A0A077ZFG3_TRITR Loading...

Polyadenylate-binding protein 1

AlphaFold DB , UniProt , Accession A0A077ZFG3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 479 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	34.5	Very low	45	Very low	250 Å²	250	122.3 Å²	122.3	100%	1.232	70%	0.696	S	S	*	*				0	98.9	0	-146.1	170.3	-169.8	0	0	106.8
2	M	32	Very low	49.1	Very low	183 Å²	183	113.3 Å²	113.3	90%	0.901	65%	0.647	S	S	*	*	P	Polyproline II helix	trans	-92.9	143.9	-176.7	-70	-149.5	171.5	0	0	110.6	M4	M2-M4 PolarHBondContact O-N 2.87Å
3	P	34.9	Very low	52.7	Low	128 Å²	128	104.6 Å²	104.6	83%	0.831	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-74.5	127	-175.9	29.6	-30.7	0	0	0	110.8
4	M	32.3	Very low	55.8	Low	187 Å²	187	99.2 Å²	99.2	92%	0.921	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-62.9	133.3	172.9	-78.3	174.7	72.6	0	0	111.1	M2	M2-M4 PolarHBondContact O-N 2.87Å
5	S	37.5	Very low	58.5	Low	99 Å²	99	92.6 Å²	92.6	69%	0.692	53%	0.525	S	S	*	.	P	Polyproline II helix	trans	-71.7	158.3	170.2	41.8	0	0	0	0	112	S7	S5-S7 PolarHBondContact O-N 3.26Å
6	P	39.6	Very low	60.8	Low	115 Å²	115	86.8 Å²	86.8	75%	0.747	49%	0.492	S	S	*	.	P	Polyproline II helix	trans	-61.4	130.2	-174.1	-16.4	29.8	0	0	0	111.2	Y8	P6-Y8 PolarHBondContact O-N 3.08Å
7	S	31.9	Very low	62.7	Low	94 Å²	94	83.4 Å²	83.4	66%	0.657	47%	0.473	S	S	*	.			trans	-57.7	113.7	-174.6	57.7	0	0	0	0	113.8	S5 T9	S5-S7 PolarHBondContact O-N 3.26Å; S7-T9 VanDerWaalsContact C-N 3.31Å; S7-T9 PolarHBondContact O-N 3.06Å; S7-T9 WeakPolarHBondContact OG-CG2 3.34Å
8	Y	48.1	Very low	64.6	Low	101 Å²	101	78.9 Å²	78.9	40%	0.396	45%	0.447	S	S	.	.			trans	-73.6	82.3	162	-71.8	-85.3	0	0	0	109.2	P6 A10 W86 E147	P6-Y8 PolarHBondContact O-N 3.08Å; Y8-A10 PolarHBondContact O-N 3.3Å; Y8-W86 HydrophobicContact CD1-CB 4.27Å; Y8-W86 HydrophobicContact CD1-CG 4.28Å; Y8-W86 HydrophobicContact CE1-CB 4.25Å; Y8-W86 HydrophobicContact CE1-CG 4.35Å; Y8-E147 PolarHBondContact OH-OE1 3.26Å
9	T	48.5	Very low	66.1	Low	128 Å²	128	77.3 Å²	77.3	79%	0.785	44%	0.435	S	S	*	.			trans	-79.4	30.1	-170.3	44.2	0	0	0	0	116.1	S7	S7-T9 VanDerWaalsContact C-N 3.31Å; S7-T9 PolarHBondContact O-N 3.06Å; S7-T9 WeakPolarHBondContact OG-CG2 3.34Å
10	A	66.1	Low	67.4	Low	44 Å²	44	77.5 Å²	77.5	36%	0.364	44%	0.44	S	S	.	.	S	Bend	trans	-154	134.2	162.8	0	0	0	0	0	110.5	Y8 S12	Y8-A10 PolarHBondContact O-N 3.3Å; A10-S12 WeakPolarHBondContact CB-OG 3.36Å; A10-S12 PolarHBondContact O-N 3.45Å
11	A	90.1	Very high	68.7	Low	16 Å²	16	78.8 Å²	78.8	13%	0.132	45%	0.445	C	S	.	.			trans	-70.7	50.8	172.5	0	0	0	0	0	111.4	F59 H62 A65	A11-F59 HydrophobicContact CB-CB 4.06Å; A11-F59 WeakPolarHBondContact CB-O 3.46Å; A11-F59 PolarHBondContact O-N 2.98Å; A11-H62 HydrophobicContact CB-CB 4.43Å; A11-A65 HydrophobicContact CB-CB 4.15Å
12	S	94.3	Very high	71.6	Confident	15 Å²	15	67 Å²	67	11%	0.105	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.2	-167	-63.4	0	0	0	0	110.1	A10 V57 N58 S87	A10-S12 WeakPolarHBondContact CB-OG 3.36Å; A10-S12 PolarHBondContact O-N 3.45Å; S12-V57 WeakPolarHBondContact CA-O 3.48Å; S12-N58 WeakPolarHBondContact CB-OD1 3.36Å; S12-N58 PolarHBondContact OG-OD1 3.37Å; S12-S87 WeakPolarHBondContact O-CB 3.27Å; S12-S87 PolarHBondContact O-N 2.91Å
13	L	95.9	Very high	74.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	140.6	177.3	-57.5	179.2	0	0	0	110.5	F31 Y56 V57 F59 A65 A68 L69 I84 M85 W86	L13-F31 HydrophobicContact CD1-CE1 4.14Å; L13-Y56 WeakPolarHBondContact O-CA 3.49Å; L13-V57 PolarHBondContact N-O 3.41Å; L13-V57 PolarHBondContact O-N 3.46Å; L13-F59 HydrophobicContact CD1-CD2 4.33Å; L13-F59 HydrophobicContact CD1-CE2 3.81Å; L13-A65 HydrophobicContact CD1-CB 4.42Å; L13-A65 WeakPolarHBondContact CD1-O 2.97Å; L13-A65 HydrophobicContact CD2-CB 4.25Å; L13-A65 HydrophobicContact CG-CB 4.2Å; L13-A68 HydrophobicContact CD1-CB 3.9Å; L13-L69 HydrophobicContact CD2-CB 4.31Å; L13-I84 HydrophobicContact CB-CG2 4.15Å; L13-I84 HydrophobicContact CD1-CG2 3.82Å; L13-I84 HydrophobicContact CD2-CG2 4.41Å; L13-I84 HydrophobicContact CG-CG2 4.35Å; L13-M85 CarbonylContact C-O 3.46Å; L13-M85 WeakPolarHBondContact CA-O 3.22Å; L13-W86 HydrophobicContact CD2-CD2 4.16Å; L13-W86 HydrophobicContact CD2-CE3 3.71Å; L13-W86 HydrophobicContact CD2-CH2 4.49Å; L13-W86 HydrophobicContact CD2-CZ3 3.89Å
