	0	0	109.8	I7 C8 N9 E10 P12 V24 E26	C5-I7 PolarHBondContact O-N 3.26Å; C5-C8 WeakPolarHBondContact CB-SG 3.29Å; C5-C8 PolarHBondContact SG-SG 3.34Å; C5-N9 WeakPolarHBondContact O-CA 3.41Å; C5-N9 PolarHBondContact O-N 3.47Å; C5-E10 WeakPolarHBondContact CB-O 3.42Å; C5-E10 PolarHBondContact N-O 3.08Å; C5-P12 HydrophobicContact CB-CB 4.49Å; C5-V24 WeakPolarHBondContact CA-O 3.19Å; C5-E26 HydrophobicContact CB-CB 4.41Å; C5-E26 PolarHBondContact SG-N 3.5Å
6	A	82.6	Confident	77.9	Confident	40 Å²	40	73.2 Å²	73.2	33%	0.331	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.9	-178.4	0	0	0	0	0	114.3	H23 V24 F25	A6-H23 HydrophobicContact CB-CB 4.22Å; A6-V24 PolarHBondContact N-O 3Å; A6-F25 HydrophobicContact CB-CD1 4.05Å; A6-F25 HydrophobicContact CB-CE1 3.67Å; A6-F25 HydrophobicContact CB-CZ 4.32Å
7	I	82.6	Confident	78.4	Confident	74 Å²	74	71.6 Å²	71.6	38%	0.379	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-51.7	179.9	-65	162.7	0	0	0	111.8	C5 F25 L29 P41	C5-I7 PolarHBondContact O-N 3.26Å; I7-F25 HydrophobicContact CD1-CD1 3.61Å; I7-F25 HydrophobicContact CD1-CE1 4.1Å; I7-F25 HydrophobicContact CG1-CD1 3.7Å; I7-F25 HydrophobicContact CG1-CE1 3.89Å; I7-L29 HydrophobicContact CB-CD1 4.44Å; I7-L29 HydrophobicContact CD1-CB 4.05Å; I7-L29 HydrophobicContact CG2-CD1 4.25Å; I7-P41 HydrophobicContact CD1-CG 4.28Å; I7-P41 HydrophobicContact CG1-CG 4.39Å
8	C	79.1	Confident	78.7	Confident	50 Å²	50	67.6 Å²	67.6	34%	0.338	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-8.5	-174.2	57.3	0	0	0	0	113.8	C5 E10 L29	C5-C8 WeakPolarHBondContact CB-SG 3.29Å; C5-C8 PolarHBondContact SG-SG 3.34Å; C8-E10 HydrophobicContact CB-CG 4.34Å; C8-E10 PolarHBondContact O-N 2.74Å; C8-E10 VanDerWaalsContact O-N 3.09Å; C8-L29 HydrophobicContact CB-CD1 3.87Å
9	N	79.3	Confident	78.8	Confident	135 Å²	135	67.5 Å²	67.5	72%	0.722	37%	0.367	S	S	*	.			trans	56.8	19.8	-174.1	-144.6	30.8	0	0	0	113.9	V4 C5	V4-N9 VanDerWaalsContact CG1-CA 3.44Å; V4-N9 HydrophobicContact CG1-CB 4.26Å; V4-N9 VanDerWaalsContact CG1-O 3.28Å; V4-N9 WeakPolarHBondContact CG1-O 3.42Å; V4-N9 WeakPolarHBondContact CG1-OD1 3.49Å; C5-N9 WeakPolarHBondContact O-CA 3.41Å; C5-N9 PolarHBondContact O-N 3.47Å
10	E	79.6	Confident	78.9	Confident	110 Å²	110	66.2 Å²	66.2	51%	0.514	36%	0.361	S	S	.	.	S	Bend	trans	-98.8	165	173.9	-63.8	-172.3	179	0	0	111.6	C5 C8 P12 R62	C5-E10 WeakPolarHBondContact CB-O 3.42Å; C5-E10 PolarHBondContact N-O 3.08Å; C8-E10 HydrophobicContact CB-CG 4.34Å; C8-E10 PolarHBondContact O-N 2.74Å; C8-E10 VanDerWaalsContact O-N 3.09Å; E10-P12 WeakPolarHBondContact O-CD 3.45Å; E10-R62 IonicContact OE2-NH2 3.84Å
11	V	81.6	Confident	79	Confident	53 Å²	53	63.7 Å²	63.7	32%	0.321	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-71.9	119.4	172	-177.1	0	0	0	0	109.2	P60 R62	V11-P60 HydrophobicContact CG1-CB 3.71Å; V11-P60 HydrophobicContact CG1-CG 3.85Å; V11-R62 PolarHBondContact O-NH2 3.18Å
12	P	78.8	Confident	80.5	Confident	5 Å²	5	57.9 Å²	57.9	3%	0.032	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-70.4	143	-177.5	28.1	-33.2	0	0	0	112.4	L3 C5 E10 P15 V24 E26	L3-P12 HydrophobicContact CB-CG 4.4Å; L3-P12 VanDerWaalsContact O-CD 3.29Å; L3-P12 WeakPolarHBondContact O-CD 3.46Å; C5-P12 HydrophobicContact CB-CB 4.49Å; E10-P12 WeakPolarHBondContact O-CD 3.45Å; P12-P15 HydrophobicContact CB-CB 4.15Å; P12-P15 HydrophobicContact CG-CB 3.82Å; P12-V24 HydrophobicContact CG-CG1 4.29Å; P12-E26 WeakPolarHBondContact CA-OE2 3.42Å; P12-E26 HydrophobicContact CB-CB 4.34Å; P12-E26 WeakPolarHBondContact CB-OE2 3.45Å
13	E	76.3	Confident	81.5	Confident	118 Å²	118	57.5 Å²	57.5	55%	0.551	31%	0.311	S	S	*	.	S	Bend	trans	-83	-43.7	171.6	-66.1	-169.9	166.1	0	0	110.7	P15 E26	E13-P15 WeakPolarHBondContact O-CD 3.44Å; E13-E26 PolarHBondContact N-OE2 3.21Å
14	H	83.3	Confident	82.2	Confident	122 Å²	122	55.7 Å²	55.7	57%	0.565	30%	0.303	S	S	*	.	S	Bend	trans	-118.9	83.3	173.8	-68.1	-69.2	0	0	0	109.5	C16 E26 R27	H14-C16 PolarHBondContact O-N 3.42Å; H14-E26 PolarHBondContact N-OE1 3.4Å; H14-E26 PolarHBondContact N-OE2 2.95Å; H14-R27 HydrophobicContact CB-CB 3.98Å; H14-R27 WeakPolarHBondContact O-CB 3.23Å; H14-R27 PolarHBondContact O-N 3.04Å
15	P	85.1	Confident	82.4	Confident	12 Å²	12	53.2 Å²	53.2	8%	0.078	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	126.1	178.7	25	-30.6	0	0	0	110.9	P12 E13 V24 F25 I55 V57	P12-P15 HydrophobicContact CB-CB 4.15Å; P12-P15 HydrophobicContact CG-CB 3.82Å; E13-P15 WeakPolarHBondContact O-CD 3.44Å; P15-V24 HydrophobicContact CB-CG1 3.96Å; P15-F25 WeakPolarHBondContact CA-O 3.4Å; P15-I55 HydrophobicContact CB-CB 4.21Å; P15-I55 HydrophobicContact CB-CD1 4.5Å; P15-I55 HydrophobicContact CG-CB 4.13Å; P15-I55 PolarHBondContact O-N 3.27Å; P15-V57 HydrophobicContact CG-CG2 3.75Å
16	C	85.4	Confident	82.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	151.7	170.9	60.3	0	0	0	0	109.2	H14 V24 F25 R27 I30 V53	H14-C16 PolarHBondContact O-N 3.42Å; C16-V24 WeakPolarHBondContact O-CA 3.45Å; C16-F25 PolarHBondContact N-O 3.46Å; C16-F25 PolarHBondContact O-N 3Å; C16-F25 PolarHBondContact SG-O 3.19Å; C16-R27 HydrophobicContact CB-CB 4.44Å; C16-R27 VanDerWaalsContact SG-CA 3.52Å; C16-I30 WeakPolarHBondContact SG-CG2 3.48Å; C16-V53 CarbonylContact C-O 3.58Å; C16-V53 WeakPolarHBondContact CA-O 3.26Å
17	I	87	Confident	82.9	Confident	46 Å²	46	56.2 Å²	56.2	24%	0.236	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	135.3	175.5	-163.6	163.5	0	0	0	109.2	H23 V53 I55	I17-H23 WeakPolarHBondContact CG1-O 3.48Å; I17-V53 HydrophobicContact CG2-CB 3.66Å; I17-V53 HydrophobicContact CG2-CG1 4.15Å; I17-V53 PolarHBondContact N-O 3.12Å; I17-V53 PolarHBondContact O-N 2.9Å; I17-I55 HydrophobicContact CB-CD1 4.26Å
18	S	84.2	Confident	83.1	Confident	0 Å²	0	61 Å²	61	0%	0	31%	0.305	C	S	.	.			trans	-82.4	125.9	166.1	168.9	0	0	0	0	108.3	V20 S21 N22 H23 D40	S18-V20 PolarHBondContact O-N 2.87Å; S18-V20 PolarHBondContact OG-N 3.41Å; S18-S21 WeakPolarHBondContact CB-OG 3.48Å; S18-S21 PolarHBondContact OG-N 2.86Å; S18-N22 VanDerWaalsContact O-CA 3.26Å; S18-N22 WeakPolarHBondContact O-CA 3.41Å; S18-N22 PolarHBondContact O-N 2.97Å; S18-H23 PolarHBondContact N-O 3.42Å; S18-D40 VanDerWaalsContact CB-OD2 3.29Å; S18-D40 WeakPolarHBondContact CB-OD2 3.3Å; S18-D40 PolarHBondContact OG-OD2 3.47Å
19	P	81	Confident	83.5	Confident	65 Å²	65	60.4 Å²	60.4	42%	0.422	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-15.4	176.9	27.3	-33.3	0	0	0	112.6	Q51	P19-Q51 WeakPolarHBondContact CD-O 3.42Å; P19-Q51 HydrophobicContact CG-CB 4.28Å; P19-Q51 WeakPolarHBondContact CG-O 3.35Å
20	V	80.6	Confident	83.8	Confident	41 Å²	41	54 Å²	54	25%	0.248	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-44.3	-174.7	173.7	0	0	0	0	111	S18 N43 Q45 L47	S18-V20 PolarHBondContact O-N 2.87Å; S18-V20 PolarHBondContact OG-N 3.41Å; V20-N43 WeakPolarHBondContact CG1-ND2 3.45Å; V20-N43 PolarHBondContact O-ND2 2.82Å; V20-Q45 HydrophobicContact CG1-CB 3.48Å; V20-Q45 VanDerWaalsContact CG1-CB 3.48Å; V20-Q45 HydrophobicContact CG1-CG 4.03Å; V20-L47 HydrophobicContact CG2-CD1 4.01Å
21	S	79.8	Confident	84.2	Confident	15 Å²	15	51.4 Å²	51.4	11%	0.105	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-15.1	176.5	57.2	0	0	0	0	113.8	S18 H23 D40	S18-S21 WeakPolarHBondContact CB-OG 3.48Å; S18-S21 PolarHBondContact OG-N 2.86Å; S21-H23 PolarHBondContact O-CE1 3.41Å; S21-H23 PolarHBondContact O-N 2.97Å; S21-H23 VanDerWaalsContact O-N 3.15Å; S21-H23 PolarHBondContact O-ND1 2.92Å; S21-D40 WeakPolarHBondContact CB-OD2 3.32Å; S21-D40 PolarHBondContact N-OD2 2.96Å; S21-D40 PolarHBondContact OG-OD1 2.79Å; S21-D40 PolarHBondContact OG-OD2 3.5Å
22	N	83.9	Confident	84.5	Confident	121 Å²	121	54.9 Å²	54.9	65%	0.647	26%	0.262	S	S	*	.			trans	54.8	21.5	-171.1	-63.8	-47.4	0	0	0	114	S18	S18-N22 VanDerWaalsContact O-CA 3.26Å; S18-N22 WeakPolarHBondContact O-CA 3.41Å; S18-N22 PolarHBondContact O-N 2.97Å
23	H	84.8	Confident	84.8	Confident	83 Å²	83	58.2 Å²	58.2	38%	0.384	28%	0.275	S	S	.	.			trans	-96.9	149.1	177.1	-74.1	73.2	0	0	0	111.2	A6 I17 S18 S21 F25	A6-H23 HydrophobicContact CB-CB 4.22Å; I17-H23 WeakPolarHBondContact CG1-O 3.48Å; S18-H23 PolarHBondContact N-O 3.42Å; S21-H23 PolarHBondContact O-CE1 3.41Å; S21-H23 PolarHBondContact O-N 2.97Å; S21-H23 VanDerWaalsContact O-N 3.15Å; S21-H23 PolarHBondContact O-ND1 2.92Å; H23-F25 HydrophobicContact CB-CD2 4.49Å; H23-F25 HydrophobicContact CB-CE1 4.47Å; H23-F25 HydrophobicContact CB-CE2 3.7Å; H23-F25 HydrophobicContact CB-CZ 3.69Å; H23-F25 WeakPolarHBondContact O-CD2 3.33Å; H23-F25 VanDerWaalsContact O-CE2 3.28Å; H23-F25 WeakPolarHBondContact O-CE2 3.31Å
24	V	87.6	Confident	85.3	Confident	28 Å²	28	53.2 Å²	53.2	17%	0.17	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	132	177.1	-178.3	0	0	0	0	109.6	L3 C5 A6 P12 P15 C16 I55	L3-V24 HydrophobicContact CD2-CG1 4.29Å; L3-V24 HydrophobicContact CD2-CG2 4.04Å; C5-V24 WeakPolarHBondContact CA-O 3.19Å; A6-V24 PolarHBondContact N-O 3Å; P12-V24 HydrophobicContact CG-CG1 4.29Å; P15-V24 HydrophobicContact CB-CG1 3.96Å; C16-V24 WeakPolarHBondContact O-CA 3.45Å; V24-I55 HydrophobicContact CG1-CD1 4.42Å; V24-I55 HydrophobicContact CG2-CD1 4.09Å
25	F	86.7	Confident	85.5	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	158.5	-179.4	-60	-78.7	0	0	0	111.4	A6 I7 P15 C16 H23 I30 P41 M42	A6-F25 HydrophobicContact CB-CD1 4.05Å; A6-F25 HydrophobicContact CB-CE1 3.67Å; A6-F25 HydrophobicContact CB-CZ 4.32Å; I7-F25 HydrophobicContact CD1-CD1 3.61Å; I7-F25 HydrophobicContact CD1-CE1 4.1Å; I7-F25 HydrophobicContact CG1-CD1 3.7Å; I7-F25 HydrophobicContact CG1-CE1 3.89Å; P15-F25 WeakPolarHBondContact CA-O 3.4Å; C16-F25 PolarHBondContact N-O 3.46Å; C16-F25 PolarHBondContact O-N 3Å; C16-F25 PolarHBondContact SG-O 3.19Å; H23-F25 HydrophobicContact CB-CD2 4.49Å; H23-F25 HydrophobicContact CB-CE1 4.47Å; H23-F25 HydrophobicContact CB-CE2 3.7Å; H23-F25 HydrophobicContact CB-CZ 3.69Å; H23-F25 WeakPolarHBondContact O-CD2 3.33Å; H23-F25 VanDerWaalsContact O-CE2 3.28Å; H23-F25 WeakPolarHBondContact O-CE2 3.31Å; F25-I30 HydrophobicContact CB-CB 4.01Å; F25-I30 HydrophobicContact CB-CD1 3.95Å; F25-I30 HydrophobicContact CB-CG2 4.15Å; F25-I30 HydrophobicContact CD1-CD1 4.13Å; F25-I30 HydrophobicContact CD2-CD1 3.28Å; F25-I30 HydrophobicContact CE1-CD1 4.44Å; F25-I30 HydrophobicContact CE2-CD1 3.68Å; F25-I30 HydrophobicContact CG-CB 4.37Å; F25-I30 HydrophobicContact CG-CD1 3.52Å; F25-I30 HydrophobicContact CZ-CD1 4.23Å; F25-P41 HydrophobicContact CD1-CG 4.5Å; F25-P41 HydrophobicContact CE1-CG 3.66Å; F25-P41 HydrophobicContact CZ-CG 3.85Å; F25-M42 HydrophobicContact CE1-CG 4.3Å; F25-M42 HydrophobicContact CZ-CG 3.92Å
26	E	87.8	Confident	85.6	Confident	21 Å²	21	56.6 Å²	56.6	10%	0.098	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	124.8	164.3	-179.4	62.1	-161.6	0	0	108.9	C5 P12 E13 H14 R28 L29 I30	C5-E26 HydrophobicContact CB-CB 4.41Å; C5-E26 PolarHBondContact SG-N 3.5Å; P12-E26 WeakPolarHBondContact CA-OE2 3.42Å; P12-E26 HydrophobicContact CB-CB 4.34Å; P12-E26 WeakPolarHBondContact CB-OE2 3.45Å; E13-E26 PolarHBondContact N-OE2 3.21Å; H14-E26 PolarHBondContact N-OE1 3.4Å; H14-E26 PolarHBondContact N-OE2 2.95Å; E26-R28 VanDerWaalsContact C-N 3.33Å; E26-R28 PolarHBondContact O-N 2.91Å; E26-L29 HydrophobicContact CB-CB 4.34Å; E26-L29 HydrophobicContact CB-CD1 4.03Å; E26-L29 HydrophobicContact CB-CG 4.12Å; E26-L29 HydrophobicContact CG-CD1 4.46Å; E26-L29 HydrophobicContact CG-CG 4.26Å; E26-L29 PolarHBondContact O-N 3.19Å; E26-I30 PolarHBondContact O-N 2.79Å; E26-I30 VanDerWaalsContact O-N 3.12Å
27	R	86.3	Confident	85.5	Confident	82 Å²	82	60.6 Å²	60.6	31%	0.309	30%	0.301	S	S	.	.	H	α-helix	trans	-51	-48.2	-173.5	-175.1	168.9	178.5	131	8.8	113.6	H14 C16 L29 I30 E31 D54	H14-R27 HydrophobicContact CB-CB 3.98Å; H14-R27 WeakPolarHBondContact O-CB 3.23Å; H14-R27 PolarHBondContact O-N 3.04Å; C16-R27 HydrophobicContact CB-CB 4.44Å; C16-R27 VanDerWaalsContact SG-CA 3.52Å; R27-L29 VanDerWaalsContact C-N 3.25Å; R27-L29 PolarHBondContact O-N 3.3Å; R27-I30 WeakPolarHBondContact O-CG2 3.5Å; R27-I30 PolarHBondContact O-N 3.06Å; R27-E31 HydrophobicContact CG-CG 4.25Å; R27-E31 WeakPolarHBondContact CG-OE1 3.48Å; R27-E31 IonicContact CZ-OE1 3.06Å; R27-E31 VanDerWaalsContact CZ-OE1 3.32Å; R27-E31 IonicContact NE-OE1 3.32Å; R27-E31 PolarHBondContact NE-OE1 3Å; R27-E31 IonicContact NH2-OE1 3.58Å; R27-E31 PolarHBondContact NH2-OE1 3.36Å; R27-E31 WeakPolarHBondContact O-CB 3.44Å; R27-E31 WeakPolarHBondContact O-CG 3.43Å; R27-E31 PolarHBondContact O-N 3.02Å; R27-D54 IonicContact CZ-OD1 3.27Å; R27-D54 IonicContact NH1-OD1 3.56Å; R27-D54 PolarHBondContact NH1-OD1 3.36Å; R27-D54 IonicContact NH1-OD2 3.8Å; R27-D54 PolarHBondContact NH1-OD2 2.81Å
28	R	88.2	Confident	85.2	Confident	174 Å²	174	60.2 Å²	60.2	66%	0.657	31%	0.308	S	S	*	.	H	α-helix	trans	-57.6	-36.7	178.5	-175	-176.5	69.1	90.1	-1.7	113.2	E26 K32	E26-R28 VanDerWaalsContact C-N 3.33Å; E26-R28 PolarHBondContact O-N 2.91Å; R28-K32 WeakPolarHBondContact O-CB 3.48Å; R28-K32 PolarHBondContact O-N 3.28Å
29	L	86.5	Confident	85.3	Confident	37 Å²	37	62.1 Å²	62.1	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-78.9	-40.6	-176	-64.9	-179	0	0	0	111.3	I7 C8 E26 R27 Y33	I7-L29 HydrophobicContact CB-CD1 4.44Å; I7-L29 HydrophobicContact CD1-CB 4.05Å; I7-L29 HydrophobicContact CG2-CD1 4.25Å; C8-L29 HydrophobicContact CB-CD1 3.87Å; E26-L29 HydrophobicContact CB-CB 4.34Å; E26-L29 HydrophobicContact CB-CD1 4.03Å; E26-L29 HydrophobicContact CB-CG 4.12Å; E26-L29 HydrophobicContact CG-CD1 4.46Å; E26-L29 HydrophobicContact CG-CG 4.26Å; E26-L29 PolarHBondContact O-N 3.19Å; R27-L29 VanDerWaalsContact C-N 3.25Å; R27-L29 PolarHBondContact O-N 3.3Å; L29-Y33 PolarHBondContact O-N 3.17Å; L29-Y33 VanDerWaalsContact O-N 3.08Å
30	I	86	Confident	85.4	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-74.4	-37.2	179.7	-169	151.5	0	0	0	112.4	C16 F25 E26 R27 K32 Y33 I34 L47 L52	C16-I30 WeakPolarHBondContact SG-CG2 3.48Å; F25-I30 HydrophobicContact CB-CB 4.01Å; F25-I30 HydrophobicContact CB-CD1 3.95Å; F25-I30 HydrophobicContact CB-CG2 4.15Å; F25-I30 HydrophobicContact CD1-CD1 4.13Å; F25-I30 HydrophobicContact CD2-CD1 3.28Å; F25-I30 HydrophobicContact CE1-CD1 4.44Å; F25-I30 HydrophobicContact CE2-CD1 3.68Å; F25-I30 HydrophobicContact CG-CB 4.37Å; F25-I30 HydrophobicContact CG-CD1 3.52Å; F25-I30 HydrophobicContact CZ-CD1 4.23Å; E26-I30 PolarHBondContact O-N 2.79Å; E26-I30 VanDerWaalsContact O-N 3.12Å; R27-I30 WeakPolarHBondContact O-CG2 3.5Å; R27-I30 PolarHBondContact O-N 3.06Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 3.24Å; I30-Y33 PolarHBondContact O-N 3.25Å; I30-Y33 VanDerWaalsContact O-N 3.16Å; I30-I34 HydrophobicContact CG1-CD1 3.81Å; I30-I34 HydrophobicContact CG1-CG1 4.18Å; I30-I34 WeakPolarHBondContact O-CB 3.46Å; I30-I34 VanDerWaalsContact O-CG1 3.25Å; I30-I34 WeakPolarHBondContact O-CG1 3.41Å; I30-I34 PolarHBondContact O-N 2.83Å; I30-L47 HydrophobicContact CD1-CD2 4.21Å; I30-L52 HydrophobicContact CD1-CD2 3.93Å; I30-L52 HydrophobicContact CG1-CD2 4.19Å; I30-L52 HydrophobicContact CG2-CD1 3.78Å; I30-L52 HydrophobicContact CG2-CD2 4.17Å
31	E	87.7	Confident	85.4	Confident	56 Å²	56	58.8 Å²	58.8	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-60.4	-44	173.7	-74.4	174.5	168.4	0	0	110.6	R27 Y33 I34 A35 L52	R27-E31 HydrophobicContact CG-CG 4.25Å; R27-E31 WeakPolarHBondContact CG-OE1 3.48Å; R27-E31 IonicContact CZ-OE1 3.06Å; R27-E31 VanDerWaalsContact CZ-OE1 3.32Å; R27-E31 IonicContact NE-OE1 3.32Å; R27-E31 PolarHBondContact NE-OE1 3Å; R27-E31 IonicContact NH2-OE1 3.58Å; R27-E31 PolarHBondContact NH2-OE1 3.36Å; R27-E31 WeakPolarHBondContact O-CB 3.44Å; R27-E31 WeakPolarHBondContact O-CG 3.43Å; R27-E31 PolarHBondContact O-N 3.02Å; E31-Y33 VanDerWaalsContact C-N 3.33Å; E31-Y33 PolarHBondContact O-N 3.31Å; E31-I34 PolarHBondContact O-N 2.92Å; E31-A35 WeakPolarHBondContact O-CB 3.49Å; E31-A35 PolarHBondContact O-N 3.27Å; E31-L52 HydrophobicContact CG-CD1 4.18Å
32	K	88.1	Confident	85.6	Confident	127 Å²	127	63 Å²	63	55%	0.552	32%	0.318	S	S	*	.	H	α-helix	trans	-61.8	-40.7	175	-171.3	179	177.3	-174	0	112.3	R28 I30 E36	R28-K32 WeakPolarHBondContact O-CB 3.48Å; R28-K32 PolarHBondContact O-N 3.28Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 3.24Å; K32-E36 WeakPolarHBondContact CE-OE1 3.37Å; K32-E36 WeakPolarHBondContact O-CG 3.33Å; K32-E36 PolarHBondContact O-N 2.94Å
33	Y	85.3	Confident	85.4	Confident	75 Å²	75	60.1 Å²	60.1	29%	0.294	30%	0.303	S	S	.	.	H	α-helix	trans	-68.1	-40.9	178.6	-172.7	-90.3	0	0	0	112.3	L29 I30 E31 E36 N37 T39 P41	L29-Y33 PolarHBondContact O-N 3.17Å; L29-Y33 VanDerWaalsContact O-N 3.08Å; I30-Y33 PolarHBondContact O-N 3.25Å; I30-Y33 VanDerWaalsContact O-N 3.16Å; E31-Y33 VanDerWaalsContact C-N 3.33Å; E31-Y33 PolarHBondContact O-N 3.31Å; Y33-E36 PolarHBondContact O-N 3.05Å; Y33-N37 HydrophobicContact CD1-CB 4.48Å; Y33-N37 WeakPolarHBondContact CD2-ND2 3.43Å; Y33-N37 HydrophobicContact CE1-CB 4.06Å; Y33-N37 WeakPolarHBondContact CE2-ND2 3.41Å; Y33-N37 PolarHBondContact O-N 2.91Å; Y33-T39 VanDerWaalsContact CD1-O 3.24Å; Y33-T39 WeakPolarHBondContact CD1-O 3.39Å; Y33-T39 WeakPolarHBondContact CE1-O 3.48Å; Y33-P41 HydrophobicContact CD1-CB 3.99Å; Y33-P41 HydrophobicContact CD1-CG 4.23Å; Y33-P41 HydrophobicContact CD2-CB 4.42Å; Y33-P41 VanDerWaalsContact CE1-CA 3.48Å; Y33-P41 HydrophobicContact CE1-CB 3.69Å; Y33-P41 HydrophobicContact CE1-CG 4.31Å; Y33-P41 HydrophobicContact CE2-CB 4.14Å; Y33-P41 HydrophobicContact CG-CB 4.34Å
34	I	86.9	Confident	85.2	Confident	12 Å²	12	58.5 Å²	58.5	6%	0.062	31%	0.309	C	S	.	.	H	α-helix	trans	-64.3	-42.3	176.3	-69.3	165.7	0	0	0	110.3	I30 E31 E36 G38 L47 E49 L52	I30-I34 HydrophobicContact CG1-CD1 3.81Å; I30-I34 HydrophobicContact CG1-CG1 4.18Å; I30-I34 WeakPolarHBondContact O-CB 3.46Å; I30-I34 VanDerWaalsContact O-CG1 3.25Å; I30-I34 WeakPolarHBondContact O-CG1 3.41Å; I30-I34 PolarHBondContact O-N 2.83Å; E31-I34 PolarHBondContact O-N 2.92Å; I34-E36 VanDerWaalsContact C-N 3.26Å; I34-E36 PolarHBondContact O-N 2.86Å; I34-G38 VanDerWaalsContact O-CA 3.27Å; I34-G38 WeakPolarHBondContact O-CA 3.46Å; I34-G38 PolarHBondContact O-N 3.46Å; I34-L47 HydrophobicContact CD1-CD2 3.76Å; I34-L47 HydrophobicContact CD1-CG 4.07Å; I34-L47 HydrophobicContact CG1-CD2 4.24Å; I34-L47 WeakPolarHBondContact CG2-O 3.41Å; I34-E49 HydrophobicContact CB-CG 4.44Å; I34-E49 HydrophobicContact CG2-CG 3.83Å; I34-L52 HydrophobicContact CD1-CD1 3.94Å; I34-L52 HydrophobicContact CD1-CD2 4.29Å; I34-L52 HydrophobicContact CD1-CG 4.26Å
35	A	86.6	Confident	85.1	Confident	76 Å²	76	62 Å²	62	63%	0.628	32%	0.324	S	S	*	.	H	α-helix	trans	-62	-32.3	176.8	0	0	0	0	0	113.2	E31	E31-A35 WeakPolarHBondContact O-CB 3.49Å; E31-A35 PolarHBondContact O-N 3.27Å
36	E	86.7	Confident	84.9	Confident	130 Å²	130	67 Å²	67	61%	0.607	36%	0.356	S	S	*	.	H	α-helix	trans	-86.5	-39.4	-179.8	-71.9	176	-172.7	0	0	113.2	K32 Y33 I34	K32-E36 WeakPolarHBondContact CE-OE1 3.37Å; K32-E36 WeakPolarHBondContact O-CG 3.33Å; K32-E36 PolarHBondContact O-N 2.94Å; Y33-E36 PolarHBondContact O-N 3.05Å; I34-E36 VanDerWaalsContact C-N 3.26Å; I34-E36 PolarHBondContact O-N 2.86Å
37	N	83.8	Confident	84.5	Confident	83 Å²	83	66.3 Å²	66.3	44%	0.444	35%	0.353	S	S	.	.	H	α-helix	trans	-120.7	-12.9	-168.3	-61.3	-52.7	0	0	0	114.9	Y33 T39	Y33-N37 HydrophobicContact CD1-CB 4.48Å; Y33-N37 WeakPolarHBondContact CD2-ND2 3.43Å; Y33-N37 HydrophobicContact CE1-CB 4.06Å; Y33-N37 WeakPolarHBondContact CE2-ND2 3.41Å; Y33-N37 PolarHBondContact O-N 2.91Å; N37-T39 PolarHBondContact O-N 2.8Å; N37-T39 PolarHBondContact O-OG1 2.88Å
38	G	81.5	Confident	84.3	Confident	38 Å²	38	64.7 Å²	64.7	39%	0.392	36%	0.355	S	S	.	.	S	Bend	trans	60.4	13.8	-179.6	0	0	0	0	0	115.4	I34 L47	I34-G38 VanDerWaalsContact O-CA 3.27Å; I34-G38 WeakPolarHBondContact O-CA 3.46Å; I34-G38 PolarHBondContact O-N 3.46Å; G38-L47 PolarHBondContact O-N 2.99Å
39	T	84.9	Confident	83.8	Confident	40 Å²	40	61.1 Å²	61.1	25%	0.245	35%	0.345	C	S	.	.	B	Isolated β-bridge	trans	-134.6	162.9	-174.6	51.1	0	0	0	0	111.1	Y33 N37 Q45	Y33-T39 VanDerWaalsContact CD1-O 3.24Å; Y33-T39 WeakPolarHBondContact CD1-O 3.39Å; Y33-T39 WeakPolarHBondContact CE1-O 3.48Å; N37-T39 PolarHBondContact O-N 2.8Å; N37-T39 PolarHBondContact O-OG1 2.88Å; T39-Q45 CarbonylContact C-O 3.57Å; T39-Q45 WeakPolarHBondContact CA-O 3.21Å; T39-Q45 WeakPolarHBondContact CB-O 3.38Å
40	D	83.4	Confident	83.5	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.378	C	S	.	.			trans	-77.9	132.1	173.8	-176.4	-36	0	0	0	110.3	S18 S21 M42 N43 G44 Q45 L47	S18-D40 VanDerWaalsContact CB-OD2 3.29Å; S18-D40 WeakPolarHBondContact CB-OD2 3.3Å; S18-D40 PolarHBondContact OG-OD2 3.47Å; S21-D40 WeakPolarHBondContact CB-OD2 3.32Å; S21-D40 PolarHBondContact N-OD2 2.96Å; S21-D40 PolarHBondContact OG-OD1 2.79Å; S21-D40 PolarHBondContact OG-OD2 3.5Å; D40-M42 PolarHBondContact O-N 3.24Å; D40-M42 VanDerWaalsContact O-N 3.16Å; D40-M42 PolarHBondContact OD1-N 2.88Å; D40-N43 WeakPolarHBondContact CB-OD1 3.3Å; D40-G44 WeakPolarHBondContact O-CA 2.92Å; D40-G44 PolarHBondContact O-N 2.78Å; D40-Q45 PolarHBondContact N-O 3.39Å; D40-L47 HydrophobicContact CB-CB 4.26Å; D40-L47 HydrophobicContact CB-CD2 4.12Å
41	P	81.4	Confident	83.2	Confident	36 Å²	36	72.5 Å²	72.5	23%	0.234	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.3	-175	25.1	-36.5	0	0	0	115.2	I7 F25 Y33	I7-P41 HydrophobicContact CD1-CG 4.28Å; I7-P41 HydrophobicContact CG1-CG 4.39Å; F25-P41 HydrophobicContact CD1-CG 4.5Å; F25-P41 HydrophobicContact CE1-CG 3.66Å; F25-P41 HydrophobicContact CZ-CG 3.85Å; Y33-P41 HydrophobicContact CD1-CB 3.99Å; Y33-P41 HydrophobicContact CD1-CG 4.23Å; Y33-P41 HydrophobicContact CD2-CB 4.42Å; Y33-P41 VanDerWaalsContact CE1-CA 3.48Å; Y33-P41 HydrophobicContact CE1-CB 3.69Å; Y33-P41 HydrophobicContact CE1-CG 4.31Å; Y33-P41 HydrophobicContact CE2-CB 4.14Å; Y33-P41 HydrophobicContact CG-CB 4.34Å
42	M	83.6	Confident	83	Confident	103 Å²	103	70.6 Å²	70.6	51%	0.507	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-36.2	-174.5	-67	-56.9	-61.7	0	0	113.9	F25 D40	F25-M42 HydrophobicContact CE1-CG 4.3Å; F25-M42 HydrophobicContact CZ-CG 3.92Å; D40-M42 PolarHBondContact O-N 3.24Å; D40-M42 VanDerWaalsContact O-N 3.16Å; D40-M42 PolarHBondContact OD1-N 2.88Å
43	N	80.5	Confident	82.9	Confident	61 Å²	61	68.5 Å²	68.5	33%	0.326	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-4.2	-173.3	65.7	13	0	0	0	113.9	V20 D40 Q45	V20-N43 WeakPolarHBondContact CG1-ND2 3.45Å; V20-N43 PolarHBondContact O-ND2 2.82Å; D40-N43 WeakPolarHBondContact CB-OD1 3.3Å; N43-Q45 HydrophobicContact CB-CG 4.46Å; N43-Q45 PolarHBondContact O-N 2.8Å; N43-Q45 WeakPolarHBondContact OD1-CB 3.25Å; N43-Q45 PolarHBondContact OD1-N 2.98Å; N43-Q45 VanDerWaalsContact OD1-N 3.12Å
44	G	79.3	Confident	82.7	Confident	50 Å²	50	69.2 Å²	69.2	52%	0.515	40%	0.396	S	S	.	.			trans	67.2	15.5	177.2	0	0	0	0	0	114.7	D40	D40-G44 WeakPolarHBondContact O-CA 2.92Å; D40-G44 PolarHBondContact O-N 2.78Å
45	Q	85.3	Confident	82.4	Confident	101 Å²	101	71.3 Å²	71.3	47%	0.472	41%	0.406	S	S	.	.			trans	-81.6	152.3	177	-66.1	-173.4	12.9	0	0	110.8	V20 T39 D40 N43 L47	V20-Q45 HydrophobicContact CG1-CB 3.48Å; V20-Q45 VanDerWaalsContact CG1-CB 3.48Å; V20-Q45 HydrophobicContact CG1-CG 4.03Å; T39-Q45 CarbonylContact C-O 3.57Å; T39-Q45 WeakPolarHBondContact CA-O 3.21Å; T39-Q45 WeakPolarHBondContact CB-O 3.38Å; D40-Q45 PolarHBondContact N-O 3.39Å; N43-Q45 HydrophobicContact CB-CG 4.46Å; N43-Q45 PolarHBondContact O-N 2.8Å; N43-Q45 WeakPolarHBondContact OD1-CB 3.25Å; N43-Q45 PolarHBondContact OD1-N 2.98Å; N43-Q45 VanDerWaalsContact OD1-N 3.12Å; Q45-L47 PolarHBondContact O-N 2.64Å
46	P	82.6	Confident	81.7	Confident	105 Å²	105	77.7 Å²	77.7	68%	0.682	42%	0.42	S	S	*	.	B	Isolated β-bridge	trans	-65.7	128.2	179.4	27.2	-33.9	0	0	0	110.6
47	L	79.8	Confident	80.9	Confident	6 Å²	6	74.5 Å²	74.5	3%	0.031	41%	0.409	C	S	.	.			trans	-135.4	127.9	-179	-176.9	70.9	0	0	0	108.9	V20 I30 I34 G38 D40 Q45 Q51 L52	V20-L47 HydrophobicContact CG2-CD1 4.01Å; I30-L47 HydrophobicContact CD1-CD2 4.21Å; I34-L47 HydrophobicContact CD1-CD2 3.76Å; I34-L47 HydrophobicContact CD1-CG 4.07Å; I34-L47 HydrophobicContact CG1-CD2 4.24Å; I34-L47 WeakPolarHBondContact CG2-O 3.41Å; G38-L47 PolarHBondContact O-N 2.99Å; D40-L47 HydrophobicContact CB-CB 4.26Å; D40-L47 HydrophobicContact CB-CD2 4.12Å; Q45-L47 PolarHBondContact O-N 2.64Å; L47-Q51 HydrophobicContact CD1-CB 3.97Å; L47-L52 HydrophobicContact CD2-CD2 4.12Å
48	S	81.5	Confident	79.9	Confident	49 Å²	49	76.9 Å²	76.9	34%	0.343	43%	0.427	S	S	.	.			trans	-100.1	154	172.8	60.5	0	0	0	0	111.4	E50 Q51	S48-E50 PolarHBondContact O-N 3.17Å; S48-Q51 WeakPolarHBondContact O-CB 3.13Å; S48-Q51 PolarHBondContact O-N 3.06Å; S48-Q51 WeakPolarHBondContact OG-CG 3.48Å
49	E	77.8	Confident	78.8	Confident	98 Å²	98	83.3 Å²	83.3	46%	0.458	45%	0.446	S	S	.	.	G	3₁₀ helix	trans	-58.1	-31.7	-177.9	-62.9	179.5	178.9	0	0	112.8	I34 Q51 L52	I34-E49 HydrophobicContact CB-CG 4.44Å; I34-E49 HydrophobicContact CG2-CG 3.83Å; E49-Q51 PolarHBondContact O-N 3.22Å; E49-L52 PolarHBondContact O-N 3.17Å
50	E	80.4	Confident	77.6	Confident	187 Å²	187	84.1 Å²	84.1	87%	0.874	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-69.2	-18.6	179.4	-60.6	-179.7	175.1	0	0	113.6	S48 L52	S48-E50 PolarHBondContact O-N 3.17Å; E50-L52 VanDerWaalsContact C-N 3.33Å
51	Q	81.1	Confident	76.4	Confident	89 Å²	89	92.3 Å²	92.3	42%	0.416	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-86.5	-6.4	-179.2	-67.6	173.5	-8.2	0	0	112.7	P19 L47 S48 E49	P19-Q51 WeakPolarHBondContact CD-O 3.42Å; P19-Q51 HydrophobicContact CG-CB 4.28Å; P19-Q51 WeakPolarHBondContact CG-O 3.35Å; L47-Q51 HydrophobicContact CD1-CB 3.97Å; S48-Q51 WeakPolarHBondContact O-CB 3.13Å; S48-Q51 PolarHBondContact O-N 3.06Å; S48-Q51 WeakPolarHBondContact OG-CG 3.48Å; E49-Q51 PolarHBondContact O-N 3.22Å
52	L	83.1	Confident	75.4	Confident	17 Å²	17	96.9 Å²	96.9	9%	0.089	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-72.5	129.2	178.2	-66.3	174.3	0	0	0	110.8	I30 E31 I34 L47 E49 E50	I30-L52 HydrophobicContact CD1-CD2 3.93Å; I30-L52 HydrophobicContact CG1-CD2 4.19Å; I30-L52 HydrophobicContact CG2-CD1 3.78Å; I30-L52 HydrophobicContact CG2-CD2 4.17Å; E31-L52 HydrophobicContact CG-CD1 4.18Å; I34-L52 HydrophobicContact CD1-CD1 3.94Å; I34-L52 HydrophobicContact CD1-CD2 4.29Å; I34-L52 HydrophobicContact CD1-CG 4.26Å; L47-L52 HydrophobicContact CD2-CD2 4.12Å; E49-L52 PolarHBondContact O-N 3.17Å; E50-L52 VanDerWaalsContact C-N 3.33Å
53	V	85.4	Confident	74.3	Confident	82 Å²	82	97.8 Å²	97.8	50%	0.497	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	122	179	177.3	0	0	0	0	109.7	C16 I17	C16-V53 CarbonylContact C-O 3.58Å; C16-V53 WeakPolarHBondContact CA-O 3.26Å; I17-V53 HydrophobicContact CG2-CB 3.66Å; I17-V53 HydrophobicContact CG2-CG1 4.15Å; I17-V53 PolarHBondContact N-O 3.12Å; I17-V53 PolarHBondContact O-N 2.9Å
54	D	81.4	Confident	73.2	Confident	91 Å²	91	104.8 Å²	104.8	49%	0.487	55%	0.548	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	134.4	178.3	-68.6	-37.6	0	0	0	111.8	R27	R27-D54 IonicContact CZ-OD1 3.27Å; R27-D54 IonicContact NH1-OD1 3.56Å; R27-D54 PolarHBondContact NH1-OD1 3.36Å; R27-D54 IonicContact NH1-OD2 3.8Å; R27-D54 PolarHBondContact NH1-OD2 2.81Å
55	I	80.8	Confident	72.4	Confident	55 Å²	55	106.3 Å²	106.3	28%	0.282	56%	0.556	S	S	.	*	P	Polyproline II helix	trans	-97.6	117	172.7	-52.9	178.4	0	0	0	108.5	P15 I17 V24 V57	P15-I55 HydrophobicContact CB-CB 4.21Å; P15-I55 HydrophobicContact CB-CD1 4.5Å; P15-I55 HydrophobicContact CG-CB 4.13Å; P15-I55 PolarHBondContact O-N 3.27Å; I17-I55 HydrophobicContact CB-CD1 4.26Å; V24-I55 HydrophobicContact CG1-CD1 4.42Å; V24-I55 HydrophobicContact CG2-CD1 4.09Å; I55-V57 HydrophobicContact CB-CG2 4.32Å; I55-V57 HydrophobicContact CG2-CG2 3.58Å; I55-V57 PolarHBondContact O-N 2.91Å
56	K	71.4	Confident	71.6	Confident	211 Å²	211	107 Å²	107	92%	0.917	57%	0.569	S	S	*	*			trans	-79	102.7	172.8	-69.9	-177.2	-179.7	177.2	0	110
57	V	68.8	Low	70.7	Confident	63 Å²	63	107 Å²	107	38%	0.382	57%	0.571	S	S	.	*			trans	-112.4	141.4	175.6	-166	0	0	0	0	109.6	L3 P15 I55 H59	L3-V57 HydrophobicContact CD1-CG1 4.15Å; L3-V57 HydrophobicContact CD1-CG2 3.66Å; P15-V57 HydrophobicContact CG-CG2 3.75Å; I55-V57 HydrophobicContact CB-CG2 4.32Å; I55-V57 HydrophobicContact CG2-CG2 3.58Å; I55-V57 PolarHBondContact O-N 2.91Å; V57-H59 PolarHBondContact O-N 2.88Å
58	T	63.7	Low	70.2	Confident	133 Å²	133	108.5 Å²	108.5	82%	0.816	59%	0.585	S	S	*	*			trans	-63.3	121.9	166.6	49.5	0	0	0	0	108.9
59	H	59.3	Low	70.1	Confident	172 Å²	172	112.6 Å²	112.6	80%	0.796	61%	0.608	S	S	*	*			trans	-35.1	120.4	-169.5	-66.1	-71	0	0	0	114.1	V57 I61	V57-H59 PolarHBondContact O-N 2.88Å; H59-I61 PolarHBondContact O-N 2.97Å
60	P	59.1	Low	70.6	Confident	57 Å²	57	110.5 Å²	110.5	37%	0.37	60%	0.604	S	S	.	*			trans	-66.7	129.3	179.3	24.7	-30.4	0	0	0	110.5	V11 R62	V11-P60 HydrophobicContact CG1-CB 3.71Å; V11-P60 HydrophobicContact CG1-CG 3.85Å; P60-R62 PolarHBondContact O-N 2.82Å; P60-R62 VanDerWaalsContact O-N 3.11Å
61	I	58.3	Low	70.9	Confident	172 Å²	172	107.9 Å²	107.9	88%	0.882	60%	0.595	S	S	*	*			trans	-75.3	100.9	-178.5	-57.6	164.9	0	0	0	108.3	H59	H59-I61 PolarHBondContact O-N 2.97Å
62	R	60.5	Low	71.3	Confident	132 Å²	132	108.1 Å²	108.1	50%	0.498	60%	0.604	S	S	.	*	P	Polyproline II helix	trans	-72.6	148.1	166.5	-79	-175.4	177.2	-148.9	-6.2	110.1	E10 V11 P60 K64	E10-R62 IonicContact OE2-NH2 3.84Å; V11-R62 PolarHBondContact O-NH2 3.18Å; P60-R62 PolarHBondContact O-N 2.82Å; P60-R62 VanDerWaalsContact O-N 3.11Å; R62-K64 PolarHBondContact O-N 3.21Å
63	P	59.9	Low	71.4	Confident	122 Å²	122	109 Å²	109	79%	0.792	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-57	130.5	161.6	25.1	-31.1	0	0	0	108.5	A65	P63-A65 PolarHBondContact O-N 3.22Å; P63-A65 VanDerWaalsContact O-N 3.17Å
64	K	58.1	Low	71.4	Confident	208 Å²	208	108.8 Å²	108.8	90%	0.904	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-54.9	123.3	-179.9	-102	179	175.1	176.5	0	109.3	R62	R62-K64 PolarHBondContact O-N 3.21Å
65	A	62.6	Low	71.7	Confident	82 Å²	82	109.1 Å²	109.1	68%	0.678	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-55.6	143.1	167.6	0	0	0	0	0	109.1	P63 S67	P63-A65 PolarHBondContact O-N 3.22Å; P63-A65 VanDerWaalsContact O-N 3.17Å; A65-S67 PolarHBondContact O-N 2.86Å; A65-S67 VanDerWaalsContact O-N 3.14Å
66	P	67.5	Low	72.1	Confident	117 Å²	117	111.4 Å²	111.4	76%	0.76	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-56.4	123.9	175.2	23.5	-32	0	0	0	108.6	A68	P66-A68 VanDerWaalsContact C-N 3.34Å; P66-A68 PolarHBondContact O-N 3.28Å
67	S	64.4	Low	72.9	Confident	104 Å²	104	103.6 Å²	103.6	73%	0.727	59%	0.59	S	S	*	*			trans	-70	92.4	-179.7	57.6	0	0	0	0	109.4	A65 T69	A65-S67 PolarHBondContact O-N 2.86Å; A65-S67 VanDerWaalsContact O-N 3.14Å; S67-T69 PolarHBondContact O-N 2.81Å; S67-T69 VanDerWaalsContact O-N 3.13Å
68	A	69	Low	73.9	Confident	38 Å²	38	104.9 Å²	104.9	31%	0.314	59%	0.594	S	S	.	*			trans	-74.3	97.8	172	0	0	0	0	0	108.8	P66 S70 A73 I74	P66-A68 VanDerWaalsContact C-N 3.34Å; P66-A68 PolarHBondContact O-N 3.28Å; A68-S70 VanDerWaalsContact C-N 3.34Å; A68-A73 HydrophobicContact CB-CB 3.84Å; A68-I74 HydrophobicContact CB-CG1 3.76Å
69	T	79.4	Confident	75.3	Confident	134 Å²	134	103.9 Å²	103.9	82%	0.822	58%	0.581	S	S	*	*			trans	-87.7	-1.1	-177.6	52.5	0	0	0	0	113.6	S67	S67-T69 PolarHBondContact O-N 2.81Å; S67-T69 VanDerWaalsContact O-N 3.13Å
70	S	88.9	Confident	76.8	Confident	55 Å²	55	99.3 Å²	99.3	39%	0.385	56%	0.562	S	S	.	*	S	Bend	trans	-127.5	147.1	179.9	73.4	0	0	0	0	112.2	A68 P72 A73 I74	A68-S70 VanDerWaalsContact C-N 3.34Å; S70-P72 VanDerWaalsContact C-N 3.34Å; S70-A73 WeakPolarHBondContact O-CB 3.27Å; S70-A73 PolarHBondContact O-N 2.58Å; S70-A73 WeakPolarHBondContact OG-CB 3.4Å; S70-A73 PolarHBondContact OG-N 3.44Å; S70-I74 PolarHBondContact O-N 3.12Å
71	I	85.9	Confident	78.2	Confident	132 Å²	132	103 Å²	103	68%	0.677	57%	0.574	S	S	*	*	H	α-helix	trans	-55	-43	178.2	-61.2	170.7	0	0	0	112	A73 I74 L75	I71-A73 VanDerWaalsContact C-N 3.32Å; I71-A73 PolarHBondContact O-N 2.92Å; I71-I74 PolarHBondContact O-N 2.89Å; I71-L75 HydrophobicContact CG2-CD1 4.23Å; I71-L75 PolarHBondContact O-N 2.92Å
72	P	89.6	Confident	80	Confident	93 Å²	93	102.9 Å²	102.9	60%	0.604	56%	0.563	S	S	*	*	H	α-helix	trans	-61.7	-36.5	174.9	-25.2	36.3	0	0	0	113.8	S70 K76	S70-P72 VanDerWaalsContact C-N 3.34Å; P72-K76 WeakPolarHBondContact O-CB 3.34Å; P72-K76 PolarHBondContact O-N 3.36Å
73	A	85.4	Confident	81.7	Confident	37 Å²	37	101.5 Å²	101.5	31%	0.306	57%	0.565	S	S	.	*	H	α-helix	trans	-69.2	-37.5	177.6	0	0	0	0	0	112	A68 S70 I71 K76 S77	A68-A73 HydrophobicContact CB-CB 3.84Å; S70-A73 WeakPolarHBondContact O-CB 3.27Å; S70-A73 PolarHBondContact O-N 2.58Å; S70-A73 WeakPolarHBondContact OG-CB 3.4Å; S70-A73 PolarHBondContact OG-N 3.44Å; I71-A73 VanDerWaalsContact C-N 3.32Å; I71-A73 PolarHBondContact O-N 2.92Å; A73-K76 PolarHBondContact O-N 2.79Å; A73-S77 PolarHBondContact O-N 2.79Å; A73-S77 PolarHBondContact O-OG 2.89Å
74	I	86.3	Confident	83.2	Confident	77 Å²	77	98.3 Å²	98.3	40%	0.395	55%	0.549	S	S	.	.	H	α-helix	trans	-63.7	-48.7	175	-64.5	168.4	0	0	0	110.1	A68 S70 I71 K76 S77 L78	A68-I74 HydrophobicContact CB-CG1 3.76Å; S70-I74 PolarHBondContact O-N 3.12Å; I71-I74 PolarHBondContact O-N 2.89Å; I74-K76 VanDerWaalsContact C-N 3.29Å; I74-K76 PolarHBondContact O-N 2.81Å; I74-S77 PolarHBondContact O-N 2.71Å; I74-S77 PolarHBondContact O-OG 3.48Å; I74-L78 HydrophobicContact CG2-CD1 4.12Å; I74-L78 WeakPolarHBondContact O-CG 3.14Å; I74-L78 PolarHBondContact O-N 3.48Å
75	L	88.1	Confident	84.8	Confident	98 Å²	98	92.4 Å²	92.4	51%	0.513	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-40.2	177.7	-71.8	173.1	0	0	0	112	I71 L78 Q79	I71-L75 HydrophobicContact CG2-CD1 4.23Å; I71-L75 PolarHBondContact O-N 2.92Å; L75-L78 PolarHBondContact O-N 3.22Å; L75-Q79 WeakPolarHBondContact O-CG 3.37Å; L75-Q79 PolarHBondContact O-N 2.6Å
76	K	88.8	Confident	86.3	Confident	103 Å²	103	94.1 Å²	94.1	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-65.7	-44.4	177.5	-174.3	53.3	178	149.1	0	112	P72 A73 I74 L78 Q79 D80	P72-K76 WeakPolarHBondContact O-CB 3.34Å; P72-K76 PolarHBondContact O-N 3.36Å; A73-K76 PolarHBondContact O-N 2.79Å; I74-K76 VanDerWaalsContact C-N 3.29Å; I74-K76 PolarHBondContact O-N 2.81Å; K76-L78 VanDerWaalsContact C-N 3.34Å; K76-L78 PolarHBondContact O-N 3.01Å; K76-Q79 WeakPolarHBondContact O-CB 3.42Å; K76-Q79 PolarHBondContact O-N 3.47Å; K76-D80 WeakPolarHBondContact CE-OD1 3.46Å; K76-D80 IonicContact NZ-OD1 2.7Å; K76-D80 PolarHBondContact NZ-OD1 3.46Å; K76-D80 IonicContact NZ-OD2 3.92Å; K76-D80 PolarHBondContact O-N 2.99Å