14	Y	95.1	Very high	77.7	Confident	29 Å²	29	57.4 Å²	57.4	11%	0.114	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	129.6	161.4	171.7	-80.9	0	0	0	108.1	Y54 Y56 I84 M85	Y14-Y54 HydrophobicContact CD2-CD2 4.14Å; Y14-Y54 AromaticContact CE2-CD2 3.46Å; Y14-Y54 HydrophobicContact CE2-CD2 3.46Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.46Å; Y14-Y54 HydrophobicContact CE2-CE2 4.18Å; Y14-Y54 AromaticContact CE2-CG 3.88Å; Y14-Y54 HydrophobicContact CE2-CG 3.88Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.15Å; Y14-Y56 HydrophobicContact CD2-CE1 4.01Å; Y14-I84 WeakPolarHBondContact O-CA 3.05Å; Y14-M85 HydrophobicContact CD1-CE 4.06Å; Y14-M85 HydrophobicContact CD1-CG 3.71Å; Y14-M85 HydrophobicContact CD1-SD 3.82Å; Y14-M85 HydrophobicContact CE1-CE 4.24Å; Y14-M85 HydrophobicContact CE1-SD 4.35Å; Y14-M85 HydrophobicContact CG-CG 4.11Å; Y14-M85 HydrophobicContact CG-SD 4.4Å; Y14-M85 PolarHBondContact N-O 3.41Å; Y14-M85 PolarHBondContact O-N 3.06Å
15	V	96.9	Very high	80.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	108.2	178.1	-169.5	0	0	0	0	108	L18 L27 F31 Y54 A55 V57 M82 R83 I84	V15-L18 HydrophobicContact CG1-CD2 3.71Å; V15-L18 HydrophobicContact CG1-CG 4.44Å; V15-L27 HydrophobicContact CG1-CD2 4.41Å; V15-F31 HydrophobicContact CB-CZ 4.48Å; V15-F31 HydrophobicContact CG1-CE2 4.32Å; V15-F31 HydrophobicContact CG1-CZ 4.07Å; V15-F31 HydrophobicContact CG2-CE1 4.16Å; V15-F31 HydrophobicContact CG2-CE2 4.12Å; V15-F31 HydrophobicContact CG2-CZ 3.54Å; V15-Y54 CarbonylContact O-C 3.57Å; V15-Y54 WeakPolarHBondContact O-CA 3.33Å; V15-Y54 WeakPolarHBondContact O-CB 3.39Å; V15-A55 PolarHBondContact N-O 3.07Å; V15-A55 PolarHBondContact O-N 2.85Å; V15-V57 HydrophobicContact CG2-CB 4.42Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; V15-M82 HydrophobicContact CG1-CB 4.16Å; V15-M82 HydrophobicContact CG1-CG 4.48Å; V15-M82 HydrophobicContact CG1-SD 4.17Å; V15-R83 CarbonylContact C-O 3.52Å; V15-R83 WeakPolarHBondContact CA-O 3.49Å; V15-I84 HydrophobicContact CG1-CG1 4.38Å
16	G	95.1	Very high	83.6	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	178.3	-178.7	0	0	0	0	0	113.4	L18 R83	G16-L18 PolarHBondContact O-N 2.97Å; G16-R83 PolarHBondContact N-O 2.87Å; G16-R83 PolarHBondContact O-N 2.82Å
17	D	93.6	Very high	86.4	Confident	29 Å²	29	47.7 Å²	47.7	16%	0.155	27%	0.265	C	S	.	.	S	Bend	trans	60.5	28.1	179.1	-56.6	-58	0	0	0	113.1	G53 R80 R83 K129	D17-G53 PolarHBondContact N-O 3.08Å; D17-G53 VanDerWaalsContact N-O 3.08Å; D17-R80 WeakPolarHBondContact O-CD 3.28Å; D17-R83 HydrophobicContact CB-CB 4.43Å; D17-R83 VanDerWaalsContact OD2-CB 3.31Å; D17-R83 WeakPolarHBondContact OD2-CB 3.21Å; D17-R83 IonicContact OD2-CZ 2.66Å; D17-R83 IonicContact OD2-NE 3.9Å; D17-R83 PolarHBondContact OD2-NE 2.8Å; D17-R83 IonicContact OD2-NH2 3.89Å; D17-R83 PolarHBondContact OD2-NH2 3.28Å; D17-K129 WeakPolarHBondContact OD1-CE 3.29Å; D17-K129 IonicContact OD1-NZ 3.55Å; D17-K129 PolarHBondContact OD1-NZ 3.36Å; D17-K129 IonicContact OD2-NZ 3.1Å
18	L	95.6	Very high	89.5	Confident	2 Å²	2	48.2 Å²	48.2	1%	0.01	26%	0.255	C	S	.	.			trans	-64.3	149.9	178.4	-62.5	178.9	0	0	0	111.3	V15 G16 V22 L27 G53 A55 R80 M82	V15-L18 HydrophobicContact CG1-CD2 3.71Å; V15-L18 HydrophobicContact CG1-CG 4.44Å; G16-L18 PolarHBondContact O-N 2.97Å; L18-V22 HydrophobicContact CB-CB 4.32Å; L18-V22 HydrophobicContact CD1-CG1 4.16Å; L18-V22 HydrophobicContact CD2-CG1 4.28Å; L18-L27 HydrophobicContact CD1-CD1 4.05Å; L18-L27 HydrophobicContact CD1-CD2 4.46Å; L18-L27 HydrophobicContact CD2-CD2 4.03Å; L18-G53 PolarHBondContact N-O 3.37Å; L18-A55 HydrophobicContact CD1-CB 3.73Å; L18-R80 PolarHBondContact O-NH1 2.99Å; L18-M82 HydrophobicContact CD2-CG 3.89Å; L18-M82 HydrophobicContact CD2-SD 4.11Å
19	H	94.3	Very high	91.8	Very high	48 Å²	48	48 Å²	48	22%	0.222	26%	0.261	C	S	.	.			trans	-62.9	141.9	166.2	-172.3	-88.4	0	0	0	109.5	D21 V22 M78 R80	H19-D21 IonicContact CE1-OD2 3.7Å; H19-D21 PolarHBondContact CE1-OD2 3.43Å; H19-D21 VanDerWaalsContact CE1-OD2 3.24Å; H19-D21 PolarHBondContact ND1-N 3.34Å; H19-D21 IonicContact ND1-OD2 2.7Å; H19-D21 PolarHBondContact O-N 2.9Å; H19-D21 VanDerWaalsContact O-N 3.09Å; H19-V22 HydrophobicContact CB-CG2 3.89Å; H19-V22 WeakPolarHBondContact O-CB 3.48Å; H19-V22 PolarHBondContact O-N 3.3Å; H19-M78 HydrophobicContact CB-CB 3.98Å; H19-R80 HydrophobicContact CB-CB 4.2Å
20	P	92.4	Very high	94.1	Very high	81 Å²	81	44.7 Å²	44.7	53%	0.526	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-31.8	-177.2	-29.2	36.3	0	0	0	114.9	S51	P20-S51 VanDerWaalsContact O-CB 3.31Å; P20-S51 WeakPolarHBondContact O-CB 3.1Å
21	D	94.1	Very high	95.6	Very high	105 Å²	105	42.6 Å²	42.6	56%	0.561	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-2.8	-178.4	-58.2	-28.9	0	0	0	114.4	H19 N23 M78	H19-D21 IonicContact CE1-OD2 3.7Å; H19-D21 PolarHBondContact CE1-OD2 3.43Å; H19-D21 VanDerWaalsContact CE1-OD2 3.24Å; H19-D21 PolarHBondContact ND1-N 3.34Å; H19-D21 IonicContact ND1-OD2 2.7Å; H19-D21 PolarHBondContact O-N 2.9Å; H19-D21 VanDerWaalsContact O-N 3.09Å; D21-N23 PolarHBondContact O-N 2.92Å; D21-M78 HydrophobicContact CB-CE 3.76Å; D21-M78 HydrophobicContact CB-SD 4.13Å
22	V	96.2	Very high	95.9	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.018	23%	0.228	C	C	.	.			trans	-66.3	123.7	175.8	168	0	0	0	0	109.5	L18 H19 L27 L77 M78	L18-V22 HydrophobicContact CB-CB 4.32Å; L18-V22 HydrophobicContact CD1-CG1 4.16Å; L18-V22 HydrophobicContact CD2-CG1 4.28Å; H19-V22 HydrophobicContact CB-CG2 3.89Å; H19-V22 WeakPolarHBondContact O-CB 3.48Å; H19-V22 PolarHBondContact O-N 3.3Å; V22-L27 HydrophobicContact CG1-CD1 4.07Å; V22-L27 HydrophobicContact CG1-CD2 4.02Å; V22-L27 HydrophobicContact CG1-CG 3.68Å; V22-L77 HydrophobicContact CB-CD2 4.48Å; V22-L77 HydrophobicContact CG1-CD2 3.76Å; V22-L77 HydrophobicContact CG2-CD2 3.78Å; V22-L77 HydrophobicContact CG2-CG 3.95Å; V22-M78 HydrophobicContact CG2-CG 4.12Å; V22-M78 HydrophobicContact CG2-SD 3.78Å
23	N	96	Very high	96.1	Very high	55 Å²	55	48.4 Å²	48.4	29%	0.294	25%	0.254	S	S	.	.			trans	-112.7	177.3	174.7	65.8	33.5	0	0	0	111.3	D21 T25 Y26 L27	D21-N23 PolarHBondContact O-N 2.92Å; N23-T25 VanDerWaalsContact C-N 3.25Å; N23-T25 PolarHBondContact O-N 3.25Å; N23-T25 VanDerWaalsContact OD1-CB 3.32Å; N23-T25 WeakPolarHBondContact OD1-CB 3.21Å; N23-T25 PolarHBondContact OD1-N 3.35Å; N23-Y26 PolarHBondContact O-N 2.86Å; N23-Y26 WeakPolarHBondContact OD1-CD2 3.43Å; N23-Y26 PolarHBondContact OD1-N 3.44Å; N23-L27 PolarHBondContact O-N 3.15Å
24	E	97.4	Very high	96.1	Very high	54 Å²	54	48.5 Å²	48.5	25%	0.252	26%	0.255	S	S	.	.	H	α-helix	trans	-56.2	-37	179.9	-73.6	75.2	-171.5	0	0	112.9	L27 F28 V40 V42 R44	E24-L27 PolarHBondContact O-N 3.32Å; E24-F28 VanDerWaalsContact O-CB 3.26Å; E24-F28 WeakPolarHBondContact O-CB 3.34Å; E24-F28 PolarHBondContact O-N 3.45Å; E24-V40 HydrophobicContact CB-CG1 4.33Å; E24-V40 HydrophobicContact CG-CG1 4.36Å; E24-V42 HydrophobicContact CG-CG2 4.37Å; E24-V42 WeakPolarHBondContact OE1-CB 3.2Å; E24-V42 PolarHBondContact OE1-N 3.16Å; E24-R44 IonicContact OE1-CZ 2.68Å; E24-R44 IonicContact OE1-NH1 3.24Å; E24-R44 PolarHBondContact OE1-NH1 2.99Å; E24-R44 IonicContact OE1-NH2 2.72Å; E24-R44 IonicContact OE2-CZ 3.52Å; E24-R44 IonicContact OE2-NH1 2.72Å; E24-R44 PolarHBondContact OE2-NH1 3.36Å; E24-R44 IonicContact OE2-NH2 2.74Å; E24-R44 PolarHBondContact OE2-NH2 3.4Å
25	T	96.8	Very high	96.1	Very high	87 Å²	87	47.6 Å²	47.6	53%	0.534	26%	0.255	S	S	.	.	H	α-helix	trans	-64.6	-45.3	-178.1	-53	0	0	0	0	111.8	N23 L27 F28 N29	N23-T25 VanDerWaalsContact C-N 3.25Å; N23-T25 PolarHBondContact O-N 3.25Å; N23-T25 VanDerWaalsContact OD1-CB 3.32Å; N23-T25 WeakPolarHBondContact OD1-CB 3.21Å; N23-T25 PolarHBondContact OD1-N 3.35Å; T25-L27 VanDerWaalsContact C-N 3.33Å; T25-L27 PolarHBondContact O-N 3.23Å; T25-F28 PolarHBondContact O-N 3.16Å; T25-N29 WeakPolarHBondContact O-CB 3.1Å; T25-N29 PolarHBondContact O-N 3.26Å
26	Y	97.3	Very high	96	Very high	110 Å²	110	50.6 Å²	50.6	43%	0.431	27%	0.274	S	S	.	.	H	α-helix	trans	-61.8	-43.1	177.3	-71.8	-70.1	0	0	0	111.8	N23 K30 M78	N23-Y26 PolarHBondContact O-N 2.86Å; N23-Y26 WeakPolarHBondContact OD1-CD2 3.43Å; N23-Y26 PolarHBondContact OD1-N 3.44Å; Y26-K30 WeakPolarHBondContact O-CB 3.42Å; Y26-K30 PolarHBondContact O-N 3.4Å; Y26-K30 VanDerWaalsContact O-N 3.09Å; Y26-M78 HydrophobicContact CD2-SD 4.33Å; Y26-M78 HydrophobicContact CE2-SD 4.2Å
27	L	97.8	Very high	96	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.6	-42.4	176.9	-70.6	173.7	0	0	0	111.5	V15 L18 V22 N23 E24 T25 N29 K30 F31 V40 V42 A55 L77 M82	V15-L27 HydrophobicContact CG1-CD2 4.41Å; L18-L27 HydrophobicContact CD1-CD1 4.05Å; L18-L27 HydrophobicContact CD1-CD2 4.46Å; L18-L27 HydrophobicContact CD2-CD2 4.03Å; V22-L27 HydrophobicContact CG1-CD1 4.07Å; V22-L27 HydrophobicContact CG1-CD2 4.02Å; V22-L27 HydrophobicContact CG1-CG 3.68Å; N23-L27 PolarHBondContact O-N 3.15Å; E24-L27 PolarHBondContact O-N 3.32Å; T25-L27 VanDerWaalsContact C-N 3.33Å; T25-L27 PolarHBondContact O-N 3.23Å; L27-N29 PolarHBondContact O-N 2.94Å; L27-K30 PolarHBondContact O-N 3.27Å; L27-F31 HydrophobicContact CD2-CD2 4.3Å; L27-F31 HydrophobicContact CD2-CE2 3.86Å; L27-F31 WeakPolarHBondContact O-CB 3.36Å; L27-F31 VanDerWaalsContact O-CD2 3.28Å; L27-F31 WeakPolarHBondContact O-CD2 3.41Å; L27-F31 PolarHBondContact O-N 2.89Å; L27-V40 HydrophobicContact CB-CG1 3.54Å; L27-V40 HydrophobicContact CD1-CG1 3.96Å; L27-V40 HydrophobicContact CG-CG1 4.43Å; L27-V42 HydrophobicContact CD1-CG2 3.63Å; L27-A55 HydrophobicContact CD1-CB 3.38Å; L27-L77 HydrophobicContact CD2-CD2 3.75Å; L27-L77 HydrophobicContact CG-CD2 4.41Å; L27-M82 HydrophobicContact CD2-SD 4.34Å