77	S	87.8	Confident	87.6	Confident	46 Å²	46	94.2 Å²	94.2	32%	0.322	52%	0.519	S	S	.	.	H	α-helix	trans	-61.4	-40.6	175.7	66.4	0	0	0	0	112.7	A73 I74 D80 E81	A73-S77 PolarHBondContact O-N 2.79Å; A73-S77 PolarHBondContact O-OG 2.89Å; I74-S77 PolarHBondContact O-N 2.71Å; I74-S77 PolarHBondContact O-OG 3.48Å; S77-D80 PolarHBondContact O-N 2.85Å; S77-E81 WeakPolarHBondContact O-CG 3.38Å; S77-E81 PolarHBondContact O-N 3.34Å
78	L	89.1	Confident	89	Confident	90 Å²	90	95.3 Å²	95.3	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-63.7	-43.1	175.2	-73	171.1	0	0	0	111.4	I74 L75 K76 E81 W82	I74-L78 HydrophobicContact CG2-CD1 4.12Å; I74-L78 WeakPolarHBondContact O-CG 3.14Å; I74-L78 PolarHBondContact O-N 3.48Å; L75-L78 PolarHBondContact O-N 3.22Å; K76-L78 VanDerWaalsContact C-N 3.34Å; K76-L78 PolarHBondContact O-N 3.01Å; L78-E81 PolarHBondContact O-N 3.22Å; L78-W82 WeakPolarHBondContact O-CB 3.43Å; L78-W82 PolarHBondContact O-N 2.86Å
79	Q	92.6	Very high	90.3	Very high	113 Å²	113	95.5 Å²	95.5	53%	0.528	51%	0.511	S	S	.	.	H	α-helix	trans	-60.2	-46	175.7	-75.3	174.6	-12.4	0	0	111.6	L75 K76 E81 W82 D83	L75-Q79 WeakPolarHBondContact O-CG 3.37Å; L75-Q79 PolarHBondContact O-N 2.6Å; K76-Q79 WeakPolarHBondContact O-CB 3.42Å; K76-Q79 PolarHBondContact O-N 3.47Å; Q79-E81 PolarHBondContact O-N 3.01Å; Q79-W82 PolarHBondContact O-N 3.17Å; Q79-D83 WeakPolarHBondContact O-CB 3.37Å; Q79-D83 VanDerWaalsContact O-CG 3.24Å; Q79-D83 PolarHBondContact O-N 2.8Å
80	D	90.8	Very high	91.1	Very high	75 Å²	75	95.6 Å²	95.6	40%	0.401	50%	0.501	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-178	-64.2	-23.4	0	0	0	111.9	K76 S77 D83 A84	K76-D80 WeakPolarHBondContact CE-OD1 3.46Å; K76-D80 IonicContact NZ-OD1 2.7Å; K76-D80 PolarHBondContact NZ-OD1 3.46Å; K76-D80 IonicContact NZ-OD2 3.92Å; K76-D80 PolarHBondContact O-N 2.99Å; S77-D80 PolarHBondContact O-N 2.85Å; D80-D83 PolarHBondContact O-N 2.97Å; D80-A84 WeakPolarHBondContact O-CB 3.47Å; D80-A84 PolarHBondContact O-N 2.85Å
81	E	90	Very high	91.4	Very high	134 Å²	134	95.3 Å²	95.3	63%	0.626	50%	0.497	S	S	*	.	H	α-helix	trans	-66.2	-42.2	174.1	-68.8	-62.7	154	0	0	112	S77 L78 Q79 A84 V85	S77-E81 WeakPolarHBondContact O-CG 3.38Å; S77-E81 PolarHBondContact O-N 3.34Å; L78-E81 PolarHBondContact O-N 3.22Å; Q79-E81 PolarHBondContact O-N 3.01Å; E81-A84 PolarHBondContact O-N 3.25Å; E81-V85 WeakPolarHBondContact O-CG2 3.41Å; E81-V85 PolarHBondContact O-N 3.15Å
82	W	94.9	Very high	91.8	Very high	170 Å²	170	93.6 Å²	93.6	64%	0.644	49%	0.488	S	S	*	.	H	α-helix	trans	-63.6	-41.4	176.3	-89.1	108.1	0	0	0	112.1	L78 Q79 A84 V85 M86	L78-W82 WeakPolarHBondContact O-CB 3.43Å; L78-W82 PolarHBondContact O-N 2.86Å; Q79-W82 PolarHBondContact O-N 3.17Å; W82-A84 VanDerWaalsContact C-N 3.34Å; W82-A84 PolarHBondContact O-N 3.43Å; W82-V85 PolarHBondContact O-N 2.96Å; W82-M86 WeakPolarHBondContact O-CB 3.36Å; W82-M86 WeakPolarHBondContact O-CG 3.39Å; W82-M86 PolarHBondContact O-N 3.28Å
83	D	95.8	Very high	92.1	Very high	103 Å²	103	97.7 Å²	97.7	55%	0.551	49%	0.492	S	S	*	.	H	α-helix	trans	-63.1	-41.8	176.9	-73.5	-16.7	0	0	0	110.9	Q79 D80 M86 L87	Q79-D83 WeakPolarHBondContact O-CB 3.37Å; Q79-D83 VanDerWaalsContact O-CG 3.24Å; Q79-D83 PolarHBondContact O-N 2.8Å; D80-D83 PolarHBondContact O-N 2.97Å; D83-M86 PolarHBondContact O-N 3.48Å; D83-L87 WeakPolarHBondContact O-CB 3.49Å; D83-L87 PolarHBondContact O-N 3.45Å
84	A	91.6	Very high	92.6	Very high	56 Å²	56	101.1 Å²	101.1	46%	0.463	50%	0.502	S	S	.	.	H	α-helix	trans	-63.2	-46.1	175.6	0	0	0	0	0	112.4	D80 E81 W82 M86 L87 H88	D80-A84 WeakPolarHBondContact O-CB 3.47Å; D80-A84 PolarHBondContact O-N 2.85Å; E81-A84 PolarHBondContact O-N 3.25Å; W82-A84 VanDerWaalsContact C-N 3.34Å; W82-A84 PolarHBondContact O-N 3.43Å; A84-M86 PolarHBondContact O-N 2.93Å; A84-L87 PolarHBondContact O-N 2.85Å; A84-H88 WeakPolarHBondContact O-CB 3.15Å; A84-H88 PolarHBondContact O-N 2.74Å
85	V	92.2	Very high	93.1	Very high	83 Å²	83	102.9 Å²	102.9	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-62.9	-42.5	177.2	170.8	0	0	0	0	111.3	E81 W82 H88 S89	E81-V85 WeakPolarHBondContact O-CG2 3.41Å; E81-V85 PolarHBondContact O-N 3.15Å; W82-V85 PolarHBondContact O-N 2.96Å; V85-H88 PolarHBondContact O-N 2.98Å; V85-S89 VanDerWaalsContact O-CB 3.29Å; V85-S89 WeakPolarHBondContact O-CB 3.32Å; V85-S89 PolarHBondContact O-N 2.91Å
86	M	93.8	Very high	93.5	Very high	118 Å²	118	103.3 Å²	103.3	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-64.9	-43.5	179	-75.3	-62.5	-67.1	0	0	111.8	W82 D83 A84 S89 F90	W82-M86 WeakPolarHBondContact O-CB 3.36Å; W82-M86 WeakPolarHBondContact O-CG 3.39Å; W82-M86 PolarHBondContact O-N 3.28Å; D83-M86 PolarHBondContact O-N 3.48Å; A84-M86 PolarHBondContact O-N 2.93Å; M86-S89 PolarHBondContact O-N 3.46Å; M86-F90 WeakPolarHBondContact O-CB 3.44Å; M86-F90 PolarHBondContact O-N 3.27Å
87	L	95.7	Very high	93.8	Very high	119 Å²	119	105.1 Å²	105.1	62%	0.623	52%	0.521	S	S	*	.	H	α-helix	trans	-63.1	-47.4	176.2	-168.3	156.6	0	0	0	110.9	D83 A84 S89 F90 T91	D83-L87 WeakPolarHBondContact O-CB 3.49Å; D83-L87 PolarHBondContact O-N 3.45Å; A84-L87 PolarHBondContact O-N 2.85Å; L87-S89 PolarHBondContact O-N 3.38Å; L87-F90 PolarHBondContact O-N 3.22Å; L87-T91 PolarHBondContact O-N 2.85Å; L87-T91 PolarHBondContact O-OG1 2.91Å
88	H	93.7	Very high	94.3	Very high	128 Å²	128	106 Å²	106	59%	0.593	52%	0.524	S	S	*	.	H	α-helix	trans	-60.7	-46.2	177.7	-176.4	-88.4	0	0	0	112	A84 V85 F90 T91 L92	A84-H88 WeakPolarHBondContact O-CB 3.15Å; A84-H88 PolarHBondContact O-N 2.74Å; V85-H88 PolarHBondContact O-N 2.98Å; H88-F90 VanDerWaalsContact C-N 3.31Å; H88-F90 PolarHBondContact O-N 2.91Å; H88-T91 PolarHBondContact O-N 2.99Å; H88-L92 WeakPolarHBondContact O-CB 3.33Å; H88-L92 PolarHBondContact O-N 2.77Å
89	S	94.9	Very high	94.6	Very high	41 Å²	41	105.3 Å²	105.3	29%	0.287	52%	0.524	S	S	.	.	H	α-helix	trans	-61.7	-38.9	176.6	173.5	0	0	0	0	111.9	V85 M86 L87 R93	V85-S89 VanDerWaalsContact O-CB 3.29Å; V85-S89 WeakPolarHBondContact O-CB 3.32Å; V85-S89 PolarHBondContact O-N 2.91Å; M86-S89 PolarHBondContact O-N 3.46Å; L87-S89 PolarHBondContact O-N 3.38Å; S89-R93 WeakPolarHBondContact O-CB 3.46Å; S89-R93 VanDerWaalsContact O-CG 3.31Å; S89-R93 WeakPolarHBondContact O-CG 3.4Å; S89-R93 PolarHBondContact O-N 2.74Å
90	F	96.4	Very high	94.8	Very high	136 Å²	136	108.9 Å²	108.9	60%	0.596	53%	0.532	S	S	*	.	H	α-helix	trans	-63.9	-49.3	175.5	178.1	-98.2	0	0	0	111.7	M86 L87 H88 L92 R93 Q94	M86-F90 WeakPolarHBondContact O-CB 3.44Å; M86-F90 PolarHBondContact O-N 3.27Å; L87-F90 PolarHBondContact O-N 3.22Å; H88-F90 VanDerWaalsContact C-N 3.31Å; H88-F90 PolarHBondContact O-N 2.91Å; F90-L92 VanDerWaalsContact C-N 3.33Å; F90-L92 PolarHBondContact O-N 2.93Å; F90-R93 PolarHBondContact O-N 2.93Å; F90-Q94 PolarHBondContact O-N 3.13Å
91	T	96.1	Very high	95.1	Very high	50 Å²	50	111.8 Å²	111.8	31%	0.307	54%	0.544	S	S	.	.	H	α-helix	trans	-60.4	-42	177	-58.7	0	0	0	0	111.8	L87 H88 Q94 Q95	L87-T91 PolarHBondContact O-N 2.85Å; L87-T91 PolarHBondContact O-OG1 2.91Å; H88-T91 PolarHBondContact O-N 2.99Å; T91-Q94 WeakPolarHBondContact O-CB 3.5Å; T91-Q94 PolarHBondContact O-N 2.86Å; T91-Q95 WeakPolarHBondContact O-CG 3.34Å; T91-Q95 PolarHBondContact O-N 2.98Å
92	L	94.7	Very high	95.4	Very high	95 Å²	95	111.3 Å²	111.3	50%	0.497	54%	0.541	S	S	.	.	H	α-helix	trans	-63.2	-43.6	177.6	-172.6	70.7	0	0	0	111.8	H88 F90 Q94 Q95 L96	H88-L92 WeakPolarHBondContact O-CB 3.33Å; H88-L92 PolarHBondContact O-N 2.77Å; F90-L92 VanDerWaalsContact C-N 3.33Å; F90-L92 PolarHBondContact O-N 2.93Å; L92-Q94 VanDerWaalsContact C-N 3.33Å; L92-Q94 PolarHBondContact O-N 2.87Å; L92-Q95 PolarHBondContact O-N 2.85Å; L92-L96 WeakPolarHBondContact O-CB 3.34Å; L92-L96 PolarHBondContact O-N 2.79Å
93	R	95.6	Very high	95.4	Very high	180 Å²	180	108.4 Å²	108.4	68%	0.679	54%	0.538	S	S	*	.	H	α-helix	trans	-63.1	-40.2	175.3	-75.7	178.8	-178.4	-174.3	1	111.9	S89 F90 L96 Q97	S89-R93 WeakPolarHBondContact O-CB 3.46Å; S89-R93 VanDerWaalsContact O-CG 3.31Å; S89-R93 WeakPolarHBondContact O-CG 3.4Å; S89-R93 PolarHBondContact O-N 2.74Å; F90-R93 PolarHBondContact O-N 2.93Å; R93-L96 PolarHBondContact O-N 3.29Å; R93-Q97 PolarHBondContact O-N 3.26Å
94	Q	96.7	Very high	95.4	Very high	108 Å²	108	105.8 Å²	105.8	51%	0.505	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-47.5	175.7	-172.8	-179.8	8.3	0	0	111	F90 T91 L92 L96 Q97 T98	F90-Q94 PolarHBondContact O-N 3.13Å; T91-Q94 WeakPolarHBondContact O-CB 3.5Å; T91-Q94 PolarHBondContact O-N 2.86Å; L92-Q94 VanDerWaalsContact C-N 3.33Å; L92-Q94 PolarHBondContact O-N 2.87Å; Q94-L96 PolarHBondContact O-N 3Å; Q94-Q97 PolarHBondContact O-N 3.4Å; Q94-T98 PolarHBondContact O-N 2.8Å; Q94-T98 PolarHBondContact O-OG1 3.25Å; Q94-T98 VanDerWaalsContact O-OG1 3.05Å
95	Q	96.4	Very high	95.7	Very high	114 Å²	114	108.2 Å²	108.2	53%	0.533	53%	0.529	S	S	.	.	H	α-helix	trans	-60.9	-42	176.3	-73.1	176.1	-7.9	0	0	112.4	T91 L92 Q97 T98 T99	T91-Q95 WeakPolarHBondContact O-CG 3.34Å; T91-Q95 PolarHBondContact O-N 2.98Å; L92-Q95 PolarHBondContact O-N 2.85Å; Q95-Q97 VanDerWaalsContact C-N 3.32Å; Q95-Q97 PolarHBondContact O-N 2.97Å; Q95-T98 PolarHBondContact O-N 2.95Å; Q95-T99 WeakPolarHBondContact O-CB 3.15Å; Q95-T99 VanDerWaalsContact O-CG2 3.32Å; Q95-T99 WeakPolarHBondContact O-CG2 3.5Å; Q95-T99 PolarHBondContact O-N 3.47Å; Q95-T99 PolarHBondContact O-OG1 3.37Å
96	L	96	Very high	95.8	Very high	108 Å²	108	106.8 Å²	106.8	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-59.7	-44.7	175.1	-171.2	165.7	0	0	0	110.9	L92 R93 Q94 T99 R100	L92-L96 WeakPolarHBondContact O-CB 3.34Å; L92-L96 PolarHBondContact O-N 2.79Å; R93-L96 PolarHBondContact O-N 3.29Å; Q94-L96 PolarHBondContact O-N 3Å; L96-T99 WeakPolarHBondContact CA-OG1 3.36Å; L96-T99 PolarHBondContact O-OG1 2.91Å; L96-R100 VanDerWaalsContact O-CB 3.24Å; L96-R100 WeakPolarHBondContact O-CB 3.43Å; L96-R100 PolarHBondContact O-N 3.3Å
97	Q	96	Very high	95.9	Very high	141 Å²	141	106.4 Å²	106.4	66%	0.659	53%	0.525	S	S	*	.	H	α-helix	trans	-66.1	-42.6	179.3	-171.7	170.2	-6.5	0	0	112.2	R93 Q94 Q95 R100 Q101	R93-Q97 PolarHBondContact O-N 3.26Å; Q94-Q97 PolarHBondContact O-N 3.4Å; Q95-Q97 VanDerWaalsContact C-N 3.32Å; Q95-Q97 PolarHBondContact O-N 2.97Å; Q97-R100 PolarHBondContact O-N 2.85Å; Q97-Q101 PolarHBondContact O-N 2.99Å
98	T	96.9	Very high	95.9	Very high	63 Å²	63	109.1 Å²	109.1	39%	0.387	53%	0.529	S	S	.	.	H	α-helix	trans	-62	-50.2	176.2	-55.5	0	0	0	0	111.3	Q94 Q95 R100 Q101 E102	Q94-T98 PolarHBondContact O-N 2.8Å; Q94-T98 PolarHBondContact O-OG1 3.25Å; Q94-T98 VanDerWaalsContact O-OG1 3.05Å; Q95-T98 PolarHBondContact O-N 2.95Å; T98-R100 VanDerWaalsContact C-N 3.3Å; T98-R100 PolarHBondContact O-N 3.46Å; T98-Q101 WeakPolarHBondContact O-CB 3.12Å; T98-Q101 PolarHBondContact O-N 3.38Å; T98-E102 WeakPolarHBondContact O-CG 3.28Å; T98-E102 PolarHBondContact O-N 3.12Å
99	T	95.6	Very high	96	Very high	77 Å²	77	108.5 Å²	108.5	47%	0.472	53%	0.526	S	S	.	.	H	α-helix	trans	-62.6	-37.1	178.7	50.7	0	0	0	0	112.1	Q95 L96 Q101 E102 L103	Q95-T99 WeakPolarHBondContact O-CB 3.15Å; Q95-T99 VanDerWaalsContact O-CG2 3.32Å; Q95-T99 WeakPolarHBondContact O-CG2 3.5Å; Q95-T99 PolarHBondContact O-N 3.47Å; Q95-T99 PolarHBondContact O-OG1 3.37Å; L96-T99 WeakPolarHBondContact CA-OG1 3.36Å; L96-T99 PolarHBondContact O-OG1 2.91Å; T99-Q101 VanDerWaalsContact C-N 3.33Å; T99-Q101 PolarHBondContact O-N 2.81Å; T99-E102 PolarHBondContact O-N 2.89Å; T99-L103 VanDerWaalsContact O-CB 3.29Å; T99-L103 WeakPolarHBondContact O-CB 3.34Å; T99-L103 PolarHBondContact O-N 2.92Å
100	R	96.6	Very high	96.1	Very high	188 Å²	188	112.5 Å²	112.5	71%	0.709	54%	0.54	S	S	*	.	H	α-helix	trans	-62.8	-40.5	173.2	-175.5	178.5	178.9	-179.3	0.6	111.8	L96 Q97 T98 S104	L96-R100 VanDerWaalsContact O-CB 3.24Å; L96-R100 WeakPolarHBondContact O-CB 3.43Å; L96-R100 PolarHBondContact O-N 3.3Å; Q97-R100 PolarHBondContact O-N 2.85Å; T98-R100 VanDerWaalsContact C-N 3.3Å; T98-R100 PolarHBondContact O-N 3.46Å; R100-S104 WeakPolarHBondContact O-CB 3.37Å; R100-S104 PolarHBondContact O-N 3.35Å
101	Q	96.9	Very high	96.1	Very high	136 Å²	136	109.5 Å²	109.5	64%	0.636	53%	0.53	S	S	*	.	H	α-helix	trans	-66.3	-45.7	176.4	-173.7	175.4	0.2	0	0	111.2	Q97 T98 T99 L103 S104 H105	Q97-Q101 PolarHBondContact O-N 2.99Å; T98-Q101 WeakPolarHBondContact O-CB 3.12Å; T98-Q101 PolarHBondContact O-N 3.38Å; T99-Q101 VanDerWaalsContact C-N 3.33Å; T99-Q101 PolarHBondContact O-N 2.81Å; Q101-L103 PolarHBondContact O-N 2.84Å; Q101-S104 PolarHBondContact O-N 3.21Å; Q101-S104 PolarHBondContact O-OG 2.75Å; Q101-H105 PolarHBondContact O-N 3.22Å
102	E	96.4	Very high	96.1	Very high	123 Å²	123	109.5 Å²	109.5	58%	0.575	54%	0.536	S	S	*	.	H	α-helix	trans	-59	-45.3	175.3	-71.5	173.9	178.5	0	0	112	T98 T99 S104 H105 A106	T98-E102 WeakPolarHBondContact O-CG 3.28Å; T98-E102 PolarHBondContact O-N 3.12Å; T99-E102 PolarHBondContact O-N 2.89Å; E102-S104 VanDerWaalsContact C-N 3.35Å; E102-S104 PolarHBondContact O-N 3.32Å; E102-H105 PolarHBondContact O-N 2.99Å; E102-A106 WeakPolarHBondContact O-CB 3.31Å; E102-A106 PolarHBondContact O-N 2.8Å
103	L	95.6	Very high	96.1	Very high	109 Å²	109	107.3 Å²	107.3	57%	0.571	53%	0.531	S	S	*	.	H	α-helix	trans	-61.4	-43.2	176.1	-178.3	142.1	0	0	0	111.4	T99 Q101 H105 A106 L107	T99-L103 VanDerWaalsContact O-CB 3.29Å; T99-L103 WeakPolarHBondContact O-CB 3.34Å; T99-L103 PolarHBondContact O-N 2.92Å; Q101-L103 PolarHBondContact O-N 2.84Å; L103-H105 VanDerWaalsContact C-N 3.31Å; L103-H105 PolarHBondContact O-N 2.97Å; L103-A106 PolarHBondContact O-N 2.87Å; L103-L107 HydrophobicContact CD2-CD1 3.61Å; L103-L107 HydrophobicContact CD2-CG 4.3Å; L103-L107 HydrophobicContact CG-CD1 4.43Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 3.4Å
104	S	96.3	Very high	96	Very high	48 Å²	48	101.3 Å²	101.3	34%	0.336	52%	0.516	S	S	.	.	H	α-helix	trans	-61	-42.9	176.5	75.3	0	0	0	0	111.6	R100 Q101 E102 L107 Y108	R100-S104 WeakPolarHBondContact O-CB 3.37Å; R100-S104 PolarHBondContact O-N 3.35Å; Q101-S104 PolarHBondContact O-N 3.21Å; Q101-S104 PolarHBondContact O-OG 2.75Å; E102-S104 VanDerWaalsContact C-N 3.35Å; E102-S104 PolarHBondContact O-N 3.32Å; S104-L107 PolarHBondContact O-N 3Å; S104-Y108 WeakPolarHBondContact O-CD2 3.36Å; S104-Y108 PolarHBondContact O-N 2.91Å
105	H	97	Very high	96	Very high	108 Å²	108	104.1 Å²	104.1	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-65.6	-43	177.7	-177.3	-103.7	0	0	0	111.8	Q101 E102 L103 L107 Y108 Q109	Q101-H105 PolarHBondContact O-N 3.22Å; E102-H105 PolarHBondContact O-N 2.99Å; L103-H105 VanDerWaalsContact C-N 3.31Å; L103-H105 PolarHBondContact O-N 2.97Å; H105-L107 VanDerWaalsContact C-N 3.34Å; H105-L107 PolarHBondContact O-N 3.36Å; H105-Y108 PolarHBondContact O-N 3.05Å; H105-Q109 VanDerWaalsContact CE1-CD 3.42Å; H105-Q109 PolarHBondContact CE1-NE2 2.72Å; H105-Q109 WeakPolarHBondContact O-CG 3.45Å; H105-Q109 PolarHBondContact O-N 3.03Å
106	A	95.1	Very high	96	Very high	52 Å²	52	102.7 Å²	102.7	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-40.9	175.9	0	0	0	0	0	112	E102 L103 Q109 H110	E102-A106 WeakPolarHBondContact O-CB 3.31Å; E102-A106 PolarHBondContact O-N 2.8Å; L103-A106 PolarHBondContact O-N 2.87Å; A106-Q109 PolarHBondContact O-N 3.46Å; A106-H110 VanDerWaalsContact O-CB 3.32Å; A106-H110 WeakPolarHBondContact O-CB 3.11Å; A106-H110 PolarHBondContact O-N 3.48Å
107	L	94.8	Very high	95.9	Very high	110 Å²	110	102.1 Å²	102.1	58%	0.576	52%	0.517	S	S	*	.	H	α-helix	trans	-64.9	-41.1	175.6	-71.7	175.6	0	0	0	112.2	L103 S104 H105 H110 D111	L103-L107 HydrophobicContact CD2-CD1 3.61Å; L103-L107 HydrophobicContact CD2-CG 4.3Å; L103-L107 HydrophobicContact CG-CD1 4.43Å; L103-L107 WeakPolarHBondContact O-CG 3.4Å; L103-L107 PolarHBondContact O-N 3.4Å; S104-L107 PolarHBondContact O-N 3Å; H105-L107 VanDerWaalsContact C-N 3.34Å; H105-L107 PolarHBondContact O-N 3.36Å; L107-H110 PolarHBondContact O-N 3.35Å; L107-D111 PolarHBondContact O-N 2.9Å
108	Y	96.7	Very high	95.8	Very high	177 Å²	177	97.9 Å²	97.9	69%	0.694	51%	0.506	S	S	*	.	H	α-helix	trans	-64.4	-41.6	174.4	-76.2	-61.1	0	0	0	112.3	S104 H105 H110 D111 A112	S104-Y108 WeakPolarHBondContact O-CD2 3.36Å; S104-Y108 PolarHBondContact O-N 2.91Å; H105-Y108 PolarHBondContact O-N 3.05Å; Y108-H110 VanDerWaalsContact C-N 3.34Å; Y108-D111 PolarHBondContact O-N 2.83Å; Y108-A112 WeakPolarHBondContact O-CB 3.33Å; Y108-A112 PolarHBondContact O-N 3.24Å
109	Q	95.9	Very high	95.8	Very high	114 Å²	114	103.1 Å²	103.1	53%	0.533	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-39.7	175.2	-73.7	-172	-23.2	0	0	112	H105 A106 A112 A113	H105-Q109 VanDerWaalsContact CE1-CD 3.42Å; H105-Q109 PolarHBondContact CE1-NE2 2.72Å; H105-Q109 WeakPolarHBondContact O-CG 3.45Å; H105-Q109 PolarHBondContact O-N 3.03Å; A106-Q109 PolarHBondContact O-N 3.46Å; Q109-A112 PolarHBondContact O-N 2.87Å; Q109-A113 WeakPolarHBondContact O-CB 3.32Å; Q109-A113 PolarHBondContact O-N 3.18Å
110	H	96.6	Very high	95.8	Very high	125 Å²	125	103.6 Å²	103.6	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-62.7	-47.1	176.2	-177.8	-82.4	0	0	0	111.4	A106 L107 Y108 A112 A113 C114	A106-H110 VanDerWaalsContact O-CB 3.32Å; A106-H110 WeakPolarHBondContact O-CB 3.11Å; A106-H110 PolarHBondContact O-N 3.48Å; L107-H110 PolarHBondContact O-N 3.35Å; Y108-H110 VanDerWaalsContact C-N 3.34Å; H110-A112 VanDerWaalsContact C-N 3.33Å; H110-A112 PolarHBondContact O-N 3.29Å; H110-A113 PolarHBondContact O-N 3.04Å; H110-C114 PolarHBondContact CE1-SG 3.02Å; H110-C114 PolarHBondContact O-N 3.49Å; H110-C114 PolarHBondContact O-SG 3.11Å
111	D	97.1	Very high	95.7	Very high	73 Å²	73	99.2 Å²	99.2	39%	0.39	51%	0.509	S	S	.	.	H	α-helix	trans	-60.9	-42.3	175.3	-174.4	56.2	0	0	0	111.8	L107 Y108 A113 C114 R115	L107-D111 PolarHBondContact O-N 2.9Å; Y108-D111 PolarHBondContact O-N 2.83Å; D111-A113 PolarHBondContact O-N 3.4Å; D111-C114 PolarHBondContact O-N 3.47Å; D111-R115 WeakPolarHBondContact O-CG 3.42Å; D111-R115 PolarHBondContact O-N 3.31Å; D111-R115 IonicContact OD2-CZ 2.74Å; D111-R115 VanDerWaalsContact OD2-CZ 3.27Å; D111-R115 IonicContact OD2-NE 2.74Å; D111-R115 PolarHBondContact OD2-NE 2.7Å; D111-R115 VanDerWaalsContact OD2-NE 3.07Å; D111-R115 IonicContact OD2-NH2 3.07Å; D111-R115 PolarHBondContact OD2-NH2 3.32Å
112	A	95.3	Very high	95.7	Very high	51 Å²	51	100.3 Å²	100.3	42%	0.421	51%	0.512	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174.8	0	0	0	0	0	112.1	Y108 Q109 H110 R115 V116	Y108-A112 WeakPolarHBondContact O-CB 3.33Å; Y108-A112 PolarHBondContact O-N 3.24Å; Q109-A112 PolarHBondContact O-N 2.87Å; H110-A112 VanDerWaalsContact C-N 3.33Å; H110-A112 PolarHBondContact O-N 3.29Å; A112-R115 WeakPolarHBondContact O-CB 3.38Å; A112-R115 PolarHBondContact O-N 3.26Å; A112-V116 WeakPolarHBondContact O-CG2 3.22Å; A112-V116 PolarHBondContact O-N 2.96Å; A112-V116 VanDerWaalsContact O-N 3.1Å
113	A	94.9	Very high	95.7	Very high	49 Å²	49	99.7 Å²	99.7	41%	0.405	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-41.7	176.4	0	0	0	0	0	111.9	Q109 H110 D111 R115 V116 I117	Q109-A113 WeakPolarHBondContact O-CB 3.32Å; Q109-A113 PolarHBondContact O-N 3.18Å; H110-A113 PolarHBondContact O-N 3.04Å; D111-A113 PolarHBondContact O-N 3.4Å; A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 3.2Å; A113-V116 WeakPolarHBondContact O-CB 3.26Å; A113-V116 PolarHBondContact O-N 2.66Å; A113-V116 VanDerWaalsContact O-N 3.1Å; A113-I117 WeakPolarHBondContact O-CG1 3.32Å; A113-I117 PolarHBondContact O-N 2.81Å
114	C	93.2	Very high	95.7	Very high	53 Å²	53	97.7 Å²	97.7	36%	0.358	50%	0.501	S	S	.	.	H	α-helix	trans	-58.9	-39.2	174	-70.3	0	0	0	0	112.1	H110 D111 I117 A118	H110-C114 PolarHBondContact CE1-SG 3.02Å; H110-C114 PolarHBondContact O-N 3.49Å; H110-C114 PolarHBondContact O-SG 3.11Å; D111-C114 PolarHBondContact O-N 3.47Å; C114-I117 PolarHBondContact O-N 3.07Å; C114-A118 PolarHBondContact O-N 3.21Å
115	R	96.4	Very high	95.6	Very high	168 Å²	168	99 Å²	99	63%	0.634	51%	0.506	S	S	*	.	H	α-helix	trans	-65.9	-36.6	174.9	-66.4	176.6	-164.8	-161.9	4.8	112.5	D111 A112 A113 A118 R119	D111-R115 WeakPolarHBondContact O-CG 3.42Å; D111-R115 PolarHBondContact O-N 3.31Å; D111-R115 IonicContact OD2-CZ 2.74Å; D111-R115 VanDerWaalsContact OD2-CZ 3.27Å; D111-R115 IonicContact OD2-NE 2.74Å; D111-R115 PolarHBondContact OD2-NE 2.7Å; D111-R115 VanDerWaalsContact OD2-NE 3.07Å; D111-R115 IonicContact OD2-NH2 3.07Å; D111-R115 PolarHBondContact OD2-NH2 3.32Å; A112-R115 WeakPolarHBondContact O-CB 3.38Å; A112-R115 PolarHBondContact O-N 3.26Å; A113-R115 VanDerWaalsContact C-N 3.28Å; A113-R115 PolarHBondContact O-N 3.2Å; R115-A118 PolarHBondContact O-N 3.09Å; R115-R119 PolarHBondContact O-N 3.13Å
116	V	97.2	Very high	95.5	Very high	84 Å²	84	96.3 Å²	96.3	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-64.1	-45.8	174.5	174.2	0	0	0	0	110.6	A112 A113 A118 R119 L120	A112-V116 WeakPolarHBondContact O-CG2 3.22Å; A112-V116 PolarHBondContact O-N 2.96Å; A112-V116 VanDerWaalsContact O-N 3.1Å; A113-V116 WeakPolarHBondContact O-CB 3.26Å; A113-V116 PolarHBondContact O-N 2.66Å; A113-V116 VanDerWaalsContact O-N 3.1Å; V116-A118 VanDerWaalsContact C-N 3.32Å; V116-A118 PolarHBondContact O-N 3.14Å; V116-R119 PolarHBondContact O-N 2.99Å; V116-R119 VanDerWaalsContact O-N 3.15Å; V116-L120 HydrophobicContact CG1-CD1 3.89Å; V116-L120 HydrophobicContact CG1-CG 4.34Å; V116-L120 WeakPolarHBondContact O-CG 3.22Å; V116-L120 PolarHBondContact O-N 3.06Å
117	I	94.3	Very high	95.4	Very high	95 Å²	95	96.4 Å²	96.4	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-59.3	-44.4	175.9	-65.6	167	0	0	0	110.6	A113 C114 R119 L120 N121	A113-I117 WeakPolarHBondContact O-CG1 3.32Å; A113-I117 PolarHBondContact O-N 2.81Å; C114-I117 PolarHBondContact O-N 3.07Å; I117-R119 VanDerWaalsContact C-N 3.3Å; I117-R119 PolarHBondContact O-N 2.93Å; I117-L120 PolarHBondContact O-N 2.99Å; I117-N121 WeakPolarHBondContact O-CB 3.08Å; I117-N121 VanDerWaalsContact O-CG 3.31Å; I117-N121 PolarHBondContact O-N 2.97Å; I117-N121 PolarHBondContact O-ND2 3.48Å
118	A	92.6	Very high	95.2	Very high	52 Å²	52	99.9 Å²	99.9	43%	0.43	51%	0.51	S	S	.	.	H	α-helix	trans	-61.9	-37.2	177.4	0	0	0	0	0	112.6	C114 R115 V116 K122	C114-A118 PolarHBondContact O-N 3.21Å; R115-A118 PolarHBondContact O-N 3.09Å; V116-A118 VanDerWaalsContact C-N 3.32Å; V116-A118 PolarHBondContact O-N 3.14Å; A118-K122 WeakPolarHBondContact O-CG 3.42Å; A118-K122 PolarHBondContact O-N 3.2Å
119	R	96.9	Very high	94.9	Very high	174 Å²	174	97.3 Å²	97.3	66%	0.657	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-49.6	174.4	-176.9	-178.8	-68.7	177.6	-2.2	111.4	R115 V116 I117 N121 K122 E123	R115-R119 PolarHBondContact O-N 3.13Å; V116-R119 PolarHBondContact O-N 2.99Å; V116-R119 VanDerWaalsContact O-N 3.15Å; I117-R119 VanDerWaalsContact C-N 3.3Å; I117-R119 PolarHBondContact O-N 2.93Å; R119-N121 VanDerWaalsContact C-N 3.3Å; R119-N121 PolarHBondContact O-N 2.94Å; R119-K122 WeakPolarHBondContact O-CB 3.34Å; R119-K122 PolarHBondContact O-N 2.99Å; R119-E123 PolarHBondContact O-N 3.33Å
120	L	96.1	Very high	94.6	Very high	86 Å²	86	94.1 Å²	94.1	45%	0.45	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-41.4	179.1	-74	171	0	0	0	111.7	V116 I117 K122 E123 V124	V116-L120 HydrophobicContact CG1-CD1 3.89Å; V116-L120 HydrophobicContact CG1-CG 4.34Å; V116-L120 WeakPolarHBondContact O-CG 3.22Å; V116-L120 PolarHBondContact O-N 3.06Å; I117-L120 PolarHBondContact O-N 2.99Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 3Å; L120-E123 PolarHBondContact O-N 2.96Å; L120-V124 WeakPolarHBondContact O-CB 3.42Å; L120-V124 VanDerWaalsContact O-CG2 3.25Å; L120-V124 WeakPolarHBondContact O-CG2 3.45Å; L120-V124 PolarHBondContact O-N 3.47Å
121	N	94.7	Very high	94.1	Very high	96 Å²	96	93.2 Å²	93.2	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-60.6	-39.1	175.6	-77	-20.6	0	0	0	112.1	I117 R119 T125	I117-N121 WeakPolarHBondContact O-CB 3.08Å; I117-N121 VanDerWaalsContact O-CG 3.31Å; I117-N121 PolarHBondContact O-N 2.97Å; I117-N121 PolarHBondContact O-ND2 3.48Å; R119-N121 VanDerWaalsContact C-N 3.3Å; R119-N121 PolarHBondContact O-N 2.94Å; N121-T125 WeakPolarHBondContact O-CB 3.18Å; N121-T125 PolarHBondContact O-N 2.91Å; N121-T125 PolarHBondContact O-OG1 3.11Å
122	K	95.7	Very high	93.4	Very high	160 Å²	160	92.7 Å²	92.7	70%	0.696	50%	0.502	S	S	*	.	H	α-helix	trans	-65.9	-43.7	174.7	-71.9	178.7	-179.2	-175.5	0	112	A118 R119 L120 T125 A126	A118-K122 WeakPolarHBondContact O-CG 3.42Å; A118-K122 PolarHBondContact O-N 3.2Å; R119-K122 WeakPolarHBondContact O-CB 3.34Å; R119-K122 PolarHBondContact O-N 2.99Å; L120-K122 VanDerWaalsContact C-N 3.29Å; L120-K122 PolarHBondContact O-N 3Å; K122-T125 PolarHBondContact O-N 3.48Å; K122-A126 WeakPolarHBondContact O-CB 3.48Å; K122-A126 PolarHBondContact O-N 3.02Å
123	E	96.6	Very high	92.7	Very high	110 Å²	110	94.7 Å²	94.7	51%	0.514	51%	0.509	S	S	.	.	H	α-helix	trans	-64.4	-41.5	178.1	-71.2	174.2	-170.8	0	0	111.8	R119 L120 A126 A127	R119-E123 PolarHBondContact O-N 3.33Å; L120-E123 PolarHBondContact O-N 2.96Å; E123-A126 PolarHBondContact O-N 3.48Å; E123-A127 WeakPolarHBondContact O-CB 2.89Å; E123-A127 PolarHBondContact O-N 3.03Å
124	V	96.4	Very high	91.8	Very high	67 Å²	67	97 Å²	97	41%	0.406	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-43.5	176.1	169.9	0	0	0	0	111.2	L120 A127 R128	L120-V124 WeakPolarHBondContact O-CB 3.42Å; L120-V124 VanDerWaalsContact O-CG2 3.25Å; L120-V124 WeakPolarHBondContact O-CG2 3.45Å; L120-V124 PolarHBondContact O-N 3.47Å; V124-A127 PolarHBondContact O-N 3.09Å; V124-R128 WeakPolarHBondContact O-CB 3.44Å; V124-R128 WeakPolarHBondContact O-CG 3.14Å; V124-R128 PolarHBondContact O-N 3.06Å
125	T	94.4	Very high	90.4	Very high	74 Å²	74	102.1 Å²	102.1	45%	0.454	53%	0.53	S	S	.	.	H	α-helix	trans	-63.2	-46.6	176.4	-58.2	0	0	0	0	111.1	N121 K122 A127 R128 E129	N121-T125 WeakPolarHBondContact O-CB 3.18Å; N121-T125 PolarHBondContact O-N 2.91Å; N121-T125 PolarHBondContact O-OG1 3.11Å; K122-T125 PolarHBondContact O-N 3.48Å; T125-A127 VanDerWaalsContact C-N 3.34Å; T125-A127 PolarHBondContact O-N 2.96Å; T125-R128 PolarHBondContact O-N 2.55Å; T125-E129 WeakPolarHBondContact O-CG 3.47Å; T125-E129 PolarHBondContact O-N 3.35Å
126	A	94.8	Very high	88.5	Confident	53 Å²	53	99 Å²	99	44%	0.438	53%	0.532	S	S	.	.	H	α-helix	trans	-61.2	-40.6	176.8	0	0	0	0	0	112.4	K122 E123 E129 A130	K122-A126 WeakPolarHBondContact O-CB 3.48Å; K122-A126 PolarHBondContact O-N 3.02Å; E123-A126 PolarHBondContact O-N 3.48Å; A126-E129 PolarHBondContact O-N 3.5Å; A126-A130 WeakPolarHBondContact O-CB 3.36Å; A126-A130 PolarHBondContact O-N 2.79Å
127	A	91.9	Very high	86.3	Confident	53 Å²	53	102.8 Å²	102.8	44%	0.438	54%	0.544	S	S	.	.	H	α-helix	trans	-66.3	-38.4	176.1	0	0	0	0	0	112.3	E123 V124 T125 A130 L131	E123-A127 WeakPolarHBondContact O-CB 2.89Å; E123-A127 PolarHBondContact O-N 3.03Å; V124-A127 PolarHBondContact O-N 3.09Å; T125-A127 VanDerWaalsContact C-N 3.34Å; T125-A127 PolarHBondContact O-N 2.96Å; A127-A130 PolarHBondContact O-N 2.94Å; A127-L131 WeakPolarHBondContact O-CB 3.43Å; A127-L131 WeakPolarHBondContact O-CG 3.15Å; A127-L131 PolarHBondContact O-N 2.83Å
128	R	91.5	Very high	84.2	Confident	184 Å²	184	102.3 Å²	102.3	69%	0.694	55%	0.554	S	S	*	*	H	α-helix	trans	-65.3	-42	174.5	-76.4	178.2	177.5	-173.3	0.3	111.8	V124 T125 L131 A132	V124-R128 WeakPolarHBondContact O-CB 3.44Å; V124-R128 WeakPolarHBondContact O-CG 3.14Å; V124-R128 PolarHBondContact O-N 3.06Å; T125-R128 PolarHBondContact O-N 2.55Å; R128-L131 PolarHBondContact O-N 3.09Å; R128-A132 WeakPolarHBondContact O-CB 3.4Å; R128-A132 PolarHBondContact O-N 2.9Å
129	E	91.3	Very high	81.9	Confident	122 Å²	122	103 Å²	103	57%	0.57	57%	0.566	S	S	*	*	H	α-helix	trans	-63	-45.6	175.1	-73	172.6	-174.1	0	0	111.4	T125 A126 L131 A132 T133	T125-E129 WeakPolarHBondContact O-CG 3.47Å; T125-E129 PolarHBondContact O-N 3.35Å; A126-E129 PolarHBondContact O-N 3.5Å; E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 2.87Å; E129-A132 WeakPolarHBondContact O-CB 3.24Å; E129-A132 PolarHBondContact O-N 3.44Å; E129-A132 VanDerWaalsContact O-N 3.17Å; E129-T133 WeakPolarHBondContact O-CG2 3.44Å; E129-T133 PolarHBondContact O-N 3.3Å; E129-T133 PolarHBondContact O-OG1 3Å
130	A	89.3	Confident	79.6	Confident	47 Å²	47	102.4 Å²	102.4	39%	0.388	58%	0.575	S	S	.	*	H	α-helix	trans	-62.8	-37.7	176	0	0	0	0	0	112.9	A126 A127 T133 L134	A126-A130 WeakPolarHBondContact O-CB 3.36Å; A126-A130 PolarHBondContact O-N 2.79Å; A127-A130 PolarHBondContact O-N 2.94Å; A130-T133 PolarHBondContact O-N 3.04Å; A130-T133 PolarHBondContact O-OG1 2.89Å; A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.36Å; A130-L134 PolarHBondContact O-N 3.44Å; A130-L134 VanDerWaalsContact O-N 3.15Å
131	L	84.8	Confident	76.7	Confident	106 Å²	106	104.6 Å²	104.6	56%	0.555	59%	0.592	S	S	*	*	H	α-helix	trans	-68.2	-37.1	173.6	-80.3	169.3	0	0	0	112.2	A127 R128 E129 T133 L134 K135	A127-L131 WeakPolarHBondContact O-CB 3.43Å; A127-L131 WeakPolarHBondContact O-CG 3.15Å; A127-L131 PolarHBondContact O-N 2.83Å; R128-L131 PolarHBondContact O-N 3.09Å; E129-L131 VanDerWaalsContact C-N 3.35Å; E129-L131 PolarHBondContact O-N 2.87Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 2.97Å; L131-L134 PolarHBondContact O-N 2.82Å; L131-K135 WeakPolarHBondContact O-CG 3.32Å; L131-K135 PolarHBondContact O-N 2.81Å
132	A	83.1	Confident	73.9	Confident	63 Å²	63	104.7 Å²	104.7	52%	0.521	61%	0.606	S	S	.	*	H	α-helix	trans	-65.6	-33.6	176.7	0	0	0	0	0	112.1	R128 E129 P136	R128-A132 WeakPolarHBondContact O-CB 3.4Å; R128-A132 PolarHBondContact O-N 2.9Å; E129-A132 WeakPolarHBondContact O-CB 3.24Å; E129-A132 PolarHBondContact O-N 3.44Å; E129-A132 VanDerWaalsContact O-N 3.17Å; A132-P136 WeakPolarHBondContact O-CD 3.44Å
133	T	81.6	Confident	71.1	Confident	93 Å²	93	102.5 Å²	102.5	57%	0.571	61%	0.608	S	S	*	*	H	α-helix	trans	-78.1	-26.7	176.2	57	0	0	0	0	113.6	E129 A130 L131 P136	E129-T133 WeakPolarHBondContact O-CG2 3.44Å; E129-T133 PolarHBondContact O-N 3.3Å; E129-T133 PolarHBondContact O-OG1 3Å; A130-T133 PolarHBondContact O-N 3.04Å; A130-T133 PolarHBondContact O-OG1 2.89Å; L131-T133 VanDerWaalsContact C-N 3.3Å; L131-T133 PolarHBondContact O-N 2.97Å; T133-P136 WeakPolarHBondContact O-CD 3.32Å; T133-P136 VanDerWaalsContact O-CG 3.27Å; T133-P136 WeakPolarHBondContact O-CG 3.38Å
134	L	75.3	Confident	68.4	Low	97 Å²	97	106.7 Å²	106.7	51%	0.508	63%	0.628	S	S	.	*	H	α-helix	trans	-82.3	-32	177	-71.2	169.8	0	0	0	113.7	A130 L131 Q137 A138	A130-L134 VanDerWaalsContact O-CG 3.3Å; A130-L134 WeakPolarHBondContact O-CG 3.36Å; A130-L134 PolarHBondContact O-N 3.44Å; A130-L134 VanDerWaalsContact O-N 3.15Å; L131-L134 PolarHBondContact O-N 2.82Å; L134-Q137 PolarHBondContact O-N 2.93Å; L134-A138 PolarHBondContact O-N 3.36Å
135	K	64	Low	65.3	Low	160 Å²	160	109.2 Å²	109.2	70%	0.696	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.2	-37.9	177	-82.6	-178.2	178.4	-175.1	0	115.4	L131 Q137 A138	L131-K135 WeakPolarHBondContact O-CG 3.32Å; L131-K135 PolarHBondContact O-N 2.81Å; K135-Q137 PolarHBondContact O-N 3.43Å; K135-A138 PolarHBondContact O-N 2.89Å
136	P	57	Low	62.2	Low	103 Å²	103	112.2 Å²	112.2	67%	0.669	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	-13.4	174.4	24	-32.9	0	0	0	114.3	A132 T133	A132-P136 WeakPolarHBondContact O-CD 3.44Å; T133-P136 WeakPolarHBondContact O-CD 3.32Å; T133-P136 VanDerWaalsContact O-CG 3.27Å; T133-P136 WeakPolarHBondContact O-CG 3.38Å
137	Q	51	Low	59.4	Low	163 Å²	163	115.7 Å²	115.7	76%	0.762	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-18.4	176	-74.7	-175.2	-19.5	0	0	114.1	L134 K135	L134-Q137 PolarHBondContact O-N 2.93Å; K135-Q137 PolarHBondContact O-N 3.43Å
138	A	49.8	Very low	56.4	Low	85 Å²	85	118 Å²	118	70%	0.702	70%	0.704	S	S	*	*	S	Bend	trans	-94.6	8.8	-178.8	0	0	0	0	0	113.9	L134 K135 L140	L134-A138 PolarHBondContact O-N 3.36Å; K135-A138 PolarHBondContact O-N 2.89Å; A138-L140 PolarHBondContact O-N 2.65Å
139	G	42.8	Very low	53.4	Low	67 Å²	67	115 Å²	115	69%	0.691	71%	0.71	S	S	*	*			trans	-89.3	54.4	178.8	0	0	0	0	0	113.9
140	L	49.5	Very low	50.4	Low	162 Å²	162	118.1 Å²	118.1	85%	0.848	73%	0.725	S	S	*	*			trans	-137	135.7	159.5	-93.2	163	0	0	0	108.4	A138	A138-L140 PolarHBondContact O-N 2.65Å
141	V	35	Very low	47.6	Very low	132 Å²	132	122 Å²	122	80%	0.8	75%	0.746	S	S	*	*			trans	92.5	85	-176.4	-163.5	0	0	0	0	114.6
142	A	36.7	Very low	44.7	Very low	98 Å²	98	122 Å²	122	81%	0.81	76%	0.762	S	S	*	*			trans	-81.3	141.9	148.9	0	0	0	0	0	109.5
143	P	37.2	Very low	42	Very low	113 Å²	113	124 Å²	124	73%	0.734	78%	0.778	S	S	*	*			trans	-111.9	137.7	146.1	22.9	-7	0	0	0	110.8
144	Q	39.4	Very low	39.3	Very low	198 Å²	198	124.5 Å²	124.5	93%	0.925	79%	0.792	S	S	*	*			trans	-55.9	142.3	174.5	-66.4	168.1	-38.1	0	0	112.3
145	S	29.9	Very low	36.9	Very low	120 Å²	120	123.9 Å²	123.9	84%	0.839	81%	0.809	S	S	*	*			trans	-142.8	147.3	151.6	63.8	0	0	0	0	111.5
146	V	30.1	Very low	35	Very low	137 Å²	137	120.1 Å²	120.1	83%	0.83	82%	0.815	S	S	*	*			trans	-89.3	156.4	-154.1	-168.5	0	0	0	0	110.5
147	P	35.6	Very low	33.7	Very low	126 Å²	126	119.7 Å²	119.7	82%	0.818	83%	0.83	S	S	*	*			trans	-85.6	144.4	-163.2	29	-24.7	0	0	0	113.8
148	A	29.6	Very low	32.5	Very low	102 Å²	102	115 Å²	115	84%	0.843	83%	0.826	S	S	*	*			trans	-110.2	129.9	169.9	0	0	0	0	0	110.9
149	S	27.9	Very low	31.4	Very low	120 Å²	120	120.2 Å²	120.2	84%	0.839	84%	0.836	S	S	*	*			trans	-59.6	139.7	-175.4	47.9	0	0	0	0	116.5
150	Q	28.8	Very low	30.8	Very low	188 Å²	188	122.8 Å²	122.8	88%	0.879	84%	0.84	S	S	*	*			trans	-106.6	145.3	148.3	-80.4	-174.2	-12.8	0	0	109.8
151	P	29.8	Very low	29.8	Very low	128 Å²	128	123.7 Å²	123.7	83%	0.831	84%	0.842	S	S	*	*			trans	-81.7	143	174.6	32.8	-31.1	0	0	0	111.6
152	A	25.3	Very low	29.4	Very low	107 Å²	107	126.6 Å²	126.6	88%	0.884	85%	0.847	S	S	*	*			trans	-75.7	143.6	177.7	0	0	0	0	0	112.6
153	A	25.8	Very low	29.1	Very low	104 Å²	104	129.4 Å²	129.4	86%	0.86	85%	0.847	S	S	*	*			trans	-137.2	136.4	152.4	0	0	0	0	0	109.8
154	A	25.2	Very low	28.9	Very low	104 Å²	104	128.5 Å²	128.5	86%	0.86	84%	0.843	S	S	*	*			trans	-64	149.4	-163.3	0	0	0	0	0	117.6
155	G	24.9	Very low	28.8	Very low	84 Å²	84	127 Å²	127	87%	0.866	84%	0.836	S	S	*	*				99.9	112.2	112.8	0	0	0	0	0	117.9
156	G	24.4	Very low	29.5	Very low	81 Å²	81	128.4 Å²	128.4	84%	0.835	83%	0.83	S	S	*	*			trans	163.5	97.2	161.7	0	0	0	0	0	112.6
157	G	29.5	Very low	30.5	Very low	95 Å²	95	125 Å²	125	98%	0.979	81%	0.809	S	S	*	*			trans	-68.3	132.7	176.4	0	0	0	0	0	112.5
158	G	24.2	Very low	31.6	Very low	65 Å²	65	121 Å²	121	67%	0.67	79%	0.791	S	S	*	*			trans	-165.7	118	165.9	0	0	0	0	0	106.6	P160	G158-P160 WeakPolarHBondContact O-CD 3.46Å
159	E	27.6	Very low	33.4	Very low	194 Å²	194	116.9 Å²	116.9	91%	0.907	75%	0.754	S	S	*	*			trans	-53.2	124.5	173.4	-65.4	-176.6	144.5	0	0	109.4	M161	E159-M161 PolarHBondContact O-N 3.21Å
160	P	29.9	Very low	35.8	Very low	121 Å²	121	113.7 Å²	113.7	79%	0.786	73%	0.729	S	S	*	*			trans	-79.2	112.1	167.9	23.8	-17	0	0	0	108	G158 E162	G158-P160 WeakPolarHBondContact O-CD 3.46Å; P160-E162 PolarHBondContact O-N 3.28Å