28	F	97.6	Very high	96	Very high	105 Å²	105	55.9 Å²	55.9	46%	0.461	30%	0.302	S	S	.	.	H	α-helix	trans	-57.9	-52	177.4	-174.6	-87.1	0	0	0	110.8	E24 T25 K30 F31 S32 L37 V40	E24-F28 VanDerWaalsContact O-CB 3.26Å; E24-F28 WeakPolarHBondContact O-CB 3.34Å; E24-F28 PolarHBondContact O-N 3.45Å; T25-F28 PolarHBondContact O-N 3.16Å; F28-K30 VanDerWaalsContact C-N 3.32Å; F28-K30 PolarHBondContact O-N 3.1Å; F28-F31 PolarHBondContact O-N 3.45Å; F28-S32 WeakPolarHBondContact O-CB 3.31Å; F28-S32 PolarHBondContact O-N 3.07Å; F28-S32 PolarHBondContact O-OG 2.05Å; F28-S32 VanDerWaalsContact O-OG 3.06Å; F28-L37 HydrophobicContact CD2-CD1 3.78Å; F28-L37 HydrophobicContact CE2-CB 4.3Å; F28-L37 HydrophobicContact CE2-CD1 4.15Å; F28-L37 HydrophobicContact CG-CD1 4.25Å; F28-V40 HydrophobicContact CB-CG2 4.37Å; F28-V40 HydrophobicContact CD2-CG2 4.25Å
29	N	96.6	Very high	96	Very high	97 Å²	97	58.5 Å²	58.5	52%	0.519	32%	0.32	S	S	.	.	H	α-helix	trans	-61.9	-37.8	179.9	-70	-15.1	0	0	0	112.8	T25 L27 S32	T25-N29 WeakPolarHBondContact O-CB 3.1Å; T25-N29 PolarHBondContact O-N 3.26Å; L27-N29 PolarHBondContact O-N 2.94Å; N29-S32 PolarHBondContact O-OG 3.02Å
30	K	97	Very high	96.1	Very high	58 Å²	58	57.3 Å²	57.3	25%	0.252	32%	0.316	S	S	.	.	H	α-helix	trans	-68.6	-52.1	178.3	-178.2	67.8	177.9	179.4	0	111	Y26 L27 F28 T33 M72 D75 M82	Y26-K30 WeakPolarHBondContact O-CB 3.42Å; Y26-K30 PolarHBondContact O-N 3.4Å; Y26-K30 VanDerWaalsContact O-N 3.09Å; L27-K30 PolarHBondContact O-N 3.27Å; F28-K30 VanDerWaalsContact C-N 3.32Å; F28-K30 PolarHBondContact O-N 3.1Å; K30-T33 PolarHBondContact O-OG1 3.23Å; K30-M72 WeakPolarHBondContact O-CE 3.41Å; K30-D75 WeakPolarHBondContact CE-OD2 3.43Å; K30-D75 IonicContact NZ-OD2 3.53Å; K30-D75 PolarHBondContact NZ-OD2 2.84Å; K30-M82 HydrophobicContact CG-CE 4.16Å
31	F	97.8	Very high	96.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-80.4	-21.7	-172.1	-77.5	-95.5	0	0	0	113.6	L13 V15 L27 F28 T33 A34 L37 V57 F59 A68 M72 M82 I84	L13-F31 HydrophobicContact CD1-CE1 4.14Å; V15-F31 HydrophobicContact CB-CZ 4.48Å; V15-F31 HydrophobicContact CG1-CE2 4.32Å; V15-F31 HydrophobicContact CG1-CZ 4.07Å; V15-F31 HydrophobicContact CG2-CE1 4.16Å; V15-F31 HydrophobicContact CG2-CE2 4.12Å; V15-F31 HydrophobicContact CG2-CZ 3.54Å; L27-F31 HydrophobicContact CD2-CD2 4.3Å; L27-F31 HydrophobicContact CD2-CE2 3.86Å; L27-F31 WeakPolarHBondContact O-CB 3.36Å; L27-F31 VanDerWaalsContact O-CD2 3.28Å; L27-F31 WeakPolarHBondContact O-CD2 3.41Å; L27-F31 PolarHBondContact O-N 2.89Å; F28-F31 PolarHBondContact O-N 3.45Å; F31-T33 PolarHBondContact O-N 2.86Å; F31-A34 PolarHBondContact O-N 3.26Å; F31-L37 HydrophobicContact CB-CD1 4.01Å; F31-L37 HydrophobicContact CB-CD2 4.1Å; F31-V57 HydrophobicContact CB-CG1 3.98Å; F31-V57 HydrophobicContact CD1-CB 4.43Å; F31-V57 HydrophobicContact CD1-CG1 3.93Å; F31-V57 HydrophobicContact CD1-CG2 4.42Å; F31-V57 HydrophobicContact CD2-CG2 4.15Å; F31-V57 HydrophobicContact CE2-CG2 4.26Å; F31-V57 HydrophobicContact CG-CG1 3.94Å; F31-V57 HydrophobicContact CG-CG2 4.24Å; F31-V57 HydrophobicContact CZ-CG2 4.44Å; F31-F59 HydrophobicContact CB-CZ 4.01Å; F31-F59 AromaticContact CD1-CE2 3.9Å; F31-F59 HydrophobicContact CD1-CE2 3.9Å; F31-F59 AromaticContact CD1-CZ 3.83Å; F31-F59 HydrophobicContact CD1-CZ 3.83Å; F31-F59 HydrophobicContact CG-CZ 4.43Å; F31-F59 WeakPolarHBondContact O-CE1 3.46Å; F31-A68 HydrophobicContact CD1-CB 4Å; F31-A68 HydrophobicContact CE1-CB 4.23Å; F31-M72 HydrophobicContact CD1-SD 4.07Å; F31-M72 HydrophobicContact CE1-SD 4.31Å; F31-M72 HydrophobicContact CG-SD 4.39Å; F31-M82 HydrophobicContact CE2-SD 4.31Å; F31-I84 HydrophobicContact CE1-CD1 3.82Å; F31-I84 HydrophobicContact CZ-CD1 3.64Å; F31-I84 HydrophobicContact CZ-CG1 4.25Å
32	S	97	Very high	96.5	Very high	49 Å²	49	56.5 Å²	56.5	34%	0.343	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-63.1	-22.9	175.3	62.1	0	0	0	0	112.8	F28 N29 A34 G35	F28-S32 WeakPolarHBondContact O-CB 3.31Å; F28-S32 PolarHBondContact O-N 3.07Å; F28-S32 PolarHBondContact O-OG 2.05Å; F28-S32 VanDerWaalsContact O-OG 3.06Å; N29-S32 PolarHBondContact O-OG 3.02Å; S32-A34 PolarHBondContact O-N 2.89Å; S32-G35 PolarHBondContact O-N 3.28Å
33	T	96.7	Very high	96.4	Very high	104 Å²	104	56.7 Å²	56.7	64%	0.638	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-67	-22.9	174.5	65.6	0	0	0	0	112.9	K30 F31 M72	K30-T33 PolarHBondContact O-OG1 3.23Å; F31-T33 PolarHBondContact O-N 2.86Å; T33-M72 WeakPolarHBondContact OG1-CE 3.41Å
34	A	96.7	Very high	96.4	Very high	2 Å²	2	58.3 Å²	58.3	2%	0.017	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-89.4	-7.7	174.7	0	0	0	0	0	113.6	F31 S32 F59 D64 R67 A68 M72	F31-A34 PolarHBondContact O-N 3.26Å; S32-A34 PolarHBondContact O-N 2.89Å; A34-F59 HydrophobicContact CB-CE1 3.95Å; A34-F59 HydrophobicContact CB-CZ 4.04Å; A34-D64 VanDerWaalsContact O-CB 3.29Å; A34-D64 WeakPolarHBondContact O-CB 3.47Å; A34-D64 VanDerWaalsContact O-OD1 3.09Å; A34-R67 PolarHBondContact O-NE 3.05Å; A34-R67 PolarHBondContact O-NH2 2.68Å; A34-A68 HydrophobicContact CB-CB 3.67Å; A34-M72 HydrophobicContact CB-CE 3.53Å; A34-M72 HydrophobicContact CB-SD 4.39Å
35	G	95.3	Very high	96	Very high	11 Å²	11	58.5 Å²	58.5	11%	0.113	30%	0.301	C	S	.	.	S	Bend	trans	141.5	175.6	178.1	0	0	0	0	0	114.4	S32 L37	S32-G35 PolarHBondContact O-N 3.28Å; G35-L37 PolarHBondContact O-N 2.87Å
36	P	95.3	Very high	95.6	Very high	62 Å²	62	60.2 Å²	60.2	40%	0.403	32%	0.317	S	S	.	.			trans	-62.3	129	-178.2	23.3	-34.3	0	0	0	113.3	R60 Y61 D64	P36-R60 HydrophobicContact CB-CB 4.24Å; P36-R60 HydrophobicContact CG-CB 4.09Å; P36-R60 PolarHBondContact O-N 3.47Å; P36-Y61 HydrophobicContact CG-CD2 3.9Å; P36-Y61 HydrophobicContact CG-CE2 3.86Å; P36-D64 WeakPolarHBondContact CD-OD2 3.31Å
37	L	95.3	Very high	95.1	Very high	30 Å²	30	59.1 Å²	59.1	16%	0.157	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	141.2	178.6	-55.8	179.7	0	0	0	111.7	F28 F31 G35 V40 V57 N58 F59	F28-L37 HydrophobicContact CD2-CD1 3.78Å; F28-L37 HydrophobicContact CE2-CB 4.3Å; F28-L37 HydrophobicContact CE2-CD1 4.15Å; F28-L37 HydrophobicContact CG-CD1 4.25Å; F31-L37 HydrophobicContact CB-CD1 4.01Å; F31-L37 HydrophobicContact CB-CD2 4.1Å; G35-L37 PolarHBondContact O-N 2.87Å; L37-V40 HydrophobicContact CD1-CG2 3.78Å; L37-V57 HydrophobicContact CD2-CG1 3.79Å; L37-N58 CarbonylContact C-O 3.59Å; L37-F59 HydrophobicContact CD2-CD1 3.52Å; L37-F59 HydrophobicContact CD2-CD2 4.08Å; L37-F59 HydrophobicContact CD2-CE1 3.35Å; L37-F59 HydrophobicContact CD2-CE2 3.92Å; L37-F59 HydrophobicContact CD2-CG 3.9Å; L37-F59 HydrophobicContact CD2-CZ 3.56Å
38	L	93.4	Very high	94.9	Very high	111 Å²	111	63 Å²	63	58%	0.581	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.6	-41.7	168.2	-70.1	176.1	0	0	0	111.8	N58 F59 R60	L38-N58 HydrophobicContact CB-CB 4.18Å; L38-N58 PolarHBondContact N-O 3.11Å; L38-F59 WeakPolarHBondContact CD1-O 3.43Å; L38-R60 HydrophobicContact CD2-CB 4.37Å; L38-R60 HydrophobicContact CG-CB 4.3Å
39	S	95.3	Very high	94.5	Very high	56 Å²	56	62.7 Å²	62.7	39%	0.392	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164	153.5	177.7	52.4	0	0	0	0	112.1	N58	S39-N58 PolarHBondContact N-O 2.97Å; S39-N58 PolarHBondContact O-N 3.47Å; S39-N58 PolarHBondContact OG-ND2 3.49Å
40	V	96.8	Very high	94.2	Very high	24 Å²	24	67.2 Å²	67.2	15%	0.145	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	131.3	171.2	177.6	0	0	0	0	107.3	E24 L27 F28 L37 Y56 V57	E24-V40 HydrophobicContact CB-CG1 4.33Å; E24-V40 HydrophobicContact CG-CG1 4.36Å; L27-V40 HydrophobicContact CB-CG1 3.54Å; L27-V40 HydrophobicContact CD1-CG1 3.96Å; L27-V40 HydrophobicContact CG-CG1 4.43Å; F28-V40 HydrophobicContact CB-CG2 4.37Å; F28-V40 HydrophobicContact CD2-CG2 4.25Å; L37-V40 HydrophobicContact CD1-CG2 3.78Å; V40-Y56 WeakPolarHBondContact CA-O 3.24Å; V40-V57 HydrophobicContact CG1-CG2 4.41Å; V40-V57 HydrophobicContact CG2-CG1 4.36Å; V40-V57 HydrophobicContact CG2-CG2 4.46Å
41	R	96.4	Very high	94.1	Very high	164 Å²	164	65.9 Å²	65.9	62%	0.619	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	116.1	-179.8	-176.4	-177.1	-178.2	-138.9	1.5	111.1	A55 Y56	R41-A55 CarbonylContact O-C 3.34Å; R41-A55 WeakPolarHBondContact O-CA 3.06Å; R41-A55 VanDerWaalsContact O-CB 3.25Å; R41-A55 WeakPolarHBondContact O-CB 3.32Å; R41-Y56 PolarHBondContact N-O 2.59Å; R41-Y56 PolarHBondContact O-N 2.81Å