161	M	29.9	Very low	38.1	Very low	180 Å²	180	109.6 Å²	109.6	89%	0.887	72%	0.719	S	S	*	*			trans	-43.1	131.2	153.5	-89.7	179.3	176.6	0	0	108.7	E159 I163	E159-M161 PolarHBondContact O-N 3.21Å; M161-I163 PolarHBondContact O-N 3.48Å
162	E	26.2	Very low	40.6	Very low	193 Å²	193	109.9 Å²	109.9	90%	0.902	71%	0.71	S	S	*	*			trans	-49.7	106.1	172.3	-70.7	-178.3	150.6	0	0	109.8	P160 S164	P160-E162 PolarHBondContact O-N 3.28Å; E162-S164 VanDerWaalsContact C-N 3.29Å; E162-S164 PolarHBondContact O-N 3.16Å
163	I	29.7	Very low	43.3	Very low	157 Å²	157	105.8 Å²	105.8	81%	0.805	67%	0.673	S	S	*	*			trans	-66.8	99.2	162	-62.2	167.3	0	0	0	104.2	M161 E165	M161-I163 PolarHBondContact O-N 3.48Å; I163-E165 PolarHBondContact O-N 2.87Å
164	S	33.4	Very low	46	Very low	95 Å²	95	102.5 Å²	102.5	66%	0.664	64%	0.64	S	S	*	*			trans	-51.6	113.6	172.8	57.8	0	0	0	0	107.9	E162 Q166	E162-S164 VanDerWaalsContact C-N 3.29Å; E162-S164 PolarHBondContact O-N 3.16Å; S164-Q166 PolarHBondContact O-N 2.99Å
165	E	36.8	Very low	48.9	Very low	166 Å²	166	103 Å²	103	78%	0.776	63%	0.625	S	S	*	*			trans	-48	110.2	174.2	-71.2	177.6	144.6	0	0	108.4	I163 V167	I163-E165 PolarHBondContact O-N 2.87Å; E165-V167 HydrophobicContact CB-CG2 4.28Å; E165-V167 PolarHBondContact O-N 2.84Å
166	Q	45.8	Very low	51.8	Low	150 Å²	150	105 Å²	105	70%	0.701	61%	0.61	S	S	*	*			trans	-68.6	86.4	167.1	-73.8	175.9	7.5	0	0	106.3	S164 G168	S164-Q166 PolarHBondContact O-N 2.99Å; Q166-G168 VanDerWaalsContact C-N 3.3Å; Q166-G168 PolarHBondContact O-N 2.82Å
167	V	50.3	Low	54.7	Low	66 Å²	66	101.5 Å²	101.5	40%	0.4	57%	0.572	S	S	.	*			trans	-67.2	97.1	172.8	-177.4	0	0	0	0	106	E165 T170	E165-V167 HydrophobicContact CB-CG2 4.28Å; E165-V167 PolarHBondContact O-N 2.84Å; V167-T170 HydrophobicContact CG1-CG2 4.49Å
168	G	59.1	Low	57.4	Low	42 Å²	42	100.4 Å²	100.4	43%	0.433	54%	0.541	S	S	.	.			trans	-51.8	150.5	174.3	0	0	0	0	0	110.6	Q166 T170	Q166-G168 VanDerWaalsContact C-N 3.3Å; Q166-G168 PolarHBondContact O-N 2.82Å; G168-T170 PolarHBondContact O-N 2.98Å
169	M	67.9	Low	60.5	Low	14 Å²	14	101.2 Å²	101.2	7%	0.069	53%	0.53	C	S	.	.			trans	-48.5	115.8	-179.8	-77.3	-158.8	-90.1	0	0	111.2	I173 I174 L177 F333 L380 R383	M169-I173 HydrophobicContact SD-CG2 4.37Å; M169-I174 HydrophobicContact CB-CD1 4.2Å; M169-I174 HydrophobicContact CB-CG1 4.12Å; M169-L177 HydrophobicContact SD-CD1 4.28Å; M169-F333 HydrophobicContact SD-CD1 4.01Å; M169-F333 HydrophobicContact SD-CE1 3.92Å; M169-L380 HydrophobicContact CE-CD1 3.95Å; M169-L380 HydrophobicContact CE-CG 3.97Å; M169-L380 WeakPolarHBondContact CE-O 3.49Å; M169-R383 HydrophobicContact CE-CG 4.5Å
170	T	78.1	Confident	63.2	Low	53 Å²	53	95.7 Å²	95.7	33%	0.325	50%	0.503	S	S	.	.			trans	-64.7	148.9	176.8	58.4	0	0	0	0	109.1	V167 G168 E172 I173 I174	V167-T170 HydrophobicContact CG1-CG2 4.49Å; G168-T170 PolarHBondContact O-N 2.98Å; T170-E172 PolarHBondContact O-N 3.42Å; T170-E172 VanDerWaalsContact O-N 3.11Å; T170-I173 PolarHBondContact O-N 3.11Å; T170-I173 WeakPolarHBondContact OG1-CD1 3.26Å; T170-I173 WeakPolarHBondContact OG1-CG1 3.42Å; T170-I174 PolarHBondContact O-N 2.92Å
171	P	76.6	Confident	65.8	Low	103 Å²	103	90 Å²	90	67%	0.669	47%	0.467	S	S	*	.	H	α-helix	trans	-57.8	-28.5	-179.7	22.7	-33.5	0	0	0	112.3	I174 Q175	P171-I174 PolarHBondContact O-N 2.86Å; P171-Q175 WeakPolarHBondContact O-CB 3.44Å; P171-Q175 PolarHBondContact O-N 2.9Å
172	E	81.9	Confident	68.4	Low	134 Å²	134	85.2 Å²	85.2	63%	0.626	45%	0.447	S	S	*	.	H	α-helix	trans	-64.4	-40.2	175	-62.2	-179.4	-175.8	0	0	113.1	T170 Q175 K176	T170-E172 PolarHBondContact O-N 3.42Å; T170-E172 VanDerWaalsContact O-N 3.11Å; E172-Q175 PolarHBondContact O-N 2.56Å; E172-K176 WeakPolarHBondContact O-CG 3.3Å; E172-K176 PolarHBondContact O-N 2.83Å
173	I	82.3	Confident	71.3	Confident	21 Å²	21	80.2 Å²	80.2	11%	0.108	43%	0.426	C	S	.	.	H	α-helix	trans	-64.6	-47.5	176.7	-66.8	168.9	0	0	0	108.8	M169 T170 Q175 K176 L177 Y321 L342	M169-I173 HydrophobicContact SD-CG2 4.37Å; T170-I173 PolarHBondContact O-N 3.11Å; T170-I173 WeakPolarHBondContact OG1-CD1 3.26Å; T170-I173 WeakPolarHBondContact OG1-CG1 3.42Å; I173-Q175 VanDerWaalsContact C-N 3.28Å; I173-Q175 PolarHBondContact O-N 2.86Å; I173-K176 PolarHBondContact O-N 2.8Å; I173-L177 HydrophobicContact CG2-CD1 3.88Å; I173-L177 HydrophobicContact CG2-CG 4.25Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 3.25Å; I173-Y321 HydrophobicContact CG2-CE1 4.34Å; I173-Y321 HydrophobicContact CG2-CE2 4.14Å; I173-L342 HydrophobicContact CD1-CD1 4.27Å; I173-L342 HydrophobicContact CD1-CD2 4.38Å
174	I	83.2	Confident	73.8	Confident	35 Å²	35	74.8 Å²	74.8	18%	0.179	40%	0.398	C	S	.	.	H	α-helix	trans	-59.1	-42.3	178.8	-62.4	172.8	0	0	0	110.8	M169 T170 P171 L177 Q178 K381	M169-I174 HydrophobicContact CB-CD1 4.2Å; M169-I174 HydrophobicContact CB-CG1 4.12Å; T170-I174 PolarHBondContact O-N 2.92Å; P171-I174 PolarHBondContact O-N 2.86Å; I174-L177 PolarHBondContact O-N 3.01Å; I174-Q178 WeakPolarHBondContact O-CG 3.11Å; I174-Q178 PolarHBondContact O-N 3.24Å; I174-K381 HydrophobicContact CG2-CD 4.19Å; I174-K381 HydrophobicContact CG2-CG 3.96Å
175	Q	85.1	Confident	76	Confident	114 Å²	114	72.1 Å²	72.1	53%	0.533	38%	0.378	S	S	.	.	H	α-helix	trans	-64	-45.4	177	-171.8	171.5	7	0	0	111.9	P171 E172 I173 L177 Q178 D179	P171-Q175 WeakPolarHBondContact O-CB 3.44Å; P171-Q175 PolarHBondContact O-N 2.9Å; E172-Q175 PolarHBondContact O-N 2.56Å; I173-Q175 VanDerWaalsContact C-N 3.28Å; I173-Q175 PolarHBondContact O-N 2.86Å; Q175-L177 VanDerWaalsContact C-N 3.3Å; Q175-L177 PolarHBondContact O-N 3.3Å; Q175-Q178 PolarHBondContact O-N 3.23Å; Q175-Q178 VanDerWaalsContact O-N 3.15Å; Q175-D179 VanDerWaalsContact O-CG 3.29Å; Q175-D179 PolarHBondContact O-N 3.05Å
176	K	86.2	Confident	78.1	Confident	126 Å²	126	67.2 Å²	67.2	55%	0.548	36%	0.36	S	S	.	.	H	α-helix	trans	-58.6	-41.7	174.9	-74.4	175.9	-179.2	177.7	0	112.3	E172 I173 K180	E172-K176 WeakPolarHBondContact O-CG 3.3Å; E172-K176 PolarHBondContact O-N 2.83Å; I173-K176 PolarHBondContact O-N 2.8Å; K176-K180 WeakPolarHBondContact O-CB 3.19Å; K176-K180 PolarHBondContact O-N 2.91Å
177	L	85.9	Confident	79.8	Confident	7 Å²	7	63.7 Å²	63.7	4%	0.037	34%	0.343	C	S	.	.	H	α-helix	trans	-63	-43.8	176.6	-64.2	170.5	0	0	0	110.6	M169 I173 I174 Q175 A181 H316 T318 Y321 F333 L380	M169-L177 HydrophobicContact SD-CD1 4.28Å; I173-L177 HydrophobicContact CG2-CD1 3.88Å; I173-L177 HydrophobicContact CG2-CG 4.25Å; I173-L177 WeakPolarHBondContact O-CG 3.45Å; I173-L177 PolarHBondContact O-N 3.25Å; I174-L177 PolarHBondContact O-N 3.01Å; Q175-L177 VanDerWaalsContact C-N 3.3Å; Q175-L177 PolarHBondContact O-N 3.3Å; L177-A181 VanDerWaalsContact O-CB 3.32Å; L177-A181 WeakPolarHBondContact O-CB 3.35Å; L177-A181 PolarHBondContact O-N 3.18Å; L177-H316 WeakPolarHBondContact CD2-CE1 3.32Å; L177-H316 WeakPolarHBondContact CD2-NE2 3.5Å; L177-T318 HydrophobicContact CD2-CG2 4.19Å; L177-Y321 HydrophobicContact CD2-CD2 3.89Å; L177-Y321 HydrophobicContact CD2-CE2 3.95Å; L177-F333 HydrophobicContact CD1-CZ 4.44Å; L177-F333 HydrophobicContact CD2-CZ 4.48Å; L177-L380 HydrophobicContact CD1-CD2 3.79Å
178	Q	86.4	Confident	81	Confident	73 Å²	73	62.2 Å²	62.2	34%	0.341	33%	0.33	S	S	.	.	H	α-helix	trans	-65.2	-47.8	177	-74.5	176.9	-8.2	0	0	112.5	I174 Q175 K180 A181 T182 L364	I174-Q178 WeakPolarHBondContact O-CG 3.11Å; I174-Q178 PolarHBondContact O-N 3.24Å; Q175-Q178 PolarHBondContact O-N 3.23Å; Q175-Q178 VanDerWaalsContact O-N 3.15Å; Q178-K180 VanDerWaalsContact C-N 3.32Å; Q178-K180 PolarHBondContact O-N 3.29Å; Q178-A181 CarbonylContact O-C 3.47Å; Q178-A181 WeakPolarHBondContact O-CB 3.39Å; Q178-A181 PolarHBondContact O-N 3.27Å; Q178-A181 VanDerWaalsContact O-N 3.11Å; Q178-T182 WeakPolarHBondContact O-CG2 3.18Å; Q178-T182 PolarHBondContact O-N 3.34Å; Q178-L364 HydrophobicContact CG-CD2 4.22Å
179	D	87.6	Confident	81.8	Confident	82 Å²	82	67.3 Å²	67.3	44%	0.439	34%	0.341	S	S	.	.	H	α-helix	trans	-58.9	-46.7	179.3	-69.5	-20.9	0	0	0	110.3	Q175 A181 T182 I183	Q175-D179 VanDerWaalsContact O-CG 3.29Å; Q175-D179 PolarHBondContact O-N 3.05Å; D179-A181 VanDerWaalsContact C-N 3.34Å; D179-A181 PolarHBondContact O-N 3.15Å; D179-T182 PolarHBondContact O-N 3.07Å; D179-T182 PolarHBondContact O-OG1 2.81Å; D179-I183 WeakPolarHBondContact O-CG1 3.46Å; D179-I183 PolarHBondContact O-N 3.08Å
180	K	85	Confident	81.9	Confident	77 Å²	77	74 Å²	74	34%	0.335	37%	0.369	S	S	.	.	H	α-helix	trans	-60.9	-43.2	175.1	-166.7	106.3	175.3	-161.7	0	111.4	K176 Q178 T182 I183 L184 A317 T318	K176-K180 WeakPolarHBondContact O-CB 3.19Å; K176-K180 PolarHBondContact O-N 2.91Å; Q178-K180 VanDerWaalsContact C-N 3.32Å; Q178-K180 PolarHBondContact O-N 3.29Å; K180-T182 VanDerWaalsContact C-N 3.33Å; K180-T182 PolarHBondContact O-N 3.06Å; K180-I183 PolarHBondContact O-N 2.53Å; K180-L184 HydrophobicContact CG-CD1 3.98Å; K180-L184 HydrophobicContact CG-CG 4.44Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.29Å; K180-L184 WeakPolarHBondContact O-CG 3.34Å; K180-L184 PolarHBondContact O-N 2.86Å; K180-A317 WeakPolarHBondContact CE-O 3.25Å; K180-A317 PolarHBondContact NZ-O 2.83Å; K180-T318 HydrophobicContact CB-CG2 4Å; K180-T318 HydrophobicContact CD-CG2 3.84Å; K180-T318 HydrophobicContact CG-CG2 3.89Å; K180-T318 PolarHBondContact NZ-O 3.17Å
181	A	84.4	Confident	81.3	Confident	3 Å²	3	78.9 Å²	78.9	3%	0.025	38%	0.382	C	S	.	.	H	α-helix	trans	-61.7	-38.9	176.1	0	0	0	0	0	112.3	L177 Q178 D179 L184 T185 D362 L364	L177-A181 VanDerWaalsContact O-CB 3.32Å; L177-A181 WeakPolarHBondContact O-CB 3.35Å; L177-A181 PolarHBondContact O-N 3.18Å; Q178-A181 CarbonylContact O-C 3.47Å; Q178-A181 WeakPolarHBondContact O-CB 3.39Å; Q178-A181 PolarHBondContact O-N 3.27Å; Q178-A181 VanDerWaalsContact O-N 3.11Å; D179-A181 VanDerWaalsContact C-N 3.34Å; D179-A181 PolarHBondContact O-N 3.15Å; A181-L184 PolarHBondContact O-N 2.9Å; A181-T185 WeakPolarHBondContact O-CB 3.36Å; A181-T185 VanDerWaalsContact O-CG2 3.25Å; A181-T185 WeakPolarHBondContact O-CG2 3.46Å; A181-T185 PolarHBondContact O-N 2.82Å; A181-T185 PolarHBondContact O-OG1 3.09Å; A181-D362 WeakPolarHBondContact CB-O 3.33Å; A181-L364 HydrophobicContact CB-CD1 3.68Å; A181-L364 HydrophobicContact CB-CD2 4.03Å; A181-L364 HydrophobicContact CB-CG 3.59Å
182	T	83.9	Confident	80.3	Confident	78 Å²	78	77 Å²	77	48%	0.479	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-40.6	175	68.4	0	0	0	0	111.6	Q178 D179 K180 T185 T186	Q178-T182 WeakPolarHBondContact O-CG2 3.18Å; Q178-T182 PolarHBondContact O-N 3.34Å; D179-T182 PolarHBondContact O-N 3.07Å; D179-T182 PolarHBondContact O-OG1 2.81Å; K180-T182 VanDerWaalsContact C-N 3.33Å; K180-T182 PolarHBondContact O-N 3.06Å; T182-T185 WeakPolarHBondContact CA-OG1 3.44Å; T182-T185 PolarHBondContact O-OG1 2.71Å; T182-T186 WeakPolarHBondContact O-CB 3.32Å; T182-T186 WeakPolarHBondContact O-CG2 3.38Å; T182-T186 PolarHBondContact O-N 3.01Å; T182-T186 PolarHBondContact O-OG1 3.16Å
183	I	86.9	Confident	78.9	Confident	89 Å²	89	79.4 Å²	79.4	46%	0.456	39%	0.39	S	S	.	.	H	α-helix	trans	-62.5	-51.9	176	-65	164.4	0	0	0	109.7	D179 K180 T185 T186 E187	D179-I183 WeakPolarHBondContact O-CG1 3.46Å; D179-I183 PolarHBondContact O-N 3.08Å; K180-I183 PolarHBondContact O-N 2.53Å; I183-T185 PolarHBondContact O-N 2.85Å; I183-T186 PolarHBondContact O-N 3.14Å; I183-T186 VanDerWaalsContact O-N 3.11Å; I183-T186 PolarHBondContact O-OG1 3.43Å; I183-E187 HydrophobicContact CG2-CG 4.5Å; I183-E187 PolarHBondContact O-N 3.11Å
184	L	82.3	Confident	77.7	Confident	42 Å²	42	83 Å²	83	22%	0.22	41%	0.413	C	S	.	.	H	α-helix	trans	-61.8	-41.9	-178.7	-67.8	170	0	0	0	112.4	K180 A181 T186 E187 R188 A317	K180-L184 HydrophobicContact CG-CD1 3.98Å; K180-L184 HydrophobicContact CG-CG 4.44Å; K180-L184 WeakPolarHBondContact O-CB 3.48Å; K180-L184 VanDerWaalsContact O-CG 3.29Å; K180-L184 WeakPolarHBondContact O-CG 3.34Å; K180-L184 PolarHBondContact O-N 2.86Å; A181-L184 PolarHBondContact O-N 2.9Å; L184-T186 VanDerWaalsContact C-N 3.35Å; L184-T186 PolarHBondContact O-N 3.08Å; L184-E187 PolarHBondContact O-N 2.9Å; L184-R188 WeakPolarHBondContact O-CB 3.48Å; L184-R188 PolarHBondContact O-N 2.89Å; L184-A317 HydrophobicContact CD1-CB 3.52Å
185	T	81.5	Confident	76.6	Confident	39 Å²	39	85.3 Å²	85.3	24%	0.239	43%	0.429	C	S	.	.	H	α-helix	trans	-66	-36.2	175.4	51.6	0	0	0	0	112.2	A181 T182 I183 K189 D362	A181-T185 WeakPolarHBondContact O-CB 3.36Å; A181-T185 VanDerWaalsContact O-CG2 3.25Å; A181-T185 WeakPolarHBondContact O-CG2 3.46Å; A181-T185 PolarHBondContact O-N 2.82Å; A181-T185 PolarHBondContact O-OG1 3.09Å; T182-T185 WeakPolarHBondContact CA-OG1 3.44Å; T182-T185 PolarHBondContact O-OG1 2.71Å; I183-T185 PolarHBondContact O-N 2.85Å; T185-K189 WeakPolarHBondContact O-CB 3.26Å; T185-K189 VanDerWaalsContact O-CG 3.3Å; T185-K189 WeakPolarHBondContact O-CG 3.24Å; T185-K189 PolarHBondContact O-N 2.85Å; T185-D362 HydrophobicContact CG2-CB 4.28Å; T185-D362 VanDerWaalsContact CG2-OD1 3.32Å; T185-D362 WeakPolarHBondContact CG2-OD1 3.34Å; T185-D362 WeakPolarHBondContact CG2-OD2 3.4Å
186	T	80.6	Confident	75.6	Confident	64 Å²	64	82.7 Å²	82.7	39%	0.393	42%	0.421	S	S	.	.	H	α-helix	trans	-70.4	-40.6	174.8	64.6	0	0	0	0	112.2	T182 I183 L184 R188 K189 K190	T182-T186 WeakPolarHBondContact O-CB 3.32Å; T182-T186 WeakPolarHBondContact O-CG2 3.38Å; T182-T186 PolarHBondContact O-N 3.01Å; T182-T186 PolarHBondContact O-OG1 3.16Å; I183-T186 PolarHBondContact O-N 3.14Å; I183-T186 VanDerWaalsContact O-N 3.11Å; I183-T186 PolarHBondContact O-OG1 3.43Å; L184-T186 VanDerWaalsContact C-N 3.35Å; L184-T186 PolarHBondContact O-N 3.08Å; T186-R188 VanDerWaalsContact C-N 3.34Å; T186-K189 PolarHBondContact O-N 2.83Å; T186-K190 WeakPolarHBondContact O-CG 3.4Å; T186-K190 PolarHBondContact O-N 2.85Å
187	E	81.1	Confident	74.3	Confident	75 Å²	75	86.4 Å²	86.4	35%	0.35	44%	0.441	S	S	.	.	H	α-helix	trans	-61.2	-43.6	172.8	-75.3	-166.9	-173.5	0	0	111.2	I183 L184 K189 K190 R191	I183-E187 HydrophobicContact CG2-CG 4.5Å; I183-E187 PolarHBondContact O-N 3.11Å; L184-E187 PolarHBondContact O-N 2.9Å; E187-K189 PolarHBondContact O-N 3.07Å; E187-K190 CarbonylContact O-C 3.52Å; E187-K190 WeakPolarHBondContact O-CA 3.31Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 2.97Å; E187-K190 VanDerWaalsContact O-N 3.09Å; E187-R191 WeakPolarHBondContact O-CG 3.47Å; E187-R191 PolarHBondContact O-N 2.99Å; E187-R191 IonicContact OE2-CZ 3.73Å; E187-R191 IonicContact OE2-NH2 2.72Å; E187-R191 PolarHBondContact OE2-NH2 3.1Å
188	R	75.6	Confident	73.6	Confident	35 Å²	35	92.1 Å²	92.1	13%	0.132	47%	0.467	C	S	.	.	H	α-helix	trans	-62.2	-43.4	175.7	-170.2	-174.2	-67.4	133.7	14.1	111.8	L184 T186 K190 R191 G192 P361 D362 E403 N404	L184-R188 WeakPolarHBondContact O-CB 3.48Å; L184-R188 PolarHBondContact O-N 2.89Å; T186-R188 VanDerWaalsContact C-N 3.34Å; R188-K190 PolarHBondContact O-N 2.8Å; R188-R191 PolarHBondContact O-N 2.92Å; R188-G192 PolarHBondContact O-N 3.41Å; R188-P361 VanDerWaalsContact NH2-CB 3.32Å; R188-D362 IonicContact CZ-OD1 3.66Å; R188-D362 IonicContact NH1-OD1 2.9Å; R188-D362 PolarHBondContact NH1-OD1 3.07Å; R188-D362 IonicContact NH1-OD2 3.9Å; R188-D362 PolarHBondContact NH1-OD2 2.87Å; R188-D362 IonicContact NH2-OD1 3.17Å; R188-D362 PolarHBondContact NH2-OD1 3.4Å; R188-E403 WeakPolarHBondContact CD-O 3.4Å; R188-E403 PolarHBondContact NE-O 2.84Å; R188-N404 WeakPolarHBondContact CD-O 3.18Å
189	K	74.7	Confident	73.1	Confident	150 Å²	150	89.7 Å²	89.7	65%	0.652	46%	0.456	S	S	*	.	H	α-helix	trans	-61	-30.2	174.7	-76.1	174.2	-176.8	175.6	0	112.6	T185 T186 E187	T185-K189 WeakPolarHBondContact O-CB 3.26Å; T185-K189 VanDerWaalsContact O-CG 3.3Å; T185-K189 WeakPolarHBondContact O-CG 3.24Å; T185-K189 PolarHBondContact O-N 2.85Å; T186-K189 PolarHBondContact O-N 2.83Å; E187-K189 PolarHBondContact O-N 3.07Å
190	K	71.4	Confident	72.6	Confident	153 Å²	153	87.1 Å²	87.1	67%	0.665	44%	0.443	S	S	*	.	H	α-helix	trans	-74	-48.1	172.9	-68.9	170.9	-177.9	176.6	0	111.1	T186 E187 R188 G192 K193	T186-K190 WeakPolarHBondContact O-CG 3.4Å; T186-K190 PolarHBondContact O-N 2.85Å; E187-K190 CarbonylContact O-C 3.52Å; E187-K190 WeakPolarHBondContact O-CA 3.31Å; E187-K190 WeakPolarHBondContact O-CB 3.45Å; E187-K190 PolarHBondContact O-N 2.97Å; E187-K190 VanDerWaalsContact O-N 3.09Å; R188-K190 PolarHBondContact O-N 2.8Å; K190-G192 PolarHBondContact O-N 3.09Å; K190-K193 PolarHBondContact O-N 3.02Å
191	R	65.5	Low	72.4	Confident	156 Å²	156	92.4 Å²	92.4	59%	0.589	46%	0.461	S	S	*	.	H	α-helix	trans	-64.9	-36.7	178.8	-67.2	-180	-157.5	-169	7.1	113	E187 R188 K193 T194	E187-R191 WeakPolarHBondContact O-CG 3.47Å; E187-R191 PolarHBondContact O-N 2.99Å; E187-R191 IonicContact OE2-CZ 3.73Å; E187-R191 IonicContact OE2-NH2 2.72Å; E187-R191 PolarHBondContact OE2-NH2 3.1Å; R188-R191 PolarHBondContact O-N 2.92Å; R191-K193 PolarHBondContact O-N 3.06Å; R191-T194 CarbonylContact O-C 3.54Å; R191-T194 PolarHBondContact O-N 3.28Å
192	G	55.1	Low	72.2	Confident	65 Å²	65	93.7 Å²	93.7	67%	0.67	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-11.7	177.8	0	0	0	0	0	114.5	R188 K190	R188-G192 PolarHBondContact O-N 3.41Å; K190-G192 PolarHBondContact O-N 3.09Å
193	K	52.7	Low	71.9	Confident	184 Å²	184	96.9 Å²	96.9	80%	0.8	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-17.8	172.8	-70.8	-175.8	177.4	-176.1	0	114.1	K190 R191	K190-K193 PolarHBondContact O-N 3.02Å; R191-K193 PolarHBondContact O-N 3.06Å
194	T	56	Low	71.7	Confident	96 Å²	96	94.9 Å²	94.9	59%	0.589	47%	0.472	S	S	*	.	S	Bend	trans	-145.4	110.5	-176.6	53.1	0	0	0	0	110	R191	R191-T194 CarbonylContact O-C 3.54Å; R191-T194 PolarHBondContact O-N 3.28Å
195	V	61.7	Low	71.6	Confident	84 Å²	84	93 Å²	93	51%	0.509	46%	0.462	S	S	.	.			trans	-59.5	130.2	165.6	-178.1	0	0	0	0	107	E197 L199	V195-E197 PolarHBondContact O-N 2.59Å; V195-L199 HydrophobicContact CG1-CB 4.39Å; V195-L199 HydrophobicContact CG1-CD2 3.66Å
196	P	62.5	Low	71.6	Confident	58 Å²	58	94 Å²	94	38%	0.377	47%	0.471	S	S	.	.			trans	-52.3	128.5	178.4	-27.2	34.7	0	0	0	111.3	E198 L199	P196-E198 PolarHBondContact O-N 3.45Å; P196-L199 WeakPolarHBondContact O-CB 3.39Å; P196-L199 PolarHBondContact O-N 2.86Å; P196-L199 VanDerWaalsContact O-N 3.08Å
197	E	60.3	Low	71.8	Confident	205 Å²	205	96.1 Å²	96.1	96%	0.958	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-21.4	-178.6	-70	-173.1	160.4	0	0	112.7	V195 L199	V195-E197 PolarHBondContact O-N 2.59Å; E197-L199 VanDerWaalsContact C-N 3.32Å
198	E	70.2	Confident	72.1	Confident	127 Å²	127	93 Å²	93	59%	0.593	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-2.4	176.5	-63.6	-168.7	-175.2	0	0	114.5	P196 V200 N487 K489	P196-E198 PolarHBondContact O-N 3.45Å; E198-V200 PolarHBondContact O-N 2.84Å; E198-N487 PolarHBondContact OE2-ND2 2.92Å; E198-K489 IonicContact OE2-NZ 3.77Å
199	L	76.9	Confident	72.6	Confident	22 Å²	22	100.3 Å²	100.3	12%	0.115	49%	0.487	C	S	.	.	S	Bend	trans	-69.3	131	178.6	-175.6	71.1	0	0	0	110.6	V195 P196 E197 R201 D445 S447 T449 Y450 A488	V195-L199 HydrophobicContact CG1-CB 4.39Å; V195-L199 HydrophobicContact CG1-CD2 3.66Å; P196-L199 WeakPolarHBondContact O-CB 3.39Å; P196-L199 PolarHBondContact O-N 2.86Å; P196-L199 VanDerWaalsContact O-N 3.08Å; E197-L199 VanDerWaalsContact C-N 3.32Å; L199-R201 PolarHBondContact O-N 3.33Å; L199-D445 VanDerWaalsContact CD1-OD2 3.28Å; L199-D445 WeakPolarHBondContact CD1-OD2 3.43Å; L199-S447 WeakPolarHBondContact CD2-OG 3.35Å; L199-T449 HydrophobicContact CD2-CG2 4.42Å; L199-Y450 HydrophobicContact CD1-CE2 4.14Å; L199-Y450 HydrophobicContact CD2-CE2 4.03Å; L199-Y450 HydrophobicContact CG-CE2 4.12Å; L199-A488 HydrophobicContact CD1-CB 4.17Å
200	V	77.1	Confident	73.1	Confident	27 Å²	27	96.4 Å²	96.4	16%	0.164	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-61.4	129.5	176.5	-178.1	0	0	0	0	110.3	E198 D204 Y208 Y450 K489	E198-V200 PolarHBondContact O-N 2.84Å; V200-D204 HydrophobicContact CG1-CB 3.6Å; V200-Y208 HydrophobicContact CG1-CE1 4.14Å; V200-Y208 WeakPolarHBondContact CG2-OH 3.3Å; V200-Y450 PolarHBondContact O-OH 2.92Å; V200-K489 HydrophobicContact CG2-CG 4.47Å
201	R	80.9	Confident	73.7	Confident	188 Å²	188	93.6 Å²	93.6	71%	0.709	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-69.4	152.7	178	-66.2	-170.5	179.9	114	2.1	110.5	L199 E203 D204 L205	L199-R201 PolarHBondContact O-N 3.33Å; R201-E203 PolarHBondContact O-N 3.42Å; R201-E203 VanDerWaalsContact O-N 3.15Å; R201-D204 PolarHBondContact O-N 2.99Å; R201-L205 PolarHBondContact O-N 3.48Å
202	A	78.7	Confident	74.5	Confident	31 Å²	31	87.1 Å²	87.1	26%	0.256	45%	0.447	S	S	.	.	H	α-helix	trans	-58.2	-31.8	-179.5	0	0	0	0	0	113.6	D204 L205 S206 Y450 I462 V469	A202-D204 VanDerWaalsContact C-N 3.29Å; A202-D204 PolarHBondContact O-N 2.96Å; A202-L205 PolarHBondContact O-N 3.03Å; A202-S206 PolarHBondContact O-N 3.37Å; A202-Y450 HydrophobicContact CB-CE1 4.36Å; A202-Y450 PolarHBondContact N-OH 3.01Å; A202-Y450 VanDerWaalsContact N-OH 3.09Å; A202-I462 HydrophobicContact CB-CD1 3.67Å; A202-I462 HydrophobicContact CB-CG1 4.47Å; A202-V469 WeakPolarHBondContact O-CG1 3.5Å
203	E	79.2	Confident	76	Confident	144 Å²	144	87 Å²	87	67%	0.673	44%	0.435	S	S	*	.	H	α-helix	trans	-68.9	-26.9	176.3	-64.6	177.7	-169.3	0	0	113.6	R201 S206 K207	R201-E203 PolarHBondContact O-N 3.42Å; R201-E203 VanDerWaalsContact O-N 3.15Å; E203-S206 PolarHBondContact O-OG 3.09Å; E203-K207 WeakPolarHBondContact O-CE 3.47Å; E203-K207 WeakPolarHBondContact O-CG 3.39Å
204	D	81.8	Confident	77.5	Confident	48 Å²	48	79.8 Å²	79.8	26%	0.257	41%	0.405	S	S	.	.	H	α-helix	trans	-87.7	-38.5	176.8	-71.6	-27.6	0	0	0	109.3	V200 R201 A202 S206 K207 Y208 L505	V200-D204 HydrophobicContact CG1-CB 3.6Å; R201-D204 PolarHBondContact O-N 2.99Å; A202-D204 VanDerWaalsContact C-N 3.29Å; A202-D204 PolarHBondContact O-N 2.96Å; D204-S206 VanDerWaalsContact C-N 3.29Å; D204-S206 PolarHBondContact O-N 3.25Å; D204-K207 WeakPolarHBondContact O-CB 3.33Å; D204-K207 PolarHBondContact O-N 2.95Å; D204-K207 IonicContact OD1-NZ 3.01Å; D204-K207 PolarHBondContact OD1-NZ 2.94Å; D204-Y208 WeakPolarHBondContact O-CD1 3.3Å; D204-L505 HydrophobicContact CB-CD1 3.52Å; D204-L505 WeakPolarHBondContact O-CD1 3.32Å
205	L	80.9	Confident	78.5	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-54.5	-46.1	170.6	-156.4	111.3	0	0	0	110.9	R201 A202 K207 Y208 Y450 V460 V469 L470 A488	R201-L205 PolarHBondContact O-N 3.48Å; A202-L205 PolarHBondContact O-N 3.03Å; L205-K207 PolarHBondContact O-N 2.87Å; L205-Y208 HydrophobicContact CD1-CE2 4.13Å; L205-Y208 HydrophobicContact CG-CE2 4.34Å; L205-Y208 WeakPolarHBondContact O-CB 3.44Å; L205-Y208 WeakPolarHBondContact O-CD1 3.29Å; L205-Y208 PolarHBondContact O-N 3.25Å; L205-Y450 HydrophobicContact CD1-CD2 4.49Å; L205-Y450 HydrophobicContact CD1-CE2 4.32Å; L205-Y450 HydrophobicContact CD2-CD1 4.39Å; L205-Y450 HydrophobicContact CD2-CE1 4.39Å; L205-V460 HydrophobicContact CD2-CB 4.19Å; L205-V460 HydrophobicContact CD2-CG1 3.77Å; L205-V469 HydrophobicContact CB-CG1 4.5Å; L205-V469 HydrophobicContact CD2-CB 4.33Å; L205-V469 HydrophobicContact CD2-CG1 3.99Å; L205-L470 HydrophobicContact CD2-CD1 3.48Å; L205-L470 VanDerWaalsContact CD2-CD1 3.48Å; L205-L470 HydrophobicContact CD2-CG 4.07Å; L205-L470 HydrophobicContact CG-CD1 3.76Å; L205-L470 VanDerWaalsContact O-CD1 3.24Å; L205-L470 WeakPolarHBondContact O-CD1 3.48Å; L205-L470 WeakPolarHBondContact O-CD2 3.16Å; L205-A488 HydrophobicContact CD1-CB 4.38Å
206	S	80.6	Confident	79.2	Confident	61 Å²	61	77.1 Å²	77.1	43%	0.427	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-16.5	178.7	69.2	0	0	0	0	114.9	A202 E203 D204	A202-S206 PolarHBondContact O-N 3.37Å; E203-S206 PolarHBondContact O-OG 3.09Å; D204-S206 VanDerWaalsContact C-N 3.29Å; D204-S206 PolarHBondContact O-N 3.25Å
207	K	84.8	Confident	79.9	Confident	109 Å²	109	75.1 Å²	75.1	47%	0.474	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-1.2	177.6	-61.9	169.9	-163.2	148.9	0	113.3	E203 D204 L205 R209 L505	E203-K207 WeakPolarHBondContact O-CE 3.47Å; E203-K207 WeakPolarHBondContact O-CG 3.39Å; D204-K207 WeakPolarHBondContact O-CB 3.33Å; D204-K207 PolarHBondContact O-N 2.95Å; D204-K207 IonicContact OD1-NZ 3.01Å; D204-K207 PolarHBondContact OD1-NZ 2.94Å; L205-K207 PolarHBondContact O-N 2.87Å; K207-R209 WeakPolarHBondContact O-CG 3.4Å; K207-R209 PolarHBondContact O-N 2.98Å; K207-L505 HydrophobicContact CB-CD1 4.42Å
208	Y	88	Confident	80.9	Confident	10 Å²	10	65.7 Å²	65.7	4%	0.039	35%	0.347	C	S	.	.			trans	-56	138.6	-177.1	-81.3	17.9	0	0	0	111.4	V200 D204 L205 L470 F472 A488 K489 S504 L505	V200-Y208 HydrophobicContact CG1-CE1 4.14Å; V200-Y208 WeakPolarHBondContact CG2-OH 3.3Å; D204-Y208 WeakPolarHBondContact O-CD1 3.3Å; L205-Y208 HydrophobicContact CD1-CE2 4.13Å; L205-Y208 HydrophobicContact CG-CE2 4.34Å; L205-Y208 WeakPolarHBondContact O-CB 3.44Å; L205-Y208 WeakPolarHBondContact O-CD1 3.29Å; L205-Y208 PolarHBondContact O-N 3.25Å; Y208-L470 HydrophobicContact CD2-CD1 4.46Å; Y208-F472 WeakPolarHBondContact O-CE1 3.28Å; Y208-F472 WeakPolarHBondContact O-CZ 3.27Å; Y208-A488 PolarHBondContact OH-O 2.81Å; Y208-K489 PolarHBondContact OH-O 2.94Å; Y208-S504 CarbonylContact C-O 3.59Å; Y208-S504 VanDerWaalsContact CA-O 3.28Å; Y208-S504 WeakPolarHBondContact CA-O 3.47Å; Y208-L505 HydrophobicContact CD1-CB 4.39Å; Y208-L505 HydrophobicContact CD1-CD1 4.19Å; Y208-L505 HydrophobicContact CE1-CB 4.24Å; Y208-L505 HydrophobicContact CE1-CD1 4.01Å
209	R	84.9	Confident	81.2	Confident	187 Å²	187	62.2 Å²	62.2	71%	0.706	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.3	156.4	176.2	-60.1	-174.2	-176.3	-155.4	-1.5	109.8	K207 V211 Y503 S504	K207-R209 WeakPolarHBondContact O-CG 3.4Å; K207-R209 PolarHBondContact O-N 2.98Å; R209-V211 PolarHBondContact O-N 3.18Å; R209-V211 VanDerWaalsContact O-N 3.15Å; R209-Y503 WeakPolarHBondContact O-CA 3.4Å; R209-S504 PolarHBondContact N-O 2.7Å; R209-S504 PolarHBondContact O-N 3.07Å; R209-S504 VanDerWaalsContact O-N 3.17Å
210	Q	85.4	Confident	80.7	Confident	68 Å²	68	64.8 Å²	64.8	32%	0.318	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	113.8	172.2	-171.8	-179.8	-16.5	0	0	109.2	S213 R501 Y503	Q210-S213 PolarHBondContact NE2-OG 3.47Å; Q210-R501 VanDerWaalsContact OE1-NH1 3.07Å; Q210-Y503 HydrophobicContact CB-CD1 4.09Å; Q210-Y503 HydrophobicContact CB-CE1 3.79Å; Q210-Y503 HydrophobicContact CG-CE1 4.24Å
211	V	85.5	Confident	80.5	Confident	95 Å²	95	68.6 Å²	68.6	58%	0.576	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	-41	179.1	173.8	0	0	0	0	111.2	R209 F502 S504	R209-V211 PolarHBondContact O-N 3.18Å; R209-V211 VanDerWaalsContact O-N 3.15Å; V211-F502 PolarHBondContact N-O 3.18Å; V211-S504 WeakPolarHBondContact CG2-OG 3.37Å
212	A	81.6	Confident	80.2	Confident	20 Å²	20	62.9 Å²	62.9	17%	0.165	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	146.8	-178.6	0	0	0	0	0	111.8	R501 F502	A212-R501 WeakPolarHBondContact O-CA 3.18Å; A212-F502 HydrophobicContact CB-CB 4.36Å; A212-F502 HydrophobicContact CB-CD2 4.08Å; A212-F502 PolarHBondContact O-N 3.1Å
213	S	85.5	Confident	79.8	Confident	62 Å²	62	65 Å²	65	43%	0.434	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	113.7	173.2	-155	0	0	0	0	108.6	Q210	Q210-S213 PolarHBondContact NE2-OG 3.47Å
214	H	84.1	Confident	79.8	Confident	33 Å²	33	58.2 Å²	58.2	15%	0.153	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	102.9	175.7	-53.5	-77.2	0	0	0	108.3	F250 S499 L500 F502	H214-F250 HydrophobicContact CB-CZ 4.49Å; H214-F250 AromaticContact CD2-CE1 3.79Å; H214-F250 AromaticContact CD2-CZ 3.66Å; H214-F250 AromaticContact CE1-CZ 3.73Å; H214-F250 AromaticContact CG-CZ 3.72Å; H214-F250 AromaticContact ND1-CZ 3.77Å; H214-F250 AromaticContact NE2-CE1 3.89Å; H214-F250 AromaticContact NE2-CZ 3.67Å; H214-S499 WeakPolarHBondContact O-CA 3.44Å; H214-L500 PolarHBondContact N-O 3.36Å; H214-L500 PolarHBondContact O-N 3.36Å; H214-F502 AromaticContact CD2-CD2 3.87Å; H214-F502 AromaticContact CD2-CE2 3.62Å; H214-F502 AromaticContact NE2-CD2 3.94Å; H214-F502 AromaticContact NE2-CE2 3.85Å
215	A	78.3	Confident	80.1	Confident	82 Å²	82	56 Å²	56	68%	0.678	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.7	134.3	170	0	0	0	0	0	109
216	G	75.4	Confident	80.5	Confident	42 Å²	42	57.8 Å²	57.8	43%	0.433	35%	0.352	S	S	.	.			trans	105.2	16.8	171.8	0	0	0	0	0	116.8	H218	G216-H218 PolarHBondContact O-N 2.93Å
217	L	78.3	Confident	80.8	Confident	15 Å²	15	55.4 Å²	55.4	8%	0.079	34%	0.336	C	S	.	.	S	Bend	trans	-59.6	-32.7	170.1	-69.1	167.3	0	0	0	112.7	I225 T240 V248 F250 I257 L500	L217-I225 HydrophobicContact CD1-CD1 4.48Å; L217-T240 HydrophobicContact CD1-CG2 4.3Å; L217-V248 HydrophobicContact CD2-CG1 4.21Å; L217-F250 HydrophobicContact CD2-CB 4.18Å; L217-F250 HydrophobicContact CD2-CD2 3.56Å; L217-F250 HydrophobicContact CD2-CE2 4.22Å; L217-F250 HydrophobicContact CD2-CG 4.05Å; L217-I257 HydrophobicContact CD2-CD1 4.18Å; L217-I257 HydrophobicContact CD2-CG1 3.87Å; L217-L500 HydrophobicContact CD1-CB 3.52Å; L217-L500 HydrophobicContact CD1-CD2 3.7Å; L217-L500 HydrophobicContact CD1-CG 4.22Å
218	H	80.5	Confident	81.1	Confident	7 Å²	7	51.1 Å²	51.1	3%	0.032	32%	0.318	C	S	.	.	S	Bend	trans	-116.2	164.2	-179.4	-68.3	-84.9	0	0	0	111.4	G216 T240 G242 D244 N246 R498	G216-H218 PolarHBondContact O-N 2.93Å; H218-T240 PolarHBondContact NE2-OG1 3.37Å; H218-G242 VanDerWaalsContact CE1-CA 3.44Å; H218-G242 WeakPolarHBondContact CE1-CA 3.39Å; H218-G242 PolarHBondContact CE1-N 3.23Å; H218-G242 VanDerWaalsContact CE1-N 3.3Å; H218-G242 WeakPolarHBondContact ND1-CA 3.32Å; H218-D244 WeakPolarHBondContact CA-OD2 3.5Å; H218-D244 WeakPolarHBondContact CB-OD2 3.2Å; H218-D244 IonicContact CE1-OD1 3.4Å; H218-D244 IonicContact CG-OD1 3.76Å; H218-D244 IonicContact CG-OD2 2.99Å; H218-D244 IonicContact ND1-OD1 3.83Å; H218-D244 PolarHBondContact ND1-OD1 2.9Å; H218-D244 IonicContact ND1-OD2 2.86Å; H218-D244 PolarHBondContact ND1-OD2 3.11Å; H218-N246 PolarHBondContact CE1-O 2.83Å; H218-R498 PolarHBondContact O-NH2 3.43Å
219	S	75.9	Confident	81.2	Confident	55 Å²	55	52.2 Å²	52.2	39%	0.385	32%	0.324	S	S	.	.			trans	-49.2	145.6	-176.9	-176.3	0	0	0	0	114.4	S221 D244 R498	S219-S221 PolarHBondContact OG-N 3.32Å; S219-D244 PolarHBondContact N-OD2 3.09Å; S219-R498 VanDerWaalsContact C-NH2 3.32Å; S219-R498 PolarHBondContact O-NE 3.47Å; S219-R498 PolarHBondContact O-NH2 3.43Å
220	A	68.1	Low	81.4	Confident	76 Å²	76	43.7 Å²	43.7	63%	0.628	29%	0.293	S	S	*	.	S	Bend	trans	-75.6	-22.1	177.5	0	0	0	0	0	114.7
221	S	73.1	Confident	81.3	Confident	106 Å²	106	40.6 Å²	40.6	74%	0.741	28%	0.279	S	S	*	.	S	Bend	trans	-78	-31.4	-176.5	-174.4	0	0	0	0	112.7	S219	S219-S221 PolarHBondContact OG-N 3.32Å
222	V	74	Confident	80.8	Confident	68 Å²	68	39.1 Å²	39.1	41%	0.412	27%	0.271	S	S	.	.	S	Bend	trans	-125.2	97	-179.9	-173.2	0	0	0	0	108.9	A243	V222-A243 HydrophobicContact CG1-CB 3.85Å
223	P	69.6	Low	80.5	Confident	76 Å²	76	41.5 Å²	41.5	49%	0.494	29%	0.286	S	S	.	.			trans	-71.3	137.6	-179.4	27.8	-33.3	0	0	0	111.7	R498	P223-R498 HydrophobicContact CB-CG 3.67Å
224	G	79.6	Confident	80.1	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.01	29%	0.285	C	S	.	.			trans	138.2	121.6	161.1	0	0	0	0	0	113.7	A243	G224-A243 WeakPolarHBondContact O-CB 3.34Å; G224-A243 PolarHBondContact O-N 2.71Å
225	I	87.9	Confident	79.8	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132.4	161.2	-53.4	175.7	0	0	0	106	L217 S227 T240 T480 A494 G495 L500	L217-I225 HydrophobicContact CD1-CD1 4.48Å; I225-S227 WeakPolarHBondContact CG2-O 3.33Å; I225-T240 HydrophobicContact CG2-CG2 4.32Å; I225-T480 WeakPolarHBondContact O-CB 3.45Å; I225-T480 PolarHBondContact O-OG1 3.33Å; I225-A494 HydrophobicContact CB-CB 3.97Å; I225-A494 HydrophobicContact CD1-CB 4.22Å; I225-A494 HydrophobicContact CG2-CB 3.61Å; I225-G495 PolarHBondContact N-O 3.37Å; I225-L500 HydrophobicContact CD1-CB 4.5Å
226	L	88.6	Confident	80	Confident	39 Å²	39	40.1 Å²	40.1	20%	0.204	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-28.3	-174.7	-68.5	172.4	0	0	0	112.8	G241 A243 K267 V268 M496	L226-G241 PolarHBondContact N-O 3.15Å; L226-A243 HydrophobicContact CD1-CB 4.25Å; L226-K267 HydrophobicContact CD1-CB 3.72Å; L226-K267 HydrophobicContact CD1-CD 3.77Å; L226-K267 HydrophobicContact CD1-CG 3.94Å; L226-V268 VanDerWaalsContact CB-O 3.32Å; L226-V268 WeakPolarHBondContact CB-O 3.36Å; L226-V268 VanDerWaalsContact CD1-O 3.3Å; L226-V268 WeakPolarHBondContact CD1-O 3.43Å; L226-M496 HydrophobicContact CD2-SD 3.99Å
227	S	87.3	Confident	80.6	Confident	12 Å²	12	40.5 Å²	40.5	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	152.9	179.4	48.2	0	0	0	0	110.4	I225 G241 V271	I225-S227 WeakPolarHBondContact CG2-O 3.33Å; S227-G241 PolarHBondContact N-O 3.45Å; S227-G241 PolarHBondContact O-N 3.47Å; S227-V271 WeakPolarHBondContact OG-CG2 3.21Å
228	L	91.4	Very high	81.1	Confident	18 Å²	18	39.8 Å²	39.8	9%	0.094	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.4	-176.7	176.1	76.4	0	0	0	107.8	V238 L239 T240 T492 A494 L500	L228-V238 HydrophobicContact CD1-CG1 3.36Å; L228-L239 WeakPolarHBondContact CA-O 3.24Å; L228-T240 HydrophobicContact CD1-CG2 3.85Å; L228-T492 HydrophobicContact CD1-CG2 4.16Å; L228-T492 HydrophobicContact CD2-CG2 3.88Å; L228-T492 WeakPolarHBondContact CD2-O 3.36Å; L228-A494 HydrophobicContact CB-CB 3.98Å; L228-A494 HydrophobicContact CD1-CB 4.25Å; L228-A494 HydrophobicContact CD2-CB 4.35Å; L228-A494 HydrophobicContact CG-CB 4.43Å; L228-L500 HydrophobicContact CD1-CD1 3.44Å; L228-L500 VanDerWaalsContact CD1-CD1 3.44Å
229	D	90.1	Very high	81.7	Confident	34 Å²	34	39.5 Å²	39.5	18%	0.182	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	154.9	164.3	-164.3	19.4	0	0	0	110.7	L239 I272 Y273	D229-L239 PolarHBondContact N-O 2.83Å; D229-L239 WeakPolarHBondContact O-CB 3.47Å; D229-L239 PolarHBondContact O-N 2.75Å; D229-I272 WeakPolarHBondContact OD2-CA 3.44Å; D229-Y273 PolarHBondContact OD2-N 3.18Å
230	V	88.7	Confident	82.4	Confident	8 Å²	8	36.9 Å²	36.9	5%	0.048	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	136	179.4	178.2	0	0	0	0	108	P232 V238 F490	V230-P232 VanDerWaalsContact O-CD 3.22Å; V230-P232 WeakPolarHBondContact O-CD 3.49Å; V230-V238 HydrophobicContact CG2-CG1 4.44Å; V230-V238 HydrophobicContact CG2-CG2 4.21Å; V230-F490 HydrophobicContact CG1-CZ 4.36Å
231	C	83.9	Confident	83.5	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.014	20%	0.201	C	C	.	.			trans	-62.7	122.2	177	179.2	0	0	0	0	110.2	S233 D234 K237 Y273	C231-S233 VanDerWaalsContact C-N 3.3Å; C231-S233 PolarHBondContact O-N 3.47Å; C231-S233 PolarHBondContact SG-OG 3.27Å; C231-D234 WeakPolarHBondContact CB-O 3.46Å; C231-D234 CarbonylContact O-C 3.59Å; C231-D234 PolarHBondContact SG-N 2.81Å; C231-D234 VanDerWaalsContact SG-N 3.43Å; C231-K237 HydrophobicContact CB-CB 4.06Å; C231-K237 PolarHBondContact N-O 3.28Å; C231-Y273 HydrophobicContact CB-CD1 3.65Å; C231-Y273 HydrophobicContact CB-CD2 4.18Å; C231-Y273 HydrophobicContact CB-CE1 3.8Å; C231-Y273 HydrophobicContact CB-CE2 4.31Å; C231-Y273 HydrophobicContact CB-CG 3.88Å; C231-Y273 VanDerWaalsContact SG-CD1 3.53Å; C231-Y273 WeakPolarHBondContact SG-CE1 3.49Å
232	P	75.6	Confident	84.3	Confident	64 Å²	64	28.2 Å²	28.2	42%	0.416	17%	0.166	S	C	.	.	S	Bend	trans	-66.2	-27	-178.4	-24.9	35.3	0	0	0	114.7	V230 P275	V230-P232 VanDerWaalsContact O-CD 3.22Å; V230-P232 WeakPolarHBondContact O-CD 3.49Å; P232-P275 HydrophobicContact CB-CB 4.44Å; P232-P275 HydrophobicContact CG-CB 4.25Å
233	S	75.2	Confident	85	Confident	70 Å²	70	25.9 Å²	25.9	49%	0.49	15%	0.154	S	C	.	.	S	Bend	trans	-91.5	-43.5	-178.4	43	0	0	0	0	113.1	C231 P275	C231-S233 VanDerWaalsContact C-N 3.3Å; C231-S233 PolarHBondContact O-N 3.47Å; C231-S233 PolarHBondContact SG-OG 3.27Å; S233-P275 VanDerWaalsContact CB-O 3.26Å; S233-P275 WeakPolarHBondContact CB-O 3.46Å; S233-P275 PolarHBondContact OG-O 2.79Å
234	D	76.9	Confident	85.9	Confident	77 Å²	77	23.3 Å²	23.3	41%	0.412	14%	0.136	S	C	.	.			trans	-110.3	88.1	174.3	-77.2	-17.6	0	0	0	108.9	C231 N236 K237	C231-D234 WeakPolarHBondContact CB-O 3.46Å; C231-D234 CarbonylContact O-C 3.59Å; C231-D234 PolarHBondContact SG-N 2.81Å; C231-D234 VanDerWaalsContact SG-N 3.43Å; D234-N236 PolarHBondContact O-N 3.35Å; D234-K237 HydrophobicContact CB-CD 4.36Å; D234-K237 PolarHBondContact O-N 3.07Å; D234-K237 IonicContact OD2-NZ 2.81Å; D234-K237 PolarHBondContact OD2-NZ 3.47Å
235	T	76.9	Confident	86.4	Confident	24 Å²	24	27.9 Å²	27.9	15%	0.147	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-12	-179	47.5	0	0	0	0	115.2	E486 F490	T235-E486 HydrophobicContact CG2-CB 3.41Å; T235-E486 VanDerWaalsContact CG2-CB 3.41Å; T235-F490 HydrophobicContact CG2-CE1 4.27Å; T235-F490 HydrophobicContact CG2-CZ 4.41Å; T235-F490 VanDerWaalsContact O-CZ 3.26Å; T235-F490 WeakPolarHBondContact O-CZ 3.32Å
236	N	82.6	Confident	86.5	Confident	47 Å²	47	29.3 Å²	29.3	25%	0.251	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.9	177.7	-55.6	-40.7	0	0	0	112.6	D234 K252 N253	D234-N236 PolarHBondContact O-N 3.35Å; N236-K252 HydrophobicContact CB-CB 4.41Å; N236-K252 VanDerWaalsContact O-CB 3.23Å; N236-K252 WeakPolarHBondContact O-CB 3.43Å; N236-K252 PolarHBondContact O-N 3.11Å; N236-N253 PolarHBondContact ND2-ND2 3.43Å; N236-N253 PolarHBondContact OD1-OD1 3.4Å
237	K	87.6	Confident	86.6	Confident	51 Å²	51	27.4 Å²	27.4	22%	0.222	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	122.2	-179.7	-70.6	173.5	-171.4	146	0	110.7	C231 D234 F250	C231-K237 HydrophobicContact CB-CB 4.06Å; C231-K237 PolarHBondContact N-O 3.28Å; D234-K237 HydrophobicContact CB-CD 4.36Å; D234-K237 PolarHBondContact O-N 3.07Å; D234-K237 IonicContact OD2-NZ 2.81Å; D234-K237 PolarHBondContact OD2-NZ 3.47Å; K237-F250 WeakPolarHBondContact CA-O 3.49Å
238	V	90.2	Very high	86.8	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	145	178.5	-176.8	0	0	0	0	109.4	L228 V230 T240 V249 F250 T492 L500 F502	L228-V238 HydrophobicContact CD1-CG1 3.36Å; V230-V238 HydrophobicContact CG2-CG1 4.44Å; V230-V238 HydrophobicContact CG2-CG2 4.21Å; V238-T240 HydrophobicContact CG1-CG2 4.41Å; V238-V249 CarbonylContact O-C 3.58Å; V238-V249 WeakPolarHBondContact O-CA 3.34Å; V238-F250 PolarHBondContact N-O 3.43Å; V238-F250 PolarHBondContact O-N 3.03Å; V238-T492 HydrophobicContact CG1-CG2 4.29Å; V238-L500 HydrophobicContact CB-CD2 4.38Å; V238-L500 HydrophobicContact CG1-CD1 4.07Å; V238-L500 HydrophobicContact CG1-CD2 3.97Å; V238-F502 HydrophobicContact CB-CZ 4.48Å; V238-F502 HydrophobicContact CG2-CE1 3.72Å; V238-F502 HydrophobicContact CG2-CZ 3.72Å
239	L	91.7	Very high	86.8	Confident	0 Å²	0	26 Å²	26	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	124.1	-172.1	173.7	67.1	0	0	0	109	L228 D229 V247 V248 V249 V271 Y273 V280	L228-L239 WeakPolarHBondContact CA-O 3.24Å; D229-L239 PolarHBondContact N-O 2.83Å; D229-L239 WeakPolarHBondContact O-CB 3.47Å; D229-L239 PolarHBondContact O-N 2.75Å; L239-V247 HydrophobicContact CD1-CG1 3.39Å; L239-V247 HydrophobicContact CG-CG1 4.4Å; L239-V248 WeakPolarHBondContact CA-O 3.34Å; L239-V249 HydrophobicContact CD1-CG2 3.83Å; L239-V271 HydrophobicContact CD1-CG1 3.79Å; L239-V271 HydrophobicContact CD2-CG1 3.16Å; L239-V271 HydrophobicContact CG-CG1 3.21Å; L239-Y273 HydrophobicContact CB-CD2 4Å; L239-Y273 HydrophobicContact CD2-CD2 3.79Å; L239-Y273 HydrophobicContact CD2-CG 4.31Å; L239-Y273 HydrophobicContact CG-CD2 4.42Å; L239-V280 HydrophobicContact CD1-CG1 3.64Å; L239-V280 HydrophobicContact CD1-CG2 4.08Å; L239-V280 HydrophobicContact CD2-CB 4.3Å; L239-V280 HydrophobicContact CD2-CG1 3.61Å; L239-V280 HydrophobicContact CD2-CG2 3.85Å; L239-V280 HydrophobicContact CG-CG1 4.27Å
240	T	91.5	Very high	86.8	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.9	-176	62.1	0	0	0	0	111.6	L217 H218 I225 L228 V238 V247 V248 L500	L217-T240 HydrophobicContact CD1-CG2 4.3Å; H218-T240 PolarHBondContact NE2-OG1 3.37Å; I225-T240 HydrophobicContact CG2-CG2 4.32Å; L228-T240 HydrophobicContact CD1-CG2 3.85Å; V238-T240 HydrophobicContact CG1-CG2 4.41Å; T240-V247 WeakPolarHBondContact O-CA 3.31Å; T240-V248 PolarHBondContact N-O 2.79Å; T240-V248 PolarHBondContact O-N 2.87Å; T240-L500 HydrophobicContact CG2-CD1 4.11Å; T240-L500 HydrophobicContact CG2-CD2 4.39Å
241	G	91.6	Very high	86.8	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	122.2	173.2	0	0	0	0	0	111	L226 S227	L226-G241 PolarHBondContact N-O 3.15Å; S227-G241 PolarHBondContact N-O 3.45Å; S227-G241 PolarHBondContact O-N 3.47Å
242	G	90.3	Very high	86.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	155.3	-174.4	0	0	0	0	0	115	H218 D244 K245 N246 V268	H218-G242 VanDerWaalsContact CE1-CA 3.44Å; H218-G242 WeakPolarHBondContact CE1-CA 3.39Å; H218-G242 PolarHBondContact CE1-N 3.23Å; H218-G242 VanDerWaalsContact CE1-N 3.3Å; H218-G242 WeakPolarHBondContact ND1-CA 3.32Å; G242-D244 PolarHBondContact O-N 2.9Å; G242-K245 PolarHBondContact O-N 2.91Å; G242-N246 PolarHBondContact N-O 2.7Å; G242-V268 PolarHBondContact O-N 2.94Å; G242-V268 VanDerWaalsContact O-N 3.12Å
243	A	88	Confident	87.3	Confident	20 Å²	20	30.1 Å²	30.1	17%	0.165	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20.3	163.7	0	0	0	0	0	112.5	V222 G224 L226 K245	V222-A243 HydrophobicContact CG1-CB 3.85Å; G224-A243 WeakPolarHBondContact O-CB 3.34Å; G224-A243 PolarHBondContact O-N 2.71Å; L226-A243 HydrophobicContact CD1-CB 4.25Å; A243-K245 PolarHBondContact O-N 2.86Å
244	D	87.9	Confident	87.6	Confident	22 Å²	22	33.2 Å²	33.2	12%	0.118	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.4	10.5	175.8	75.4	-17.5	0	0	0	114.3	H218 S219 G242 N246	H218-D244 WeakPolarHBondContact CA-OD2 3.5Å; H218-D244 WeakPolarHBondContact CB-OD2 3.2Å; H218-D244 IonicContact CE1-OD1 3.4Å; H218-D244 IonicContact CG-OD1 3.76Å; H218-D244 IonicContact CG-OD2 2.99Å; H218-D244 IonicContact ND1-OD1 3.83Å; H218-D244 PolarHBondContact ND1-OD1 2.9Å; H218-D244 IonicContact ND1-OD2 2.86Å; H218-D244 PolarHBondContact ND1-OD2 3.11Å; S219-D244 PolarHBondContact N-OD2 3.09Å; G242-D244 PolarHBondContact O-N 2.9Å; D244-N246 PolarHBondContact O-N 2.85Å; D244-N246 PolarHBondContact O-ND2 3.1Å; D244-N246 PolarHBondContact OD1-N 2.75Å; D244-N246 VanDerWaalsContact OD1-N 3.17Å; D244-N246 PolarHBondContact OD2-ND2 3.4Å
245	K	89.8	Confident	87.9	Confident	97 Å²	97	35 Å²	35	42%	0.422	17%	0.173	S	C	.	.	S	Bend	trans	71.9	2.1	176.8	-39.4	174.4	-178.4	-169.2	0	114.5	G242 A243 H264 A265 K266	G242-K245 PolarHBondContact O-N 2.91Å; A243-K245 PolarHBondContact O-N 2.86Å; K245-H264 HydrophobicContact CB-CB 4.46Å; K245-A265 WeakPolarHBondContact CD-O 3.32Å; K245-A265 WeakPolarHBondContact CE-O 3.46Å; K245-A265 PolarHBondContact NZ-O 2.75Å; K245-K266 VanDerWaalsContact CB-O 3.31Å; K245-K266 WeakPolarHBondContact CB-O 2.96Å; K245-K266 WeakPolarHBondContact CG-O 3.48Å
246	N	90.3	Very high	88.3	Confident	30 Å²	30	39.7 Å²	39.7	16%	0.16	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	151	-179.2	-56.5	-43	0	0	0	110.1	H218 G242 D244 T260 K262	H218-N246 PolarHBondContact CE1-O 2.83Å; G242-N246 PolarHBondContact N-O 2.7Å; D244-N246 PolarHBondContact O-N 2.85Å; D244-N246 PolarHBondContact O-ND2 3.1Å; D244-N246 PolarHBondContact OD1-N 2.75Å; D244-N246 VanDerWaalsContact OD1-N 3.17Å; D244-N246 PolarHBondContact OD2-ND2 3.4Å; N246-T260 HydrophobicContact CB-CG2 4.24Å; N246-K262 WeakPolarHBondContact OD1-CG 3.23Å
247	V	91.4	Very high	88.5	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.7	167.4	-177.7	0	0	0	0	107.4	L239 T240 L261 V268 V271 V280	L239-V247 HydrophobicContact CD1-CG1 3.39Å; L239-V247 HydrophobicContact CG-CG1 4.4Å; T240-V247 WeakPolarHBondContact O-CA 3.31Å; V247-L261 HydrophobicContact CB-CB 4.12Å; V247-L261 HydrophobicContact CB-CD1 4.2Å; V247-L261 HydrophobicContact CG1-CD1 4.12Å; V247-L261 PolarHBondContact N-O 2.96Å; V247-L261 WeakPolarHBondContact O-CB 3.28Å; V247-L261 PolarHBondContact O-N 3.01Å; V247-V268 HydrophobicContact CG2-CB 4.45Å; V247-V268 HydrophobicContact CG2-CG1 4Å; V247-V268 HydrophobicContact CG2-CG2 3.85Å; V247-V271 HydrophobicContact CG1-CG1 4.06Å; V247-V271 HydrophobicContact CG1-CG2 4.44Å; V247-V271 HydrophobicContact CG2-CG2 4.34Å; V247-V280 HydrophobicContact CG1-CG1 4.23Å
248	V	91.8	Very high	88.5	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.5	-174.3	176.5	0	0	0	0	108.9	L217 L239 T240 I257 T260	L217-V248 HydrophobicContact CD2-CG1 4.21Å; L239-V248 WeakPolarHBondContact CA-O 3.34Å; T240-V248 PolarHBondContact N-O 2.79Å; T240-V248 PolarHBondContact O-N 2.87Å; V248-I257 HydrophobicContact CG1-CB 4.48Å; V248-I257 HydrophobicContact CG1-CD1 4.42Å; V248-I257 HydrophobicContact CG1-CG1 4.11Å; V248-I257 HydrophobicContact CG1-CG2 3.69Å; V248-T260 HydrophobicContact CG2-CG2 4.29Å
249	V	91.4	Very high	88.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.3	170	-176.3	0	0	0	0	107.5	V238 L239 V258 A259 V294	V238-V249 CarbonylContact O-C 3.58Å; V238-V249 WeakPolarHBondContact O-CA 3.34Å; L239-V249 HydrophobicContact CD1-CG2 3.83Å; V249-V258 HydrophobicContact CB-CB 4.39Å; V249-V258 HydrophobicContact CG1-CB 4.2Å; V249-V258 PolarHBondContact O-N 2.88Å; V249-A259 HydrophobicContact CB-CB 4.38Å; V249-A259 HydrophobicContact CG2-CB 4.48Å; V249-A259 PolarHBondContact N-O 2.84Å; V249-A259 PolarHBondContact O-N 3.2Å; V249-V294 HydrophobicContact CG1-CG1 4.16Å; V249-V294 HydrophobicContact CG2-CG1 4.35Å; V249-V294 HydrophobicContact CG2-CG2 4.3Å
250	F	90.2	Very high	88.2	Confident	5 Å²	5	45.4 Å²	45.4	2%	0.022	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	132.9	-178.8	179.5	-103.9	0	0	0	109.9	H214 L217 K237 V238 E255 Q256 I257 L500 F502	H214-F250 HydrophobicContact CB-CZ 4.49Å; H214-F250 AromaticContact CD2-CE1 3.79Å; H214-F250 AromaticContact CD2-CZ 3.66Å; H214-F250 AromaticContact CE1-CZ 3.73Å; H214-F250 AromaticContact CG-CZ 3.72Å; H214-F250 AromaticContact ND1-CZ 3.77Å; H214-F250 AromaticContact NE2-CE1 3.89Å; H214-F250 AromaticContact NE2-CZ 3.67Å; L217-F250 HydrophobicContact CD2-CB 4.18Å; L217-F250 HydrophobicContact CD2-CD2 3.56Å; L217-F250 HydrophobicContact CD2-CE2 4.22Å; L217-F250 HydrophobicContact CD2-CG 4.05Å; K237-F250 WeakPolarHBondContact CA-O 3.49Å; V238-F250 PolarHBondContact N-O 3.43Å; V238-F250 PolarHBondContact O-N 3.03Å; F250-E255 HydrophobicContact CZ-CB 4.37Å; F250-Q256 WeakPolarHBondContact CD2-O 3.44Å; F250-I257 HydrophobicContact CD2-CG1 4.49Å; F250-L500 HydrophobicContact CD1-CD2 3.81Å; F250-L500 HydrophobicContact CE1-CD2 4.35Å; F250-L500 HydrophobicContact CG-CD2 4.32Å; F250-F502 HydrophobicContact CD1-CE2 4.3Å; F250-F502 HydrophobicContact CD1-CZ 4.19Å; F250-F502 AromaticContact CE1-CE2 3.8Å; F250-F502 HydrophobicContact CE1-CE2 3.8Å; F250-F502 HydrophobicContact CE1-CZ 4.08Å
251	D	88.8	Confident	88.1	Confident	20 Å²	20	45.4 Å²	45.4	11%	0.107	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	122.2	170.9	-163.1	-36.7	0	0	0	109.8	N253 E255 Q256 V258	D251-N253 PolarHBondContact OD1-N 2.93Å; D251-E255 VanDerWaalsContact O-CA 3.29Å; D251-E255 WeakPolarHBondContact O-CA 3.31Å; D251-E255 PolarHBondContact O-N 3.04Å; D251-Q256 PolarHBondContact N-O 2.84Å; D251-Q256 PolarHBondContact O-N 2.72Å; D251-V258 HydrophobicContact CB-CG2 3.65Å
252	K	84	Confident	87.9	Confident	57 Å²	57	52.5 Å²	52.5	25%	0.248	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-33.5	179.3	-176	-174.9	175.4	-173.1	0	112.9	N236 F502	N236-K252 HydrophobicContact CB-CB 4.41Å; N236-K252 VanDerWaalsContact O-CB 3.23Å; N236-K252 WeakPolarHBondContact O-CB 3.43Å; N236-K252 PolarHBondContact O-N 3.11Å; K252-F502 HydrophobicContact CB-CZ 4.34Å; K252-F502 HydrophobicContact CD-CD1 4.15Å; K252-F502 HydrophobicContact CD-CE1 4.02Å; K252-F502 HydrophobicContact CD-CZ 4.41Å; K252-F502 HydrophobicContact CG-CE1 4.34Å; K252-F502 HydrophobicContact CG-CE2 4.48Å; K252-F502 HydrophobicContact CG-CZ 4.24Å
253	N	84.9	Confident	87.6	Confident	112 Å²	112	54.1 Å²	54.1	60%	0.599	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-40.3	-175.2	-73.5	-13.9	0	0	0	112.2	N236 D251	N236-N253 PolarHBondContact ND2-ND2 3.43Å; N236-N253 PolarHBondContact OD1-OD1 3.4Å; D251-N253 PolarHBondContact OD1-N 2.93Å
254	E	82.6	Confident	87.6	Confident	135 Å²	135	53.7 Å²	53.7	63%	0.631	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-12.8	179.9	-60.3	-172.9	171.4	0	0	111.8	Q256	E254-Q256 HydrophobicContact CB-CB 4.32Å; E254-Q256 HydrophobicContact CB-CG 4.29Å; E254-Q256 WeakPolarHBondContact O-CG 3.28Å; E254-Q256 PolarHBondContact O-N 3.18Å
255	E	82.8	Confident	87.7	Confident	115 Å²	115	55.7 Å²	55.7	54%	0.537	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	30.7	-171.4	-58.5	-173.7	165.7	0	0	112.7	F250 D251	F250-E255 HydrophobicContact CZ-CB 4.37Å; D251-E255 VanDerWaalsContact O-CA 3.29Å; D251-E255 WeakPolarHBondContact O-CA 3.31Å; D251-E255 PolarHBondContact O-N 3.04Å
256	Q	85.9	Confident	87.7	Confident	121 Å²	121	56.3 Å²	56.3	57%	0.565	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.5	154.9	-178.2	-66	-52	-49	0	0	112.2	F250 D251 E254 V258	F250-Q256 WeakPolarHBondContact CD2-O 3.44Å; D251-Q256 PolarHBondContact N-O 2.84Å; D251-Q256 PolarHBondContact O-N 2.72Å; E254-Q256 HydrophobicContact CB-CB 4.32Å; E254-Q256 HydrophobicContact CB-CG 4.29Å; E254-Q256 WeakPolarHBondContact O-CG 3.28Å; E254-Q256 PolarHBondContact O-N 3.18Å; Q256-V258 PolarHBondContact O-N 3.41Å
257	I	86.9	Confident	87.8	Confident	74 Å²	74	60 Å²	60	38%	0.379	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	112.6	168.6	-63	168.8	0	0	0	108.1	L217 V248 F250	L217-I257 HydrophobicContact CD2-CD1 4.18Å; L217-I257 HydrophobicContact CD2-CG1 3.87Å; V248-I257 HydrophobicContact CG1-CB 4.48Å; V248-I257 HydrophobicContact CG1-CD1 4.42Å; V248-I257 HydrophobicContact CG1-CG1 4.11Å; V248-I257 HydrophobicContact CG1-CG2 3.69Å; F250-I257 HydrophobicContact CD2-CG1 4.49Å
258	V	87.1	Confident	87.8	Confident	69 Å²	69	60 Å²	60	42%	0.418	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	-46.8	178.4	180	0	0	0	0	110.4	V249 D251 Q256 V294	V249-V258 HydrophobicContact CB-CB 4.39Å; V249-V258 HydrophobicContact CG1-CB 4.2Å; V249-V258 PolarHBondContact O-N 2.88Å; D251-V258 HydrophobicContact CB-CG2 3.65Å; Q256-V258 PolarHBondContact O-N 3.41Å; V258-V294 HydrophobicContact CG1-CG1 4.4Å
259	A	85.5	Confident	87.8	Confident	12 Å²	12	61.8 Å²	61.8	10%	0.099	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	139.7	-177.2	0	0	0	0	0	111.4	V249 L261	V249-A259 HydrophobicContact CB-CB 4.38Å; V249-A259 HydrophobicContact CG2-CB 4.48Å; V249-A259 PolarHBondContact N-O 2.84Å; V249-A259 PolarHBondContact O-N 3.2Å; A259-L261 HydrophobicContact CB-CD2 4.46Å
260	T	89.3	Confident	87.7	Confident	63 Å²	63	62.8 Å²	62.8	39%	0.387	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	106.9	167.9	-57.7	0	0	0	0	108.8	N246 V248 K262	N246-T260 HydrophobicContact CB-CG2 4.24Å; V248-T260 HydrophobicContact CG2-CG2 4.29Å; T260-K262 HydrophobicContact CG2-CG 4.03Å
261	L	89.1	Confident	87.8	Confident	1 Å²	1	63 Å²	63	1%	0.005	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	109.5	-176.5	-53.9	168	0	0	0	108.7	V247 A259 V280 W292 G297	V247-L261 HydrophobicContact CB-CB 4.12Å; V247-L261 HydrophobicContact CB-CD1 4.2Å; V247-L261 HydrophobicContact CG1-CD1 4.12Å; V247-L261 PolarHBondContact N-O 2.96Å; V247-L261 WeakPolarHBondContact O-CB 3.28Å; V247-L261 PolarHBondContact O-N 3.01Å; A259-L261 HydrophobicContact CB-CD2 4.46Å; L261-V280 HydrophobicContact CD1-CG1 4.24Å; L261-W292 HydrophobicContact CB-CD2 3.91Å; L261-W292 HydrophobicContact CB-CE3 3.85Å; L261-W292 HydrophobicContact CB-CG 4.41Å; L261-W292 HydrophobicContact CB-CH2 4.42Å; L261-W292 HydrophobicContact CB-CZ2 4.47Å; L261-W292 HydrophobicContact CB-CZ3 4.11Å; L261-W292 HydrophobicContact CD1-CB 3.61Å; L261-W292 HydrophobicContact CD1-CD2 4.07Å; L261-W292 HydrophobicContact CD1-CG 3.68Å; L261-W292 HydrophobicContact CD2-CB 4.16Å; L261-W292 HydrophobicContact CD2-CD2 4.25Å; L261-W292 HydrophobicContact CD2-CE3 3.86Å; L261-W292 HydrophobicContact CD2-CG 4.41Å; L261-W292 HydrophobicContact CG-CB 4.42Å; L261-W292 HydrophobicContact CG-CD2 4.3Å; L261-W292 HydrophobicContact CG-CE3 4.28Å; L261-W292 HydrophobicContact CG-CG 4.38Å; L261-G297 WeakPolarHBondContact CD2-O 3.34Å
262	K	87.9	Confident	88	Confident	149 Å²	149	63.2 Å²	63.2	65%	0.648	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.7	-177.9	-54.8	-169.6	177.9	171.9	0	109.9	N246 T260 W292	N246-K262 WeakPolarHBondContact OD1-CG 3.23Å; T260-K262 HydrophobicContact CG2-CG 4.03Å; K262-W292 WeakPolarHBondContact O-CH2 3.38Å
263	G	84.2	Confident	88.3	Confident	34 Å²	34	61 Å²	61	35%	0.351	32%	0.321	S	S	.	.			trans	170.5	-18.2	171.8	0	0	0	0	0	116.4	R290	G263-R290 PolarHBondContact O-NH1 2.99Å; G263-R290 PolarHBondContact O-NH2 3.49Å
264	H	88.7	Confident	88.6	Confident	11 Å²	11	55.8 Å²	55.8	5%	0.051	29%	0.293	C	S	.	.			trans	-67.9	146.1	174.6	-79.4	-70.4	0	0	0	112.1	K245 S282 S284 D286 T288	K245-H264 HydrophobicContact CB-CB 4.46Å; H264-S282 PolarHBondContact CD2-OG 2.86Å; H264-S282 PolarHBondContact NE2-OG 3.41Å; H264-S284 WeakPolarHBondContact ND1-CB 3.26Å; H264-D286 IonicContact CG-OD2 2.73Å; H264-D286 IonicContact ND1-OD1 3.1Å; H264-D286 IonicContact ND1-OD2 3.01Å; H264-D286 PolarHBondContact ND1-OD2 3.31Å; H264-T288 PolarHBondContact ND1-OG1 2.91Å
265	A	88.4	Confident	88.6	Confident	64 Å²	64	51.9 Å²	51.9	53%	0.529	28%	0.28	S	S	.	.	S	Bend	trans	-86.1	-23.2	179.4	0	0	0	0	0	112.2	K245 D286	K245-A265 WeakPolarHBondContact CD-O 3.32Å; K245-A265 WeakPolarHBondContact CE-O 3.46Å; K245-A265 PolarHBondContact NZ-O 2.75Å; A265-D286 HydrophobicContact CB-CB 4.04Å; A265-D286 PolarHBondContact N-OD2 3.19Å
266	K	91.4	Very high	88.5	Confident	109 Å²	109	51.1 Å²	51.1	47%	0.474	29%	0.287	S	S	.	.	S	Bend	trans	-127.1	176.6	178.7	-63.2	-174.7	-166.6	167.4	0	110.9	K245 P285 D286	K245-K266 VanDerWaalsContact CB-O 3.31Å; K245-K266 WeakPolarHBondContact CB-O 2.96Å; K245-K266 WeakPolarHBondContact CG-O 3.48Å; K266-P285 HydrophobicContact CD-CB 3.97Å; K266-P285 WeakPolarHBondContact CD-O 3.28Å; K266-P285 PolarHBondContact NZ-O 2.75Å; K266-D286 HydrophobicContact CB-CB 4.34Å; K266-D286 HydrophobicContact CD-CB 4.44Å; K266-D286 HydrophobicContact CG-CB 4.21Å
267	K	91.4	Very high	88.3	Confident	109 Å²	109	49.8 Å²	49.8	47%	0.474	28%	0.281	S	S	.	.			trans	-56.7	148.3	177.6	63	-175.9	-176.6	174.9	0	111.5	L226 S284 P285	L226-K267 HydrophobicContact CD1-CB 3.72Å; L226-K267 HydrophobicContact CD1-CD 3.77Å; L226-K267 HydrophobicContact CD1-CG 3.94Å; K267-S284 PolarHBondContact O-OG 2.82Å; K267-P285 HydrophobicContact CG-CG 4.28Å; K267-P285 WeakPolarHBondContact O-CD 3.38Å
268	V	92.3	Very high	88.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.28	C	S	.	.			trans	-88.3	121	-179.7	-171.2	0	0	0	0	109.5	L226 G242 V247 V271 A283	L226-V268 VanDerWaalsContact CB-O 3.32Å; L226-V268 WeakPolarHBondContact CB-O 3.36Å; L226-V268 VanDerWaalsContact CD1-O 3.3Å; L226-V268 WeakPolarHBondContact CD1-O 3.43Å; G242-V268 PolarHBondContact O-N 2.94Å; G242-V268 VanDerWaalsContact O-N 3.12Å; V247-V268 HydrophobicContact CG2-CB 4.45Å; V247-V268 HydrophobicContact CG2-CG1 4Å; V247-V268 HydrophobicContact CG2-CG2 3.85Å; V268-V271 HydrophobicContact CB-CG2 4.47Å; V268-V271 HydrophobicContact CG1-CG2 3.33Å; V268-A283 VanDerWaalsContact CG1-O 3.3Å; V268-A283 WeakPolarHBondContact CG1-O 3.31Å
269	T	90.3	Very high	88.3	Confident	37 Å²	37	46.1 Å²	46.1	23%	0.227	26%	0.264	C	S	.	.			trans	-88	-41.9	-175	37	0	0	0	0	112.9	A283 P285 V310	T269-A283 PolarHBondContact N-O 3.15Å; T269-A283 PolarHBondContact OG1-O 3.21Å; T269-A283 VanDerWaalsContact OG1-O 3.13Å; T269-P285 HydrophobicContact CG2-CG 3.58Å; T269-V310 PolarHBondContact OG1-O 3.06Å
270	S	89.9	Confident	88.6	Confident	22 Å²	22	45.5 Å²	45.5	15%	0.154	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	146	-179.3	-51.6	0	0	0	0	110.3	S282 A283 T311	S270-S282 WeakPolarHBondContact O-CA 3.38Å; S270-A283 PolarHBondContact O-N 3.35Å; S270-T311 PolarHBondContact OG-O 2.92Å
271	V	92.9	Very high	88.7	Confident	9 Å²	9	42.5 Å²	42.5	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	137.3	-176.2	178.8	0	0	0	0	108.6	S227 L239 V247 V268 V280 F281	S227-V271 WeakPolarHBondContact OG-CG2 3.21Å; L239-V271 HydrophobicContact CD1-CG1 3.79Å; L239-V271 HydrophobicContact CD2-CG1 3.16Å; L239-V271 HydrophobicContact CG-CG1 3.21Å; V247-V271 HydrophobicContact CG1-CG1 4.06Å; V247-V271 HydrophobicContact CG1-CG2 4.44Å; V247-V271 HydrophobicContact CG2-CG2 4.34Å; V268-V271 HydrophobicContact CB-CG2 4.47Å; V268-V271 HydrophobicContact CG1-CG2 3.33Å; V271-V280 HydrophobicContact CG1-CG1 4.47Å; V271-F281 WeakPolarHBondContact CA-O 3.34Å
272	I	92.5	Very high	88.9	Confident	25 Å²	25	42.5 Å²	42.5	13%	0.128	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.1	-179.2	-66.8	171.1	0	0	0	110.4	D229 F281 L313 S314 L315	D229-I272 WeakPolarHBondContact OD2-CA 3.44Å; I272-F281 HydrophobicContact CB-CB 4.48Å; I272-F281 HydrophobicContact CB-CD2 4.33Å; I272-F281 HydrophobicContact CG2-CD2 4.23Å; I272-F281 PolarHBondContact N-O 3.36Å; I272-F281 PolarHBondContact O-N 3.11Å; I272-L313 VanDerWaalsContact CD1-C 3.43Å; I272-L313 HydrophobicContact CD1-CB 4.11Å; I272-L313 HydrophobicContact CD1-CD2 4.22Å; I272-L313 HydrophobicContact CD1-CG 3.98Å; I272-L313 WeakPolarHBondContact CD1-O 3.15Å; I272-L313 HydrophobicContact CG1-CD2 4.5Å; I272-S314 VanDerWaalsContact CD1-CA 3.41Å; I272-L315 HydrophobicContact CG2-CB 4.03Å
273	Y	90.8	Very high	89.2	Confident	9 Å²	9	35.4 Å²	35.4	4%	0.035	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	135	171.4	-150.3	-74.5	0	0	0	110.4	D229 C231 L239 V280 V294	D229-Y273 PolarHBondContact OD2-N 3.18Å; C231-Y273 HydrophobicContact CB-CD1 3.65Å; C231-Y273 HydrophobicContact CB-CD2 4.18Å; C231-Y273 HydrophobicContact CB-CE1 3.8Å; C231-Y273 HydrophobicContact CB-CE2 4.31Å; C231-Y273 HydrophobicContact CB-CG 3.88Å; C231-Y273 VanDerWaalsContact SG-CD1 3.53Å; C231-Y273 WeakPolarHBondContact SG-CE1 3.49Å; L239-Y273 HydrophobicContact CB-CD2 4Å; L239-Y273 HydrophobicContact CD2-CD2 3.79Å; L239-Y273 HydrophobicContact CD2-CG 4.31Å; L239-Y273 HydrophobicContact CG-CD2 4.42Å; Y273-V280 HydrophobicContact CD2-CG2 3.66Å; Y273-V280 HydrophobicContact CE2-CG2 3.68Å; Y273-V280 HydrophobicContact CG-CG2 4.29Å; Y273-V294 HydrophobicContact CE2-CG2 4.16Å
274	H	89.8	Confident	89.6	Confident	3 Å²	3	33.8 Å²	33.8	1%	0.014	19%	0.193	C	C	.	.			trans	-74.3	135	176.4	-175.6	-76.1	0	0	0	111.2	S276 Q277 V279 F281 G319	H274-S276 PolarHBondContact CE1-OG 2.96Å; H274-S276 PolarHBondContact ND1-N 3.07Å; H274-S276 PolarHBondContact O-N 2.88Å; H274-Q277 PolarHBondContact CE1-N 3.4Å; H274-Q277 WeakPolarHBondContact ND1-CB 3.11Å; H274-Q277 PolarHBondContact ND1-N 2.94Å; H274-V279 HydrophobicContact CB-CB 4.22Å; H274-V279 WeakPolarHBondContact CB-O 3.35Å; H274-V279 PolarHBondContact N-O 2.97Å; H274-F281 HydrophobicContact CB-CE2 3.83Å; H274-F281 HydrophobicContact CB-CZ 4.3Å; H274-G319 PolarHBondContact CD2-O 2.81Å; H274-G319 WeakPolarHBondContact NE2-CA 3.49Å; H274-G319 PolarHBondContact NE2-O 2.89Å
275	P	83.5	Confident	89.7	Confident	54 Å²	54	34.4 Å²	34.4	35%	0.351	20%	0.199	S	C	.	.	S	Bend	trans	-65.8	-34.2	-169.6	23.1	-34	0	0	0	115.2	P232 S233 L315	P232-P275 HydrophobicContact CB-CB 4.44Å; P232-P275 HydrophobicContact CG-CB 4.25Å; S233-P275 VanDerWaalsContact CB-O 3.26Å; S233-P275 WeakPolarHBondContact CB-O 3.46Å; S233-P275 PolarHBondContact OG-O 2.79Å; P275-L315 HydrophobicContact CG-CD2 4.17Å
276	S	80.2	Confident	89.8	Confident	98 Å²	98	32.8 Å²	32.8	69%	0.685	18%	0.181	S	C	*	.	S	Bend	trans	-116.2	-37.6	-176.6	62.2	0	0	0	0	115.3	H274	H274-S276 PolarHBondContact CE1-OG 2.96Å; H274-S276 PolarHBondContact ND1-N 3.07Å; H274-S276 PolarHBondContact O-N 2.88Å
277	Q	81.8	Confident	89.7	Confident	93 Å²	93	28.4 Å²	28.4	44%	0.435	17%	0.165	S	C	.	.	S	Bend	trans	-86.4	151.1	174.6	-54.9	177.9	12.4	0	0	112.2	H274 V279	H274-Q277 PolarHBondContact CE1-N 3.4Å; H274-Q277 WeakPolarHBondContact ND1-CB 3.11Å; H274-Q277 PolarHBondContact ND1-N 2.94Å; Q277-V279 HydrophobicContact CB-CB 4.44Å; Q277-V279 HydrophobicContact CB-CG2 4.04Å; Q277-V279 PolarHBondContact O-N 3.29Å
278	S	84.3	Confident	89.7	Confident	51 Å²	51	23.8 Å²	23.8	36%	0.357	15%	0.146	S	C	.	.	S	Bend	trans	-78.9	49.1	173.8	55	0	0	0	0	112.5	V294	S278-V294 WeakPolarHBondContact O-CB 3.37Å; S278-V294 WeakPolarHBondContact O-CG2 3.23Å; S278-V294 PolarHBondContact O-N 2.96Å
279	V	90.3	Very high	89.8	Confident	15 Å²	15	23.9 Å²	23.9	9%	0.091	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	141.9	-177.9	179.1	0	0	0	0	109.3	H274 Q277 F281 V291 W292 I300	H274-V279 HydrophobicContact CB-CB 4.22Å; H274-V279 WeakPolarHBondContact CB-O 3.35Å; H274-V279 PolarHBondContact N-O 2.97Å; Q277-V279 HydrophobicContact CB-CB 4.44Å; Q277-V279 HydrophobicContact CB-CG2 4.04Å; Q277-V279 PolarHBondContact O-N 3.29Å; V279-F281 HydrophobicContact CG1-CE1 3.77Å; V279-F281 HydrophobicContact CG1-CZ 3.81Å; V279-V291 HydrophobicContact CG1-CG1 3.35Å; V279-W292 CarbonylContact C-O 3.52Å; V279-W292 VanDerWaalsContact CA-O 3.32Å; V279-W292 WeakPolarHBondContact CA-O 3.4Å; V279-W292 WeakPolarHBondContact CG1-O 3.2Å; V279-I300 HydrophobicContact CG2-CD1 4.43Å
280	V	91.4	Very high	89.8	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	142.8	-177	161.8	0	0	0	0	109.9	L239 V247 L261 V271 Y273 V291 W292 V294	L239-V280 HydrophobicContact CD1-CG1 3.64Å; L239-V280 HydrophobicContact CD1-CG2 4.08Å; L239-V280 HydrophobicContact CD2-CB 4.3Å; L239-V280 HydrophobicContact CD2-CG1 3.61Å; L239-V280 HydrophobicContact CD2-CG2 3.85Å; L239-V280 HydrophobicContact CG-CG1 4.27Å; V247-V280 HydrophobicContact CG1-CG1 4.23Å; L261-V280 HydrophobicContact CD1-CG1 4.24Å; V271-V280 HydrophobicContact CG1-CG1 4.47Å; Y273-V280 HydrophobicContact CD2-CG2 3.66Å; Y273-V280 HydrophobicContact CE2-CG2 3.68Å; Y273-V280 HydrophobicContact CG-CG2 4.29Å; V280-V291 WeakPolarHBondContact O-CA 3.31Å; V280-W292 HydrophobicContact CB-CB 4.29Å; V280-W292 PolarHBondContact N-O 3.31Å; V280-W292 PolarHBondContact O-N 3.03Å; V280-V294 HydrophobicContact CB-CG2 4.38Å; V280-V294 HydrophobicContact CG2-CG2 3.49Å; V280-V294 VanDerWaalsContact CG2-CG2 3.49Å
281	F	92.6	Very high	90	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	137.6	177.5	-48.4	-70	0	0	0	110.6	V271 I272 H274 V279 R290 V291 L313 L315 L322 I336	V271-F281 WeakPolarHBondContact CA-O 3.34Å; I272-F281 HydrophobicContact CB-CB 4.48Å; I272-F281 HydrophobicContact CB-CD2 4.33Å; I272-F281 HydrophobicContact CG2-CD2 4.23Å; I272-F281 PolarHBondContact N-O 3.36Å; I272-F281 PolarHBondContact O-N 3.11Å; H274-F281 HydrophobicContact CB-CE2 3.83Å; H274-F281 HydrophobicContact CB-CZ 4.3Å; V279-F281 HydrophobicContact CG1-CE1 3.77Å; V279-F281 HydrophobicContact CG1-CZ 3.81Å; F281-R290 WeakPolarHBondContact CA-O 3.43Å; F281-V291 HydrophobicContact CD1-CB 4.26Å; F281-V291 HydrophobicContact CD1-CG1 4Å; F281-V291 HydrophobicContact CD1-CG2 3.88Å; F281-V291 HydrophobicContact CE1-CB 4.3Å; F281-V291 HydrophobicContact CE1-CG1 3.63Å; F281-V291 HydrophobicContact CE1-CG2 3.97Å; F281-L313 HydrophobicContact CB-CD2 3.66Å; F281-L315 HydrophobicContact CD2-CD1 4.44Å; F281-L315 HydrophobicContact CE2-CD1 3.78Å; F281-L315 HydrophobicContact CE2-CD2 4.4Å; F281-L315 HydrophobicContact CZ-CD1 4.28Å; F281-L322 HydrophobicContact CB-CD2 4.36Å; F281-L322 HydrophobicContact CD1-CD1 3.61Å; F281-L322 HydrophobicContact CD1-CD2 4.17Å; F281-L322 HydrophobicContact CD1-CG 4.42Å; F281-L322 HydrophobicContact CD2-CD2 3.88Å; F281-L322 HydrophobicContact CE1-CD1 3.91Å; F281-L322 HydrophobicContact CE1-CD2 4.47Å; F281-L322 HydrophobicContact CE2-CD2 4.22Å; F281-L322 HydrophobicContact CG-CD1 4.08Å; F281-L322 HydrophobicContact CG-CD2 3.85Å; F281-I336 HydrophobicContact CE1-CB 4.45Å; F281-I336 HydrophobicContact CE1-CD1 4.08Å; F281-I336 HydrophobicContact CE1-CG1 4Å; F281-I336 HydrophobicContact CE1-CG2 3.6Å; F281-I336 HydrophobicContact CE2-CD1 4.35Å; F281-I336 HydrophobicContact CZ-CD1 3.65Å; F281-I336 HydrophobicContact CZ-CG1 4.09Å; F281-I336 HydrophobicContact CZ-CG2 3.87Å
282	S	92.8	Very high	89.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	138.2	174.8	61.4	0	0	0	0	111.5	H264 S270 I289 R290 W292	H264-S282 PolarHBondContact CD2-OG 2.86Å; H264-S282 PolarHBondContact NE2-OG 3.41Å; S270-S282 WeakPolarHBondContact O-CA 3.38Å; S282-I289 CarbonylContact O-C 3.59Å; S282-I289 WeakPolarHBondContact O-CA 3.45Å; S282-R290 PolarHBondContact N-O 3.39Å; S282-R290 PolarHBondContact O-N 2.77Å; S282-W292 PolarHBondContact OG-NE1 3.03Å
283	A	92.9	Very high	89.7	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	146.7	176.3	0	0	0	0	0	110.1	V268 T269 S270 V310 L313	V268-A283 VanDerWaalsContact CG1-O 3.3Å; V268-A283 WeakPolarHBondContact CG1-O 3.31Å; T269-A283 PolarHBondContact N-O 3.15Å; T269-A283 PolarHBondContact OG1-O 3.21Å; T269-A283 VanDerWaalsContact OG1-O 3.13Å; S270-A283 PolarHBondContact O-N 3.35Å; A283-V310 HydrophobicContact CB-CB 4.08Å; A283-V310 HydrophobicContact CB-CG1 3.69Å; A283-L313 HydrophobicContact CB-CB 4.12Å; A283-L313 HydrophobicContact CB-CD1 4.5Å; A283-L313 HydrophobicContact CB-CD2 4.24Å
284	S	92.9	Very high	89.4	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	14%	0.141	C	C	.	.			trans	-144.4	154.4	-176.4	167.1	0	0	0	0	111.2	H264 K267 D286 A287 T288 V310	H264-S284 WeakPolarHBondContact ND1-CB 3.26Å; K267-S284 PolarHBondContact O-OG 2.82Å; S284-D286 VanDerWaalsContact CB-OD1 3.25Å; S284-D286 WeakPolarHBondContact CB-OD1 3.49Å; S284-D286 PolarHBondContact O-N 2.81Å; S284-D286 PolarHBondContact OG-N 2.91Å; S284-D286 PolarHBondContact OG-OD1 3.38Å; S284-D286 PolarHBondContact OG-OD2 3.32Å; S284-A287 PolarHBondContact O-N 3.03Å; S284-T288 PolarHBondContact N-O 2.84Å; S284-V310 PolarHBondContact O-N 3.42Å
285	P	91.6	Very high	88.9	Confident	25 Å²	25	29.2 Å²	29.2	16%	0.162	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	3.7	169.9	-21.1	35.2	0	0	0	114.3	K266 K267 T269 A287	K266-P285 HydrophobicContact CD-CB 3.97Å; K266-P285 WeakPolarHBondContact CD-O 3.28Å; K266-P285 PolarHBondContact NZ-O 2.75Å; K267-P285 HydrophobicContact CG-CG 4.28Å; K267-P285 WeakPolarHBondContact O-CD 3.38Å; T269-P285 HydrophobicContact CG2-CG 3.58Å; P285-A287 PolarHBondContact O-N 3.37Å
286	D	90.3	Very high	88.4	Confident	30 Å²	30	28.6 Å²	28.6	16%	0.16	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	10.3	169.2	64.5	19.8	0	0	0	113.2	H264 A265 K266 S284 T288	H264-D286 IonicContact CG-OD2 2.73Å; H264-D286 IonicContact ND1-OD1 3.1Å; H264-D286 IonicContact ND1-OD2 3.01Å; H264-D286 PolarHBondContact ND1-OD2 3.31Å; A265-D286 HydrophobicContact CB-CB 4.04Å; A265-D286 PolarHBondContact N-OD2 3.19Å; K266-D286 HydrophobicContact CB-CB 4.34Å; K266-D286 HydrophobicContact CD-CB 4.44Å; K266-D286 HydrophobicContact CG-CB 4.21Å; S284-D286 VanDerWaalsContact CB-OD1 3.25Å; S284-D286 WeakPolarHBondContact CB-OD1 3.49Å; S284-D286 PolarHBondContact O-N 2.81Å; S284-D286 PolarHBondContact OG-N 2.91Å; S284-D286 PolarHBondContact OG-OD1 3.38Å; S284-D286 PolarHBondContact OG-OD2 3.32Å; D286-T288 VanDerWaalsContact CG-OG1 3.31Å; D286-T288 PolarHBondContact O-N 3.28Å; D286-T288 WeakPolarHBondContact OD1-CB 3.34Å; D286-T288 PolarHBondContact OD1-N 2.73Å; D286-T288 PolarHBondContact OD1-OG1 2.94Å
287	A	89.5	Confident	88.3	Confident	17 Å²	17	25.3 Å²	25.3	14%	0.14	16%	0.16	C	C	.	.	S	Bend	trans	66	10.6	-179	0	0	0	0	0	114.5	S284 P285 A308	S284-A287 PolarHBondContact O-N 3.03Å; P285-A287 PolarHBondContact O-N 3.37Å; A287-A308 WeakPolarHBondContact CA-O 3.02Å; A287-A308 WeakPolarHBondContact CB-O 3.23Å
288	T	91.8	Very high	88.3	Confident	11 Å²	11	26.3 Å²	26.3	7%	0.067	17%	0.168	C	C	.	.			trans	-109.2	141.3	179	73.1	0	0	0	0	111.9	H264 S284 D286 V302 R304	H264-T288 PolarHBondContact ND1-OG1 2.91Å; S284-T288 PolarHBondContact N-O 2.84Å; D286-T288 VanDerWaalsContact CG-OG1 3.31Å; D286-T288 PolarHBondContact O-N 3.28Å; D286-T288 WeakPolarHBondContact OD1-CB 3.34Å; D286-T288 PolarHBondContact OD1-N 2.73Å; D286-T288 PolarHBondContact OD1-OG1 2.94Å; T288-V302 HydrophobicContact CG2-CG1 4.19Å; T288-R304 HydrophobicContact CG2-CG 4.34Å
289	I	92.9	Very high	88.4	Confident	2 Å²	2	26 Å²	26	1%	0.01	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.9	166	-54.4	161.5	0	0	0	106.2	S282 V303 V310 L313 L322 S324	S282-I289 CarbonylContact O-C 3.59Å; S282-I289 WeakPolarHBondContact O-CA 3.45Å; I289-V303 HydrophobicContact CB-CB 4.27Å; I289-V303 PolarHBondContact N-O 3.31Å; I289-V303 PolarHBondContact O-N 3.11Å; I289-V310 HydrophobicContact CG1-CG1 4.28Å; I289-V310 HydrophobicContact CG1-CG2 4.14Å; I289-L313 HydrophobicContact CD1-CD1 4.16Å; I289-L313 HydrophobicContact CG1-CD1 4.36Å; I289-L313 HydrophobicContact CG2-CD1 3.83Å; I289-L313 HydrophobicContact CG2-CD2 4.45Å; I289-L322 HydrophobicContact CG2-CD1 4.47Å; I289-S324 WeakPolarHBondContact CD1-OG 3.18Å
290	R	92.1	Very high	88.2	Confident	51 Å²	51	29.2 Å²	29.2	19%	0.192	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	136.9	-177.8	-67.7	-174.4	175.3	-133.5	3	110.5	G263 F281 S282 W292 V302	G263-R290 PolarHBondContact O-NH1 2.99Å; G263-R290 PolarHBondContact O-NH2 3.49Å; F281-R290 WeakPolarHBondContact CA-O 3.43Å; S282-R290 PolarHBondContact N-O 3.39Å; S282-R290 PolarHBondContact O-N 2.77Å; R290-W292 HydrophobicContact CB-CZ2 3.92Å; R290-W292 VanDerWaalsContact CB-NE1 3.33Å; R290-W292 HydrophobicContact CG-CZ2 4.31Å; R290-V302 HydrophobicContact CG-CG1 4.4Å; R290-V302 HydrophobicContact CG-CG2 4.28Å