42	V	97.3	Very high	93.9	Very high	4 Å²	4	70.1 Å²	70.1	2%	0.024	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	128.2	169.1	179.1	0	0	0	0	109	E24 L27 R44 A55	E24-V42 HydrophobicContact CG-CG2 4.37Å; E24-V42 WeakPolarHBondContact OE1-CB 3.2Å; E24-V42 PolarHBondContact OE1-N 3.16Å; L27-V42 HydrophobicContact CD1-CG2 3.63Å; V42-R44 PolarHBondContact O-NH1 3.09Å; V42-A55 HydrophobicContact CG2-CB 4.14Å
43	C	94.9	Very high	93.7	Very high	7 Å²	7	68.6 Å²	68.6	5%	0.047	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	130	177.7	-69.3	0	0	0	0	110	L52 Y54	C43-L52 HydrophobicContact CB-CD1 4.4Å; C43-L52 WeakPolarHBondContact O-CB 2.96Å; C43-L52 PolarHBondContact O-N 3.05Å; C43-Y54 HydrophobicContact CB-CD1 4.16Å; C43-Y54 HydrophobicContact CB-CD2 3.91Å; C43-Y54 HydrophobicContact CB-CE1 3.68Å; C43-Y54 HydrophobicContact CB-CE2 3.43Å; C43-Y54 VanDerWaalsContact CB-CE2 3.43Å; C43-Y54 HydrophobicContact CB-CG 4.26Å; C43-Y54 PolarHBondContact N-O 3.37Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.36Å
44	R	96.4	Very high	93.7	Very high	90 Å²	90	66.6 Å²	66.6	34%	0.34	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	152.1	-174.4	-68.5	173.2	176.4	91	-4.2	110.9	E24 V42 V49 R50	E24-R44 IonicContact OE1-CZ 2.68Å; E24-R44 IonicContact OE1-NH1 3.24Å; E24-R44 PolarHBondContact OE1-NH1 2.99Å; E24-R44 IonicContact OE1-NH2 2.72Å; E24-R44 IonicContact OE2-CZ 3.52Å; E24-R44 IonicContact OE2-NH1 2.72Å; E24-R44 PolarHBondContact OE2-NH1 3.36Å; E24-R44 IonicContact OE2-NH2 2.74Å; E24-R44 PolarHBondContact OE2-NH2 3.4Å; V42-R44 PolarHBondContact O-NH1 3.09Å; R44-V49 VanDerWaalsContact CD-O 3.22Å; R44-V49 WeakPolarHBondContact CD-O 3.44Å; R44-R50 CarbonylContact C-O 3.53Å; R44-R50 WeakPolarHBondContact CA-O 3.44Å; R44-R50 WeakPolarHBondContact CB-O 3.44Å
45	D	89.4	Confident	93.8	Very high	58 Å²	58	66.5 Å²	66.5	31%	0.31	36%	0.363	S	S	.	.			trans	-65.3	132.6	169.7	176	-96.9	0	0	0	109.6	A47 T48 V49 R50 L52	D45-A47 VanDerWaalsContact C-N 3.28Å; D45-A47 PolarHBondContact O-N 3.21Å; D45-A47 PolarHBondContact OD1-N 2.76Å; D45-A47 VanDerWaalsContact OD1-N 3.07Å; D45-T48 WeakPolarHBondContact CB-OG1 3.35Å; D45-T48 WeakPolarHBondContact OD1-CB 3.08Å; D45-T48 PolarHBondContact OD1-N 2.82Å; D45-T48 PolarHBondContact OD1-OG1 3.39Å; D45-V49 VanDerWaalsContact O-CA 3.31Å; D45-V49 WeakPolarHBondContact O-CA 3.41Å; D45-V49 PolarHBondContact O-N 2.7Å; D45-R50 PolarHBondContact N-O 3.34Å; D45-L52 HydrophobicContact CB-CD2 3.91Å
46	S	87.2	Confident	93.8	Very high	123 Å²	123	69 Å²	69	86%	0.86	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-24.5	-172.8	54.5	0	0	0	0	113.5
47	A	87.6	Confident	93.9	Very high	87 Å²	87	66.1 Å²	66.1	72%	0.719	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-40.2	-178.6	0	0	0	0	0	112.1	D45	D45-A47 VanDerWaalsContact C-N 3.28Å; D45-A47 PolarHBondContact O-N 3.21Å; D45-A47 PolarHBondContact OD1-N 2.76Å; D45-A47 VanDerWaalsContact OD1-N 3.07Å
48	T	92.6	Very high	94	Very high	80 Å²	80	66.4 Å²	66.4	49%	0.491	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-12.2	-172.1	62.4	0	0	0	0	114.1	D45 R50	D45-T48 WeakPolarHBondContact CB-OG1 3.35Å; D45-T48 WeakPolarHBondContact OD1-CB 3.08Å; D45-T48 PolarHBondContact OD1-N 2.82Å; D45-T48 PolarHBondContact OD1-OG1 3.39Å; T48-R50 PolarHBondContact O-N 3.1Å; T48-R50 PolarHBondContact OG1-N 3.3Å
49	V	89.6	Confident	94.1	Very high	100 Å²	100	61.3 Å²	61.3	61%	0.606	33%	0.325	S	S	*	.			trans	59.7	10.5	-174.5	-164.7	0	0	0	0	112.7	R44 D45	R44-V49 VanDerWaalsContact CD-O 3.22Å; R44-V49 WeakPolarHBondContact CD-O 3.44Å; D45-V49 VanDerWaalsContact O-CA 3.31Å; D45-V49 WeakPolarHBondContact O-CA 3.41Å; D45-V49 PolarHBondContact O-N 2.7Å
50	R	90.9	Very high	94	Very high	191 Å²	191	65.7 Å²	65.7	72%	0.721	33%	0.334	S	S	*	.			trans	-77.6	146.5	177.6	-68.3	-175.2	179.3	-169.3	-0.2	110.8	R44 D45 T48 L52	R44-R50 CarbonylContact C-O 3.53Å; R44-R50 WeakPolarHBondContact CA-O 3.44Å; R44-R50 WeakPolarHBondContact CB-O 3.44Å; D45-R50 PolarHBondContact N-O 3.34Å; T48-R50 PolarHBondContact O-N 3.1Å; T48-R50 PolarHBondContact OG1-N 3.3Å; R50-L52 PolarHBondContact O-N 2.9Å
51	S	94	Very high	93.8	Very high	30 Å²	30	70.7 Å²	70.7	21%	0.21	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	132.9	174.9	-178.9	0	0	0	0	111	P20 G53	P20-S51 VanDerWaalsContact O-CB 3.31Å; P20-S51 WeakPolarHBondContact O-CB 3.1Å; S51-G53 PolarHBondContact O-N 3.28Å; S51-G53 PolarHBondContact OG-N 3.06Å; S51-G53 VanDerWaalsContact OG-N 3.1Å
52	L	93.3	Very high	93.7	Very high	89 Å²	89	66.8 Å²	66.8	47%	0.466	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	4.3	170.1	-64.2	173.6	0	0	0	112	C43 D45 R50 Y54	C43-L52 HydrophobicContact CB-CD1 4.4Å; C43-L52 WeakPolarHBondContact O-CB 2.96Å; C43-L52 PolarHBondContact O-N 3.05Å; D45-L52 HydrophobicContact CB-CD2 3.91Å; R50-L52 PolarHBondContact O-N 2.9Å; L52-Y54 HydrophobicContact CB-CD1 3.79Å; L52-Y54 HydrophobicContact CB-CE1 3.53Å; L52-Y54 HydrophobicContact CD1-CE1 3.91Å; L52-Y54 HydrophobicContact CG-CE1 4.38Å
53	G	94.3	Very high	93.6	Very high	17 Å²	17	74.1 Å²	74.1	18%	0.175	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	79.4	18.3	178.2	0	0	0	0	0	114.6	D17 L18 S51	D17-G53 PolarHBondContact N-O 3.08Å; D17-G53 VanDerWaalsContact N-O 3.08Å; L18-G53 PolarHBondContact N-O 3.37Å; S51-G53 PolarHBondContact O-N 3.28Å; S51-G53 PolarHBondContact OG-N 3.06Å; S51-G53 VanDerWaalsContact OG-N 3.1Å
54	Y	96.3	Very high	93.7	Very high	63 Å²	63	74.5 Å²	74.5	25%	0.247	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	160.1	174	74.2	-81.4	0	0	0	113	Y14 V15 C43 L52 Y56	Y14-Y54 HydrophobicContact CD2-CD2 4.14Å; Y14-Y54 AromaticContact CE2-CD2 3.46Å; Y14-Y54 HydrophobicContact CE2-CD2 3.46Å; Y14-Y54 VanDerWaalsContact CE2-CD2 3.46Å; Y14-Y54 HydrophobicContact CE2-CE2 4.18Å; Y14-Y54 AromaticContact CE2-CG 3.88Å; Y14-Y54 HydrophobicContact CE2-CG 3.88Å; Y14-Y54 WeakPolarHBondContact OH-CB 3.15Å; V15-Y54 CarbonylContact O-C 3.57Å; V15-Y54 WeakPolarHBondContact O-CA 3.33Å; V15-Y54 WeakPolarHBondContact O-CB 3.39Å; C43-Y54 HydrophobicContact CB-CD1 4.16Å; C43-Y54 HydrophobicContact CB-CD2 3.91Å; C43-Y54 HydrophobicContact CB-CE1 3.68Å; C43-Y54 HydrophobicContact CB-CE2 3.43Å; C43-Y54 VanDerWaalsContact CB-CE2 3.43Å; C43-Y54 HydrophobicContact CB-CG 4.26Å; C43-Y54 PolarHBondContact N-O 3.37Å; C43-Y54 WeakPolarHBondContact SG-CE2 3.36Å; L52-Y54 HydrophobicContact CB-CD1 3.79Å; L52-Y54 HydrophobicContact CB-CE1 3.53Å; L52-Y54 HydrophobicContact CD1-CE1 3.91Å; L52-Y54 HydrophobicContact CG-CE1 4.38Å; Y54-Y56 HydrophobicContact CD2-CE2 4.27Å; Y54-Y56 AromaticContact CE2-CE2 3.81Å; Y54-Y56 HydrophobicContact CE2-CE2 3.81Å
55	A	97.5	Very high	93.7	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	165.4	-178.6	0	0	0	0	0	112	V15 L18 L27 R41 V42	V15-A55 PolarHBondContact N-O 3.07Å; V15-A55 PolarHBondContact O-N 2.85Å; L18-A55 HydrophobicContact CD1-CB 3.73Å; L27-A55 HydrophobicContact CD1-CB 3.38Å; R41-A55 CarbonylContact O-C 3.34Å; R41-A55 WeakPolarHBondContact O-CA 3.06Å; R41-A55 VanDerWaalsContact O-CB 3.25Å; R41-A55 WeakPolarHBondContact O-CB 3.32Å; V42-A55 HydrophobicContact CG2-CB 4.14Å
56	Y	96.6	Very high	93.9	Very high	64 Å²	64	72 Å²	72	25%	0.251	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	131	167.9	-66.9	-80.4	0	0	0	109.9	L13 Y14 V40 R41 Y54 S87	L13-Y56 WeakPolarHBondContact O-CA 3.49Å; Y14-Y56 HydrophobicContact CD2-CE1 4.01Å; V40-Y56 WeakPolarHBondContact CA-O 3.24Å; R41-Y56 PolarHBondContact N-O 2.59Å; R41-Y56 PolarHBondContact O-N 2.81Å; Y54-Y56 HydrophobicContact CD2-CE2 4.27Å; Y54-Y56 AromaticContact CE2-CE2 3.81Å; Y54-Y56 HydrophobicContact CE2-CE2 3.81Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.39Å
57	V	97.2	Very high	94.4	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.2	176.5	179.3	0	0	0	0	108.1	S12 L13 V15 F31 L37 V40 F59	S12-V57 WeakPolarHBondContact CA-O 3.48Å; L13-V57 PolarHBondContact N-O 3.41Å; L13-V57 PolarHBondContact O-N 3.46Å; V15-V57 HydrophobicContact CG2-CB 4.42Å; V15-V57 HydrophobicContact CG2-CG2 3.78Å; F31-V57 HydrophobicContact CB-CG1 3.98Å; F31-V57 HydrophobicContact CD1-CB 4.43Å; F31-V57 HydrophobicContact CD1-CG1 3.93Å; F31-V57 HydrophobicContact CD1-CG2 4.42Å; F31-V57 HydrophobicContact CD2-CG2 4.15Å; F31-V57 HydrophobicContact CE2-CG2 4.26Å; F31-V57 HydrophobicContact CG-CG1 3.94Å; F31-V57 HydrophobicContact CG-CG2 4.24Å; F31-V57 HydrophobicContact CZ-CG2 4.44Å; L37-V57 HydrophobicContact CD2-CG1 3.79Å; V40-V57 HydrophobicContact CG1-CG2 4.41Å; V40-V57 HydrophobicContact CG2-CG1 4.36Å; V40-V57 HydrophobicContact CG2-CG2 4.46Å; V57-F59 HydrophobicContact CG1-CD2 4.13Å; V57-F59 HydrophobicContact CG1-CE2 3.7Å; V57-F59 HydrophobicContact CG1-CZ 4.36Å