291	V	92.3	Very high	87.9	Confident	4 Å²	4	32.7 Å²	32.7	2%	0.024	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.6	174.1	-174.5	0	0	0	0	107.7	V279 V280 F281 C299 I300 Q301 I336	V279-V291 HydrophobicContact CG1-CG1 3.35Å; V280-V291 WeakPolarHBondContact O-CA 3.31Å; F281-V291 HydrophobicContact CD1-CB 4.26Å; F281-V291 HydrophobicContact CD1-CG1 4Å; F281-V291 HydrophobicContact CD1-CG2 3.88Å; F281-V291 HydrophobicContact CE1-CB 4.3Å; F281-V291 HydrophobicContact CE1-CG1 3.63Å; F281-V291 HydrophobicContact CE1-CG2 3.97Å; V291-C299 CarbonylContact O-C 3.6Å; V291-I300 HydrophobicContact CG1-CD1 4.34Å; V291-I300 PolarHBondContact O-N 3.21Å; V291-Q301 HydrophobicContact CB-CB 4.05Å; V291-Q301 HydrophobicContact CG2-CB 4.03Å; V291-Q301 PolarHBondContact N-O 3.05Å; V291-Q301 PolarHBondContact O-N 3.27Å; V291-I336 HydrophobicContact CG1-CG2 4.3Å
292	W	91.1	Very high	87.8	Confident	5 Å²	5	35.5 Å²	35.5	2%	0.019	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	141.2	-174.5	-56.3	93.3	0	0	0	111.1	L261 K262 V279 V280 S282 R290 N298 C299	L261-W292 HydrophobicContact CB-CD2 3.91Å; L261-W292 HydrophobicContact CB-CE3 3.85Å; L261-W292 HydrophobicContact CB-CG 4.41Å; L261-W292 HydrophobicContact CB-CH2 4.42Å; L261-W292 HydrophobicContact CB-CZ2 4.47Å; L261-W292 HydrophobicContact CB-CZ3 4.11Å; L261-W292 HydrophobicContact CD1-CB 3.61Å; L261-W292 HydrophobicContact CD1-CD2 4.07Å; L261-W292 HydrophobicContact CD1-CG 3.68Å; L261-W292 HydrophobicContact CD2-CB 4.16Å; L261-W292 HydrophobicContact CD2-CD2 4.25Å; L261-W292 HydrophobicContact CD2-CE3 3.86Å; L261-W292 HydrophobicContact CD2-CG 4.41Å; L261-W292 HydrophobicContact CG-CB 4.42Å; L261-W292 HydrophobicContact CG-CD2 4.3Å; L261-W292 HydrophobicContact CG-CE3 4.28Å; L261-W292 HydrophobicContact CG-CG 4.38Å; K262-W292 WeakPolarHBondContact O-CH2 3.38Å; V279-W292 CarbonylContact C-O 3.52Å; V279-W292 VanDerWaalsContact CA-O 3.32Å; V279-W292 WeakPolarHBondContact CA-O 3.4Å; V279-W292 WeakPolarHBondContact CG1-O 3.2Å; V280-W292 HydrophobicContact CB-CB 4.29Å; V280-W292 PolarHBondContact N-O 3.31Å; V280-W292 PolarHBondContact O-N 3.03Å; S282-W292 PolarHBondContact OG-NE1 3.03Å; R290-W292 HydrophobicContact CB-CZ2 3.92Å; R290-W292 VanDerWaalsContact CB-NE1 3.33Å; R290-W292 HydrophobicContact CG-CZ2 4.31Å; W292-N298 WeakPolarHBondContact CA-O 3.21Å; W292-C299 HydrophobicContact CD2-CB 4.35Å; W292-C299 HydrophobicContact CE3-CB 3.7Å; W292-C299 HydrophobicContact CH2-CB 4Å; W292-C299 HydrophobicContact CZ3-CB 3.51Å
293	S	89.6	Confident	87.6	Confident	25 Å²	25	35.7 Å²	35.7	18%	0.175	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	126.5	165.6	-173.7	0	0	0	0	109.5	T295 G297 N298	S293-T295 PolarHBondContact OG-OG1 3.25Å; S293-G297 WeakPolarHBondContact O-CA 3.32Å; S293-G297 PolarHBondContact O-N 3.1Å; S293-N298 PolarHBondContact N-O 3.45Å
294	V	83.1	Confident	87.4	Confident	12 Å²	12	45.1 Å²	45.1	7%	0.073	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-38.5	177.5	178.8	0	0	0	0	111.4	V249 V258 Y273 S278 V280 G296	V249-V294 HydrophobicContact CG1-CG1 4.16Å; V249-V294 HydrophobicContact CG2-CG1 4.35Å; V249-V294 HydrophobicContact CG2-CG2 4.3Å; V258-V294 HydrophobicContact CG1-CG1 4.4Å; Y273-V294 HydrophobicContact CE2-CG2 4.16Å; S278-V294 WeakPolarHBondContact O-CB 3.37Å; S278-V294 WeakPolarHBondContact O-CG2 3.23Å; S278-V294 PolarHBondContact O-N 2.96Å; V280-V294 HydrophobicContact CB-CG2 4.38Å; V280-V294 HydrophobicContact CG2-CG2 3.49Å; V280-V294 VanDerWaalsContact CG2-CG2 3.49Å; V294-G296 PolarHBondContact O-N 2.97Å
295	T	80.1	Confident	87.1	Confident	121 Å²	121	45.5 Å²	45.5	74%	0.742	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-33	-177.1	50.9	0	0	0	0	113	S293	S293-T295 PolarHBondContact OG-OG1 3.25Å
296	G	72.8	Confident	86.9	Confident	41 Å²	41	44.9 Å²	44.9	42%	0.423	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.4	-12.9	-179.9	0	0	0	0	0	114.8	V294 N298	V294-G296 PolarHBondContact O-N 2.97Å; G296-N298 VanDerWaalsContact O-CG 3.29Å; G296-N298 PolarHBondContact O-N 2.96Å; G296-N298 VanDerWaalsContact O-N 3.08Å; G296-N298 PolarHBondContact O-ND2 3.28Å; G296-N298 PolarHBondContact O-OD1 3.11Å
297	G	77.6	Confident	86.7	Confident	28 Å²	28	52.1 Å²	52.1	29%	0.289	28%	0.283	S	S	.	.			trans	62.1	11.2	-172.1	0	0	0	0	0	114.4	L261 S293	L261-G297 WeakPolarHBondContact CD2-O 3.34Å; S293-G297 WeakPolarHBondContact O-CA 3.32Å; S293-G297 PolarHBondContact O-N 3.1Å
298	N	82.9	Confident	86.7	Confident	114 Å²	114	52.7 Å²	52.7	61%	0.61	29%	0.288	S	S	*	.			trans	-101.9	147.1	-170.8	-69.2	-35.2	0	0	0	111.5	W292 S293 G296 I300	W292-N298 WeakPolarHBondContact CA-O 3.21Å; S293-N298 PolarHBondContact N-O 3.45Å; G296-N298 VanDerWaalsContact O-CG 3.29Å; G296-N298 PolarHBondContact O-N 2.96Å; G296-N298 VanDerWaalsContact O-N 3.08Å; G296-N298 PolarHBondContact O-ND2 3.28Å; G296-N298 PolarHBondContact O-OD1 3.11Å; N298-I300 PolarHBondContact O-N 2.83Å
299	C	85.7	Confident	86.6	Confident	44 Å²	44	52.5 Å²	52.5	30%	0.297	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	113.6	169.7	-163.9	0	0	0	0	108.3	V291 W292 Q301	V291-C299 CarbonylContact O-C 3.6Å; W292-C299 HydrophobicContact CD2-CB 4.35Å; W292-C299 HydrophobicContact CE3-CB 3.7Å; W292-C299 HydrophobicContact CH2-CB 4Å; W292-C299 HydrophobicContact CZ3-CB 3.51Å; C299-Q301 PolarHBondContact SG-O 2.96Å
300	I	86.6	Confident	86.6	Confident	84 Å²	84	52.4 Å²	52.4	43%	0.431	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	-49.6	178.6	-51.1	166.7	0	0	0	109.2	V279 V291 N298	V279-I300 HydrophobicContact CG2-CD1 4.43Å; V291-I300 HydrophobicContact CG1-CD1 4.34Å; V291-I300 PolarHBondContact O-N 3.21Å; N298-I300 PolarHBondContact O-N 2.83Å
301	Q	85.6	Confident	86.5	Confident	73 Å²	73	51.3 Å²	51.3	34%	0.341	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.3	-174.7	-65	-59.8	-26.9	0	0	111.6	V291 C299	V291-Q301 HydrophobicContact CB-CB 4.05Å; V291-Q301 HydrophobicContact CG2-CB 4.03Å; V291-Q301 PolarHBondContact N-O 3.05Å; V291-Q301 PolarHBondContact O-N 3.27Å; C299-Q301 PolarHBondContact SG-O 2.96Å
302	V	90.1	Very high	86.4	Confident	59 Å²	59	51.3 Å²	51.3	36%	0.358	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	109.7	172.2	-175.5	0	0	0	0	108	T288 R290 R304	T288-V302 HydrophobicContact CG2-CG1 4.19Å; R290-V302 HydrophobicContact CG-CG1 4.4Å; R290-V302 HydrophobicContact CG-CG2 4.28Å; V302-R304 HydrophobicContact CG1-CG 4.46Å
303	V	89.1	Confident	86.5	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.018	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124	178.2	-175.3	0	0	0	0	108.9	I289 A305 V341	I289-V303 HydrophobicContact CB-CB 4.27Å; I289-V303 PolarHBondContact N-O 3.31Å; I289-V303 PolarHBondContact O-N 3.11Å; V303-A305 HydrophobicContact CG1-CB 4.42Å; V303-V341 HydrophobicContact CG1-CG2 4.1Å
304	R	88.8	Confident	86.6	Confident	198 Å²	198	51 Å²	51	75%	0.747	29%	0.285	S	S	*	.			trans	-113	79.8	177.2	-65.3	-171.9	-179.5	-151.4	2.1	109.9	T288 V302	T288-R304 HydrophobicContact CG2-CG 4.34Å; V302-R304 HydrophobicContact CG1-CG 4.46Å
305	A	84.9	Confident	87	Confident	9 Å²	9	51.8 Å²	51.8	7%	0.074	29%	0.288	C	S	.	.			trans	-89.7	-23	-179	0	0	0	0	0	113.8	V303 A332 V341 K344	V303-A305 HydrophobicContact CG1-CB 4.42Å; A305-A332 HydrophobicContact CB-CB 3.7Å; A305-V341 HydrophobicContact CB-CG1 4.3Å; A305-V341 HydrophobicContact CB-CG2 3.59Å; A305-K344 PolarHBondContact O-NZ 3.43Å
306	H	87.7	Confident	87.5	Confident	12 Å²	12	46.2 Å²	46.2	6%	0.056	25%	0.254	C	S	.	.			trans	-122.9	156.4	-169	-62.7	-75.3	0	0	0	111.7	V310 S324 S326 D328 Y330	H306-V310 HydrophobicContact CB-CG2 4.36Å; H306-S324 PolarHBondContact NE2-OG 3.07Å; H306-S326 WeakPolarHBondContact ND1-CB 3.06Å; H306-D328 WeakPolarHBondContact CA-OD2 3.36Å; H306-D328 WeakPolarHBondContact CB-OD2 3.46Å; H306-D328 IonicContact CE1-OD1 2.98Å; H306-D328 IonicContact CG-OD1 3.12Å; H306-D328 IonicContact CG-OD2 3.63Å; H306-D328 IonicContact ND1-OD1 3.98Å; H306-D328 PolarHBondContact ND1-OD1 3.48Å; H306-D328 IonicContact ND1-OD2 2.9Å; H306-D328 PolarHBondContact ND1-OD2 2.87Å; H306-Y330 PolarHBondContact CE1-O 3.08Å; H306-Y330 VanDerWaalsContact CE1-O 3.26Å
307	E	86.8	Confident	88	Confident	181 Å²	181	46.2 Å²	46.2	85%	0.846	25%	0.25	S	C	*	.	S	Bend	trans	-97.6	-22.2	174.4	-65	-178.4	-174.9	0	0	111.9	D328	E307-D328 PolarHBondContact N-OD2 3.38Å
308	A	90	Very high	88.4	Confident	30 Å²	30	45.9 Å²	45.9	25%	0.248	24%	0.242	C	C	.	.	S	Bend	trans	-109.8	-177.7	175.3	0	0	0	0	0	112.1	A287 S326 E327 D328	A287-A308 WeakPolarHBondContact CA-O 3.02Å; A287-A308 WeakPolarHBondContact CB-O 3.23Å; A308-S326 PolarHBondContact O-OG 3.39Å; A308-E327 HydrophobicContact CB-CB 4.01Å; A308-D328 HydrophobicContact CB-CB 3.78Å
309	G	88.9	Confident	88.4	Confident	6 Å²	6	40.7 Å²	40.7	6%	0.062	22%	0.215	C	C	.	.			trans	-66.1	133.8	-176.3	0	0	0	0	0	113.1	S326 E327	G309-S326 WeakPolarHBondContact O-CA 3.46Å; G309-S326 PolarHBondContact O-OG 3.4Å; G309-E327 PolarHBondContact O-N 3.49Å
310	V	93	Very high	88.4	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	122.3	175.3	-173.1	0	0	0	0	109	T269 A283 S284 I289 H306 G312 S325	T269-V310 PolarHBondContact OG1-O 3.06Å; A283-V310 HydrophobicContact CB-CB 4.08Å; A283-V310 HydrophobicContact CB-CG1 3.69Å; S284-V310 PolarHBondContact O-N 3.42Å; I289-V310 HydrophobicContact CG1-CG1 4.28Å; I289-V310 HydrophobicContact CG1-CG2 4.14Å; H306-V310 HydrophobicContact CB-CG2 4.36Å; V310-G312 WeakPolarHBondContact CG1-O 3.38Å; V310-S325 CarbonylContact C-O 3.59Å; V310-S325 WeakPolarHBondContact CA-O 3.41Å; V310-S325 WeakPolarHBondContact CG1-O 3.32Å
311	T	90.8	Very high	88.6	Confident	27 Å²	27	38.1 Å²	38.1	17%	0.166	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	-29.3	-172.8	53.5	0	0	0	0	112.9	S270 S325 E327 L354 T355	S270-T311 PolarHBondContact OG-O 2.92Å; T311-S325 PolarHBondContact N-O 2.9Å; T311-S325 PolarHBondContact OG1-O 2.92Å; T311-S325 PolarHBondContact OG1-OG 2.88Å; T311-E327 HydrophobicContact CG2-CG 3.6Å; T311-L354 WeakPolarHBondContact CB-O 3.19Å; T311-L354 WeakPolarHBondContact CG2-O 3.39Å; T311-L354 PolarHBondContact OG1-O 3.16Å; T311-T355 WeakPolarHBondContact CB-O 3.27Å
312	G	88.6	Confident	88.9	Confident	4 Å²	4	34.8 Å²	34.8	4%	0.041	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	146.6	-179.5	0	0	0	0	0	111.3	V310 S324 S325	V310-G312 WeakPolarHBondContact CG1-O 3.38Å; G312-S324 WeakPolarHBondContact O-CA 3.15Å; G312-S325 VanDerWaalsContact CA-OG 3.26Å; G312-S325 WeakPolarHBondContact CA-OG 3.48Å; G312-S325 PolarHBondContact N-O 3.41Å; G312-S325 PolarHBondContact N-OG 3.25Å; G312-S325 PolarHBondContact O-N 3.28Å
313	L	92.9	Very high	89.1	Confident	13 Å²	13	32 Å²	32	7%	0.068	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	139.5	176.1	-167.6	71.9	0	0	0	107.6	I272 F281 A283 I289 L322 L323	I272-L313 VanDerWaalsContact CD1-C 3.43Å; I272-L313 HydrophobicContact CD1-CB 4.11Å; I272-L313 HydrophobicContact CD1-CD2 4.22Å; I272-L313 HydrophobicContact CD1-CG 3.98Å; I272-L313 WeakPolarHBondContact CD1-O 3.15Å; I272-L313 HydrophobicContact CG1-CD2 4.5Å; F281-L313 HydrophobicContact CB-CD2 3.66Å; A283-L313 HydrophobicContact CB-CB 4.12Å; A283-L313 HydrophobicContact CB-CD1 4.5Å; A283-L313 HydrophobicContact CB-CD2 4.24Å; I289-L313 HydrophobicContact CD1-CD1 4.16Å; I289-L313 HydrophobicContact CG1-CD1 4.36Å; I289-L313 HydrophobicContact CG2-CD1 3.83Å; I289-L313 HydrophobicContact CG2-CD2 4.45Å; L313-L322 HydrophobicContact CD1-CD2 4.5Å; L313-L323 CarbonylContact C-O 3.59Å; L313-L323 WeakPolarHBondContact CA-O 3.42Å
314	S	92.5	Very high	89.3	Confident	12 Å²	12	31.8 Å²	31.8	8%	0.084	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	135.3	173.9	-169.7	0	0	0	0	110.2	I272 L323 F359	I272-S314 VanDerWaalsContact CD1-CA 3.41Å; S314-L323 PolarHBondContact N-O 2.99Å; S314-L323 PolarHBondContact O-N 2.97Å; S314-F359 WeakPolarHBondContact OG-CD2 3.1Å; S314-F359 PolarHBondContact OG-N 3.17Å
315	L	91.6	Very high	89.4	Confident	28 Å²	28	22.4 Å²	22.4	15%	0.147	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	138.3	172.3	-174.3	70.3	0	0	0	110	I272 P275 F281 Y321 L322 I336 F359	I272-L315 HydrophobicContact CG2-CB 4.03Å; P275-L315 HydrophobicContact CG-CD2 4.17Å; F281-L315 HydrophobicContact CD2-CD1 4.44Å; F281-L315 HydrophobicContact CE2-CD1 3.78Å; F281-L315 HydrophobicContact CE2-CD2 4.4Å; F281-L315 HydrophobicContact CZ-CD1 4.28Å; L315-Y321 WeakPolarHBondContact CD1-O 3.38Å; L315-L322 HydrophobicContact CB-CD2 4.37Å; L315-L322 HydrophobicContact CD1-CD2 3.71Å; L315-L322 HydrophobicContact CD1-CG 4.38Å; L315-I336 HydrophobicContact CD1-CD1 3.46Å; L315-I336 VanDerWaalsContact CD1-CD1 3.46Å; L315-F359 WeakPolarHBondContact O-CD2 3.36Å
316	H	90.9	Very high	89.7	Confident	3 Å²	3	22 Å²	22	1%	0.014	13%	0.126	C	C	.	.			trans	-73.7	148.4	172.2	-175.2	-97.1	0	0	0	110.7	L177 T318 G319 Y321 F359 G363	L177-H316 WeakPolarHBondContact CD2-CE1 3.32Å; L177-H316 WeakPolarHBondContact CD2-NE2 3.5Å; H316-T318 VanDerWaalsContact CE1-CG2 3.49Å; H316-T318 WeakPolarHBondContact CE1-CG2 3.29Å; H316-T318 WeakPolarHBondContact ND1-CB 3.36Å; H316-T318 WeakPolarHBondContact ND1-CG2 3.36Å; H316-T318 PolarHBondContact ND1-N 3.25Å; H316-T318 PolarHBondContact ND1-OG1 2.95Å; H316-T318 PolarHBondContact O-N 3.22Å; H316-G319 PolarHBondContact O-N 3.15Å; H316-Y321 WeakPolarHBondContact CB-O 3.47Å; H316-Y321 PolarHBondContact N-O 3.49Å; H316-F359 HydrophobicContact CB-CD2 4.22Å; H316-F359 HydrophobicContact CB-CE2 3.82Å; H316-F359 HydrophobicContact CB-CZ 4.2Å; H316-F359 AromaticContact CD2-CE1 3.89Å; H316-F359 AromaticContact CD2-CZ 4Å; H316-G363 PolarHBondContact CD2-O 3.25Å; H316-G363 WeakPolarHBondContact NE2-CA 3.41Å; H316-G363 PolarHBondContact NE2-O 2.96Å; H316-G363 VanDerWaalsContact NE2-O 3.1Å
317	A	84.1	Confident	89.8	Confident	42 Å²	42	26.7 Å²	26.7	35%	0.347	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-16	-178.1	0	0	0	0	0	114.5	K180 L184 G319	K180-A317 WeakPolarHBondContact CE-O 3.25Å; K180-A317 PolarHBondContact NZ-O 2.83Å; L184-A317 HydrophobicContact CD1-CB 3.52Å; A317-G319 VanDerWaalsContact C-N 3.32Å
318	T	84.7	Confident	89.9	Confident	20 Å²	20	19.1 Å²	19.1	12%	0.123	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.5	171.6	53.3	0	0	0	0	112.6	L177 K180 H316 D320 Y321	L177-T318 HydrophobicContact CD2-CG2 4.19Å; K180-T318 HydrophobicContact CB-CG2 4Å; K180-T318 HydrophobicContact CD-CG2 3.84Å; K180-T318 HydrophobicContact CG-CG2 3.89Å; K180-T318 PolarHBondContact NZ-O 3.17Å; H316-T318 VanDerWaalsContact CE1-CG2 3.49Å; H316-T318 WeakPolarHBondContact CE1-CG2 3.29Å; H316-T318 WeakPolarHBondContact ND1-CB 3.36Å; H316-T318 WeakPolarHBondContact ND1-CG2 3.36Å; H316-T318 PolarHBondContact ND1-N 3.25Å; H316-T318 PolarHBondContact ND1-OG1 2.95Å; H316-T318 PolarHBondContact O-N 3.22Å; T318-D320 VanDerWaalsContact C-N 3.34Å; T318-D320 PolarHBondContact OG1-N 3.39Å; T318-Y321 WeakPolarHBondContact OG1-CD2 3.42Å
319	G	83.6	Confident	89.8	Confident	5 Å²	5	21.1 Å²	21.1	5%	0.052	12%	0.118	C	C	.	.	S	Bend	trans	90.3	-9.5	-170.5	0	0	0	0	0	114.1	H274 H316 A317 I336	H274-G319 PolarHBondContact CD2-O 2.81Å; H274-G319 WeakPolarHBondContact NE2-CA 3.49Å; H274-G319 PolarHBondContact NE2-O 2.89Å; H316-G319 PolarHBondContact O-N 3.15Å; A317-G319 VanDerWaalsContact C-N 3.32Å; G319-I336 WeakPolarHBondContact O-CD1 3.33Å
320	D	86.4	Confident	89.8	Confident	55 Å²	55	25 Å²	25	29%	0.294	13%	0.131	S	C	.	.	S	Bend	trans	-97.6	-16.7	-173.1	-58.3	-51.6	0	0	0	114	T318 I336	T318-D320 VanDerWaalsContact C-N 3.34Å; T318-D320 PolarHBondContact OG1-N 3.39Å; D320-I336 WeakPolarHBondContact O-CB 3.28Å; D320-I336 WeakPolarHBondContact O-CD1 3.36Å; D320-I336 WeakPolarHBondContact O-CG1 3.37Å; D320-I336 PolarHBondContact O-N 3.46Å
321	Y	90.8	Very high	89.8	Confident	19 Å²	19	25 Å²	25	8%	0.075	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.1	-173	-51.3	-71.7	0	0	0	113	I173 L177 L315 H316 T318 F333 S334 D335 L342	I173-Y321 HydrophobicContact CG2-CE1 4.34Å; I173-Y321 HydrophobicContact CG2-CE2 4.14Å; L177-Y321 HydrophobicContact CD2-CD2 3.89Å; L177-Y321 HydrophobicContact CD2-CE2 3.95Å; L315-Y321 WeakPolarHBondContact CD1-O 3.38Å; H316-Y321 WeakPolarHBondContact CB-O 3.47Å; H316-Y321 PolarHBondContact N-O 3.49Å; T318-Y321 WeakPolarHBondContact OG1-CD2 3.42Å; Y321-F333 AromaticContact CD1-CE1 3.79Å; Y321-F333 HydrophobicContact CD1-CE1 3.79Å; Y321-F333 AromaticContact CD1-CZ 3.82Å; Y321-F333 HydrophobicContact CD1-CZ 3.82Å; Y321-F333 HydrophobicContact CD2-CE1 4.26Å; Y321-F333 AromaticContact CD2-CZ 3.63Å; Y321-F333 HydrophobicContact CD2-CZ 3.63Å; Y321-F333 HydrophobicContact CE1-CE1 4.4Å; Y321-F333 HydrophobicContact CE2-CZ 4.48Å; Y321-F333 AromaticContact CG-CE1 3.74Å; Y321-F333 HydrophobicContact CG-CE1 3.74Å; Y321-F333 AromaticContact CG-CE2 3.99Å; Y321-F333 HydrophobicContact CG-CE2 3.99Å; Y321-F333 AromaticContact CG-CZ 3.25Å; Y321-F333 HydrophobicContact CG-CZ 3.25Å; Y321-S334 CarbonylContact C-O 3.45Å; Y321-S334 WeakPolarHBondContact CA-O 3.27Å; Y321-D335 HydrophobicContact CD1-CB 4.19Å; Y321-D335 HydrophobicContact CE1-CB 4.27Å; Y321-L342 HydrophobicContact CD1-CD1 3.8Å; Y321-L342 HydrophobicContact CE1-CD1 3.75Å
322	L	91.8	Very high	89.8	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.016	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	139.2	175.8	-70.9	166.4	0	0	0	110.8	F281 I289 L313 L315 F333 S334 I336	F281-L322 HydrophobicContact CB-CD2 4.36Å; F281-L322 HydrophobicContact CD1-CD1 3.61Å; F281-L322 HydrophobicContact CD1-CD2 4.17Å; F281-L322 HydrophobicContact CD1-CG 4.42Å; F281-L322 HydrophobicContact CD2-CD2 3.88Å; F281-L322 HydrophobicContact CE1-CD1 3.91Å; F281-L322 HydrophobicContact CE1-CD2 4.47Å; F281-L322 HydrophobicContact CE2-CD2 4.22Å; F281-L322 HydrophobicContact CG-CD1 4.08Å; F281-L322 HydrophobicContact CG-CD2 3.85Å; I289-L322 HydrophobicContact CG2-CD1 4.47Å; L313-L322 HydrophobicContact CD1-CD2 4.5Å; L315-L322 HydrophobicContact CB-CD2 4.37Å; L315-L322 HydrophobicContact CD1-CD2 3.71Å; L315-L322 HydrophobicContact CD1-CG 4.38Å; L322-F333 CarbonylContact O-C 3.57Å; L322-F333 WeakPolarHBondContact O-CA 3.47Å; L322-S334 PolarHBondContact N-O 3.01Å; L322-S334 PolarHBondContact O-N 3.02Å; L322-I336 HydrophobicContact CD1-CD1 4.39Å; L322-I336 HydrophobicContact CD1-CG1 3.68Å; L322-I336 HydrophobicContact CD2-CD1 4.37Å; L322-I336 HydrophobicContact CG-CD1 3.87Å; L322-I336 HydrophobicContact CG-CG1 3.56Å
323	L	93.1	Very high	90	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.8	164.4	174.6	72.1	0	0	0	108.9	L313 S314 W331 A332 A357 F359 F366	L313-L323 CarbonylContact C-O 3.59Å; L313-L323 WeakPolarHBondContact CA-O 3.42Å; S314-L323 PolarHBondContact N-O 2.99Å; S314-L323 PolarHBondContact O-N 2.97Å; L323-W331 HydrophobicContact CD1-CB 4.24Å; L323-W331 HydrophobicContact CD1-CD2 4.49Å; L323-W331 HydrophobicContact CD1-CE3 3.87Å; L323-A332 WeakPolarHBondContact CA-O 3.36Å; L323-A357 HydrophobicContact CD2-CB 4.05Å; L323-A357 HydrophobicContact CG-CB 4.42Å; L323-F359 HydrophobicContact CB-CD2 3.93Å; L323-F359 HydrophobicContact CB-CE1 4.48Å; L323-F359 HydrophobicContact CB-CE2 3.17Å; L323-F359 HydrophobicContact CB-CZ 3.49Å; L323-F359 VanDerWaalsContact CB-CZ 3.49Å; L323-F359 HydrophobicContact CD2-CD2 4.23Å; L323-F359 HydrophobicContact CD2-CE1 4.29Å; L323-F359 HydrophobicContact CD2-CE2 4.05Å; L323-F359 HydrophobicContact CD2-CG 4.47Å; L323-F359 HydrophobicContact CD2-CZ 4.06Å; L323-F359 HydrophobicContact CG-CE2 4.22Å; L323-F359 HydrophobicContact CG-CZ 4.26Å; L323-F366 HydrophobicContact CD1-CD2 4.15Å; L323-F366 HydrophobicContact CD1-CE2 3.97Å; L323-F366 HydrophobicContact CD1-CZ 4.2Å; L323-F366 HydrophobicContact CD2-CB 3.72Å; L323-F366 HydrophobicContact CD2-CD1 4.39Å; L323-F366 HydrophobicContact CD2-CD2 3.54Å; L323-F366 HydrophobicContact CD2-CE2 4.21Å; L323-F366 HydrophobicContact CD2-CG 3.63Å; L323-F366 HydrophobicContact CG-CD2 4.49Å
324	S	92.7	Very high	89.9	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	144.5	171.4	55.4	0	0	0	0	111.2	I289 H306 G312 W331 A332	I289-S324 WeakPolarHBondContact CD1-OG 3.18Å; H306-S324 PolarHBondContact NE2-OG 3.07Å; G312-S324 WeakPolarHBondContact O-CA 3.15Å; S324-W331 CarbonylContact O-C 3.44Å; S324-W331 WeakPolarHBondContact O-CA 3.17Å; S324-A332 PolarHBondContact N-O 3.31Å; S324-A332 PolarHBondContact O-N 3.44Å; S324-A332 PolarHBondContact OG-O 3.31Å
325	S	91.9	Very high	89.8	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	148.6	170.7	62.9	0	0	0	0	110.3	V310 T311 G312 A357	V310-S325 CarbonylContact C-O 3.59Å; V310-S325 WeakPolarHBondContact CA-O 3.41Å; V310-S325 WeakPolarHBondContact CG1-O 3.32Å; T311-S325 PolarHBondContact N-O 2.9Å; T311-S325 PolarHBondContact OG1-O 2.92Å; T311-S325 PolarHBondContact OG1-OG 2.88Å; G312-S325 VanDerWaalsContact CA-OG 3.26Å; G312-S325 WeakPolarHBondContact CA-OG 3.48Å; G312-S325 PolarHBondContact N-O 3.41Å; G312-S325 PolarHBondContact N-OG 3.25Å; G312-S325 PolarHBondContact O-N 3.28Å; S325-A357 WeakPolarHBondContact OG-CB 3.36Å
326	S	91.5	Very high	89.4	Confident	0 Å²	0	23 Å²	23	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	160.7	-173	167.5	0	0	0	0	112.1	H306 A308 G309 D328 Q329 Y330 L354	H306-S326 WeakPolarHBondContact ND1-CB 3.06Å; A308-S326 PolarHBondContact O-OG 3.39Å; G309-S326 WeakPolarHBondContact O-CA 3.46Å; G309-S326 PolarHBondContact O-OG 3.4Å; S326-D328 WeakPolarHBondContact CB-OD1 3.45Å; S326-D328 PolarHBondContact O-N 3.19Å; S326-D328 VanDerWaalsContact OG-CG 3.25Å; S326-D328 PolarHBondContact OG-N 2.96Å; S326-D328 VanDerWaalsContact OG-N 3.11Å; S326-D328 PolarHBondContact OG-OD1 2.92Å; S326-Q329 PolarHBondContact O-N 3.43Å; S326-Y330 PolarHBondContact N-O 3.4Å; S326-L354 WeakPolarHBondContact O-CB 3.4Å; S326-L354 PolarHBondContact O-N 3.31Å
327	E	89.6	Confident	89	Confident	111 Å²	111	29.2 Å²	29.2	52%	0.519	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.2	170.1	-66.1	175	176.7	0	0	112.4	A308 G309 T311 Q329 A353	A308-E327 HydrophobicContact CB-CB 4.01Å; G309-E327 PolarHBondContact O-N 3.49Å; T311-E327 HydrophobicContact CG2-CG 3.6Å; E327-Q329 PolarHBondContact O-N 3.42Å; E327-Q329 VanDerWaalsContact O-N 3.09Å; E327-A353 HydrophobicContact CB-CB 4.43Å
328	D	88	Confident	88.9	Confident	22 Å²	22	30.6 Å²	30.6	12%	0.118	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	2.9	174.9	72.7	-2.6	0	0	0	113.4	H306 E307 A308 S326 Y330 K344	H306-D328 WeakPolarHBondContact CA-OD2 3.36Å; H306-D328 WeakPolarHBondContact CB-OD2 3.46Å; H306-D328 IonicContact CE1-OD1 2.98Å; H306-D328 IonicContact CG-OD1 3.12Å; H306-D328 IonicContact CG-OD2 3.63Å; H306-D328 IonicContact ND1-OD1 3.98Å; H306-D328 PolarHBondContact ND1-OD1 3.48Å; H306-D328 IonicContact ND1-OD2 2.9Å; H306-D328 PolarHBondContact ND1-OD2 2.87Å; E307-D328 PolarHBondContact N-OD2 3.38Å; A308-D328 HydrophobicContact CB-CB 3.78Å; S326-D328 WeakPolarHBondContact CB-OD1 3.45Å; S326-D328 PolarHBondContact O-N 3.19Å; S326-D328 VanDerWaalsContact OG-CG 3.25Å; S326-D328 PolarHBondContact OG-N 2.96Å; S326-D328 VanDerWaalsContact OG-N 3.11Å; S326-D328 PolarHBondContact OG-OD1 2.92Å; D328-Y330 HydrophobicContact CB-CD2 4.08Å; D328-Y330 WeakPolarHBondContact O-CD2 3.38Å; D328-Y330 WeakPolarHBondContact O-CE2 3.43Å; D328-Y330 PolarHBondContact O-N 2.89Å; D328-Y330 WeakPolarHBondContact OD1-CB 3.45Å; D328-Y330 PolarHBondContact OD1-N 2.94Å; D328-Y330 VanDerWaalsContact OD1-N 3.13Å; D328-K344 IonicContact OD2-NZ 3.76Å; D328-K344 PolarHBondContact OD2-NZ 2.87Å; D328-K344 VanDerWaalsContact OD2-NZ 3.14Å
329	Q	88.4	Confident	88.7	Confident	73 Å²	73	30.5 Å²	30.5	34%	0.341	15%	0.153	S	C	.	.	S	Bend	trans	75.9	-4.8	178.8	-42.7	169.7	1	0	0	113.8	S326 E327 G351 C352	S326-Q329 PolarHBondContact O-N 3.43Å; E327-Q329 PolarHBondContact O-N 3.42Å; E327-Q329 VanDerWaalsContact O-N 3.09Å; Q329-G351 VanDerWaalsContact NE2-C 3.29Å; Q329-G351 PolarHBondContact NE2-O 3.38Å; Q329-C352 WeakPolarHBondContact CG-O 3.49Å
330	Y	90.1	Very high	88.7	Confident	86 Å²	86	38.2 Å²	38.2	34%	0.337	18%	0.181	S	C	.	.			trans	-93.3	146	177.7	-60	-97.2	0	0	0	110.5	H306 S326 D328 K344 V345 T346	H306-Y330 PolarHBondContact CE1-O 3.08Å; H306-Y330 VanDerWaalsContact CE1-O 3.26Å; S326-Y330 PolarHBondContact N-O 3.4Å; D328-Y330 HydrophobicContact CB-CD2 4.08Å; D328-Y330 WeakPolarHBondContact O-CD2 3.38Å; D328-Y330 WeakPolarHBondContact O-CE2 3.43Å; D328-Y330 PolarHBondContact O-N 2.89Å; D328-Y330 WeakPolarHBondContact OD1-CB 3.45Å; D328-Y330 PolarHBondContact OD1-N 2.94Å; D328-Y330 VanDerWaalsContact OD1-N 3.13Å; Y330-K344 VanDerWaalsContact CB-CE 3.41Å; Y330-K344 HydrophobicContact CD1-CD 4.19Å; Y330-K344 HydrophobicContact CD1-CG 3.71Å; Y330-K344 HydrophobicContact CG-CD 4.21Å; Y330-K344 HydrophobicContact CG-CG 3.97Å; Y330-V345 WeakPolarHBondContact CA-O 3.43Å; Y330-T346 VanDerWaalsContact CD1-CB 3.47Å; Y330-T346 HydrophobicContact CD1-CG2 4Å; Y330-T346 HydrophobicContact CE1-CG2 3.4Å
331	W	91.9	Very high	88.7	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	147.9	155.2	60	-94.1	0	0	0	109	L323 S324 F333 T343 K344 V345 L354 F366 W378 L380 R383	L323-W331 HydrophobicContact CD1-CB 4.24Å; L323-W331 HydrophobicContact CD1-CD2 4.49Å; L323-W331 HydrophobicContact CD1-CE3 3.87Å; S324-W331 CarbonylContact O-C 3.44Å; S324-W331 WeakPolarHBondContact O-CA 3.17Å; W331-F333 HydrophobicContact CZ3-CB 4.37Å; W331-T343 HydrophobicContact CH2-CG2 4.09Å; W331-T343 HydrophobicContact CZ3-CG2 4.13Å; W331-K344 WeakPolarHBondContact O-CA 3.44Å; W331-V345 HydrophobicContact CD2-CB 4.24Å; W331-V345 HydrophobicContact CH2-CB 4Å; W331-V345 HydrophobicContact CH2-CG2 3.91Å; W331-V345 HydrophobicContact CZ2-CB 3.4Å; W331-V345 VanDerWaalsContact CZ2-CB 3.4Å; W331-V345 HydrophobicContact CZ2-CG1 3.68Å; W331-V345 HydrophobicContact CZ2-CG2 3.76Å; W331-V345 PolarHBondContact N-O 2.83Å; W331-V345 VanDerWaalsContact N-O 3.07Å; W331-V345 PolarHBondContact O-N 3.45Å; W331-L354 HydrophobicContact CB-CD1 4.13Å; W331-F366 HydrophobicContact CB-CE2 4.49Å; W331-F366 AromaticContact CD2-CE2 3.8Å; W331-F366 HydrophobicContact CD2-CE2 3.8Å; W331-F366 AromaticContact CD2-CZ 3.48Å; W331-F366 HydrophobicContact CD2-CZ 3.48Å; W331-F366 VanDerWaalsContact CD2-CZ 3.48Å; W331-F366 AromaticContact CE2-CZ 3.49Å; W331-F366 VanDerWaalsContact CE2-CZ 3.49Å; W331-F366 HydrophobicContact CE3-CE1 4.42Å; W331-F366 HydrophobicContact CE3-CE2 4.18Å; W331-F366 AromaticContact CE3-CZ 3.59Å; W331-F366 HydrophobicContact CE3-CZ 3.59Å; W331-F366 AromaticContact CG-CE2 3.93Å; W331-F366 HydrophobicContact CG-CE2 3.93Å; W331-F366 HydrophobicContact CG-CZ 4.12Å; W331-F366 HydrophobicContact CH2-CE1 4.19Å; W331-F366 AromaticContact CH2-CZ 3.74Å; W331-F366 HydrophobicContact CH2-CZ 3.74Å; W331-F366 HydrophobicContact CZ2-CE1 4.4Å; W331-F366 AromaticContact CZ2-CZ 3.63Å; W331-F366 HydrophobicContact CZ2-CZ 3.63Å; W331-F366 HydrophobicContact CZ3-CE1 4.2Å; W331-F366 AromaticContact CZ3-CZ 3.73Å; W331-F366 HydrophobicContact CZ3-CZ 3.73Å; W331-W378 AromaticContact CD1-CE2 3.9Å; W331-W378 HydrophobicContact CZ2-CD2 4.47Å; W331-W378 HydrophobicContact CZ2-CE3 4.06Å; W331-W378 AromaticContact NE1-CD2 3.41Å; W331-W378 AromaticContact NE1-CE2 3.53Å; W331-W378 AromaticContact NE1-CE3 3.5Å; W331-W378 AromaticContact NE1-CH2 3.83Å; W331-W378 AromaticContact NE1-CZ2 3.75Å; W331-W378 AromaticContact NE1-CZ3 3.71Å; W331-L380 HydrophobicContact CZ3-CD1 4.33Å; W331-R383 HydrophobicContact CH2-CB 4.47Å; W331-R383 HydrophobicContact CH2-CG 4.33Å
332	A	91.8	Very high	88.5	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	142.1	179.2	0	0	0	0	0	111.2	A305 L323 S324 V341 T343	A305-A332 HydrophobicContact CB-CB 3.7Å; L323-A332 WeakPolarHBondContact CA-O 3.36Å; S324-A332 PolarHBondContact N-O 3.31Å; S324-A332 PolarHBondContact O-N 3.44Å; S324-A332 PolarHBondContact OG-O 3.31Å; A332-V341 HydrophobicContact CB-CG1 4.09Å; A332-T343 CarbonylContact C-O 3.59Å; A332-T343 VanDerWaalsContact CA-O 3.24Å; A332-T343 WeakPolarHBondContact CA-O 3.23Å
333	F	92.1	Very high	88.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	119.3	174.9	-172.4	-113.3	0	0	0	108.5	M169 L177 Y321 L322 W331 L342 T343 F359 L380	M169-F333 HydrophobicContact SD-CD1 4.01Å; M169-F333 HydrophobicContact SD-CE1 3.92Å; L177-F333 HydrophobicContact CD1-CZ 4.44Å; L177-F333 HydrophobicContact CD2-CZ 4.48Å; Y321-F333 AromaticContact CD1-CE1 3.79Å; Y321-F333 HydrophobicContact CD1-CE1 3.79Å; Y321-F333 AromaticContact CD1-CZ 3.82Å; Y321-F333 HydrophobicContact CD1-CZ 3.82Å; Y321-F333 HydrophobicContact CD2-CE1 4.26Å; Y321-F333 AromaticContact CD2-CZ 3.63Å; Y321-F333 HydrophobicContact CD2-CZ 3.63Å; Y321-F333 HydrophobicContact CE1-CE1 4.4Å; Y321-F333 HydrophobicContact CE2-CZ 4.48Å; Y321-F333 AromaticContact CG-CE1 3.74Å; Y321-F333 HydrophobicContact CG-CE1 3.74Å; Y321-F333 AromaticContact CG-CE2 3.99Å; Y321-F333 HydrophobicContact CG-CE2 3.99Å; Y321-F333 AromaticContact CG-CZ 3.25Å; Y321-F333 HydrophobicContact CG-CZ 3.25Å; L322-F333 CarbonylContact O-C 3.57Å; L322-F333 WeakPolarHBondContact O-CA 3.47Å; W331-F333 HydrophobicContact CZ3-CB 4.37Å; F333-L342 HydrophobicContact CD1-CB 4.09Å; F333-L342 HydrophobicContact CD1-CD1 3.67Å; F333-L342 HydrophobicContact CD1-CG 4.47Å; F333-L342 HydrophobicContact CE1-CD1 3.69Å; F333-L342 WeakPolarHBondContact O-CB 3.39Å; F333-L342 PolarHBondContact O-N 3.37Å; F333-T343 PolarHBondContact N-O 3.31Å; F333-T343 PolarHBondContact O-N 3.41Å; F333-F359 HydrophobicContact CD2-CZ 4Å; F333-F359 AromaticContact CE2-CZ 3.8Å; F333-F359 HydrophobicContact CE2-CZ 3.8Å; F333-L380 HydrophobicContact CB-CD1 4.45Å; F333-L380 HydrophobicContact CD1-CD1 4.47Å; F333-L380 HydrophobicContact CD2-CD1 3.98Å; F333-L380 HydrophobicContact CE2-CD1 4.25Å; F333-L380 HydrophobicContact CE2-CD2 3.96Å; F333-L380 HydrophobicContact CG-CD1 4.07Å; F333-L380 HydrophobicContact CZ-CD2 4.01Å
334	S	91.1	Very high	87.9	Confident	1 Å²	1	40.7 Å²	40.7	1%	0.007	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	144.1	-171.8	-54.3	0	0	0	0	111.3	Y321 L322 R340	Y321-S334 CarbonylContact C-O 3.45Å; Y321-S334 WeakPolarHBondContact CA-O 3.27Å; L322-S334 PolarHBondContact N-O 3.01Å; L322-S334 PolarHBondContact O-N 3.02Å; S334-R340 CarbonylContact C-O 3.36Å; S334-R340 VanDerWaalsContact CA-O 3.3Å; S334-R340 WeakPolarHBondContact CA-O 3.5Å
335	D	89.1	Confident	87.7	Confident	27 Å²	27	41.9 Å²	41.9	14%	0.144	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.9	172.2	174.4	13	0	0	0	110.2	Y321 Q337 T338 G339 R340 L342	Y321-D335 HydrophobicContact CD1-CB 4.19Å; Y321-D335 HydrophobicContact CE1-CB 4.27Å; D335-Q337 PolarHBondContact OD1-N 3Å; D335-T338 WeakPolarHBondContact CB-OG1 3.45Å; D335-T338 VanDerWaalsContact CG-OG1 3.27Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.38Å; D335-T338 PolarHBondContact OD2-OG1 3.21Å; D335-G339 VanDerWaalsContact O-CA 3.24Å; D335-G339 WeakPolarHBondContact O-CA 3.49Å; D335-G339 PolarHBondContact O-N 3.37Å; D335-R340 PolarHBondContact N-O 2.82Å; D335-L342 HydrophobicContact CB-CD1 4.28Å; D335-L342 HydrophobicContact CB-CG 4.45Å
336	I	85.1	Confident	87.3	Confident	14 Å²	14	43.8 Å²	43.8	7%	0.072	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-38.2	-176.3	-65	162.1	0	0	0	111.5	F281 V291 L315 G319 D320 L322	F281-I336 HydrophobicContact CE1-CB 4.45Å; F281-I336 HydrophobicContact CE1-CD1 4.08Å; F281-I336 HydrophobicContact CE1-CG1 4Å; F281-I336 HydrophobicContact CE1-CG2 3.6Å; F281-I336 HydrophobicContact CE2-CD1 4.35Å; F281-I336 HydrophobicContact CZ-CD1 3.65Å; F281-I336 HydrophobicContact CZ-CG1 4.09Å; F281-I336 HydrophobicContact CZ-CG2 3.87Å; V291-I336 HydrophobicContact CG1-CG2 4.3Å; L315-I336 HydrophobicContact CD1-CD1 3.46Å; L315-I336 VanDerWaalsContact CD1-CD1 3.46Å; G319-I336 WeakPolarHBondContact O-CD1 3.33Å; D320-I336 WeakPolarHBondContact O-CB 3.28Å; D320-I336 WeakPolarHBondContact O-CD1 3.36Å; D320-I336 WeakPolarHBondContact O-CG1 3.37Å; D320-I336 PolarHBondContact O-N 3.46Å; L322-I336 HydrophobicContact CD1-CD1 4.39Å; L322-I336 HydrophobicContact CD1-CG1 3.68Å; L322-I336 HydrophobicContact CD2-CD1 4.37Å; L322-I336 HydrophobicContact CG-CD1 3.87Å; L322-I336 HydrophobicContact CG-CG1 3.56Å
337	Q	82.4	Confident	86.5	Confident	135 Å²	135	45.3 Å²	45.3	63%	0.631	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	-40.6	-172.4	-62.2	-175	7.2	0	0	111.2	D335	D335-Q337 PolarHBondContact OD1-N 3Å
338	T	81.8	Confident	85.3	Confident	71 Å²	71	49.3 Å²	49.3	44%	0.436	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-16.2	-177.7	61.4	0	0	0	0	113.2	D335 R340	D335-T338 WeakPolarHBondContact CB-OG1 3.45Å; D335-T338 VanDerWaalsContact CG-OG1 3.27Å; D335-T338 WeakPolarHBondContact OD2-CG2 3.38Å; D335-T338 PolarHBondContact OD2-OG1 3.21Å; T338-R340 PolarHBondContact O-N 2.95Å; T338-R340 PolarHBondContact OG1-N 3.06Å
339	G	78.9	Confident	83.8	Confident	17 Å²	17	53.3 Å²	53.3	18%	0.175	27%	0.27	C	S	.	.			trans	66.1	13.7	-173.8	0	0	0	0	0	113.7	D335	D335-G339 VanDerWaalsContact O-CA 3.24Å; D335-G339 WeakPolarHBondContact O-CA 3.49Å; D335-G339 PolarHBondContact O-N 3.37Å
340	R	84.8	Confident	82.3	Confident	167 Å²	167	51 Å²	51	63%	0.63	26%	0.264	S	S	*	.			trans	-88.8	144.5	-177.2	-67.8	-175.3	-179.2	-153.2	0	111.4	S334 D335 T338	S334-R340 CarbonylContact C-O 3.36Å; S334-R340 VanDerWaalsContact CA-O 3.3Å; S334-R340 WeakPolarHBondContact CA-O 3.5Å; D335-R340 PolarHBondContact N-O 2.82Å; T338-R340 PolarHBondContact O-N 2.95Å; T338-R340 PolarHBondContact OG1-N 3.06Å
341	V	87.1	Confident	81.1	Confident	46 Å²	46	49.3 Å²	49.3	28%	0.279	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	114.6	173.6	-174.1	0	0	0	0	108.4	V303 A305 A332	V303-V341 HydrophobicContact CG1-CG2 4.1Å; A305-V341 HydrophobicContact CB-CG1 4.3Å; A305-V341 HydrophobicContact CB-CG2 3.59Å; A332-V341 HydrophobicContact CB-CG1 4.09Å
342	L	85.6	Confident	80.5	Confident	19 Å²	19	50 Å²	50	10%	0.099	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	-37.5	-178.8	-63.5	172.6	0	0	0	111.7	I173 Y321 F333 D335	I173-L342 HydrophobicContact CD1-CD1 4.27Å; I173-L342 HydrophobicContact CD1-CD2 4.38Å; Y321-L342 HydrophobicContact CD1-CD1 3.8Å; Y321-L342 HydrophobicContact CE1-CD1 3.75Å; F333-L342 HydrophobicContact CD1-CB 4.09Å; F333-L342 HydrophobicContact CD1-CD1 3.67Å; F333-L342 HydrophobicContact CD1-CG 4.47Å; F333-L342 HydrophobicContact CE1-CD1 3.69Å; F333-L342 WeakPolarHBondContact O-CB 3.39Å; F333-L342 PolarHBondContact O-N 3.37Å; D335-L342 HydrophobicContact CB-CD1 4.28Å; D335-L342 HydrophobicContact CB-CG 4.45Å
343	T	84.3	Confident	80.3	Confident	11 Å²	11	51.6 Å²	51.6	7%	0.067	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	136.4	-175.3	-67	0	0	0	0	109.3	W331 A332 F333 V345 R383	W331-T343 HydrophobicContact CH2-CG2 4.09Å; W331-T343 HydrophobicContact CZ3-CG2 4.13Å; A332-T343 CarbonylContact C-O 3.59Å; A332-T343 VanDerWaalsContact CA-O 3.24Å; A332-T343 WeakPolarHBondContact CA-O 3.23Å; F333-T343 PolarHBondContact N-O 3.31Å; F333-T343 PolarHBondContact O-N 3.41Å; T343-V345 HydrophobicContact CG2-CG2 3.47Å; T343-V345 VanDerWaalsContact CG2-CG2 3.47Å; T343-R383 HydrophobicContact CG2-CG 4.14Å
344	K	88.5	Confident	80.2	Confident	53 Å²	53	51.9 Å²	51.9	23%	0.23	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	120.5	171.7	-176.8	174.4	-178.3	166.4	0	107.3	A305 D328 Y330 W331	A305-K344 PolarHBondContact O-NZ 3.43Å; D328-K344 IonicContact OD2-NZ 3.76Å; D328-K344 PolarHBondContact OD2-NZ 2.87Å; D328-K344 VanDerWaalsContact OD2-NZ 3.14Å; Y330-K344 VanDerWaalsContact CB-CE 3.41Å; Y330-K344 HydrophobicContact CD1-CD 4.19Å; Y330-K344 HydrophobicContact CD1-CG 3.71Å; Y330-K344 HydrophobicContact CG-CD 4.21Å; Y330-K344 HydrophobicContact CG-CG 3.97Å; W331-K344 WeakPolarHBondContact O-CA 3.44Å
345	V	87.6	Confident	80.1	Confident	26 Å²	26	53.6 Å²	53.6	16%	0.158	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.1	-172.8	172.1	0	0	0	0	108.8	Y330 W331 T343 W378 R383	Y330-V345 WeakPolarHBondContact CA-O 3.43Å; W331-V345 HydrophobicContact CD2-CB 4.24Å; W331-V345 HydrophobicContact CH2-CB 4Å; W331-V345 HydrophobicContact CH2-CG2 3.91Å; W331-V345 HydrophobicContact CZ2-CB 3.4Å; W331-V345 VanDerWaalsContact CZ2-CB 3.4Å; W331-V345 HydrophobicContact CZ2-CG1 3.68Å; W331-V345 HydrophobicContact CZ2-CG2 3.76Å; W331-V345 PolarHBondContact N-O 2.83Å; W331-V345 VanDerWaalsContact N-O 3.07Å; W331-V345 PolarHBondContact O-N 3.45Å; T343-V345 HydrophobicContact CG2-CG2 3.47Å; T343-V345 VanDerWaalsContact CG2-CG2 3.47Å; V345-W378 HydrophobicContact CG1-CH2 4.45Å; V345-W378 HydrophobicContact CG1-CZ3 3.99Å; V345-R383 HydrophobicContact CG2-CB 4.05Å; V345-R383 HydrophobicContact CG2-CG 4.35Å
346	T	84.2	Confident	80.1	Confident	40 Å²	40	53 Å²	53	25%	0.245	30%	0.3	C	S	.	.			trans	-124.4	164.4	171.5	-173.6	0	0	0	0	109.3	Y330	Y330-T346 VanDerWaalsContact CD1-CB 3.47Å; Y330-T346 HydrophobicContact CD1-CG2 4Å; Y330-T346 HydrophobicContact CE1-CG2 3.4Å
347	D	74.6	Confident	80.5	Confident	31 Å²	31	52.8 Å²	52.8	17%	0.166	30%	0.3	C	S	.	.			trans	-98.6	112.9	170.2	-161.5	-15.2	0	0	0	109	S349 K376 W378 N385	D347-S349 PolarHBondContact O-N 2.87Å; D347-S349 WeakPolarHBondContact OD1-CB 3.15Å; D347-S349 PolarHBondContact OD1-N 3.41Å; D347-K376 IonicContact OD2-NZ 3.2Å; D347-K376 PolarHBondContact OD2-NZ 2.91Å; D347-W378 HydrophobicContact CB-CH2 3.74Å; D347-W378 HydrophobicContact CB-CZ2 4Å; D347-N385 PolarHBondContact OD2-ND2 3.35Å
348	E	63.4	Low	81	Confident	195 Å²	195	49.1 Å²	49.1	91%	0.911	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-20.6	179.4	-66.2	-176.9	166.6	0	0	112.7
349	S	57.7	Low	81.5	Confident	106 Å²	106	46.3 Å²	46.3	74%	0.741	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-32.1	-173.7	171	0	0	0	0	113.9	D347	D347-S349 PolarHBondContact O-N 2.87Å; D347-S349 WeakPolarHBondContact OD1-CB 3.15Å; D347-S349 PolarHBondContact OD1-N 3.41Å
350	A	57.5	Low	82.1	Confident	26 Å²	26	45.9 Å²	45.9	22%	0.215	26%	0.258	C	S	.	.			trans	-151.3	97.1	-175.1	0	0	0	0	0	109.4	C352	A350-C352 VanDerWaalsContact C-N 3.26Å; A350-C352 PolarHBondContact O-N 3.41Å
351	G	64.3	Low	82.2	Confident	49 Å²	49	39 Å²	39	51%	0.505	24%	0.235	S	C	.	.			trans	-73	76	179.2	0	0	0	0	0	112	Q329	Q329-G351 VanDerWaalsContact NE2-C 3.29Å; Q329-G351 PolarHBondContact NE2-O 3.38Å
352	C	79.4	Confident	82	Confident	17 Å²	17	38 Å²	38	12%	0.115	23%	0.229	C	C	.	.			trans	-123.1	140.4	-174.7	-47.5	0	0	0	0	110.6	Q329 A350 D372	Q329-C352 WeakPolarHBondContact CG-O 3.49Å; A350-C352 VanDerWaalsContact C-N 3.26Å; A350-C352 PolarHBondContact O-N 3.41Å; C352-D372 HydrophobicContact CB-CB 4.33Å; C352-D372 PolarHBondContact SG-OD2 3.48Å
353	A	86.6	Confident	81.9	Confident	32 Å²	32	37.1 Å²	37.1	26%	0.264	22%	0.224	S	C	.	.			trans	-61.5	136.7	179.3	0	0	0	0	0	111.2	E327 T370 A371	E327-A353 HydrophobicContact CB-CB 4.43Å; A353-T370 WeakPolarHBondContact O-CA 3.3Å; A353-A371 PolarHBondContact O-N 3.29Å
354	L	90.1	Very high	82.1	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.4	174.7	-54.6	-178.9	0	0	0	109.2	T311 S326 W331 T368 G369 T370	T311-L354 WeakPolarHBondContact CB-O 3.19Å; T311-L354 WeakPolarHBondContact CG2-O 3.39Å; T311-L354 PolarHBondContact OG1-O 3.16Å; S326-L354 WeakPolarHBondContact O-CB 3.4Å; S326-L354 PolarHBondContact O-N 3.31Å; W331-L354 HydrophobicContact CB-CD1 4.13Å; L354-T368 HydrophobicContact CD1-CG2 4.49Å; L354-G369 CarbonylContact C-O 3.55Å; L354-G369 WeakPolarHBondContact CA-O 3.47Å; L354-T370 HydrophobicContact CD2-CG2 3.95Å
355	T	90.1	Very high	82.2	Confident	37 Å²	37	39.1 Å²	39.1	23%	0.227	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-29.3	-175	52.7	0	0	0	0	113	T311 G369 A371 V396	T311-T355 WeakPolarHBondContact CB-O 3.27Å; T355-G369 PolarHBondContact N-O 3.15Å; T355-G369 PolarHBondContact OG1-O 3.04Å; T355-G369 VanDerWaalsContact OG1-O 3.11Å; T355-A371 HydrophobicContact CG2-CB 4.31Å; T355-V396 WeakPolarHBondContact CB-O 3.38Å; T355-V396 PolarHBondContact OG1-O 2.9Å
356	C	89	Confident	82.5	Confident	14 Å²	14	37.9 Å²	37.9	10%	0.095	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	156.7	179.9	55.1	0	0	0	0	110.5	T368 G369	C356-T368 WeakPolarHBondContact O-CA 3.28Å; C356-G369 PolarHBondContact O-N 3.04Å
357	A	92.1	Very high	82.8	Confident	10 Å²	10	36 Å²	36	8%	0.083	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	140.9	174.6	0	0	0	0	0	110.7	L323 S325 G367 T368	L323-A357 HydrophobicContact CD2-CB 4.05Å; L323-A357 HydrophobicContact CG-CB 4.42Å; S325-A357 WeakPolarHBondContact OG-CB 3.36Å; A357-G367 VanDerWaalsContact CA-O 3.3Å; A357-G367 WeakPolarHBondContact CA-O 3.38Å; A357-T368 HydrophobicContact CB-CG2 4.15Å
358	Q	93.1	Very high	83.6	Confident	59 Å²	59	34.5 Å²	34.5	28%	0.276	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	139.3	175.2	-157.2	-167.6	26.5	0	0	110.8	F366 G367 I399 F401	Q358-F366 WeakPolarHBondContact O-CA 3.35Å; Q358-F366 VanDerWaalsContact O-CB 3.28Å; Q358-F366 WeakPolarHBondContact O-CB 3.37Å; Q358-G367 PolarHBondContact N-O 3.18Å; Q358-G367 PolarHBondContact O-N 2.85Å; Q358-I399 PolarHBondContact OE1-O 3.3Å; Q358-F401 HydrophobicContact CB-CD2 4.23Å; Q358-F401 HydrophobicContact CB-CE2 4.35Å; Q358-F401 HydrophobicContact CG-CD2 4.45Å; Q358-F401 VanDerWaalsContact O-CE2 3.26Å; Q358-F401 WeakPolarHBondContact O-CE2 3.38Å
359	F	93	Very high	84.9	Confident	12 Å²	12	25.2 Å²	25.2	5%	0.053	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	143.9	169.1	-84.1	-67.2	0	0	0	111.5	S314 L315 H316 L323 F333 F366 L380 F401	S314-F359 WeakPolarHBondContact OG-CD2 3.1Å; S314-F359 PolarHBondContact OG-N 3.17Å; L315-F359 WeakPolarHBondContact O-CD2 3.36Å; H316-F359 HydrophobicContact CB-CD2 4.22Å; H316-F359 HydrophobicContact CB-CE2 3.82Å; H316-F359 HydrophobicContact CB-CZ 4.2Å; H316-F359 AromaticContact CD2-CE1 3.89Å; H316-F359 AromaticContact CD2-CZ 4Å; L323-F359 HydrophobicContact CB-CD2 3.93Å; L323-F359 HydrophobicContact CB-CE1 4.48Å; L323-F359 HydrophobicContact CB-CE2 3.17Å; L323-F359 HydrophobicContact CB-CZ 3.49Å; L323-F359 VanDerWaalsContact CB-CZ 3.49Å; L323-F359 HydrophobicContact CD2-CD2 4.23Å; L323-F359 HydrophobicContact CD2-CE1 4.29Å; L323-F359 HydrophobicContact CD2-CE2 4.05Å; L323-F359 HydrophobicContact CD2-CG 4.47Å; L323-F359 HydrophobicContact CD2-CZ 4.06Å; L323-F359 HydrophobicContact CG-CE2 4.22Å; L323-F359 HydrophobicContact CG-CZ 4.26Å; F333-F359 HydrophobicContact CD2-CZ 4Å; F333-F359 AromaticContact CE2-CZ 3.8Å; F333-F359 HydrophobicContact CE2-CZ 3.8Å; F359-F366 HydrophobicContact CD1-CB 3.74Å; F359-F366 HydrophobicContact CD1-CD1 4.38Å; F359-F366 HydrophobicContact CD1-CG 4.44Å; F359-F366 HydrophobicContact CE1-CB 4.09Å; F359-F366 AromaticContact CE1-CD1 3.94Å; F359-F366 HydrophobicContact CE1-CD1 3.94Å; F359-F366 HydrophobicContact CE1-CG 4.31Å; F359-F366 HydrophobicContact CG-CB 4.37Å; F359-L380 HydrophobicContact CE1-CD2 4.19Å; F359-F401 WeakPolarHBondContact O-CD2 3.43Å
360	H	91.1	Very high	86.5	Confident	7 Å²	7	20.2 Å²	20.2	3%	0.032	13%	0.13	C	C	.	.			trans	-67.4	146.9	160.3	-175.7	-95.3	0	0	0	109.3	D362 G363 I365 F401 G405	H360-D362 VanDerWaalsContact CE1-CG 3.5Å; H360-D362 IonicContact CE1-OD2 2.79Å; H360-D362 PolarHBondContact CE1-OD2 2.61Å; H360-D362 WeakPolarHBondContact ND1-CB 3.48Å; H360-D362 PolarHBondContact ND1-N 2.96Å; H360-D362 IonicContact ND1-OD2 3.86Å; H360-D362 PolarHBondContact ND1-OD2 3.39Å; H360-D362 PolarHBondContact O-N 3.25Å; H360-G363 PolarHBondContact O-N 3.12Å; H360-I365 HydrophobicContact CB-CD1 4.11Å; H360-I365 HydrophobicContact CB-CG1 3.35Å; H360-I365 WeakPolarHBondContact CB-O 3.4Å; H360-I365 PolarHBondContact N-O 3.34Å; H360-F401 HydrophobicContact CB-CD1 4.24Å; H360-F401 HydrophobicContact CB-CE1 4.33Å; H360-F401 HydrophobicContact CB-CG 4.31Å; H360-F401 AromaticContact CD2-CD1 3.47Å; H360-F401 VanDerWaalsContact CD2-CD1 3.47Å; H360-F401 WeakPolarHBondContact CD2-CD1 3.2Å; H360-F401 AromaticContact CD2-CE1 3.93Å; H360-G405 VanDerWaalsContact NE2-CA 3.28Å; H360-G405 WeakPolarHBondContact NE2-CA 3.41Å; H360-G405 PolarHBondContact NE2-O 3.46Å; H360-G405 VanDerWaalsContact NE2-O 3.11Å
361	P	86.1	Confident	88	Confident	22 Å²	22	20.7 Å²	20.7	14%	0.143	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-7.1	-179.1	16.7	-26.2	0	0	0	115.1	R188 E403	R188-P361 VanDerWaalsContact NH2-CB 3.32Å; P361-E403 VanDerWaalsContact CB-OE2 3.31Å; P361-E403 WeakPolarHBondContact CB-OE2 3.25Å
362	D	84.1	Confident	89	Confident	27 Å²	27	23 Å²	23	14%	0.144	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-15.1	167.7	-65.6	-21	0	0	0	113.9	A181 T185 R188 H360 L364	A181-D362 WeakPolarHBondContact CB-O 3.33Å; T185-D362 HydrophobicContact CG2-CB 4.28Å; T185-D362 VanDerWaalsContact CG2-OD1 3.32Å; T185-D362 WeakPolarHBondContact CG2-OD1 3.34Å; T185-D362 WeakPolarHBondContact CG2-OD2 3.4Å; R188-D362 IonicContact CZ-OD1 3.66Å; R188-D362 IonicContact NH1-OD1 2.9Å; R188-D362 PolarHBondContact NH1-OD1 3.07Å; R188-D362 IonicContact NH1-OD2 3.9Å; R188-D362 PolarHBondContact NH1-OD2 2.87Å; R188-D362 IonicContact NH2-OD1 3.17Å; R188-D362 PolarHBondContact NH2-OD1 3.4Å; H360-D362 VanDerWaalsContact CE1-CG 3.5Å; H360-D362 IonicContact CE1-OD2 2.79Å; H360-D362 PolarHBondContact CE1-OD2 2.61Å; H360-D362 WeakPolarHBondContact ND1-CB 3.48Å; H360-D362 PolarHBondContact ND1-N 2.96Å; H360-D362 IonicContact ND1-OD2 3.86Å; H360-D362 PolarHBondContact ND1-OD2 3.39Å; H360-D362 PolarHBondContact O-N 3.25Å; D362-L364 PolarHBondContact O-N 2.65Å
363	G	83.8	Confident	89.4	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	79.1	-14.2	178.2	0	0	0	0	0	116.2	H316 H360	H316-G363 PolarHBondContact CD2-O 3.25Å; H316-G363 WeakPolarHBondContact NE2-CA 3.41Å; H316-G363 PolarHBondContact NE2-O 2.96Å; H316-G363 VanDerWaalsContact NE2-O 3.1Å; H360-G363 PolarHBondContact O-N 3.12Å
364	L	87.3	Confident	89.4	Confident	60 Å²	60	25 Å²	25	31%	0.314	14%	0.139	S	C	.	.	S	Bend	trans	-78.5	-33.6	-178.8	-65.8	175.1	0	0	0	113.9	Q178 A181 D362 L380	Q178-L364 HydrophobicContact CG-CD2 4.22Å; A181-L364 HydrophobicContact CB-CD1 3.68Å; A181-L364 HydrophobicContact CB-CD2 4.03Å; A181-L364 HydrophobicContact CB-CG 3.59Å; D362-L364 PolarHBondContact O-N 2.65Å; L364-L380 VanDerWaalsContact O-CB 3.27Å; L364-L380 WeakPolarHBondContact O-CB 3.27Å; L364-L380 PolarHBondContact O-N 3.46Å
365	I	91.8	Very high	89.5	Confident	45 Å²	45	24.7 Å²	24.7	23%	0.231	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	155.8	-179.4	70.2	179.4	0	0	0	109.9	H360 I377 W378 L422	H360-I365 HydrophobicContact CB-CD1 4.11Å; H360-I365 HydrophobicContact CB-CG1 3.35Å; H360-I365 WeakPolarHBondContact CB-O 3.4Å; H360-I365 PolarHBondContact N-O 3.34Å; I365-I377 HydrophobicContact CB-CG2 4.27Å; I365-I377 HydrophobicContact CD1-CG2 4.31Å; I365-W378 VanDerWaalsContact CA-O 3.23Å; I365-W378 WeakPolarHBondContact CA-O 3.18Å; I365-W378 WeakPolarHBondContact CB-O 3.45Å; I365-L422 HydrophobicContact CD1-CD1 4.49Å
366	F	92.6	Very high	89.5	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	152.8	172	58.9	-86.9	0	0	0	110.5	L323 W331 Q358 F359 T368 I377 W378 L380	L323-F366 HydrophobicContact CD1-CD2 4.15Å; L323-F366 HydrophobicContact CD1-CE2 3.97Å; L323-F366 HydrophobicContact CD1-CZ 4.2Å; L323-F366 HydrophobicContact CD2-CB 3.72Å; L323-F366 HydrophobicContact CD2-CD1 4.39Å; L323-F366 HydrophobicContact CD2-CD2 3.54Å; L323-F366 HydrophobicContact CD2-CE2 4.21Å; L323-F366 HydrophobicContact CD2-CG 3.63Å; L323-F366 HydrophobicContact CG-CD2 4.49Å; W331-F366 HydrophobicContact CB-CE2 4.49Å; W331-F366 AromaticContact CD2-CE2 3.8Å; W331-F366 HydrophobicContact CD2-CE2 3.8Å; W331-F366 AromaticContact CD2-CZ 3.48Å; W331-F366 HydrophobicContact CD2-CZ 3.48Å; W331-F366 VanDerWaalsContact CD2-CZ 3.48Å; W331-F366 AromaticContact CE2-CZ 3.49Å; W331-F366 VanDerWaalsContact CE2-CZ 3.49Å; W331-F366 HydrophobicContact CE3-CE1 4.42Å; W331-F366 HydrophobicContact CE3-CE2 4.18Å; W331-F366 AromaticContact CE3-CZ 3.59Å; W331-F366 HydrophobicContact CE3-CZ 3.59Å; W331-F366 AromaticContact CG-CE2 3.93Å; W331-F366 HydrophobicContact CG-CE2 3.93Å; W331-F366 HydrophobicContact CG-CZ 4.12Å; W331-F366 HydrophobicContact CH2-CE1 4.19Å; W331-F366 AromaticContact CH2-CZ 3.74Å; W331-F366 HydrophobicContact CH2-CZ 3.74Å; W331-F366 HydrophobicContact CZ2-CE1 4.4Å; W331-F366 AromaticContact CZ2-CZ 3.63Å; W331-F366 HydrophobicContact CZ2-CZ 3.63Å; W331-F366 HydrophobicContact CZ3-CE1 4.2Å; W331-F366 AromaticContact CZ3-CZ 3.73Å; W331-F366 HydrophobicContact CZ3-CZ 3.73Å; Q358-F366 WeakPolarHBondContact O-CA 3.35Å; Q358-F366 VanDerWaalsContact O-CB 3.28Å; Q358-F366 WeakPolarHBondContact O-CB 3.37Å; F359-F366 HydrophobicContact CD1-CB 3.74Å; F359-F366 HydrophobicContact CD1-CD1 4.38Å; F359-F366 HydrophobicContact CD1-CG 4.44Å; F359-F366 HydrophobicContact CE1-CB 4.09Å; F359-F366 AromaticContact CE1-CD1 3.94Å; F359-F366 HydrophobicContact CE1-CD1 3.94Å; F359-F366 HydrophobicContact CE1-CG 4.31Å; F359-F366 HydrophobicContact CG-CB 4.37Å; F366-T368 HydrophobicContact CD2-CG2 3.91Å; F366-T368 HydrophobicContact CE2-CG2 3.92Å; F366-I377 WeakPolarHBondContact O-CA 3.37Å; F366-W378 HydrophobicContact CD1-CB 4.09Å; F366-W378 HydrophobicContact CD2-CB 3.94Å; F366-W378 HydrophobicContact CD2-CG 4.27Å; F366-W378 HydrophobicContact CE1-CB 3.58Å; F366-W378 HydrophobicContact CE2-CB 3.42Å; F366-W378 VanDerWaalsContact CE2-CB 3.42Å; F366-W378 AromaticContact CE2-CD1 3.55Å; F366-W378 AromaticContact CE2-CG 3.56Å; F366-W378 HydrophobicContact CE2-CG 3.56Å; F366-W378 HydrophobicContact CG-CB 4.25Å; F366-W378 HydrophobicContact CZ-CB 3.22Å; F366-W378 AromaticContact CZ-CG 3.72Å; F366-W378 HydrophobicContact CZ-CG 3.72Å; F366-W378 PolarHBondContact N-O 3.29Å; F366-W378 VanDerWaalsContact N-O 3.07Å; F366-W378 PolarHBondContact O-N 3.2Å; F366-L380 HydrophobicContact CD1-CB 4.38Å; F366-L380 HydrophobicContact CE1-CB 4.17Å; F366-L380 HydrophobicContact CE1-CD1 4.04Å
367	G	91.8	Very high	89.6	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	139.1	176.3	0	0	0	0	0	110.3	A357 Q358 K376	A357-G367 VanDerWaalsContact CA-O 3.3Å; A357-G367 WeakPolarHBondContact CA-O 3.38Å; Q358-G367 PolarHBondContact N-O 3.18Å; Q358-G367 PolarHBondContact O-N 2.85Å; G367-K376 WeakPolarHBondContact CA-O 3.4Å
368	T	91.8	Very high	89.6	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	135.7	170.6	57.3	0	0	0	0	109.2	L354 C356 A357 F366 I375 K376 W378 I399	L354-T368 HydrophobicContact CD1-CG2 4.49Å; C356-T368 WeakPolarHBondContact O-CA 3.28Å; A357-T368 HydrophobicContact CB-CG2 4.15Å; F366-T368 HydrophobicContact CD2-CG2 3.91Å; F366-T368 HydrophobicContact CE2-CG2 3.92Å; T368-I375 WeakPolarHBondContact O-CA 3.45Å; T368-K376 PolarHBondContact N-O 3.2Å; T368-K376 PolarHBondContact O-N 3.48Å; T368-K376 PolarHBondContact OG1-O 2.74Å; T368-W378 PolarHBondContact OG1-NE1 3.02Å; T368-I399 VanDerWaalsContact C-CD1 3.47Å
369	G	90.6	Very high	89.4	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	141.2	172.3	0	0	0	0	0	109.9	L354 T355 C356 I399	L354-G369 CarbonylContact C-O 3.55Å; L354-G369 WeakPolarHBondContact CA-O 3.47Å; T355-G369 PolarHBondContact N-O 3.15Å; T355-G369 PolarHBondContact OG1-O 3.04Å; T355-G369 VanDerWaalsContact OG1-O 3.11Å; C356-G369 PolarHBondContact O-N 3.04Å; G369-I399 VanDerWaalsContact N-CD1 3.28Å
370	T	90.1	Very high	89.1	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.012	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	159.3	176.1	72.8	0	0	0	0	111.6	A353 L354 D372 S373 Q374 K376 V396	A353-T370 WeakPolarHBondContact O-CA 3.3Å; L354-T370 HydrophobicContact CD2-CG2 3.95Å; T370-D372 PolarHBondContact O-N 3.32Å; T370-D372 PolarHBondContact OG1-N 2.82Å; T370-S373 PolarHBondContact O-N 3.31Å; T370-Q374 PolarHBondContact N-O 2.97Å; T370-Q374 PolarHBondContact OG1-N 3.22Å; T370-Q374 PolarHBondContact OG1-O 3.38Å; T370-Q374 VanDerWaalsContact OG1-O 3.09Å; T370-K376 HydrophobicContact CG2-CD 4.2Å; T370-K376 HydrophobicContact CG2-CG 4.21Å; T370-V396 PolarHBondContact O-N 3.21Å
371	A	88.4	Confident	88.7	Confident	35 Å²	35	25 Å²	25	29%	0.289	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.7	169.5	0	0	0	0	0	112.6	A353 T355 S373 P395	A353-A371 PolarHBondContact O-N 3.29Å; T355-A371 HydrophobicContact CG2-CB 4.31Å; A371-S373 PolarHBondContact O-N 3.35Å; A371-S373 VanDerWaalsContact O-N 3.1Å; A371-P395 WeakPolarHBondContact O-CA 3.47Å
372	D	85.9	Confident	88.5	Confident	97 Å²	97	28.5 Å²	28.5	52%	0.519	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	21.2	-178.3	-75.9	25.4	0	0	0	113.4	C352 T370 Q374	C352-D372 HydrophobicContact CB-CB 4.33Å; C352-D372 PolarHBondContact SG-OD2 3.48Å; T370-D372 PolarHBondContact O-N 3.32Å; T370-D372 PolarHBondContact OG1-N 2.82Å; D372-Q374 PolarHBondContact O-N 3.06Å
373	S	87.4	Confident	88.6	Confident	21 Å²	21	32.2 Å²	32.2	15%	0.147	16%	0.16	C	C	.	.	S	Bend	trans	63.8	20	177.2	-37.1	0	0	0	0	114.3	T370 A371 H392 G394	T370-S373 PolarHBondContact O-N 3.31Å; A371-S373 PolarHBondContact O-N 3.35Å; A371-S373 VanDerWaalsContact O-N 3.1Å; S373-H392 WeakPolarHBondContact CB-O 3.48Å; S373-G394 WeakPolarHBondContact CA-O 3.48Å; S373-G394 WeakPolarHBondContact CB-O 3.44Å; S373-G394 VanDerWaalsContact OG-CA 3.23Å; S373-G394 WeakPolarHBondContact OG-CA 3.34Å; S373-G394 PolarHBondContact OG-N 2.8Å; S373-G394 VanDerWaalsContact OG-N 3.07Å; S373-G394 PolarHBondContact OG-O 2.86Å
374	Q	88.4	Confident	88.6	Confident	71 Å²	71	35.7 Å²	35.7	33%	0.332	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	144.9	176	-62.6	-171.9	-1.5	0	0	110.6	T370 D372	T370-Q374 PolarHBondContact N-O 2.97Å; T370-Q374 PolarHBondContact OG1-N 3.22Å; T370-Q374 PolarHBondContact OG1-O 3.38Å; T370-Q374 VanDerWaalsContact OG1-O 3.09Å; D372-Q374 PolarHBondContact O-N 3.06Å
375	I	90.6	Very high	88.6	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.2	169.4	-54.3	140.7	0	0	0	106.7	T368 I377 N388 F389 V396 I399 L408 T410 W420	T368-I375 WeakPolarHBondContact O-CA 3.45Å; I375-I377 HydrophobicContact CG2-CD1 4.33Å; I375-N388 WeakPolarHBondContact O-CA 3.42Å; I375-F389 HydrophobicContact CB-CB 4.17Å; I375-F389 HydrophobicContact CB-CD2 4.26Å; I375-F389 HydrophobicContact CD1-CB 4.18Å; I375-F389 HydrophobicContact CG2-CD2 4.14Å; I375-F389 PolarHBondContact N-O 2.83Å; I375-F389 PolarHBondContact O-N 3.31Å; I375-V396 HydrophobicContact CG1-CG1 4.38Å; I375-V396 HydrophobicContact CG1-CG2 3.94Å; I375-I399 HydrophobicContact CG2-CD1 3.94Å; I375-L408 HydrophobicContact CG2-CD2 4.25Å; I375-T410 HydrophobicContact CD1-CG2 3.44Å; I375-T410 VanDerWaalsContact CD1-CG2 3.44Å; I375-T410 WeakPolarHBondContact CD1-OG1 3.15Å; I375-T410 HydrophobicContact CG1-CG2 3.97Å; I375-T410 HydrophobicContact CG2-CG2 4.4Å; I375-W420 HydrophobicContact CD1-CZ2 4.11Å
376	K	90.3	Very high	88.3	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.026	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	130	178.1	-51.8	-172.9	170.6	-174.4	0	109.3	D347 G367 T368 T370 W378 N388	D347-K376 IonicContact OD2-NZ 3.2Å; D347-K376 PolarHBondContact OD2-NZ 2.91Å; G367-K376 WeakPolarHBondContact CA-O 3.4Å; T368-K376 PolarHBondContact N-O 3.2Å; T368-K376 PolarHBondContact O-N 3.48Å; T368-K376 PolarHBondContact OG1-O 2.74Å; T370-K376 HydrophobicContact CG2-CD 4.2Å; T370-K376 HydrophobicContact CG2-CG 4.21Å; K376-W378 HydrophobicContact CD-CZ2 4.21Å; K376-N388 WeakPolarHBondContact CG-OD1 3.4Å
377	I	91.9	Very high	88	Confident	8 Å²	8	37.4 Å²	37.4	4%	0.041	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	125.7	172.9	-54.9	-57.3	0	0	0	108.8	I365 F366 I375 N385 V386 A387 F389 F401 L408	I365-I377 HydrophobicContact CB-CG2 4.27Å; I365-I377 HydrophobicContact CD1-CG2 4.31Å; F366-I377 WeakPolarHBondContact O-CA 3.37Å; I375-I377 HydrophobicContact CG2-CD1 4.33Å; I377-N385 PolarHBondContact O-OD1 2.97Å; I377-V386 PolarHBondContact O-N 3.38Å; I377-A387 HydrophobicContact CB-CB 4.25Å; I377-A387 HydrophobicContact CG1-CB 4.44Å; I377-A387 PolarHBondContact N-O 3.1Å; I377-A387 PolarHBondContact O-N 3.15Å; I377-F389 HydrophobicContact CD1-CD2 4.43Å; I377-F389 HydrophobicContact CD1-CE2 3.92Å; I377-F389 HydrophobicContact CG1-CD2 4.07Å; I377-F389 HydrophobicContact CG1-CE2 3.42Å; I377-F389 VanDerWaalsContact CG1-CE2 3.42Å; I377-F389 HydrophobicContact CG1-CZ 4.23Å; I377-F401 HydrophobicContact CD1-CZ 4.09Å; I377-L408 HydrophobicContact CD1-CD2 3.97Å
378	W	90.9	Very high	87.8	Confident	7 Å²	7	41.3 Å²	41.3	3%	0.027	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	141	-177.6	-63.9	89.6	0	0	0	110.4	W331 V345 D347 I365 F366 T368 K376 T384 N385	W331-W378 AromaticContact CD1-CE2 3.9Å; W331-W378 HydrophobicContact CZ2-CD2 4.47Å; W331-W378 HydrophobicContact CZ2-CE3 4.06Å; W331-W378 AromaticContact NE1-CD2 3.41Å; W331-W378 AromaticContact NE1-CE2 3.53Å; W331-W378 AromaticContact NE1-CE3 3.5Å; W331-W378 AromaticContact NE1-CH2 3.83Å; W331-W378 AromaticContact NE1-CZ2 3.75Å; W331-W378 AromaticContact NE1-CZ3 3.71Å; V345-W378 HydrophobicContact CG1-CH2 4.45Å; V345-W378 HydrophobicContact CG1-CZ3 3.99Å; D347-W378 HydrophobicContact CB-CH2 3.74Å; D347-W378 HydrophobicContact CB-CZ2 4Å; I365-W378 VanDerWaalsContact CA-O 3.23Å; I365-W378 WeakPolarHBondContact CA-O 3.18Å; I365-W378 WeakPolarHBondContact CB-O 3.45Å; F366-W378 HydrophobicContact CD1-CB 4.09Å; F366-W378 HydrophobicContact CD2-CB 3.94Å; F366-W378 HydrophobicContact CD2-CG 4.27Å; F366-W378 HydrophobicContact CE1-CB 3.58Å; F366-W378 HydrophobicContact CE2-CB 3.42Å; F366-W378 VanDerWaalsContact CE2-CB 3.42Å; F366-W378 AromaticContact CE2-CD1 3.55Å; F366-W378 AromaticContact CE2-CG 3.56Å; F366-W378 HydrophobicContact CE2-CG 3.56Å; F366-W378 HydrophobicContact CG-CB 4.25Å; F366-W378 HydrophobicContact CZ-CB 3.22Å; F366-W378 AromaticContact CZ-CG 3.72Å; F366-W378 HydrophobicContact CZ-CG 3.72Å; F366-W378 PolarHBondContact N-O 3.29Å; F366-W378 VanDerWaalsContact N-O 3.07Å; F366-W378 PolarHBondContact O-N 3.2Å; T368-W378 PolarHBondContact OG1-NE1 3.02Å; K376-W378 HydrophobicContact CD-CZ2 4.21Å; W378-T384 WeakPolarHBondContact CA-O 3.46Å; W378-T384 VanDerWaalsContact CE3-C 3.49Å; W378-N385 HydrophobicContact CD2-CB 4.32Å; W378-N385 HydrophobicContact CE3-CB 4.06Å; W378-N385 HydrophobicContact CH2-CB 4.1Å; W378-N385 HydrophobicContact CZ2-CB 4.35Å; W378-N385 HydrophobicContact CZ3-CB 3.95Å
379	D	90	Very high	87.5	Confident	39 Å²	39	41.4 Å²	41.4	21%	0.209	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.2	163	-175	-13.9	0	0	0	108.5	K381 E382 R383 T384 V386	D379-K381 VanDerWaalsContact C-N 3.26Å; D379-K381 PolarHBondContact O-N 3.41Å; D379-K381 WeakPolarHBondContact OD1-CB 3.01Å; D379-K381 PolarHBondContact OD1-N 3.41Å; D379-E382 HydrophobicContact CB-CB 4.47Å; D379-R383 VanDerWaalsContact O-CA 3.28Å; D379-R383 WeakPolarHBondContact O-CA 3.33Å; D379-R383 PolarHBondContact O-N 3.33Å; D379-T384 PolarHBondContact N-O 3.04Å; D379-V386 HydrophobicContact CB-CG2 3.54Å
380	L	85.7	Confident	87.1	Confident	2 Å²	2	46 Å²	46	1%	0.01	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-36.8	179.5	-176.4	62.4	0	0	0	111.2	M169 L177 W331 F333 F359 L364 F366	M169-L380 HydrophobicContact CE-CD1 3.95Å; M169-L380 HydrophobicContact CE-CG 3.97Å; M169-L380 WeakPolarHBondContact CE-O 3.49Å; L177-L380 HydrophobicContact CD1-CD2 3.79Å; W331-L380 HydrophobicContact CZ3-CD1 4.33Å; F333-L380 HydrophobicContact CB-CD1 4.45Å; F333-L380 HydrophobicContact CD1-CD1 4.47Å; F333-L380 HydrophobicContact CD2-CD1 3.98Å; F333-L380 HydrophobicContact CE2-CD1 4.25Å; F333-L380 HydrophobicContact CE2-CD2 3.96Å; F333-L380 HydrophobicContact CG-CD1 4.07Å; F333-L380 HydrophobicContact CZ-CD2 4.01Å; F359-L380 HydrophobicContact CE1-CD2 4.19Å; L364-L380 VanDerWaalsContact O-CB 3.27Å; L364-L380 WeakPolarHBondContact O-CB 3.27Å; L364-L380 PolarHBondContact O-N 3.46Å; F366-L380 HydrophobicContact CD1-CB 4.38Å; F366-L380 HydrophobicContact CE1-CB 4.17Å; F366-L380 HydrophobicContact CE1-CD1 4.04Å
381	K	83.2	Confident	86.4	Confident	82 Å²	82	47.9 Å²	47.9	36%	0.357	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-53.1	-175.4	179.7	-176.3	175.8	-110.6	0	112	I174 D379 R383	I174-K381 HydrophobicContact CG2-CD 4.19Å; I174-K381 HydrophobicContact CG2-CG 3.96Å; D379-K381 VanDerWaalsContact C-N 3.26Å; D379-K381 PolarHBondContact O-N 3.41Å; D379-K381 WeakPolarHBondContact OD1-CB 3.01Å; D379-K381 PolarHBondContact OD1-N 3.41Å; K381-R383 VanDerWaalsContact C-N 3.29Å
382	E	82	Confident	86.2	Confident	97 Å²	97	47 Å²	47	45%	0.453	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-16.3	-176.4	-59.8	-58.4	146	0	0	111.4	D379 T384	D379-E382 HydrophobicContact CB-CB 4.47Å; E382-T384 HydrophobicContact CB-CG2 4.37Å; E382-T384 WeakPolarHBondContact CB-OG1 3.4Å; E382-T384 PolarHBondContact O-N 2.88Å
383	R	85.2	Confident	86.2	Confident	104 Å²	104	47.5 Å²	47.5	39%	0.392	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.2	27.5	-175.3	-58.3	169.2	-70.1	-120	-5.4	112.4	M169 W331 T343 V345 D379 K381	M169-R383 HydrophobicContact CE-CG 4.5Å; W331-R383 HydrophobicContact CH2-CB 4.47Å; W331-R383 HydrophobicContact CH2-CG 4.33Å; T343-R383 HydrophobicContact CG2-CG 4.14Å; V345-R383 HydrophobicContact CG2-CB 4.05Å; V345-R383 HydrophobicContact CG2-CG 4.35Å; D379-R383 VanDerWaalsContact O-CA 3.28Å; D379-R383 WeakPolarHBondContact O-CA 3.33Å; D379-R383 PolarHBondContact O-N 3.33Å; K381-R383 VanDerWaalsContact C-N 3.29Å
384	T	85.3	Confident	86.1	Confident	73 Å²	73	47 Å²	47	45%	0.448	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	151.9	-179	54.4	0	0	0	0	110.3	W378 D379 E382 V386	W378-T384 WeakPolarHBondContact CA-O 3.46Å; W378-T384 VanDerWaalsContact CE3-C 3.49Å; D379-T384 PolarHBondContact N-O 3.04Å; E382-T384 HydrophobicContact CB-CG2 4.37Å; E382-T384 WeakPolarHBondContact CB-OG1 3.4Å; E382-T384 PolarHBondContact O-N 2.88Å; T384-V386 PolarHBondContact O-N 3.16Å
385	N	86.2	Confident	86.2	Confident	38 Å²	38	45.6 Å²	45.6	20%	0.203	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	116.1	169.6	-176	-16.9	0	0	0	108.5	D347 I377 W378 A387 N388	D347-N385 PolarHBondContact OD2-ND2 3.35Å; I377-N385 PolarHBondContact O-OD1 2.97Å; W378-N385 HydrophobicContact CD2-CB 4.32Å; W378-N385 HydrophobicContact CE3-CB 4.06Å; W378-N385 HydrophobicContact CH2-CB 4.1Å; W378-N385 HydrophobicContact CZ2-CB 4.35Å; W378-N385 HydrophobicContact CZ3-CB 3.95Å; N385-A387 PolarHBondContact OD1-N 2.9Å; N385-A387 PolarHBondContact OD1-O 2.79Å; N385-N388 PolarHBondContact ND2-OD1 3.28Å; N385-N388 PolarHBondContact OD1-OD1 2.93Å
386	V	86.4	Confident	86.2	Confident	92 Å²	92	45.6 Å²	45.6	56%	0.558	26%	0.263	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	-33.4	-176.6	180	0	0	0	0	111.5	I377 D379 T384	I377-V386 PolarHBondContact O-N 3.38Å; D379-V386 HydrophobicContact CB-CG2 3.54Å; T384-V386 PolarHBondContact O-N 3.16Å
387	A	85	Confident	86.2	Confident	12 Å²	12	47.3 Å²	47.3	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	137.9	-177.3	0	0	0	0	0	112	I377 N385 F389 L425	I377-A387 HydrophobicContact CB-CB 4.25Å; I377-A387 HydrophobicContact CG1-CB 4.44Å; I377-A387 PolarHBondContact N-O 3.1Å; I377-A387 PolarHBondContact O-N 3.15Å; N385-A387 PolarHBondContact OD1-N 2.9Å; N385-A387 PolarHBondContact OD1-O 2.79Å; A387-F389 HydrophobicContact CB-CZ 4.4Å; A387-L425 HydrophobicContact CB-CD1 4.37Å; A387-L425 HydrophobicContact CB-CD2 3.71Å
388	N	87.5	Confident	86.1	Confident	81 Å²	81	47.4 Å²	47.4	43%	0.433	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	130.1	170.3	-67.4	-48.2	0	0	0	109.1	I375 K376 N385 P390	I375-N388 WeakPolarHBondContact O-CA 3.42Å; K376-N388 WeakPolarHBondContact CG-OD1 3.4Å; N385-N388 PolarHBondContact ND2-OD1 3.28Å; N385-N388 PolarHBondContact OD1-OD1 2.93Å; N388-P390 WeakPolarHBondContact O-CD 3.41Å
389	F	85.8	Confident	86.2	Confident	3 Å²	3	47.6 Å²	47.6	1%	0.013	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	98.6	172.7	-58.8	-59.5	0	0	0	110.1	I375 I377 A387 L408 W420 L422 L425	I375-F389 HydrophobicContact CB-CB 4.17Å; I375-F389 HydrophobicContact CB-CD2 4.26Å; I375-F389 HydrophobicContact CD1-CB 4.18Å; I375-F389 HydrophobicContact CG2-CD2 4.14Å; I375-F389 PolarHBondContact N-O 2.83Å; I375-F389 PolarHBondContact O-N 3.31Å; I377-F389 HydrophobicContact CD1-CD2 4.43Å; I377-F389 HydrophobicContact CD1-CE2 3.92Å; I377-F389 HydrophobicContact CG1-CD2 4.07Å; I377-F389 HydrophobicContact CG1-CE2 3.42Å; I377-F389 VanDerWaalsContact CG1-CE2 3.42Å; I377-F389 HydrophobicContact CG1-CZ 4.23Å; A387-F389 HydrophobicContact CB-CZ 4.4Å; F389-L408 HydrophobicContact CD2-CD2 4.28Å; F389-L408 HydrophobicContact CE2-CD2 4.05Å; F389-W420 HydrophobicContact CB-CD2 4.11Å; F389-W420 HydrophobicContact CB-CE3 3.85Å; F389-W420 HydrophobicContact CB-CH2 3.87Å; F389-W420 HydrophobicContact CB-CZ2 4.1Å; F389-W420 HydrophobicContact CB-CZ3 3.73Å; F389-W420 HydrophobicContact CD1-CD2 4.27Å; F389-W420 AromaticContact CD1-CE3 3.6Å; F389-W420 HydrophobicContact CD1-CE3 3.6Å; F389-W420 AromaticContact CD1-CZ3 3.97Å; F389-W420 HydrophobicContact CD1-CZ3 3.97Å; F389-W420 HydrophobicContact CE1-CE3 4.34Å; F389-W420 HydrophobicContact CG-CD2 4.08Å; F389-W420 AromaticContact CG-CE3 3.8Å; F389-W420 HydrophobicContact CG-CE3 3.8Å; F389-W420 HydrophobicContact CG-CZ3 4.13Å; F389-L422 HydrophobicContact CE2-CD2 4.03Å; F389-L422 HydrophobicContact CZ-CD2 4Å; F389-L425 HydrophobicContact CE1-CB 3.84Å; F389-L425 HydrophobicContact CE1-CD2 3.62Å; F389-L425 HydrophobicContact CE1-CG 4.36Å; F389-L425 HydrophobicContact CZ-CD2 3.51Å
390	P	83.5	Confident	86.3	Confident	96 Å²	96	45.7 Å²	45.7	62%	0.623	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	141.5	169.4	32.6	-33.5	0	0	0	109.8	N388 W420	N388-P390 WeakPolarHBondContact O-CD 3.41Å; P390-W420 WeakPolarHBondContact O-CH2 3.24Å
391	G	75.2	Confident	86.6	Confident	42 Å²	42	46 Å²	46	43%	0.433	27%	0.268	S	S	.	.			trans	151.9	-6.7	169.2	0	0	0	0	0	116.5	K418	G391-K418 WeakPolarHBondContact O-CE 3.27Å; G391-K418 PolarHBondContact O-NZ 2.94Å
392	H	84.8	Confident	86.9	Confident	16 Å²	16	42.1 Å²	42.1	7%	0.074	25%	0.251	C	S	.	.			trans	-80.8	153.3	165.1	-77.8	-71.3	0	0	0	110.5	S373 T410 A412 D414 K418	S373-H392 WeakPolarHBondContact CB-O 3.48Å; H392-T410 PolarHBondContact NE2-OG1 2.99Å; H392-A412 HydrophobicContact CB-CB 4.04Å; H392-A412 WeakPolarHBondContact ND1-CB 3.46Å; H392-D414 WeakPolarHBondContact CA-OD2 3.32Å; H392-D414 IonicContact CG-OD2 2.97Å; H392-D414 IonicContact ND1-OD1 3.78Å; H392-D414 PolarHBondContact ND1-OD1 2.98Å; H392-D414 IonicContact ND1-OD2 3.94Å; H392-D414 PolarHBondContact ND1-OD2 3.34Å; H392-K418 VanDerWaalsContact CE1-CD 3.45Å; H392-K418 WeakPolarHBondContact CE1-CD 3.3Å
393	S	84.7	Confident	87	Confident	108 Å²	108	41.3 Å²	41.3	76%	0.755	25%	0.247	S	C	*	.	S	Bend	trans	-109.6	9	177.7	-170.2	0	0	0	0	112.8	D414	S393-D414 PolarHBondContact N-OD2 3.12Å
394	G	85.9	Confident	86.8	Confident	9 Å²	9	39.4 Å²	39.4	9%	0.093	25%	0.245	C	C	.	.	S	Bend	trans	-154.1	172	174.8	0	0	0	0	0	112.4	S373 V396	S373-G394 WeakPolarHBondContact CA-O 3.48Å; S373-G394 WeakPolarHBondContact CB-O 3.44Å; S373-G394 VanDerWaalsContact OG-CA 3.23Å; S373-G394 WeakPolarHBondContact OG-CA 3.34Å; S373-G394 PolarHBondContact OG-N 2.8Å; S373-G394 VanDerWaalsContact OG-N 3.07Å; S373-G394 PolarHBondContact OG-O 2.86Å; G394-V396 PolarHBondContact O-N 3.37Å
395	P	89.3	Confident	86.6	Confident	43 Å²	43	36.4 Å²	36.4	28%	0.279	23%	0.228	S	C	.	.			trans	-51.1	132	179.9	-27.6	34.3	0	0	0	112.2	A371 T397 A412 Q413	A371-P395 WeakPolarHBondContact O-CA 3.47Å; P395-T397 PolarHBondContact O-N 2.74Å; P395-A412 VanDerWaalsContact O-CA 3.32Å; P395-A412 WeakPolarHBondContact O-CA 3.44Å; P395-A412 WeakPolarHBondContact O-CB 3.43Å; P395-Q413 PolarHBondContact O-N 3.41Å
396	V	91.6	Very high	86.6	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	125.4	175.8	-176.5	0	0	0	0	107.7	T355 T370 I375 G394 I399	T355-V396 WeakPolarHBondContact CB-O 3.38Å; T355-V396 PolarHBondContact OG1-O 2.9Å; T370-V396 PolarHBondContact O-N 3.21Å; I375-V396 HydrophobicContact CG1-CG1 4.38Å; I375-V396 HydrophobicContact CG1-CG2 3.94Å; G394-V396 PolarHBondContact O-N 3.37Å; V396-I399 HydrophobicContact CG1-CD1 4.3Å; V396-I399 HydrophobicContact CG1-CG1 3.94Å
397	T	90.6	Very high	86.8	Confident	41 Å²	41	37.4 Å²	37.4	25%	0.252	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	-35.4	-177.9	55.9	0	0	0	0	112	P395 G411 V439	P395-T397 PolarHBondContact O-N 2.74Å; T397-G411 PolarHBondContact N-O 2.74Å; T397-G411 PolarHBondContact OG1-O 3.07Å; T397-V439 VanDerWaalsContact CB-O 3.29Å; T397-V439 WeakPolarHBondContact CB-O 3.39Å; T397-V439 PolarHBondContact OG1-O 3.11Å
398	S	89.3	Confident	87.1	Confident	10 Å²	10	36.8 Å²	36.8	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	149	-174.8	52.9	0	0	0	0	111.9	G411 L442	S398-G411 PolarHBondContact N-O 3.22Å; S398-G411 PolarHBondContact O-N 3.35Å; S398-L442 WeakPolarHBondContact OG-CG 3.33Å
399	I	93.2	Very high	87.3	Confident	11 Å²	11	33 Å²	33	6%	0.056	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135.1	177.5	-63.7	175.3	0	0	0	106.7	Q358 T368 G369 I375 V396 F401 L408 T410	Q358-I399 PolarHBondContact OE1-O 3.3Å; T368-I399 VanDerWaalsContact C-CD1 3.47Å; G369-I399 VanDerWaalsContact N-CD1 3.28Å; I375-I399 HydrophobicContact CG2-CD1 3.94Å; V396-I399 HydrophobicContact CG1-CD1 4.3Å; V396-I399 HydrophobicContact CG1-CG1 3.94Å; I399-F401 HydrophobicContact CG2-CE2 4.17Å; I399-L408 HydrophobicContact CG2-CD1 3.29Å; I399-L408 HydrophobicContact CG2-CG 4.29Å; I399-T410 HydrophobicContact CG1-CG2 4.09Å; I399-T410 HydrophobicContact CG2-CG2 4.4Å
400	A	92.6	Very high	87.7	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	121.7	176.3	0	0	0	0	0	109.5	L408 A409 L442 F444	A400-L408 WeakPolarHBondContact O-CD1 3.42Å; A400-A409 HydrophobicContact CB-CB 4.39Å; A400-A409 PolarHBondContact N-O 3.47Å; A400-A409 PolarHBondContact O-N 2.93Å; A400-L442 HydrophobicContact CB-CB 3.82Å; A400-L442 WeakPolarHBondContact CB-O 3.16Å; A400-F444 HydrophobicContact CB-CD2 3.67Å; A400-F444 HydrophobicContact CB-CE2 3.9Å; A400-F444 VanDerWaalsContact O-CE2 3.28Å; A400-F444 WeakPolarHBondContact O-CE2 3.38Å
401	F	91.9	Very high	88	Confident	7 Å²	7	28.2 Å²	28.2	3%	0.031	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	136.1	168.1	-72.8	-80.5	0	0	0	110.6	Q358 F359 H360 I377 I399 L408 L422 F444	Q358-F401 HydrophobicContact CB-CD2 4.23Å; Q358-F401 HydrophobicContact CB-CE2 4.35Å; Q358-F401 HydrophobicContact CG-CD2 4.45Å; Q358-F401 VanDerWaalsContact O-CE2 3.26Å; Q358-F401 WeakPolarHBondContact O-CE2 3.38Å; F359-F401 WeakPolarHBondContact O-CD2 3.43Å; H360-F401 HydrophobicContact CB-CD1 4.24Å; H360-F401 HydrophobicContact CB-CE1 4.33Å; H360-F401 HydrophobicContact CB-CG 4.31Å; H360-F401 AromaticContact CD2-CD1 3.47Å; H360-F401 VanDerWaalsContact CD2-CD1 3.47Å; H360-F401 WeakPolarHBondContact CD2-CD1 3.2Å; H360-F401 AromaticContact CD2-CE1 3.93Å; I377-F401 HydrophobicContact CD1-CZ 4.09Å; I399-F401 HydrophobicContact CG2-CE2 4.17Å; F401-L408 HydrophobicContact CD1-CB 4.37Å; F401-L408 HydrophobicContact CD1-CD1 3.52Å; F401-L408 HydrophobicContact CD1-CG 4.48Å; F401-L408 HydrophobicContact CD2-CD1 4.05Å; F401-L408 HydrophobicContact CE1-CB 4.35Å; F401-L408 HydrophobicContact CE1-CD1 3.45Å; F401-L408 VanDerWaalsContact CE1-CD1 3.45Å; F401-L408 HydrophobicContact CE1-CD2 4.3Å; F401-L408 HydrophobicContact CE1-CG 4.24Å; F401-L408 HydrophobicContact CE2-CD1 3.94Å; F401-L408 HydrophobicContact CG-CD1 3.85Å; F401-L408 HydrophobicContact CZ-CD1 3.67Å; F401-L422 HydrophobicContact CD1-CD1 4.05Å; F401-L422 HydrophobicContact CE1-CD1 3.91Å; F401-L422 HydrophobicContact CE1-CD2 4.4Å; F401-F444 VanDerWaalsContact C-CD2 3.47Å; F401-F444 WeakPolarHBondContact O-CD2 3.49Å
402	S	89.3	Confident	88.7	Confident	1 Å²	1	26.2 Å²	26.2	1%	0.007	14%	0.144	C	C	.	.			trans	-76.7	141.3	172.4	177.5	0	0	0	0	110.4	N404 G405 Y407	S402-N404 PolarHBondContact O-N 3.16Å; S402-N404 VanDerWaalsContact O-N 3.07Å; S402-N404 PolarHBondContact OG-N 3.08Å; S402-G405 PolarHBondContact O-N 2.99Å; S402-Y407 WeakPolarHBondContact CB-O 3.38Å; S402-Y407 PolarHBondContact N-O 3.36Å
403	E	84.4	Confident	88.8	Confident	80 Å²	80	30.8 Å²	30.8	37%	0.374	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-9.5	172.5	-69	-59.8	152.2	0	0	114	R188 P361 G405 Q446	R188-E403 WeakPolarHBondContact CD-O 3.4Å; R188-E403 PolarHBondContact NE-O 2.84Å; P361-E403 VanDerWaalsContact CB-OE2 3.31Å; P361-E403 WeakPolarHBondContact CB-OE2 3.25Å; E403-G405 PolarHBondContact O-N 3.41Å; E403-Q446 WeakPolarHBondContact CB-O 3.32Å; E403-Q446 WeakPolarHBondContact CG-O 3.39Å
404	N	80.6	Confident	88.8	Confident	65 Å²	65	27.8 Å²	27.8	35%	0.348	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15.9	167.7	-166.6	14.9	0	0	0	112.4	R188 S402 Y406	R188-N404 WeakPolarHBondContact CD-O 3.18Å; S402-N404 PolarHBondContact O-N 3.16Å; S402-N404 VanDerWaalsContact O-N 3.07Å; S402-N404 PolarHBondContact OG-N 3.08Å; N404-Y406 VanDerWaalsContact O-CD2 3.27Å; N404-Y406 WeakPolarHBondContact O-CD2 3.32Å; N404-Y406 PolarHBondContact O-N 3.22Å
405	G	81.6	Confident	88.8	Confident	9 Å²	9	27.9 Å²	27.9	9%	0.093	14%	0.14	C	C	.	.	S	Bend	trans	74.8	4.9	176.4	0	0	0	0	0	115.7	H360 S402 E403	H360-G405 VanDerWaalsContact NE2-CA 3.28Å; H360-G405 WeakPolarHBondContact NE2-CA 3.41Å; H360-G405 PolarHBondContact NE2-O 3.46Å; H360-G405 VanDerWaalsContact NE2-O 3.11Å; S402-G405 PolarHBondContact O-N 2.99Å; E403-G405 PolarHBondContact O-N 3.41Å
406	Y	85.9	Confident	88.7	Confident	90 Å²	90	26.1 Å²	26.1	35%	0.353	13%	0.129	S	C	.	.	S	Bend	trans	-115.7	-23.2	179.5	-57.2	-57.4	0	0	0	113.2	N404 D421 L422 R423	N404-Y406 VanDerWaalsContact O-CD2 3.27Å; N404-Y406 WeakPolarHBondContact O-CD2 3.32Å; N404-Y406 PolarHBondContact O-N 3.22Å; Y406-D421 WeakPolarHBondContact O-CA 3.44Å; Y406-L422 PolarHBondContact O-N 3.06Å; Y406-R423 VanDerWaalsContact CD1-CD 3.43Å; Y406-R423 HydrophobicContact CD1-CG 3.73Å; Y406-R423 HydrophobicContact CE1-CG 4.26Å
407	Y	89.7	Confident	88.7	Confident	61 Å²	61	26.1 Å²	26.1	24%	0.239	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.2	-175.3	-59.2	-34.8	0	0	0	111.4	S402 W420 F428	S402-Y407 WeakPolarHBondContact CB-O 3.38Å; S402-Y407 PolarHBondContact N-O 3.36Å; Y407-W420 WeakPolarHBondContact CA-O 3.45Å; Y407-F428 AromaticContact CD1-CE1 3.9Å; Y407-F428 HydrophobicContact CD1-CE1 3.9Å; Y407-F428 HydrophobicContact CD1-CZ 4.23Å; Y407-F428 HydrophobicContact CE1-CE1 4.09Å; Y407-F428 HydrophobicContact CE1-CZ 4.24Å
408	L	91.9	Very high	88.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.2	172.7	176.5	66.3	0	0	0	108	I375 I377 F389 I399 A400 F401 T410 L419 W420 L422	I375-L408 HydrophobicContact CG2-CD2 4.25Å; I377-L408 HydrophobicContact CD1-CD2 3.97Å; F389-L408 HydrophobicContact CD2-CD2 4.28Å; F389-L408 HydrophobicContact CE2-CD2 4.05Å; I399-L408 HydrophobicContact CG2-CD1 3.29Å; I399-L408 HydrophobicContact CG2-CG 4.29Å; A400-L408 WeakPolarHBondContact O-CD1 3.42Å; F401-L408 HydrophobicContact CD1-CB 4.37Å; F401-L408 HydrophobicContact CD1-CD1 3.52Å; F401-L408 HydrophobicContact CD1-CG 4.48Å; F401-L408 HydrophobicContact CD2-CD1 4.05Å; F401-L408 HydrophobicContact CE1-CB 4.35Å; F401-L408 HydrophobicContact CE1-CD1 3.45Å; F401-L408 VanDerWaalsContact CE1-CD1 3.45Å; F401-L408 HydrophobicContact CE1-CD2 4.3Å; F401-L408 HydrophobicContact CE1-CG 4.24Å; F401-L408 HydrophobicContact CE2-CD1 3.94Å; F401-L408 HydrophobicContact CG-CD1 3.85Å; F401-L408 HydrophobicContact CZ-CD1 3.67Å; L408-T410 HydrophobicContact CD2-CG2 4.07Å; L408-T410 HydrophobicContact CG-CG2 3.94Å; L408-L419 WeakPolarHBondContact O-CA 3.46Å; L408-W420 HydrophobicContact CB-CB 4.24Å; L408-W420 PolarHBondContact N-O 3.43Å; L408-W420 PolarHBondContact O-N 3.37Å; L408-L422 HydrophobicContact CB-CD2 4.11Å; L408-L422 HydrophobicContact CB-CG 4.35Å; L408-L422 HydrophobicContact CD2-CD2 4.24Å
409	A	92.2	Very high	88.9	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135	169.6	0	0	0	0	0	109.5	A400 K418 L419 L442 F444 L451	A400-A409 HydrophobicContact CB-CB 4.39Å; A400-A409 PolarHBondContact N-O 3.47Å; A400-A409 PolarHBondContact O-N 2.93Å; A409-K418 WeakPolarHBondContact CA-O 3.26Å; A409-L419 HydrophobicContact CB-CD2 3.6Å; A409-L442 HydrophobicContact CB-CD1 4.39Å; A409-F444 HydrophobicContact CB-CE2 3.52Å; A409-F444 HydrophobicContact CB-CZ 3.66Å; A409-L451 HydrophobicContact CB-CD1 4.13Å; A409-L451 HydrophobicContact CB-CD2 4.04Å
410	T	92.4	Very high	88.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.8	177.4	60	0	0	0	0	110.3	I375 H392 I399 L408 V417 K418 W420 L442	I375-T410 HydrophobicContact CD1-CG2 3.44Å; I375-T410 VanDerWaalsContact CD1-CG2 3.44Å; I375-T410 WeakPolarHBondContact CD1-OG1 3.15Å; I375-T410 HydrophobicContact CG1-CG2 3.97Å; I375-T410 HydrophobicContact CG2-CG2 4.4Å; H392-T410 PolarHBondContact NE2-OG1 2.99Å; I399-T410 HydrophobicContact CG1-CG2 4.09Å; I399-T410 HydrophobicContact CG2-CG2 4.4Å; L408-T410 HydrophobicContact CD2-CG2 4.07Å; L408-T410 HydrophobicContact CG-CG2 3.94Å; T410-V417 CarbonylContact O-C 3.54Å; T410-V417 VanDerWaalsContact O-CA 3.31Å; T410-V417 WeakPolarHBondContact O-CA 3.29Å; T410-K418 PolarHBondContact N-O 2.85Å; T410-K418 PolarHBondContact O-N 3.1Å; T410-K418 PolarHBondContact OG1-O 3.2Å; T410-W420 PolarHBondContact OG1-NE1 3.36Å; T410-L442 VanDerWaalsContact C-CD1 3.42Å
411	G	90.6	Very high	88.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.1	177.7	0	0	0	0	0	108.5	T397 S398	T397-G411 PolarHBondContact N-O 2.74Å; T397-G411 PolarHBondContact OG1-O 3.07Å; S398-G411 PolarHBondContact N-O 3.22Å; S398-G411 PolarHBondContact O-N 3.35Å
412	A	90.1	Very high	88.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	172.1	176.6	0	0	0	0	0	110.9	H392 P395 D414 S415 S416	H392-A412 HydrophobicContact CB-CB 4.04Å; H392-A412 WeakPolarHBondContact ND1-CB 3.46Å; P395-A412 VanDerWaalsContact O-CA 3.32Å; P395-A412 WeakPolarHBondContact O-CA 3.44Å; P395-A412 WeakPolarHBondContact O-CB 3.43Å; A412-D414 PolarHBondContact O-N 3.06Å; A412-S415 PolarHBondContact O-N 3.44Å; A412-S416 PolarHBondContact N-O 2.98Å
413	Q	87.1	Confident	88.1	Confident	111 Å²	111	33.7 Å²	33.7	52%	0.519	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-8.9	175.8	-160.3	174.8	7.6	0	0	113.2	P395 S415	P395-Q413 PolarHBondContact O-N 3.41Å; Q413-S415 PolarHBondContact O-N 2.84Å
414	D	84.4	Confident	88.1	Confident	45 Å²	45	37.1 Å²	37.1	24%	0.241	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	13.8	173.8	65.5	11.7	0	0	0	114	H392 S393 A412 S416	H392-D414 WeakPolarHBondContact CA-OD2 3.32Å; H392-D414 IonicContact CG-OD2 2.97Å; H392-D414 IonicContact ND1-OD1 3.78Å; H392-D414 PolarHBondContact ND1-OD1 2.98Å; H392-D414 IonicContact ND1-OD2 3.94Å; H392-D414 PolarHBondContact ND1-OD2 3.34Å; S393-D414 PolarHBondContact N-OD2 3.12Å; A412-D414 PolarHBondContact O-N 3.06Å; D414-S416 PolarHBondContact O-N 3.23Å; D414-S416 VanDerWaalsContact O-N 3.09Å; D414-S416 VanDerWaalsContact OD1-CB 3.31Å; D414-S416 WeakPolarHBondContact OD1-CB 3.17Å; D414-S416 PolarHBondContact OD1-N 3.23Å; D414-S416 PolarHBondContact OD1-OG 2.95Å; D414-S416 PolarHBondContact OD2-OG 3.23Å
415	S	85.6	Confident	88.3	Confident	11 Å²	11	38.3 Å²	38.3	8%	0.077	17%	0.173	C	C	.	.	S	Bend	trans	56.5	20.9	-176.9	-50.9	0	0	0	0	113.6	A412 Q413 L433 D434 Y437	A412-S415 PolarHBondContact O-N 3.44Å; Q413-S415 PolarHBondContact O-N 2.84Å; S415-L433 WeakPolarHBondContact O-CB 3.33Å; S415-L433 PolarHBondContact O-N 2.97Å; S415-D434 WeakPolarHBondContact CB-O 3.5Å; S415-Y437 VanDerWaalsContact CA-O 3.3Å; S415-Y437 WeakPolarHBondContact CA-O 3.41Å; S415-Y437 VanDerWaalsContact CB-O 3.27Å; S415-Y437 WeakPolarHBondContact CB-O 3.48Å; S415-Y437 PolarHBondContact OG-N 3.09Å; S415-Y437 PolarHBondContact OG-O 2.83Å
416	S	88.4	Confident	88.4	Confident	7 Å²	7	45 Å²	45	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.8	179.8	81.1	0	0	0	0	111.9	A412 D414 K418 I431	A412-S416 PolarHBondContact N-O 2.98Å; D414-S416 PolarHBondContact O-N 3.23Å; D414-S416 VanDerWaalsContact O-N 3.09Å; D414-S416 VanDerWaalsContact OD1-CB 3.31Å; D414-S416 WeakPolarHBondContact OD1-CB 3.17Å; D414-S416 PolarHBondContact OD1-N 3.23Å; D414-S416 PolarHBondContact OD1-OG 2.95Å; D414-S416 PolarHBondContact OD2-OG 3.23Å; S416-K418 WeakPolarHBondContact OG-CE 3.38Å; S416-I431 WeakPolarHBondContact CA-O 3.17Å
417	V	91.1	Very high	88.5	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	114.7	166	-178.3	0	0	0	0	107.5	T410 I431 L433 V439 L442 L451 V453	T410-V417 CarbonylContact O-C 3.54Å; T410-V417 VanDerWaalsContact O-CA 3.31Å; T410-V417 WeakPolarHBondContact O-CA 3.29Å; V417-I431 HydrophobicContact CB-CB 4.37Å; V417-I431 PolarHBondContact N-O 2.84Å; V417-I431 PolarHBondContact O-N 2.86Å; V417-L433 HydrophobicContact CG2-CD1 4.24Å; V417-V439 HydrophobicContact CG2-CG1 4.46Å; V417-V439 HydrophobicContact CG2-CG2 3.97Å; V417-L442 HydrophobicContact CG1-CD1 4.26Å; V417-L442 HydrophobicContact CG1-CD2 4.14Å; V417-L442 HydrophobicContact CG2-CD2 4.11Å; V417-L451 HydrophobicContact CG1-CD2 4.44Å; V417-V453 HydrophobicContact CG2-CG1 4.08Å; V417-V453 HydrophobicContact CG2-CG2 4.3Å
418	K	91.6	Very high	88.4	Confident	31 Å²	31	44.4 Å²	44.4	14%	0.135	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	139.9	178.6	-70.1	-178.5	-169.4	-105.4	0	109.9	G391 H392 A409 T410 S416 W420 N427 T430	G391-K418 WeakPolarHBondContact O-CE 3.27Å; G391-K418 PolarHBondContact O-NZ 2.94Å; H392-K418 VanDerWaalsContact CE1-CD 3.45Å; H392-K418 WeakPolarHBondContact CE1-CD 3.3Å; A409-K418 WeakPolarHBondContact CA-O 3.26Å; T410-K418 PolarHBondContact N-O 2.85Å; T410-K418 PolarHBondContact O-N 3.1Å; T410-K418 PolarHBondContact OG1-O 3.2Å; S416-K418 WeakPolarHBondContact OG-CE 3.38Å; K418-W420 HydrophobicContact CB-CZ2 4.08Å; K418-W420 HydrophobicContact CD-CZ2 3.93Å; K418-N427 WeakPolarHBondContact CB-ND2 3.1Å; K418-N427 WeakPolarHBondContact CD-ND2 3.46Å; K418-N427 WeakPolarHBondContact CG-ND2 3.41Å; K418-T430 HydrophobicContact CG-CG2 3.97Å
419	L	91.6	Very high	88.1	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	125.7	-179.8	-62.1	162.1	0	0	0	109.4	L408 A409 N427 F428 K429 I431 L451 W466	L408-L419 WeakPolarHBondContact O-CA 3.46Å; A409-L419 HydrophobicContact CB-CD2 3.6Å; L419-N427 WeakPolarHBondContact O-CA 3.13Å; L419-N427 PolarHBondContact O-OD1 2.84Å; L419-F428 HydrophobicContact CB-CD1 4.43Å; L419-F428 HydrophobicContact CB-CE1 3.71Å; L419-F428 HydrophobicContact CB-CE2 4.26Å; L419-F428 HydrophobicContact CB-CZ 3.61Å; L419-F428 HydrophobicContact CD1-CZ 4.37Å; L419-F428 WeakPolarHBondContact O-CD1 3.28Å; L419-F428 PolarHBondContact O-N 3.43Å; L419-F428 VanDerWaalsContact O-N 3.11Å; L419-K429 HydrophobicContact CB-CB 4.27Å; L419-K429 HydrophobicContact CD1-CB 3.95Å; L419-K429 HydrophobicContact CD1-CG 4Å; L419-K429 PolarHBondContact N-O 3.49Å; L419-I431 HydrophobicContact CD1-CD1 4.04Å; L419-L451 HydrophobicContact CD2-CD2 4.2Å; L419-W466 HydrophobicContact CD1-CD2 3.42Å; L419-W466 VanDerWaalsContact CD1-CD2 3.42Å; L419-W466 HydrophobicContact CD1-CE3 3.36Å; L419-W466 HydrophobicContact CD1-CG 4.23Å; L419-W466 HydrophobicContact CD1-CH2 3.5Å; L419-W466 HydrophobicContact CD1-CZ2 3.58Å; L419-W466 HydrophobicContact CD1-CZ3 3.4Å; L419-W466 HydrophobicContact CD2-CE3 4.47Å; L419-W466 HydrophobicContact CD2-CH2 3.46Å; L419-W466 VanDerWaalsContact CD2-CH2 3.46Å; L419-W466 HydrophobicContact CD2-CZ2 4.15Å; L419-W466 HydrophobicContact CD2-CZ3 3.66Å; L419-W466 HydrophobicContact CG-CH2 4.08Å; L419-W466 HydrophobicContact CG-CZ2 4.37Å; L419-W466 HydrophobicContact CG-CZ3 4.17Å
420	W	91.1	Very high	87.9	Confident	10 Å²	10	51.4 Å²	51.4	4%	0.038	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	136.8	-173.7	-51.4	85.8	0	0	0	109.8	I375 F389 P390 Y407 L408 T410 K418 N427	I375-W420 HydrophobicContact CD1-CZ2 4.11Å; F389-W420 HydrophobicContact CB-CD2 4.11Å; F389-W420 HydrophobicContact CB-CE3 3.85Å; F389-W420 HydrophobicContact CB-CH2 3.87Å; F389-W420 HydrophobicContact CB-CZ2 4.1Å; F389-W420 HydrophobicContact CB-CZ3 3.73Å; F389-W420 HydrophobicContact CD1-CD2 4.27Å; F389-W420 AromaticContact CD1-CE3 3.6Å; F389-W420 HydrophobicContact CD1-CE3 3.6Å; F389-W420 AromaticContact CD1-CZ3 3.97Å; F389-W420 HydrophobicContact CD1-CZ3 3.97Å; F389-W420 HydrophobicContact CE1-CE3 4.34Å; F389-W420 HydrophobicContact CG-CD2 4.08Å; F389-W420 AromaticContact CG-CE3 3.8Å; F389-W420 HydrophobicContact CG-CE3 3.8Å; F389-W420 HydrophobicContact CG-CZ3 4.13Å; P390-W420 WeakPolarHBondContact O-CH2 3.24Å; Y407-W420 WeakPolarHBondContact CA-O 3.45Å; L408-W420 HydrophobicContact CB-CB 4.24Å; L408-W420 PolarHBondContact N-O 3.43Å; L408-W420 PolarHBondContact O-N 3.37Å; T410-W420 PolarHBondContact OG1-NE1 3.36Å; K418-W420 HydrophobicContact CB-CZ2 4.08Å; K418-W420 HydrophobicContact CD-CZ2 3.93Å; W420-N427 HydrophobicContact CD2-CB 4.13Å; W420-N427 HydrophobicContact CE3-CB 3.68Å; W420-N427 VanDerWaalsContact CE3-N 3.29Å; W420-N427 HydrophobicContact CH2-CB 3.88Å; W420-N427 HydrophobicContact CZ2-CB 4.32Å; W420-N427 HydrophobicContact CZ3-CB 3.55Å
421	D	89.8	Confident	87.6	Confident	11 Å²	11	52.3 Å²	52.3	6%	0.059	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	113.6	166.8	-172.6	-26.3	0	0	0	108.2	Y406 R423 K424 L425 K426 F428	Y406-D421 WeakPolarHBondContact O-CA 3.44Å; D421-R423 PolarHBondContact O-N 2.98Å; D421-R423 WeakPolarHBondContact OD1-CB 3.45Å; D421-R423 IonicContact OD1-CZ 3.68Å; D421-R423 PolarHBondContact OD1-N 3.46Å; D421-R423 IonicContact OD1-NE 3.82Å; D421-R423 PolarHBondContact OD1-NE 3.25Å; D421-R423 IonicContact OD1-NH2 3.14Å; D421-R423 IonicContact OD2-CZ 3.06Å; D421-R423 IonicContact OD2-NE 2.94Å; D421-R423 IonicContact OD2-NH2 3.98Å; D421-R423 PolarHBondContact OD2-NH2 3.37Å; D421-K424 HydrophobicContact CB-CB 4.45Å; D421-K424 PolarHBondContact O-N 2.94Å; D421-L425 WeakPolarHBondContact O-CA 3.45Å; D421-L425 PolarHBondContact O-N 3.22Å; D421-K426 PolarHBondContact N-O 3.33Å; D421-K426 VanDerWaalsContact N-O 3.08Å; D421-F428 HydrophobicContact CB-CD1 4.14Å
422	L	86	Confident	87.2	Confident	27 Å²	27	57 Å²	57	14%	0.141	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.8	-177.7	-65.4	173.6	0	0	0	112.8	I365 F389 F401 Y406 L408 L425	I365-L422 HydrophobicContact CD1-CD1 4.49Å; F389-L422 HydrophobicContact CE2-CD2 4.03Å; F389-L422 HydrophobicContact CZ-CD2 4Å; F401-L422 HydrophobicContact CD1-CD1 4.05Å; F401-L422 HydrophobicContact CE1-CD1 3.91Å; F401-L422 HydrophobicContact CE1-CD2 4.4Å; Y406-L422 PolarHBondContact O-N 3.06Å; L408-L422 HydrophobicContact CB-CD2 4.11Å; L408-L422 HydrophobicContact CB-CG 4.35Å; L408-L422 HydrophobicContact CD2-CD2 4.24Å; L422-L425 WeakPolarHBondContact O-CD2 3.25Å
423	R	84.9	Confident	86.8	Confident	150 Å²	150	57.6 Å²	57.6	57%	0.566	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-36	178.7	-60.4	171.4	-66.7	-174.6	4.5	112.4	Y406 D421	Y406-R423 VanDerWaalsContact CD1-CD 3.43Å; Y406-R423 HydrophobicContact CD1-CG 3.73Å; Y406-R423 HydrophobicContact CE1-CG 4.26Å; D421-R423 PolarHBondContact O-N 2.98Å; D421-R423 WeakPolarHBondContact OD1-CB 3.45Å; D421-R423 IonicContact OD1-CZ 3.68Å; D421-R423 PolarHBondContact OD1-N 3.46Å; D421-R423 IonicContact OD1-NE 3.82Å; D421-R423 PolarHBondContact OD1-NE 3.25Å; D421-R423 IonicContact OD1-NH2 3.14Å; D421-R423 IonicContact OD2-CZ 3.06Å; D421-R423 IonicContact OD2-NE 2.94Å; D421-R423 IonicContact OD2-NH2 3.98Å; D421-R423 PolarHBondContact OD2-NH2 3.37Å
424	K	83.9	Confident	86.3	Confident	151 Å²	151	57.8 Å²	57.8	66%	0.657	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-11.7	-179.2	-65	-177	-179	178.4	0	112.3	D421 K426	D421-K424 HydrophobicContact CB-CB 4.45Å; D421-K424 PolarHBondContact O-N 2.94Å; K424-K426 WeakPolarHBondContact O-CG 3.38Å; K424-K426 PolarHBondContact O-N 3.45Å
425	L	83.4	Confident	85.3	Confident	91 Å²	91	63.1 Å²	63.1	48%	0.476	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	52	37	-175.3	-61.2	172.3	0	0	0	112.8	A387 F389 D421 L422	A387-L425 HydrophobicContact CB-CD1 4.37Å; A387-L425 HydrophobicContact CB-CD2 3.71Å; F389-L425 HydrophobicContact CE1-CB 3.84Å; F389-L425 HydrophobicContact CE1-CD2 3.62Å; F389-L425 HydrophobicContact CE1-CG 4.36Å; F389-L425 HydrophobicContact CZ-CD2 3.51Å; D421-L425 WeakPolarHBondContact O-CA 3.45Å; D421-L425 PolarHBondContact O-N 3.22Å; L422-L425 WeakPolarHBondContact O-CD2 3.25Å
426	K	84.7	Confident	84.7	Confident	148 Å²	148	69.9 Å²	69.9	64%	0.643	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.9	145.3	-175.7	-75.6	-179.8	-177.8	-171.9	0	111	D421 K424 F428	D421-K426 PolarHBondContact N-O 3.33Å; D421-K426 VanDerWaalsContact N-O 3.08Å; K424-K426 WeakPolarHBondContact O-CG 3.38Å; K424-K426 PolarHBondContact O-N 3.45Å; K426-F428 PolarHBondContact O-N 2.98Å
427	N	86.9	Confident	84.3	Confident	51 Å²	51	69.8 Å²	69.8	27%	0.273	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	123	165.4	-176.6	-37.9	0	0	0	108.2	K418 L419 W420 K429 T430	K418-N427 WeakPolarHBondContact CB-ND2 3.1Å; K418-N427 WeakPolarHBondContact CD-ND2 3.46Å; K418-N427 WeakPolarHBondContact CG-ND2 3.41Å; L419-N427 WeakPolarHBondContact O-CA 3.13Å; L419-N427 PolarHBondContact O-OD1 2.84Å; W420-N427 HydrophobicContact CD2-CB 4.13Å; W420-N427 HydrophobicContact CE3-CB 3.68Å; W420-N427 VanDerWaalsContact CE3-N 3.29Å; W420-N427 HydrophobicContact CH2-CB 3.88Å; W420-N427 HydrophobicContact CZ2-CB 4.32Å; W420-N427 HydrophobicContact CZ3-CB 3.55Å; N427-K429 PolarHBondContact OD1-N 3.22Å; N427-K429 PolarHBondContact OD1-O 3.33Å; N427-K429 VanDerWaalsContact OD1-O 3.05Å; N427-T430 PolarHBondContact ND2-OG1 2.91Å; N427-T430 PolarHBondContact OD1-OG1 3.36Å
428	F	88.3	Confident	84	Confident	89 Å²	89	73.1 Å²	73.1	39%	0.39	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-19.7	176.4	70.6	-91.2	0	0	0	112.5	Y407 L419 D421 K426 W466	Y407-F428 AromaticContact CD1-CE1 3.9Å; Y407-F428 HydrophobicContact CD1-CE1 3.9Å; Y407-F428 HydrophobicContact CD1-CZ 4.23Å; Y407-F428 HydrophobicContact CE1-CE1 4.09Å; Y407-F428 HydrophobicContact CE1-CZ 4.24Å; L419-F428 HydrophobicContact CB-CD1 4.43Å; L419-F428 HydrophobicContact CB-CE1 3.71Å; L419-F428 HydrophobicContact CB-CE2 4.26Å; L419-F428 HydrophobicContact CB-CZ 3.61Å; L419-F428 HydrophobicContact CD1-CZ 4.37Å; L419-F428 WeakPolarHBondContact O-CD1 3.28Å; L419-F428 PolarHBondContact O-N 3.43Å; L419-F428 VanDerWaalsContact O-N 3.11Å; D421-F428 HydrophobicContact CB-CD1 4.14Å; K426-F428 PolarHBondContact O-N 2.98Å; F428-W466 HydrophobicContact CE2-CZ2 4.33Å; F428-W466 AromaticContact CE2-NE1 3.66Å; F428-W466 AromaticContact CZ-CZ2 3.93Å; F428-W466 HydrophobicContact CZ-CZ2 3.93Å
429	K	85.6	Confident	83.7	Confident	92 Å²	92	71.7 Å²	71.7	40%	0.4	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	130.2	-179.4	-174.5	70.4	173.6	-175.8	0	109.9	L419 N427 I431 W466	L419-K429 HydrophobicContact CB-CB 4.27Å; L419-K429 HydrophobicContact CD1-CB 3.95Å; L419-K429 HydrophobicContact CD1-CG 4Å; L419-K429 PolarHBondContact N-O 3.49Å; N427-K429 PolarHBondContact OD1-N 3.22Å; N427-K429 PolarHBondContact OD1-O 3.33Å; N427-K429 VanDerWaalsContact OD1-O 3.05Å; K429-I431 HydrophobicContact CG-CG1 4.38Å; K429-W466 HydrophobicContact CG-CG 4.45Å
430	T	88.8	Confident	83.6	Confident	54 Å²	54	75.3 Å²	75.3	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	128.1	168.2	-59.5	0	0	0	0	107.9	K418 N427	K418-T430 HydrophobicContact CG-CG2 3.97Å; N427-T430 PolarHBondContact ND2-OG1 2.91Å; N427-T430 PolarHBondContact OD1-OG1 3.36Å
431	I	86.6	Confident	83.5	Confident	20 Å²	20	75.4 Å²	75.4	10%	0.103	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	101.2	172.6	-58.7	168.4	0	0	0	105.3	S416 V417 L419 K429 L433 W466	S416-I431 WeakPolarHBondContact CA-O 3.17Å; V417-I431 HydrophobicContact CB-CB 4.37Å; V417-I431 PolarHBondContact N-O 2.84Å; V417-I431 PolarHBondContact O-N 2.86Å; L419-I431 HydrophobicContact CD1-CD1 4.04Å; K429-I431 HydrophobicContact CG-CG1 4.38Å; I431-L433 HydrophobicContact CG2-CD2 4.28Å; I431-W466 HydrophobicContact CD1-CE3 4.21Å
432	S	82.3	Confident	83.6	Confident	98 Å²	98	75.3 Å²	75.3	69%	0.685	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84	117.8	173.4	-63.9	0	0	0	0	108.3
433	L	80.3	Confident	83.8	Confident	13 Å²	13	76 Å²	76	7%	0.068	38%	0.378	C	S	.	.			trans	-88.2	174.4	171.7	-58.8	165.2	0	0	0	108.7	S415 V417 I431 Y437 V439 V453	S415-L433 WeakPolarHBondContact O-CB 3.33Å; S415-L433 PolarHBondContact O-N 2.97Å; V417-L433 HydrophobicContact CG2-CD1 4.24Å; I431-L433 HydrophobicContact CG2-CD2 4.28Å; L433-Y437 HydrophobicContact CB-CD1 4.15Å; L433-Y437 HydrophobicContact CB-CG 3.95Å; L433-Y437 HydrophobicContact CD1-CD1 3.35Å; L433-Y437 HydrophobicContact CD1-CE1 3.51Å; L433-Y437 HydrophobicContact CD1-CG 3.98Å; L433-Y437 HydrophobicContact CG-CD1 4.34Å; L433-V439 HydrophobicContact CD1-CG2 4.06Å; L433-V453 HydrophobicContact CD1-CG1 4.38Å
434	D	76.9	Confident	84.1	Confident	114 Å²	114	69.7 Å²	69.7	61%	0.61	35%	0.354	S	S	*	.			trans	-56.8	148.1	179.9	-62.4	-48.8	0	0	0	111.4	S415 N436 Y437 R459	S415-D434 WeakPolarHBondContact CB-O 3.5Å; D434-N436 PolarHBondContact O-N 3.24Å; D434-Y437 VanDerWaalsContact O-CB 3.26Å; D434-Y437 WeakPolarHBondContact O-CB 3.46Å; D434-Y437 PolarHBondContact O-N 3.27Å; D434-R459 IonicContact OD2-NH2 3.65Å
435	N	64.6	Low	84.2	Confident	157 Å²	157	62.6 Å²	62.6	84%	0.84	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-9.6	-168.3	-68.2	-20.3	0	0	0	116.2
436	N	72.8	Confident	84	Confident	153 Å²	153	62.6 Å²	62.6	82%	0.818	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	14.5	178.5	-67.8	-22.3	0	0	0	112.8	D434 E438	D434-N436 PolarHBondContact O-N 3.24Å; N436-E438 PolarHBondContact O-N 2.75Å
437	Y	80.1	Confident	83.8	Confident	6 Å²	6	57.2 Å²	57.2	2%	0.024	30%	0.302	C	S	.	.			trans	-87.4	109.8	-175.1	-165.3	-83.3	0	0	0	111.6	S415 L433 D434 V439 V453 D457	S415-Y437 VanDerWaalsContact CA-O 3.3Å; S415-Y437 WeakPolarHBondContact CA-O 3.41Å; S415-Y437 VanDerWaalsContact CB-O 3.27Å; S415-Y437 WeakPolarHBondContact CB-O 3.48Å; S415-Y437 PolarHBondContact OG-N 3.09Å; S415-Y437 PolarHBondContact OG-O 2.83Å; L433-Y437 HydrophobicContact CB-CD1 4.15Å; L433-Y437 HydrophobicContact CB-CG 3.95Å; L433-Y437 HydrophobicContact CD1-CD1 3.35Å; L433-Y437 HydrophobicContact CD1-CE1 3.51Å; L433-Y437 HydrophobicContact CD1-CG 3.98Å; L433-Y437 HydrophobicContact CG-CD1 4.34Å; D434-Y437 VanDerWaalsContact O-CB 3.26Å; D434-Y437 WeakPolarHBondContact O-CB 3.46Å; D434-Y437 PolarHBondContact O-N 3.27Å; Y437-V439 HydrophobicContact CD1-CG2 3.89Å; Y437-V439 HydrophobicContact CE1-CG2 3.99Å; Y437-V439 PolarHBondContact O-N 3.39Å; Y437-V453 HydrophobicContact CE1-CG1 4.26Å; Y437-D457 HydrophobicContact CE2-CB 4.03Å; Y437-D457 PolarHBondContact OH-N 2.92Å; Y437-D457 PolarHBondContact OH-O 3.36Å
438	E	83.1	Confident	83.6	Confident	70 Å²	70	55.2 Å²	55.2	33%	0.327	29%	0.294	S	S	.	.			trans	-86.4	111	175.1	-66.4	-167.9	-177.5	0	0	111.2	N436 K440 G455 L478	N436-E438 PolarHBondContact O-N 2.75Å; E438-K440 PolarHBondContact O-N 3.48Å; E438-K440 WeakPolarHBondContact OE2-CE 3.47Å; E438-K440 IonicContact OE2-NZ 4Å; E438-K440 PolarHBondContact OE2-NZ 3.06Å; E438-G455 CarbonylContact O-C 3.6Å; E438-G455 WeakPolarHBondContact O-CA 2.9Å; E438-L478 HydrophobicContact CB-CD2 4.39Å
439	V	87.3	Confident	83.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.284	C	S	.	.			trans	-77.2	122.6	170.7	-175.2	0	0	0	0	109.1	T397 V417 L433 Y437 L442 V453	T397-V439 VanDerWaalsContact CB-O 3.29Å; T397-V439 WeakPolarHBondContact CB-O 3.39Å; T397-V439 PolarHBondContact OG1-O 3.11Å; V417-V439 HydrophobicContact CG2-CG1 4.46Å; V417-V439 HydrophobicContact CG2-CG2 3.97Å; L433-V439 HydrophobicContact CD1-CG2 4.06Å; Y437-V439 HydrophobicContact CD1-CG2 3.89Å; Y437-V439 HydrophobicContact CE1-CG2 3.99Å; Y437-V439 PolarHBondContact O-N 3.39Å; V439-L442 HydrophobicContact CG1-CD1 4.47Å; V439-L442 HydrophobicContact CG1-CD2 4.03Å; V439-L442 HydrophobicContact CG1-CG 4Å; V439-V453 HydrophobicContact CG1-CG1 4.02Å; V439-V453 HydrophobicContact CG2-CG1 4.31Å
440	K	88.4	Confident	83.6	Confident	76 Å²	76	48.4 Å²	48.4	33%	0.33	27%	0.266	S	S	.	.			trans	-109.6	-39.3	176.7	-64.2	-61.8	-176.7	-165.6	0	112.8	E438 G454 V479	E438-K440 PolarHBondContact O-N 3.48Å; E438-K440 WeakPolarHBondContact OE2-CE 3.47Å; E438-K440 IonicContact OE2-NZ 4Å; E438-K440 PolarHBondContact OE2-NZ 3.06Å; K440-G454 PolarHBondContact N-O 3.45Å; K440-V479 WeakPolarHBondContact CB-O 3.4Å
441	S	88.1	Confident	83.7	Confident	13 Å²	13	45.9 Å²	45.9	9%	0.091	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	139.8	-177.1	63.7	0	0	0	0	111.8	G454 V482	S441-G454 PolarHBondContact N-O 3.4Å; S441-G454 PolarHBondContact O-N 2.97Å; S441-V482 PolarHBondContact OG-N 3.34Å
442	L	91.9	Very high	83.9	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.047	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	131.9	172.5	-69	173.7	0	0	0	108.3	S398 A400 A409 T410 V417 V439 A452 V453	S398-L442 WeakPolarHBondContact OG-CG 3.33Å; A400-L442 HydrophobicContact CB-CB 3.82Å; A400-L442 WeakPolarHBondContact CB-O 3.16Å; A409-L442 HydrophobicContact CB-CD1 4.39Å; T410-L442 VanDerWaalsContact C-CD1 3.42Å; V417-L442 HydrophobicContact CG1-CD1 4.26Å; V417-L442 HydrophobicContact CG1-CD2 4.14Å; V417-L442 HydrophobicContact CG2-CD2 4.11Å; V439-L442 HydrophobicContact CG1-CD1 4.47Å; V439-L442 HydrophobicContact CG1-CD2 4.03Å; V439-L442 HydrophobicContact CG1-CG 4Å; L442-A452 WeakPolarHBondContact CA-O 3.39Å; L442-V453 HydrophobicContact CD2-CB 4Å; L442-V453 HydrophobicContact CD2-CG1 3.83Å; L442-V453 HydrophobicContact CD2-CG2 3.59Å
443	V	91.6	Very high	84.3	Confident	41 Å²	41	40.2 Å²	40.2	25%	0.248	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	131.7	177.3	175.1	0	0	0	0	110	A452 V482 F484	V443-A452 PolarHBondContact N-O 3.2Å; V443-A452 VanDerWaalsContact N-O 3.09Å; V443-A452 PolarHBondContact O-N 3.45Å; V443-V482 WeakPolarHBondContact CG2-O 3.46Å; V443-F484 HydrophobicContact CG1-CD2 4.18Å
444	F	90.8	Very high	84.7	Confident	18 Å²	18	39.6 Å²	39.6	8%	0.079	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	147.6	167.4	-77.3	-80.1	0	0	0	110.3	A400 F401 A409 L451 C463 W466	A400-F444 HydrophobicContact CB-CD2 3.67Å; A400-F444 HydrophobicContact CB-CE2 3.9Å; A400-F444 VanDerWaalsContact O-CE2 3.28Å; A400-F444 WeakPolarHBondContact O-CE2 3.38Å; F401-F444 VanDerWaalsContact C-CD2 3.47Å; F401-F444 WeakPolarHBondContact O-CD2 3.49Å; A409-F444 HydrophobicContact CB-CE2 3.52Å; A409-F444 HydrophobicContact CB-CZ 3.66Å; F444-L451 HydrophobicContact CD1-CB 4.07Å; F444-L451 HydrophobicContact CD1-CD1 4.01Å; F444-L451 HydrophobicContact CD2-CD1 4.05Å; F444-L451 HydrophobicContact CE1-CB 3.89Å; F444-L451 HydrophobicContact CE1-CD1 3.89Å; F444-L451 HydrophobicContact CE1-CD2 4.44Å; F444-L451 HydrophobicContact CE1-CG 4.29Å; F444-L451 HydrophobicContact CE2-CD1 3.93Å; F444-L451 HydrophobicContact CG-CD1 4.1Å; F444-L451 HydrophobicContact CZ-CD1 3.85Å; F444-L451 HydrophobicContact CZ-CD2 4.36Å; F444-L451 HydrophobicContact CZ-CG 4.49Å; F444-C463 VanDerWaalsContact CE1-SG 3.55Å; F444-W466 HydrophobicContact CE1-CH2 4.33Å
445	D	86.4	Confident	85.2	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.181	C	C	.	.			trans	-64.8	155.3	165.2	167.5	35	0	0	0	111	L199 S447 G448 Y450 F484	L199-D445 VanDerWaalsContact CD1-OD2 3.28Å; L199-D445 WeakPolarHBondContact CD1-OD2 3.43Å; D445-S447 PolarHBondContact O-N 3.47Å; D445-S447 VanDerWaalsContact O-N 3.11Å; D445-S447 PolarHBondContact OD1-N 3.01Å; D445-S447 VanDerWaalsContact OD2-CB 3.31Å; D445-S447 WeakPolarHBondContact OD2-CB 3.45Å; D445-S447 PolarHBondContact OD2-N 2.67Å; D445-S447 PolarHBondContact OD2-OG 3.43Å; D445-G448 WeakPolarHBondContact O-CA 3.36Å; D445-G448 PolarHBondContact O-N 2.94Å; D445-Y450 HydrophobicContact CB-CD2 4.45Å; D445-Y450 PolarHBondContact N-O 2.88Å; D445-F484 HydrophobicContact CB-CD2 4.1Å; D445-F484 HydrophobicContact CB-CE2 4.31Å; D445-F484 HydrophobicContact CB-CG 4.31Å
446	Q	79.8	Confident	86.3	Confident	92 Å²	92	28.6 Å²	28.6	43%	0.43	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-28.9	173.4	-61.3	-176.9	5.8	0	0	113	E403	E403-Q446 WeakPolarHBondContact CB-O 3.32Å; E403-Q446 WeakPolarHBondContact CG-O 3.39Å
447	S	79.8	Confident	87	Confident	34 Å²	34	23 Å²	23	24%	0.238	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-15.7	175.6	79.3	0	0	0	0	113.9	L199 D445 T449	L199-S447 WeakPolarHBondContact CD2-OG 3.35Å; D445-S447 PolarHBondContact O-N 3.47Å; D445-S447 VanDerWaalsContact O-N 3.11Å; D445-S447 PolarHBondContact OD1-N 3.01Å; D445-S447 VanDerWaalsContact OD2-CB 3.31Å; D445-S447 WeakPolarHBondContact OD2-CB 3.45Å; D445-S447 PolarHBondContact OD2-N 2.67Å; D445-S447 PolarHBondContact OD2-OG 3.43Å; S447-T449 PolarHBondContact O-N 2.83Å; S447-T449 VanDerWaalsContact OG-CB 3.23Å; S447-T449 WeakPolarHBondContact OG-CB 3.38Å; S447-T449 PolarHBondContact OG-N 2.93Å; S447-T449 VanDerWaalsContact OG-N 3.14Å; S447-T449 PolarHBondContact OG-OG1 3.36Å
448	G	81.4	Confident	87.4	Confident	10 Å²	10	22.7 Å²	22.7	10%	0.103	12%	0.123	C	C	.	.	S	Bend	trans	69.3	11	-170.5	0	0	0	0	0	114.4	D445 C463	D445-G448 WeakPolarHBondContact O-CA 3.36Å; D445-G448 PolarHBondContact O-N 2.94Å; G448-C463 PolarHBondContact O-SG 3.05Å
449	T	85.2	Confident	87.8	Confident	29 Å²	29	20.7 Å²	20.7	18%	0.178	11%	0.112	C	C	.	.	S	Bend	trans	-82.6	-35.3	-179.5	-53.5	0	0	0	0	112.3	L199 S447 C463	L199-T449 HydrophobicContact CD2-CG2 4.42Å; S447-T449 PolarHBondContact O-N 2.83Å; S447-T449 VanDerWaalsContact OG-CB 3.23Å; S447-T449 WeakPolarHBondContact OG-CB 3.38Å; S447-T449 PolarHBondContact OG-N 2.93Å; S447-T449 VanDerWaalsContact OG-N 3.14Å; S447-T449 PolarHBondContact OG-OG1 3.36Å; T449-C463 WeakPolarHBondContact O-CB 3.29Å; T449-C463 PolarHBondContact O-N 3.27Å; T449-C463 PolarHBondContact O-SG 2.94Å
450	Y	89.5	Confident	87.9	Confident	9 Å²	9	20.7 Å²	20.7	4%	0.035	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	144.5	-177.5	-55.6	-70.8	0	0	0	111.4	L199 V200 A202 L205 D445 V460 Y461 I462 A488	L199-Y450 HydrophobicContact CD1-CE2 4.14Å; L199-Y450 HydrophobicContact CD2-CE2 4.03Å; L199-Y450 HydrophobicContact CG-CE2 4.12Å; V200-Y450 PolarHBondContact O-OH 2.92Å; A202-Y450 HydrophobicContact CB-CE1 4.36Å; A202-Y450 PolarHBondContact N-OH 3.01Å; A202-Y450 VanDerWaalsContact N-OH 3.09Å; L205-Y450 HydrophobicContact CD1-CD2 4.49Å; L205-Y450 HydrophobicContact CD1-CE2 4.32Å; L205-Y450 HydrophobicContact CD2-CD1 4.39Å; L205-Y450 HydrophobicContact CD2-CE1 4.39Å; D445-Y450 HydrophobicContact CB-CD2 4.45Å; D445-Y450 PolarHBondContact N-O 2.88Å; Y450-V460 HydrophobicContact CD1-CG1 4.43Å; Y450-Y461 CarbonylContact C-O 3.57Å; Y450-Y461 WeakPolarHBondContact CA-O 3.47Å; Y450-I462 HydrophobicContact CD1-CG1 4.05Å; Y450-I462 HydrophobicContact CE1-CG1 3.87Å; Y450-A488 HydrophobicContact CD2-CB 4.31Å
451	L	91.5	Very high	88	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	121	171.6	174	65.7	0	0	0	108.3	A409 V417 L419 F444 V453 V460 Y461 W466	A409-L451 HydrophobicContact CB-CD1 4.13Å; A409-L451 HydrophobicContact CB-CD2 4.04Å; V417-L451 HydrophobicContact CG1-CD2 4.44Å; L419-L451 HydrophobicContact CD2-CD2 4.2Å; F444-L451 HydrophobicContact CD1-CB 4.07Å; F444-L451 HydrophobicContact CD1-CD1 4.01Å; F444-L451 HydrophobicContact CD2-CD1 4.05Å; F444-L451 HydrophobicContact CE1-CB 3.89Å; F444-L451 HydrophobicContact CE1-CD1 3.89Å; F444-L451 HydrophobicContact CE1-CD2 4.44Å; F444-L451 HydrophobicContact CE1-CG 4.29Å; F444-L451 HydrophobicContact CE2-CD1 3.93Å; F444-L451 HydrophobicContact CG-CD1 4.1Å; F444-L451 HydrophobicContact CZ-CD1 3.85Å; F444-L451 HydrophobicContact CZ-CD2 4.36Å; F444-L451 HydrophobicContact CZ-CG 4.49Å; L451-V453 HydrophobicContact CG-CG2 4.41Å; L451-V460 CarbonylContact O-C 3.57Å; L451-V460 WeakPolarHBondContact O-CA 3.41Å; L451-Y461 PolarHBondContact N-O 3.48Å; L451-Y461 PolarHBondContact O-N 3Å; L451-W466 HydrophobicContact CB-CZ3 4.35Å; L451-W466 HydrophobicContact CD2-CZ3 3.81Å
452	A	91	Very high	88.1	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	136.5	170	0	0	0	0	0	110.5	L442 V443 R459 V460 V482 F484 L491	L442-A452 WeakPolarHBondContact CA-O 3.39Å; V443-A452 PolarHBondContact N-O 3.2Å; V443-A452 VanDerWaalsContact N-O 3.09Å; V443-A452 PolarHBondContact O-N 3.45Å; A452-R459 CarbonylContact C-O 3.59Å; A452-R459 WeakPolarHBondContact CA-O 3.02Å; A452-V460 HydrophobicContact CB-CG2 4.36Å; A452-V482 HydrophobicContact CB-CG1 3.71Å; A452-F484 HydrophobicContact CB-CD2 4.37Å; A452-F484 HydrophobicContact CB-CE2 3.42Å; A452-F484 VanDerWaalsContact CB-CE2 3.42Å; A452-F484 HydrophobicContact CB-CZ 3.56Å; A452-L491 HydrophobicContact CB-CD1 4.32Å
453	V	90.9	Very high	87.7	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	115.7	175	-175	0	0	0	0	107.7	V417 L433 Y437 V439 L442 L451 I458 R459 Y461	V417-V453 HydrophobicContact CG2-CG1 4.08Å; V417-V453 HydrophobicContact CG2-CG2 4.3Å; L433-V453 HydrophobicContact CD1-CG1 4.38Å; Y437-V453 HydrophobicContact CE1-CG1 4.26Å; V439-V453 HydrophobicContact CG1-CG1 4.02Å; V439-V453 HydrophobicContact CG2-CG1 4.31Å; L442-V453 HydrophobicContact CD2-CB 4Å; L442-V453 HydrophobicContact CD2-CG1 3.83Å; L442-V453 HydrophobicContact CD2-CG2 3.59Å; L451-V453 HydrophobicContact CG-CG2 4.41Å; V453-I458 WeakPolarHBondContact O-CA 3.45Å; V453-R459 PolarHBondContact N-O 3.43Å; V453-R459 PolarHBondContact O-N 2.9Å; V453-Y461 HydrophobicContact CB-CE2 4.45Å; V453-Y461 HydrophobicContact CG2-CD2 3.84Å; V453-Y461 HydrophobicContact CG2-CE2 3.76Å
454	G	88.6	Confident	87.1	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	126.7	172.5	0	0	0	0	0	110.6	K440 S441	K440-G454 PolarHBondContact N-O 3.45Å; S441-G454 PolarHBondContact N-O 3.4Å; S441-G454 PolarHBondContact O-N 2.97Å
455	G	86.9	Confident	86.7	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-160.4	-122	179.2	0	0	0	0	0	111.2	E438 D457 V479	E438-G455 CarbonylContact O-C 3.6Å; E438-G455 WeakPolarHBondContact O-CA 2.9Å; G455-D457 VanDerWaalsContact C-N 3.27Å; G455-D457 PolarHBondContact N-O 3.39Å; G455-V479 WeakPolarHBondContact O-CB 3.43Å; G455-V479 PolarHBondContact O-N 2.96Å
456	S	86.9	Confident	86.5	Confident	40 Å²	40	32.5 Å²	32.5	28%	0.28	16%	0.162	S	C	.	.	S	Bend	trans	-63.6	-38.6	168	-54.7	0	0	0	0	111.6
457	D	88.1	Confident	86.8	Confident	35 Å²	35	30.2 Å²	30.2	19%	0.187	16%	0.156	C	C	.	.	S	Bend	trans	-121.5	-179.9	176.1	-53.8	-31.9	0	0	0	110	Y437 G455 R459 N471 T473	Y437-D457 HydrophobicContact CE2-CB 4.03Å; Y437-D457 PolarHBondContact OH-N 2.92Å; Y437-D457 PolarHBondContact OH-O 3.36Å; G455-D457 VanDerWaalsContact C-N 3.27Å; G455-D457 PolarHBondContact N-O 3.39Å; D457-R459 IonicContact OD2-NH2 3.45Å; D457-N471 WeakPolarHBondContact CB-OD1 3.29Å; D457-T473 HydrophobicContact CB-CG2 4.46Å
458	I	89.2	Confident	87.1	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	114.7	168.2	-53.5	167.2	0	0	0	107.8	V453 N471 F472 V479 V482 L491 S493 Y503	V453-I458 WeakPolarHBondContact O-CA 3.45Å; I458-N471 CarbonylContact O-C 3.52Å; I458-N471 WeakPolarHBondContact O-CA 3.15Å; I458-F472 HydrophobicContact CB-CB 4.2Å; I458-F472 HydrophobicContact CB-CD2 4.48Å; I458-F472 HydrophobicContact CD1-CB 4.46Å; I458-F472 PolarHBondContact N-O 3.23Å; I458-F472 PolarHBondContact O-N 2.92Å; I458-V479 HydrophobicContact CD1-CG1 4.37Å; I458-V479 HydrophobicContact CD1-CG2 4.31Å; I458-V479 HydrophobicContact CG1-CB 4.37Å; I458-V479 HydrophobicContact CG1-CG1 4.06Å; I458-V479 HydrophobicContact CG1-CG2 3.86Å; I458-V482 HydrophobicContact CG2-CG1 4.49Å; I458-V482 HydrophobicContact CG2-CG2 4.45Å; I458-L491 HydrophobicContact CG2-CD2 3.84Å; I458-S493 WeakPolarHBondContact CD1-OG 3.21Å; I458-Y503 HydrophobicContact CD1-CE2 3.83Å
459	R	90.2	Very high	87.3	Confident	27 Å²	27	33.9 Å²	33.9	10%	0.102	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	137	176.8	-60.5	-173.5	-172.1	-168.7	7.3	110.8	D434 A452 V453 D457 Y461 E468 L470	D434-R459 IonicContact OD2-NH2 3.65Å; A452-R459 CarbonylContact C-O 3.59Å; A452-R459 WeakPolarHBondContact CA-O 3.02Å; V453-R459 PolarHBondContact N-O 3.43Å; V453-R459 PolarHBondContact O-N 2.9Å; D457-R459 IonicContact OD2-NH2 3.45Å; R459-Y461 HydrophobicContact CB-CE2 3.73Å; R459-Y461 VanDerWaalsContact CD-OH 3.31Å; R459-Y461 WeakPolarHBondContact CD-OH 3.43Å; R459-E468 IonicContact NH1-OE2 3.56Å; R459-L470 VanDerWaalsContact CA-O 3.32Å; R459-L470 WeakPolarHBondContact CA-O 3.37Å
460	V	90.6	Very high	87.2	Confident	1 Å²	1	33.1 Å²	33.1	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127	174.3	-173.2	0	0	0	0	110.4	L205 Y450 L451 A452 V469 L470 F484 L491	L205-V460 HydrophobicContact CD2-CB 4.19Å; L205-V460 HydrophobicContact CD2-CG1 3.77Å; Y450-V460 HydrophobicContact CD1-CG1 4.43Å; L451-V460 CarbonylContact O-C 3.57Å; L451-V460 WeakPolarHBondContact O-CA 3.41Å; A452-V460 HydrophobicContact CB-CG2 4.36Å; V460-V469 PolarHBondContact O-N 2.89Å; V460-L470 HydrophobicContact CB-CB 4.14Å; V460-L470 HydrophobicContact CB-CD1 4.48Å; V460-L470 HydrophobicContact CG2-CB 4.26Å; V460-L470 HydrophobicContact CG2-CD1 4.26Å; V460-L470 PolarHBondContact N-O 3.33Å; V460-F484 HydrophobicContact CG1-CZ 4.03Å; V460-L491 HydrophobicContact CG2-CD2 4.13Å
461	Y	89.9	Confident	87.1	Confident	9 Å²	9	36 Å²	36	4%	0.035	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	144.6	-179	-65	-82.6	0	0	0	111.6	Y450 L451 V453 R459 S467 E468	Y450-Y461 CarbonylContact C-O 3.57Å; Y450-Y461 WeakPolarHBondContact CA-O 3.47Å; L451-Y461 PolarHBondContact N-O 3.48Å; L451-Y461 PolarHBondContact O-N 3Å; V453-Y461 HydrophobicContact CB-CE2 4.45Å; V453-Y461 HydrophobicContact CG2-CD2 3.84Å; V453-Y461 HydrophobicContact CG2-CE2 3.76Å; R459-Y461 HydrophobicContact CB-CE2 3.73Å; R459-Y461 VanDerWaalsContact CD-OH 3.31Å; R459-Y461 WeakPolarHBondContact CD-OH 3.43Å; Y461-S467 WeakPolarHBondContact CA-O 3.44Å; Y461-E468 HydrophobicContact CD1-CB 4.13Å; Y461-E468 HydrophobicContact CE1-CB 3.7Å; Y461-E468 HydrophobicContact CE1-CG 4.06Å; Y461-E468 PolarHBondContact OH-OE2 3.33Å
462	I	89.4	Confident	86.8	Confident	25 Å²	25	37 Å²	37	13%	0.128	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.9	168.9	-65.1	164.7	0	0	0	109.3	A202 Y450 K464 Q465 W466 S467 V469	A202-I462 HydrophobicContact CB-CD1 3.67Å; A202-I462 HydrophobicContact CB-CG1 4.47Å; Y450-I462 HydrophobicContact CD1-CG1 4.05Å; Y450-I462 HydrophobicContact CE1-CG1 3.87Å; I462-K464 HydrophobicContact CG2-CB 4.19Å; I462-K464 PolarHBondContact O-N 2.94Å; I462-K464 VanDerWaalsContact O-N 3.15Å; I462-Q465 PolarHBondContact O-N 3.27Å; I462-W466 WeakPolarHBondContact O-CA 2.91Å; I462-W466 PolarHBondContact O-N 2.91Å; I462-S467 PolarHBondContact N-O 2.88Å; I462-S467 VanDerWaalsContact N-O 3.08Å; I462-V469 HydrophobicContact CD1-CG2 3.33Å; I462-V469 HydrophobicContact CG1-CG2 3.39Å
463	C	83.3	Confident	86.4	Confident	11 Å²	11	41.4 Å²	41.4	7%	0.074	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-19.6	-174.6	-58.8	0	0	0	0	114.4	F444 G448 T449 W466	F444-C463 VanDerWaalsContact CE1-SG 3.55Å; G448-C463 PolarHBondContact O-SG 3.05Å; T449-C463 WeakPolarHBondContact O-CB 3.29Å; T449-C463 PolarHBondContact O-N 3.27Å; T449-C463 PolarHBondContact O-SG 2.94Å; C463-W466 HydrophobicContact CB-CH2 3.82Å; C463-W466 HydrophobicContact CB-CZ2 4Å; C463-W466 HydrophobicContact CB-CZ3 4.22Å; C463-W466 WeakPolarHBondContact O-CZ2 3.42Å; C463-W466 PolarHBondContact O-NE1 3.35Å
464	K	79.8	Confident	85.8	Confident	174 Å²	174	44.3 Å²	44.3	76%	0.757	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-43.9	177	-73.1	-173.5	179.5	177.9	0	112.9	I462	I462-K464 HydrophobicContact CG2-CB 4.19Å; I462-K464 PolarHBondContact O-N 2.94Å; I462-K464 VanDerWaalsContact O-N 3.15Å
465	Q	82.4	Confident	85.4	Confident	152 Å²	152	45.1 Å²	45.1	71%	0.71	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-15.5	-173.4	-67.3	174.7	-3	0	0	112.4	I462 S467	I462-Q465 PolarHBondContact O-N 3.27Å; Q465-S467 PolarHBondContact O-N 3.47Å
466	W	83.1	Confident	85	Confident	35 Å²	35	51.4 Å²	51.4	13%	0.133	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.1	35	-170.4	-56	99.4	0	0	0	112.7	L419 F428 K429 I431 F444 L451 I462 C463	L419-W466 HydrophobicContact CD1-CD2 3.42Å; L419-W466 VanDerWaalsContact CD1-CD2 3.42Å; L419-W466 HydrophobicContact CD1-CE3 3.36Å; L419-W466 HydrophobicContact CD1-CG 4.23Å; L419-W466 HydrophobicContact CD1-CH2 3.5Å; L419-W466 HydrophobicContact CD1-CZ2 3.58Å; L419-W466 HydrophobicContact CD1-CZ3 3.4Å; L419-W466 HydrophobicContact CD2-CE3 4.47Å; L419-W466 HydrophobicContact CD2-CH2 3.46Å; L419-W466 VanDerWaalsContact CD2-CH2 3.46Å; L419-W466 HydrophobicContact CD2-CZ2 4.15Å; L419-W466 HydrophobicContact CD2-CZ3 3.66Å; L419-W466 HydrophobicContact CG-CH2 4.08Å; L419-W466 HydrophobicContact CG-CZ2 4.37Å; L419-W466 HydrophobicContact CG-CZ3 4.17Å; F428-W466 HydrophobicContact CE2-CZ2 4.33Å; F428-W466 AromaticContact CE2-NE1 3.66Å; F428-W466 AromaticContact CZ-CZ2 3.93Å; F428-W466 HydrophobicContact CZ-CZ2 3.93Å; K429-W466 HydrophobicContact CG-CG 4.45Å; I431-W466 HydrophobicContact CD1-CE3 4.21Å; F444-W466 HydrophobicContact CE1-CH2 4.33Å; L451-W466 HydrophobicContact CB-CZ3 4.35Å; L451-W466 HydrophobicContact CD2-CZ3 3.81Å; I462-W466 WeakPolarHBondContact O-CA 2.91Å; I462-W466 PolarHBondContact O-N 2.91Å; C463-W466 HydrophobicContact CB-CH2 3.82Å; C463-W466 HydrophobicContact CB-CZ2 4Å; C463-W466 HydrophobicContact CB-CZ3 4.22Å; C463-W466 WeakPolarHBondContact O-CZ2 3.42Å; C463-W466 PolarHBondContact O-NE1 3.35Å
467	S	84.8	Confident	84.7	Confident	43 Å²	43	50.7 Å²	50.7	30%	0.301	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	143.1	171.9	48.5	0	0	0	0	110.4	Y461 I462 Q465	Y461-S467 WeakPolarHBondContact CA-O 3.44Å; I462-S467 PolarHBondContact N-O 2.88Å; I462-S467 VanDerWaalsContact N-O 3.08Å; Q465-S467 PolarHBondContact O-N 3.47Å
468	E	86.6	Confident	84.6	Confident	87 Å²	87	51.5 Å²	51.5	41%	0.407	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	128.2	173.6	-167	170.3	142	0	0	109.3	R459 Y461 N471	R459-E468 IonicContact NH1-OE2 3.56Å; Y461-E468 HydrophobicContact CD1-CB 4.13Å; Y461-E468 HydrophobicContact CE1-CB 3.7Å; Y461-E468 HydrophobicContact CE1-CG 4.06Å; Y461-E468 PolarHBondContact OH-OE2 3.33Å; E468-N471 WeakPolarHBondContact OE1-CB 3.14Å
469	V	85.6	Confident	84.6	Confident	35 Å²	35	51.6 Å²	51.6	21%	0.212	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-39.2	179.8	-176.7	0	0	0	0	111.4	A202 L205 V460 I462	A202-V469 WeakPolarHBondContact O-CG1 3.5Å; L205-V469 HydrophobicContact CB-CG1 4.5Å; L205-V469 HydrophobicContact CD2-CB 4.33Å; L205-V469 HydrophobicContact CD2-CG1 3.99Å; V460-V469 PolarHBondContact O-N 2.89Å; I462-V469 HydrophobicContact CD1-CG2 3.33Å; I462-V469 HydrophobicContact CG1-CG2 3.39Å
470	L	83.2	Confident	84.4	Confident	12 Å²	12	51.1 Å²	51.1	6%	0.063	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	140.9	-174.8	-76.8	173.4	0	0	0	109.9	L205 Y208 R459 V460 F472	L205-L470 HydrophobicContact CD2-CD1 3.48Å; L205-L470 VanDerWaalsContact CD2-CD1 3.48Å; L205-L470 HydrophobicContact CD2-CG 4.07Å; L205-L470 HydrophobicContact CG-CD1 3.76Å; L205-L470 VanDerWaalsContact O-CD1 3.24Å; L205-L470 WeakPolarHBondContact O-CD1 3.48Å; L205-L470 WeakPolarHBondContact O-CD2 3.16Å; Y208-L470 HydrophobicContact CD2-CD1 4.46Å; R459-L470 VanDerWaalsContact CA-O 3.32Å; R459-L470 WeakPolarHBondContact CA-O 3.37Å; V460-L470 HydrophobicContact CB-CB 4.14Å; V460-L470 HydrophobicContact CB-CD1 4.48Å; V460-L470 HydrophobicContact CG2-CB 4.26Å; V460-L470 HydrophobicContact CG2-CD1 4.26Å; V460-L470 PolarHBondContact N-O 3.33Å; L470-F472 HydrophobicContact CB-CE2 4.36Å; L470-F472 HydrophobicContact CD1-CE2 3.9Å; L470-F472 HydrophobicContact CD1-CZ 4.21Å; L470-F472 HydrophobicContact CD2-CE2 4.28Å; L470-F472 HydrophobicContact CD2-CZ 3.93Å; L470-F472 HydrophobicContact CG-CE2 4.45Å
471	N	88.2	Confident	84.3	Confident	70 Å²	70	51.3 Å²	51.3	37%	0.374	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	117	166.6	-172.4	8.3	0	0	0	109	D457 I458 E468	D457-N471 WeakPolarHBondContact CB-OD1 3.29Å; I458-N471 CarbonylContact O-C 3.52Å; I458-N471 WeakPolarHBondContact O-CA 3.15Å; E468-N471 WeakPolarHBondContact OE1-CB 3.14Å
472	F	84.2	Confident	84.3	Confident	21 Å²	21	51 Å²	51	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	129.3	172.2	-62.3	-68.1	0	0	0	110.3	Y208 I458 L470 Y503	Y208-F472 WeakPolarHBondContact O-CE1 3.28Å; Y208-F472 WeakPolarHBondContact O-CZ 3.27Å; I458-F472 HydrophobicContact CB-CB 4.2Å; I458-F472 HydrophobicContact CB-CD2 4.48Å; I458-F472 HydrophobicContact CD1-CB 4.46Å; I458-F472 PolarHBondContact N-O 3.23Å; I458-F472 PolarHBondContact O-N 2.92Å; L470-F472 HydrophobicContact CB-CE2 4.36Å; L470-F472 HydrophobicContact CD1-CE2 3.9Å; L470-F472 HydrophobicContact CD1-CZ 4.21Å; L470-F472 HydrophobicContact CD2-CE2 4.28Å; L470-F472 HydrophobicContact CD2-CZ 3.93Å; L470-F472 HydrophobicContact CG-CE2 4.45Å; F472-Y503 HydrophobicContact CB-CE1 4.25Å; F472-Y503 HydrophobicContact CD1-CD1 4.05Å; F472-Y503 AromaticContact CD1-CE1 3.74Å; F472-Y503 HydrophobicContact CD1-CE1 3.74Å; F472-Y503 HydrophobicContact CD2-CD1 4.03Å; F472-Y503 HydrophobicContact CD2-CE1 4.02Å; F472-Y503 HydrophobicContact CD2-CG 4.37Å; F472-Y503 AromaticContact CE1-CD1 3.88Å; F472-Y503 HydrophobicContact CE1-CD1 3.88Å; F472-Y503 HydrophobicContact CE1-CE1 4.05Å; F472-Y503 AromaticContact CE2-CD1 3.82Å; F472-Y503 HydrophobicContact CE2-CD1 3.82Å; F472-Y503 HydrophobicContact CE2-CE1 4.27Å; F472-Y503 HydrophobicContact CE2-CG 4.08Å; F472-Y503 HydrophobicContact CG-CD1 4.14Å; F472-Y503 AromaticContact CG-CE1 3.75Å; F472-Y503 HydrophobicContact CG-CE1 3.75Å; F472-Y503 AromaticContact CZ-CD1 3.76Å; F472-Y503 HydrophobicContact CZ-CD1 3.76Å; F472-Y503 HydrophobicContact CZ-CE1 4.3Å; F472-Y503 HydrophobicContact CZ-CG 4.36Å
473	T	82.8	Confident	84.4	Confident	93 Å²	93	50.5 Å²	50.5	57%	0.571	27%	0.272	S	S	*	.			trans	-115	23.5	179.2	51.8	0	0	0	0	111.4	D457 H475	D457-T473 HydrophobicContact CB-CG2 4.46Å; T473-H475 VanDerWaalsContact C-N 3.35Å; T473-H475 PolarHBondContact O-N 3.48Å
474	D	77.6	Confident	84.6	Confident	60 Å²	60	50.7 Å²	50.7	32%	0.321	27%	0.272	S	S	.	.			trans	-78.2	-22.8	-167.8	-45.6	-49.4	0	0	0	112.9	R501 Y503	D474-R501 PolarHBondContact O-NH1 3.3Å; D474-R501 PolarHBondContact O-NH2 2.98Å; D474-Y503 WeakPolarHBondContact OD2-CE1 3.24Å; D474-Y503 PolarHBondContact OD2-OH 3.42Å
475	H	80.1	Confident	84.9	Confident	18 Å²	18	42.4 Å²	42.4	8%	0.083	24%	0.236	C	C	.	.			trans	-75	133.7	177.7	-76.9	-78.4	0	0	0	111.1	T473 G477 V479 S493 D497 S499 R501	T473-H475 VanDerWaalsContact C-N 3.35Å; T473-H475 PolarHBondContact O-N 3.48Å; H475-G477 VanDerWaalsContact C-N 3.25Å; H475-G477 WeakPolarHBondContact CB-O 3.49Å; H475-G477 PolarHBondContact O-N 3.42Å; H475-V479 HydrophobicContact CB-CG2 3.91Å; H475-V479 VanDerWaalsContact CD2-CG2 3.47Å; H475-V479 WeakPolarHBondContact CD2-CG2 3.32Å; H475-S493 PolarHBondContact NE2-OG 2.94Å; H475-D497 WeakPolarHBondContact CA-OD2 3.35Å; H475-D497 IonicContact CE1-OD1 2.7Å; H475-D497 IonicContact CE1-OD2 3.48Å; H475-D497 IonicContact CG-OD2 3.04Å; H475-D497 VanDerWaalsContact ND1-CG 3.34Å; H475-D497 IonicContact ND1-OD1 2.75Å; H475-D497 PolarHBondContact ND1-OD1 2.97Å; H475-D497 VanDerWaalsContact ND1-OD1 3.12Å; H475-D497 IonicContact ND1-OD2 3.65Å; H475-D497 PolarHBondContact ND1-OD2 2.98Å; H475-S499 PolarHBondContact CE1-OG 3.46Å; H475-S499 PolarHBondContact ND1-OG 2.94Å; H475-S499 VanDerWaalsContact ND1-OG 3.17Å; H475-R501 VanDerWaalsContact CE1-CD 3.5Å; H475-R501 WeakPolarHBondContact CE1-CD 3.49Å; H475-R501 PolarHBondContact CE1-NE 2.86Å; H475-R501 PolarHBondContact ND1-NE 3.13Å
476	T	79.4	Confident	84.8	Confident	131 Å²	131	38.9 Å²	38.9	80%	0.804	22%	0.219	S	C	*	.	S	Bend	trans	-82.4	-6.5	177.5	61.1	0	0	0	0	112.8	D497	T476-D497 PolarHBondContact N-OD2 3.25Å; T476-D497 WeakPolarHBondContact OG1-CB 3.41Å
477	G	80	Confident	84.7	Confident	25 Å²	25	38.2 Å²	38.2	26%	0.258	22%	0.219	S	C	.	.	S	Bend	trans	-142.5	175.4	178.2	0	0	0	0	0	110.9	H475 V479	H475-G477 VanDerWaalsContact C-N 3.25Å; H475-G477 WeakPolarHBondContact CB-O 3.49Å; H475-G477 PolarHBondContact O-N 3.42Å; G477-V479 PolarHBondContact O-N 2.96Å
478	L	85.8	Confident	84.5	Confident	53 Å²	53	36.2 Å²	36.2	28%	0.277	20%	0.204	S	C	.	.			trans	-56.4	132.2	-176.4	-63.6	171.9	0	0	0	111.9	E438 G495 M496	E438-L478 HydrophobicContact CB-CD2 4.39Å; L478-G495 CarbonylContact O-C 3.59Å; L478-G495 WeakPolarHBondContact O-CA 3.33Å; L478-M496 HydrophobicContact CB-CG 4.31Å; L478-M496 PolarHBondContact O-N 2.74Å
479	V	89.4	Confident	84.4	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.006	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	117.2	170.7	-173.6	0	0	0	0	108.3	K440 G455 I458 H475 G477 V482 A494	K440-V479 WeakPolarHBondContact CB-O 3.4Å; G455-V479 WeakPolarHBondContact O-CB 3.43Å; G455-V479 PolarHBondContact O-N 2.96Å; I458-V479 HydrophobicContact CD1-CG1 4.37Å; I458-V479 HydrophobicContact CD1-CG2 4.31Å; I458-V479 HydrophobicContact CG1-CB 4.37Å; I458-V479 HydrophobicContact CG1-CG1 4.06Å; I458-V479 HydrophobicContact CG1-CG2 3.86Å; H475-V479 HydrophobicContact CB-CG2 3.91Å; H475-V479 VanDerWaalsContact CD2-CG2 3.47Å; H475-V479 WeakPolarHBondContact CD2-CG2 3.32Å; G477-V479 PolarHBondContact O-N 2.96Å; V479-V482 HydrophobicContact CG1-CG2 3.58Å; V479-A494 WeakPolarHBondContact CG1-O 3.44Å
480	T	87.2	Confident	84.5	Confident	18 Å²	18	35.5 Å²	35.5	11%	0.11	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	-22.5	-172.3	49.8	0	0	0	0	112.6	I225 A494 M496	I225-T480 WeakPolarHBondContact O-CB 3.45Å; I225-T480 PolarHBondContact O-OG1 3.33Å; T480-A494 PolarHBondContact N-O 3.14Å; T480-A494 PolarHBondContact OG1-O 3.17Å; T480-M496 HydrophobicContact CG2-CG 3.71Å; T480-M496 HydrophobicContact CG2-SD 3.93Å
481	G	87.4	Confident	84.8	Confident	5 Å²	5	35 Å²	35	5%	0.052	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	137.6	177	0	0	0	0	0	111.5	S493 A494	G481-S493 CarbonylContact O-C 3.59Å; G481-S493 WeakPolarHBondContact O-CA 3.39Å; G481-A494 PolarHBondContact N-O 3.05Å; G481-A494 PolarHBondContact O-N 2.95Å
482	V	91.1	Very high	84.8	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.1	174.7	179.8	0	0	0	0	107.7	S441 V443 A452 I458 V479 L491 T492	S441-V482 PolarHBondContact OG-N 3.34Å; V443-V482 WeakPolarHBondContact CG2-O 3.46Å; A452-V482 HydrophobicContact CB-CG1 3.71Å; I458-V482 HydrophobicContact CG2-CG1 4.49Å; I458-V482 HydrophobicContact CG2-CG2 4.45Å; V479-V482 HydrophobicContact CG1-CG2 3.58Å; V482-L491 HydrophobicContact CG1-CD1 3.57Å; V482-L491 HydrophobicContact CG1-CD2 4.49Å; V482-L491 HydrophobicContact CG1-CG 4.18Å; V482-T492 WeakPolarHBondContact CA-O 3.41Å
483	S	89.8	Confident	85.2	Confident	13 Å²	13	30.6 Å²	30.6	9%	0.091	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	141.5	177	-173.9	0	0	0	0	111.1	T492	S483-T492 PolarHBondContact N-O 3.18Å; S483-T492 PolarHBondContact O-N 3.05Å
484	F	89.1	Confident	85.5	Confident	15 Å²	15	26.2 Å²	26.2	7%	0.066	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	138.8	175.3	-74.4	-77.6	0	0	0	110.5	V443 D445 A452 V460 A488 L491	V443-F484 HydrophobicContact CG1-CD2 4.18Å; D445-F484 HydrophobicContact CB-CD2 4.1Å; D445-F484 HydrophobicContact CB-CE2 4.31Å; D445-F484 HydrophobicContact CB-CG 4.31Å; A452-F484 HydrophobicContact CB-CD2 4.37Å; A452-F484 HydrophobicContact CB-CE2 3.42Å; A452-F484 VanDerWaalsContact CB-CE2 3.42Å; A452-F484 HydrophobicContact CB-CZ 3.56Å; V460-F484 HydrophobicContact CG1-CZ 4.03Å; F484-A488 HydrophobicContact CD1-CB 4.07Å; F484-A488 HydrophobicContact CE1-CB 4.49Å; F484-L491 HydrophobicContact CD1-CD1 3.64Å; F484-L491 HydrophobicContact CD2-CD1 4.47Å; F484-L491 HydrophobicContact CE1-CD1 3.66Å; F484-L491 HydrophobicContact CE2-CD1 4.48Å; F484-L491 HydrophobicContact CG-CD1 4.08Å; F484-L491 HydrophobicContact CZ-CD1 4.1Å
485	G	84.1	Confident	86	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.01	13%	0.13	C	C	.	.	P	Polyproline II helix	trans	-71.8	173	162.4	0	0	0	0	0	112	N487 A488 F490	G485-N487 PolarHBondContact O-N 3.49Å; G485-A488 PolarHBondContact O-N 3.44Å; G485-F490 VanDerWaalsContact CA-CZ 3.5Å; G485-F490 PolarHBondContact N-O 3.49Å
486	E	82.3	Confident	86.3	Confident	77 Å²	77	26.1 Å²	26.1	36%	0.36	14%	0.144	S	C	.	.	G	3₁₀ helix	trans	-52.9	131.1	178.1	-176.3	-178.2	-167.2	0	0	111.9	T235 A488 K489	T235-E486 HydrophobicContact CG2-CB 3.41Å; T235-E486 VanDerWaalsContact CG2-CB 3.41Å; E486-A488 PolarHBondContact O-N 3.44Å; E486-A488 VanDerWaalsContact O-N 3.09Å; E486-K489 WeakPolarHBondContact O-CB 3.31Å; E486-K489 VanDerWaalsContact O-CG 3.31Å; E486-K489 WeakPolarHBondContact O-CG 3.46Å; E486-K489 PolarHBondContact O-N 3.37Å
487	N	80.3	Confident	86.4	Confident	22 Å²	22	21.5 Å²	21.5	12%	0.118	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	50.3	32.1	-177.7	-62	-28.3	0	0	0	113.9	E198 G485 K489	E198-N487 PolarHBondContact OE2-ND2 2.92Å; G485-N487 PolarHBondContact O-N 3.49Å; N487-K489 PolarHBondContact O-N 2.89Å; N487-K489 VanDerWaalsContact O-N 3.11Å
488	A	81.3	Confident	86.5	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	56.9	19.1	-176.2	0	0	0	0	0	114.9	L199 L205 Y208 Y450 F484 G485 E486 F490	L199-A488 HydrophobicContact CD1-CB 4.17Å; L205-A488 HydrophobicContact CD1-CB 4.38Å; Y208-A488 PolarHBondContact OH-O 2.81Å; Y450-A488 HydrophobicContact CD2-CB 4.31Å; F484-A488 HydrophobicContact CD1-CB 4.07Å; F484-A488 HydrophobicContact CE1-CB 4.49Å; G485-A488 PolarHBondContact O-N 3.44Å; E486-A488 PolarHBondContact O-N 3.44Å; E486-A488 VanDerWaalsContact O-N 3.09Å; A488-F490 PolarHBondContact O-N 3.42Å; A488-F490 VanDerWaalsContact O-N 3.12Å
489	K	84.2	Confident	86.6	Confident	94 Å²	94	20.8 Å²	20.8	41%	0.409	10%	0.1	S	C	.	.	S	Bend	trans	-56.5	-29.5	-178.8	-73.7	172.5	-177.7	167.2	0	113.8	E198 V200 Y208 E486 N487	E198-K489 IonicContact OE2-NZ 3.77Å; V200-K489 HydrophobicContact CG2-CG 4.47Å; Y208-K489 PolarHBondContact OH-O 2.94Å; E486-K489 WeakPolarHBondContact O-CB 3.31Å; E486-K489 VanDerWaalsContact O-CG 3.31Å; E486-K489 WeakPolarHBondContact O-CG 3.46Å; E486-K489 PolarHBondContact O-N 3.37Å; N487-K489 PolarHBondContact O-N 2.89Å; N487-K489 VanDerWaalsContact O-N 3.11Å
490	F	87	Confident	86.5	Confident	13 Å²	13	20.7 Å²	20.7	6%	0.057	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	160.1	170.7	65	-86.1	0	0	0	109.7	V230 T235 G485 A488 T492 F502 Y503	V230-F490 HydrophobicContact CG1-CZ 4.36Å; T235-F490 HydrophobicContact CG2-CE1 4.27Å; T235-F490 HydrophobicContact CG2-CZ 4.41Å; T235-F490 VanDerWaalsContact O-CZ 3.26Å; T235-F490 WeakPolarHBondContact O-CZ 3.32Å; G485-F490 VanDerWaalsContact CA-CZ 3.5Å; G485-F490 PolarHBondContact N-O 3.49Å; A488-F490 PolarHBondContact O-N 3.42Å; A488-F490 VanDerWaalsContact O-N 3.12Å; F490-T492 WeakPolarHBondContact CD2-OG1 3.29Å; F490-T492 VanDerWaalsContact CE2-OG1 3.27Å; F490-T492 WeakPolarHBondContact CE2-OG1 3.47Å; F490-F502 HydrophobicContact CD2-CD1 4.19Å; F490-F502 HydrophobicContact CE2-CD1 4.41Å; F490-F502 HydrophobicContact CE2-CE1 4.46Å; F490-Y503 CarbonylContact C-O 3.6Å; F490-Y503 WeakPolarHBondContact CA-O 3.41Å; F490-Y503 VanDerWaalsContact CB-O 3.22Å; F490-Y503 WeakPolarHBondContact CB-O 3.49Å
491	L	89	Confident	86.7	Confident	1 Å²	1	21.1 Å²	21.1	1%	0.005	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	136.2	172.5	-179.6	74.1	0	0	0	108	A452 I458 V460 V482 F484 Y503	A452-L491 HydrophobicContact CB-CD1 4.32Å; I458-L491 HydrophobicContact CG2-CD2 3.84Å; V460-L491 HydrophobicContact CG2-CD2 4.13Å; V482-L491 HydrophobicContact CG1-CD1 3.57Å; V482-L491 HydrophobicContact CG1-CD2 4.49Å; V482-L491 HydrophobicContact CG1-CG 4.18Å; F484-L491 HydrophobicContact CD1-CD1 3.64Å; F484-L491 HydrophobicContact CD2-CD1 4.47Å; F484-L491 HydrophobicContact CE1-CD1 3.66Å; F484-L491 HydrophobicContact CE2-CD1 4.48Å; F484-L491 HydrophobicContact CG-CD1 4.08Å; F484-L491 HydrophobicContact CZ-CD1 4.1Å; L491-Y503 PolarHBondContact N-O 3.04Å; L491-Y503 PolarHBondContact O-N 3.39Å
492	T	89.8	Confident	86.8	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	137.3	177.4	-48.4	0	0	0	0	109.1	L228 V238 V482 S483 F490 L500 R501 F502	L228-T492 HydrophobicContact CD1-CG2 4.16Å; L228-T492 HydrophobicContact CD2-CG2 3.88Å; L228-T492 WeakPolarHBondContact CD2-O 3.36Å; V238-T492 HydrophobicContact CG1-CG2 4.29Å; V482-T492 WeakPolarHBondContact CA-O 3.41Å; S483-T492 PolarHBondContact N-O 3.18Å; S483-T492 PolarHBondContact O-N 3.05Å; F490-T492 WeakPolarHBondContact CD2-OG1 3.29Å; F490-T492 VanDerWaalsContact CE2-OG1 3.27Å; F490-T492 WeakPolarHBondContact CE2-OG1 3.47Å; T492-L500 HydrophobicContact CG2-CD1 3.55Å; T492-L500 HydrophobicContact CG2-CG 4.25Å; T492-R501 WeakPolarHBondContact CA-O 3.37Å; T492-F502 HydrophobicContact CG2-CD1 3.82Å; T492-F502 HydrophobicContact CG2-CE1 3.56Å; T492-F502 HydrophobicContact CG2-CZ 4.15Å; T492-F502 WeakPolarHBondContact OG1-CD1 3.45Å; T492-F502 WeakPolarHBondContact OG1-CE1 3.33Å
493	S	90.9	Very high	86.7	Confident	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.2	175.4	65.4	0	0	0	0	111.8	I458 H475 G481 L500 R501 Y503	I458-S493 WeakPolarHBondContact CD1-OG 3.21Å; H475-S493 PolarHBondContact NE2-OG 2.94Å; G481-S493 CarbonylContact O-C 3.59Å; G481-S493 WeakPolarHBondContact O-CA 3.39Å; S493-L500 WeakPolarHBondContact O-CA 3.36Å; S493-R501 PolarHBondContact N-O 3.04Å; S493-R501 PolarHBondContact O-N 2.94Å; S493-Y503 WeakPolarHBondContact OG-CE2 3.33Å
494	A	90.1	Very high	86.4	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128	138.2	173.8	0	0	0	0	0	109.8	I225 L228 V479 T480 G481 L500	I225-A494 HydrophobicContact CB-CB 3.97Å; I225-A494 HydrophobicContact CD1-CB 4.22Å; I225-A494 HydrophobicContact CG2-CB 3.61Å; L228-A494 HydrophobicContact CB-CB 3.98Å; L228-A494 HydrophobicContact CD1-CB 4.25Å; L228-A494 HydrophobicContact CD2-CB 4.35Å; L228-A494 HydrophobicContact CG-CB 4.43Å; V479-A494 WeakPolarHBondContact CG1-O 3.44Å; T480-A494 PolarHBondContact N-O 3.14Å; T480-A494 PolarHBondContact OG1-O 3.17Å; G481-A494 PolarHBondContact N-O 3.05Å; G481-A494 PolarHBondContact O-N 2.95Å; A494-L500 HydrophobicContact CB-CD1 4.38Å
495	G	87.8	Confident	85.9	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	166.7	-176.4	0	0	0	0	0	114.4	I225 L478 D497 R498 S499	I225-G495 PolarHBondContact N-O 3.37Å; L478-G495 CarbonylContact O-C 3.59Å; L478-G495 WeakPolarHBondContact O-CA 3.33Å; G495-D497 PolarHBondContact O-N 3.27Å; G495-R498 PolarHBondContact O-N 3.21Å; G495-S499 PolarHBondContact N-O 3.36Å
496	M	85.7	Confident	86	Confident	77 Å²	77	28.4 Å²	28.4	38%	0.379	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-16.5	168.6	-70.6	-64.4	-75.2	0	0	112.5	L226 L478 T480 R498	L226-M496 HydrophobicContact CD2-SD 3.99Å; L478-M496 HydrophobicContact CB-CG 4.31Å; L478-M496 PolarHBondContact O-N 2.74Å; T480-M496 HydrophobicContact CG2-CG 3.71Å; T480-M496 HydrophobicContact CG2-SD 3.93Å; M496-R498 PolarHBondContact O-N 3.5Å
497	D	82.7	Confident	86.2	Confident	33 Å²	33	25.8 Å²	25.8	18%	0.176	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	6.9	173.6	71	-5.1	0	0	0	114.1	H475 T476 G495 S499 R501	H475-D497 WeakPolarHBondContact CA-OD2 3.35Å; H475-D497 IonicContact CE1-OD1 2.7Å; H475-D497 IonicContact CE1-OD2 3.48Å; H475-D497 IonicContact CG-OD2 3.04Å; H475-D497 VanDerWaalsContact ND1-CG 3.34Å; H475-D497 IonicContact ND1-OD1 2.75Å; H475-D497 PolarHBondContact ND1-OD1 2.97Å; H475-D497 VanDerWaalsContact ND1-OD1 3.12Å; H475-D497 IonicContact ND1-OD2 3.65Å; H475-D497 PolarHBondContact ND1-OD2 2.98Å; T476-D497 PolarHBondContact N-OD2 3.25Å; T476-D497 WeakPolarHBondContact OG1-CB 3.41Å; G495-D497 PolarHBondContact O-N 3.27Å; D497-S499 PolarHBondContact O-N 2.84Å; D497-S499 WeakPolarHBondContact OD1-CB 3.37Å; D497-S499 PolarHBondContact OD1-N 3.48Å; D497-S499 PolarHBondContact OD1-OG 3.05Å; D497-S499 PolarHBondContact OD2-OG 3.36Å; D497-R501 IonicContact OD2-CZ 3.69Å; D497-R501 IonicContact OD2-NE 2.88Å; D497-R501 IonicContact OD2-NH2 3.88Å; D497-R501 PolarHBondContact OD2-NH2 3.4Å
498	R	82.3	Confident	86.6	Confident	59 Å²	59	26 Å²	26	22%	0.223	13%	0.126	C	C	.	.	S	Bend	trans	65.1	11.5	-179.2	-53	170.3	63.8	-150.7	-7.2	114.3	H218 S219 P223 G495 M496	H218-R498 PolarHBondContact O-NH2 3.43Å; S219-R498 VanDerWaalsContact C-NH2 3.32Å; S219-R498 PolarHBondContact O-NE 3.47Å; S219-R498 PolarHBondContact O-NH2 3.43Å; P223-R498 HydrophobicContact CB-CG 3.67Å; G495-R498 PolarHBondContact O-N 3.21Å; M496-R498 PolarHBondContact O-N 3.5Å
499	S	86.6	Confident	86.9	Confident	4 Å²	4	27.5 Å²	27.5	3%	0.028	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	134	178.6	72.5	0	0	0	0	110.8	H214 H475 G495 D497 R501	H214-S499 WeakPolarHBondContact O-CA 3.44Å; H475-S499 PolarHBondContact CE1-OG 3.46Å; H475-S499 PolarHBondContact ND1-OG 2.94Å; H475-S499 VanDerWaalsContact ND1-OG 3.17Å; G495-S499 PolarHBondContact N-O 3.36Å; D497-S499 PolarHBondContact O-N 2.84Å; D497-S499 WeakPolarHBondContact OD1-CB 3.37Å; D497-S499 PolarHBondContact OD1-N 3.48Å; D497-S499 PolarHBondContact OD1-OG 3.05Å; D497-S499 PolarHBondContact OD2-OG 3.36Å; S499-R501 PolarHBondContact OG-NE 3.4Å
500	L	88.8	Confident	87	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	122.8	159.5	-180	70.4	0	0	0	107.2	H214 L217 I225 L228 V238 T240 F250 T492 S493 A494 F502	H214-L500 PolarHBondContact N-O 3.36Å; H214-L500 PolarHBondContact O-N 3.36Å; L217-L500 HydrophobicContact CD1-CB 3.52Å; L217-L500 HydrophobicContact CD1-CD2 3.7Å; L217-L500 HydrophobicContact CD1-CG 4.22Å; I225-L500 HydrophobicContact CD1-CB 4.5Å; L228-L500 HydrophobicContact CD1-CD1 3.44Å; L228-L500 VanDerWaalsContact CD1-CD1 3.44Å; V238-L500 HydrophobicContact CB-CD2 4.38Å; V238-L500 HydrophobicContact CG1-CD1 4.07Å; V238-L500 HydrophobicContact CG1-CD2 3.97Å; T240-L500 HydrophobicContact CG2-CD1 4.11Å; T240-L500 HydrophobicContact CG2-CD2 4.39Å; F250-L500 HydrophobicContact CD1-CD2 3.81Å; F250-L500 HydrophobicContact CE1-CD2 4.35Å; F250-L500 HydrophobicContact CG-CD2 4.32Å; T492-L500 HydrophobicContact CG2-CD1 3.55Å; T492-L500 HydrophobicContact CG2-CG 4.25Å; S493-L500 WeakPolarHBondContact O-CA 3.36Å; A494-L500 HydrophobicContact CB-CD1 4.38Å; L500-F502 HydrophobicContact CD2-CE2 3.86Å; L500-F502 HydrophobicContact CD2-CZ 3.81Å; L500-F502 HydrophobicContact CG-CE2 4.09Å; L500-F502 HydrophobicContact CG-CZ 4.23Å
501	R	90.4	Very high	87	Confident	26 Å²	26	24.1 Å²	24.1	10%	0.098	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	143	-177.9	-59.7	-175.4	-171.9	-155.2	17.8	110.8	Q210 A212 D474 H475 T492 S493 D497 S499 Y503	Q210-R501 VanDerWaalsContact OE1-NH1 3.07Å; A212-R501 WeakPolarHBondContact O-CA 3.18Å; D474-R501 PolarHBondContact O-NH1 3.3Å; D474-R501 PolarHBondContact O-NH2 2.98Å; H475-R501 VanDerWaalsContact CE1-CD 3.5Å; H475-R501 WeakPolarHBondContact CE1-CD 3.49Å; H475-R501 PolarHBondContact CE1-NE 2.86Å; H475-R501 PolarHBondContact ND1-NE 3.13Å; T492-R501 WeakPolarHBondContact CA-O 3.37Å; S493-R501 PolarHBondContact N-O 3.04Å; S493-R501 PolarHBondContact O-N 2.94Å; D497-R501 IonicContact OD2-CZ 3.69Å; D497-R501 IonicContact OD2-NE 2.88Å; D497-R501 IonicContact OD2-NH2 3.88Å; D497-R501 PolarHBondContact OD2-NH2 3.4Å; S499-R501 PolarHBondContact OG-NE 3.4Å; R501-Y503 HydrophobicContact CB-CE2 3.91Å
502	F	89.7	Confident	86.9	Confident	3 Å²	3	25.7 Å²	25.7	1%	0.013	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	131.4	175.7	-65.8	-81.2	0	0	0	109.7	V211 A212 H214 V238 F250 K252 F490 T492 L500	V211-F502 PolarHBondContact N-O 3.18Å; A212-F502 HydrophobicContact CB-CB 4.36Å; A212-F502 HydrophobicContact CB-CD2 4.08Å; A212-F502 PolarHBondContact O-N 3.1Å; H214-F502 AromaticContact CD2-CD2 3.87Å; H214-F502 AromaticContact CD2-CE2 3.62Å; H214-F502 AromaticContact NE2-CD2 3.94Å; H214-F502 AromaticContact NE2-CE2 3.85Å; V238-F502 HydrophobicContact CB-CZ 4.48Å; V238-F502 HydrophobicContact CG2-CE1 3.72Å; V238-F502 HydrophobicContact CG2-CZ 3.72Å; F250-F502 HydrophobicContact CD1-CE2 4.3Å; F250-F502 HydrophobicContact CD1-CZ 4.19Å; F250-F502 AromaticContact CE1-CE2 3.8Å; F250-F502 HydrophobicContact CE1-CE2 3.8Å; F250-F502 HydrophobicContact CE1-CZ 4.08Å; K252-F502 HydrophobicContact CB-CZ 4.34Å; K252-F502 HydrophobicContact CD-CD1 4.15Å; K252-F502 HydrophobicContact CD-CE1 4.02Å; K252-F502 HydrophobicContact CD-CZ 4.41Å; K252-F502 HydrophobicContact CG-CE1 4.34Å; K252-F502 HydrophobicContact CG-CE2 4.48Å; K252-F502 HydrophobicContact CG-CZ 4.24Å; F490-F502 HydrophobicContact CD2-CD1 4.19Å; F490-F502 HydrophobicContact CE2-CD1 4.41Å; F490-F502 HydrophobicContact CE2-CE1 4.46Å; T492-F502 HydrophobicContact CG2-CD1 3.82Å; T492-F502 HydrophobicContact CG2-CE1 3.56Å; T492-F502 HydrophobicContact CG2-CZ 4.15Å; T492-F502 WeakPolarHBondContact OG1-CD1 3.45Å; T492-F502 WeakPolarHBondContact OG1-CE1 3.33Å; L500-F502 HydrophobicContact CD2-CE2 3.86Å; L500-F502 HydrophobicContact CD2-CZ 3.81Å; L500-F502 HydrophobicContact CG-CE2 4.09Å; L500-F502 HydrophobicContact CG-CZ 4.23Å
503	Y	88.3	Confident	86.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.9	177.5	-60.8	-85.2	0	0	0	109.1	R209 Q210 I458 F472 D474 F490 L491 S493 R501	R209-Y503 WeakPolarHBondContact O-CA 3.4Å; Q210-Y503 HydrophobicContact CB-CD1 4.09Å; Q210-Y503 HydrophobicContact CB-CE1 3.79Å; Q210-Y503 HydrophobicContact CG-CE1 4.24Å; I458-Y503 HydrophobicContact CD1-CE2 3.83Å; F472-Y503 HydrophobicContact CB-CE1 4.25Å; F472-Y503 HydrophobicContact CD1-CD1 4.05Å; F472-Y503 AromaticContact CD1-CE1 3.74Å; F472-Y503 HydrophobicContact CD1-CE1 3.74Å; F472-Y503 HydrophobicContact CD2-CD1 4.03Å; F472-Y503 HydrophobicContact CD2-CE1 4.02Å; F472-Y503 HydrophobicContact CD2-CG 4.37Å; F472-Y503 AromaticContact CE1-CD1 3.88Å; F472-Y503 HydrophobicContact CE1-CD1 3.88Å; F472-Y503 HydrophobicContact CE1-CE1 4.05Å; F472-Y503 AromaticContact CE2-CD1 3.82Å; F472-Y503 HydrophobicContact CE2-CD1 3.82Å; F472-Y503 HydrophobicContact CE2-CE1 4.27Å; F472-Y503 HydrophobicContact CE2-CG 4.08Å; F472-Y503 HydrophobicContact CG-CD1 4.14Å; F472-Y503 AromaticContact CG-CE1 3.75Å; F472-Y503 HydrophobicContact CG-CE1 3.75Å; F472-Y503 AromaticContact CZ-CD1 3.76Å; F472-Y503 HydrophobicContact CZ-CD1 3.76Å; F472-Y503 HydrophobicContact CZ-CE1 4.3Å; F472-Y503 HydrophobicContact CZ-CG 4.36Å; D474-Y503 WeakPolarHBondContact OD2-CE1 3.24Å; D474-Y503 PolarHBondContact OD2-OH 3.42Å; F490-Y503 CarbonylContact C-O 3.6Å; F490-Y503 WeakPolarHBondContact CA-O 3.41Å; F490-Y503 VanDerWaalsContact CB-O 3.22Å; F490-Y503 WeakPolarHBondContact CB-O 3.49Å; L491-Y503 PolarHBondContact N-O 3.04Å; L491-Y503 PolarHBondContact O-N 3.39Å; S493-Y503 WeakPolarHBondContact OG-CE2 3.33Å; R501-Y503 HydrophobicContact CB-CE2 3.91Å
504	S	85	Confident	86.3	Confident	30 Å²	30	30 Å²	30	21%	0.21	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	178.7	170.6	66.8	0	0	0	0	109.6	Y208 R209 V211	Y208-S504 CarbonylContact C-O 3.59Å; Y208-S504 VanDerWaalsContact CA-O 3.28Å; Y208-S504 WeakPolarHBondContact CA-O 3.47Å; R209-S504 PolarHBondContact N-O 2.7Å; R209-S504 PolarHBondContact O-N 3.07Å; R209-S504 VanDerWaalsContact O-N 3.17Å; V211-S504 WeakPolarHBondContact CG2-OG 3.37Å
505	L	78.8	Confident	86	Confident	128 Å²	128	32.7 Å²	32.7	67%	0.67	16%	0.163	S	C	*	.			trans	-55.4	0	176	-154.3	96.1	0	0	0	113	D204 K207 Y208	D204-L505 HydrophobicContact CB-CD1 3.52Å; D204-L505 WeakPolarHBondContact O-CD1 3.32Å; K207-L505 HydrophobicContact CB-CD1 4.42Å; Y208-L505 HydrophobicContact CD1-CB 4.39Å; Y208-L505 HydrophobicContact CD1-CD1 4.19Å; Y208-L505 HydrophobicContact CE1-CB 4.24Å; Y208-L505 HydrophobicContact CE1-CD1 4.01Å

Retrieved 505 of 505 residues in 557.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).