58	N	96.2	Very high	94.8	Very high	37 Å²	37	68 Å²	68	20%	0.198	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.3	-179.9	-58.6	-68.3	0	0	0	108.7	S12 L37 L38 S39	S12-N58 WeakPolarHBondContact CB-OD1 3.36Å; S12-N58 PolarHBondContact OG-OD1 3.37Å; L37-N58 CarbonylContact C-O 3.59Å; L38-N58 HydrophobicContact CB-CB 4.18Å; L38-N58 PolarHBondContact N-O 3.11Å; S39-N58 PolarHBondContact N-O 2.97Å; S39-N58 PolarHBondContact O-N 3.47Å; S39-N58 PolarHBondContact OG-ND2 3.49Å
59	F	96.7	Very high	94.9	Very high	3 Å²	3	65.4 Å²	65.4	1%	0.013	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	158.3	173	-75.9	-94.7	0	0	0	110.9	A11 L13 F31 A34 L37 L38 V57 Y61 D64 A65 A68	A11-F59 HydrophobicContact CB-CB 4.06Å; A11-F59 WeakPolarHBondContact CB-O 3.46Å; A11-F59 PolarHBondContact O-N 2.98Å; L13-F59 HydrophobicContact CD1-CD2 4.33Å; L13-F59 HydrophobicContact CD1-CE2 3.81Å; F31-F59 HydrophobicContact CB-CZ 4.01Å; F31-F59 AromaticContact CD1-CE2 3.9Å; F31-F59 HydrophobicContact CD1-CE2 3.9Å; F31-F59 AromaticContact CD1-CZ 3.83Å; F31-F59 HydrophobicContact CD1-CZ 3.83Å; F31-F59 HydrophobicContact CG-CZ 4.43Å; F31-F59 WeakPolarHBondContact O-CE1 3.46Å; A34-F59 HydrophobicContact CB-CE1 3.95Å; A34-F59 HydrophobicContact CB-CZ 4.04Å; L37-F59 HydrophobicContact CD2-CD1 3.52Å; L37-F59 HydrophobicContact CD2-CD2 4.08Å; L37-F59 HydrophobicContact CD2-CE1 3.35Å; L37-F59 HydrophobicContact CD2-CE2 3.92Å; L37-F59 HydrophobicContact CD2-CG 3.9Å; L37-F59 HydrophobicContact CD2-CZ 3.56Å; L38-F59 WeakPolarHBondContact CD1-O 3.43Å; V57-F59 HydrophobicContact CG1-CD2 4.13Å; V57-F59 HydrophobicContact CG1-CE2 3.7Å; V57-F59 HydrophobicContact CG1-CZ 4.36Å; F59-Y61 WeakPolarHBondContact CB-O 3.47Å; F59-D64 HydrophobicContact CB-CB 4.25Å; F59-D64 HydrophobicContact CD1-CB 3.33Å; F59-D64 HydrophobicContact CE1-CB 3.88Å; F59-D64 HydrophobicContact CG-CB 4.01Å; F59-A65 HydrophobicContact CB-CB 4.05Å; F59-A65 HydrophobicContact CD2-CB 3.67Å; F59-A65 HydrophobicContact CE2-CB 4.42Å; F59-A65 HydrophobicContact CG-CB 4.02Å; F59-A68 HydrophobicContact CE1-CB 4.48Å; F59-A68 HydrophobicContact CE2-CB 3.82Å; F59-A68 HydrophobicContact CZ-CB 3.54Å
60	R	92.2	Very high	95	Very high	149 Å²	149	65.2 Å²	65.2	56%	0.562	29%	0.29	S	S	*	.	S	Bend	trans	-71.1	-37.6	170.2	-177.2	175.8	-77.9	-134.6	-1.9	111.5	P36 L38	P36-R60 HydrophobicContact CB-CB 4.24Å; P36-R60 HydrophobicContact CG-CB 4.09Å; P36-R60 PolarHBondContact O-N 3.47Å; L38-R60 HydrophobicContact CD2-CB 4.37Å; L38-R60 HydrophobicContact CG-CB 4.3Å
61	Y	93.9	Very high	95.2	Very high	128 Å²	128	60.3 Å²	60.3	50%	0.502	28%	0.281	S	S	.	.	S	Bend	trans	-120.8	142.8	-177.5	-51.8	-64.4	0	0	0	111.8	P36 F59 E63 D64 A65	P36-Y61 HydrophobicContact CG-CD2 3.9Å; P36-Y61 HydrophobicContact CG-CE2 3.86Å; F59-Y61 WeakPolarHBondContact CB-O 3.47Å; Y61-E63 VanDerWaalsContact C-N 3.26Å; Y61-E63 PolarHBondContact O-N 3.18Å; Y61-D64 WeakPolarHBondContact CB-OD2 3.3Å; Y61-D64 WeakPolarHBondContact CD2-OD2 3.21Å; Y61-D64 PolarHBondContact O-N 3.39Å; Y61-A65 PolarHBondContact O-N 2.03Å
62	H	93.8	Very high	95.3	Very high	83 Å²	83	59.3 Å²	59.3	38%	0.384	27%	0.273	S	S	.	.	H	α-helix	trans	-62.1	-35.3	179.6	-179.9	84.2	0	0	0	112.2	A11 D64 A65 K66 W86	A11-H62 HydrophobicContact CB-CB 4.43Å; H62-D64 VanDerWaalsContact C-N 3.33Å; H62-D64 PolarHBondContact O-N 2.89Å; H62-A65 PolarHBondContact O-N 2.9Å; H62-K66 WeakPolarHBondContact O-CB 3.32Å; H62-K66 PolarHBondContact O-N 3.17Å; H62-W86 AromaticContact CE1-CH2 3.23Å; H62-W86 WeakPolarHBondContact CE1-CH2 3.42Å; H62-W86 AromaticContact CE1-CZ2 3.59Å; H62-W86 AromaticContact CE1-CZ3 3.8Å; H62-W86 AromaticContact ND1-CH2 3.54Å; H62-W86 AromaticContact ND1-CZ3 3.85Å; H62-W86 AromaticContact NE2-CH2 3.82Å; H62-W86 AromaticContact NE2-CZ2 3.95Å
63	E	94.9	Very high	95.3	Very high	157 Å²	157	56.3 Å²	56.3	73%	0.734	26%	0.258	S	S	*	.	H	α-helix	trans	-62.7	-38.6	178.8	-62.8	176.1	-169.5	0	0	112.1	Y61 K66 R67	Y61-E63 VanDerWaalsContact C-N 3.26Å; Y61-E63 PolarHBondContact O-N 3.18Å; E63-K66 PolarHBondContact O-N 3.08Å; E63-R67 WeakPolarHBondContact O-CB 3.21Å; E63-R67 PolarHBondContact O-N 3.21Å
64	D	96.7	Very high	95.3	Very high	15 Å²	15	57.1 Å²	57.1	8%	0.08	26%	0.257	C	S	.	.	H	α-helix	trans	-68.5	-42.2	176.3	-61.9	-41.7	0	0	0	111.6	A34 P36 F59 Y61 H62 K66 R67 A68	A34-D64 VanDerWaalsContact O-CB 3.29Å; A34-D64 WeakPolarHBondContact O-CB 3.47Å; A34-D64 VanDerWaalsContact O-OD1 3.09Å; P36-D64 WeakPolarHBondContact CD-OD2 3.31Å; F59-D64 HydrophobicContact CB-CB 4.25Å; F59-D64 HydrophobicContact CD1-CB 3.33Å; F59-D64 HydrophobicContact CE1-CB 3.88Å; F59-D64 HydrophobicContact CG-CB 4.01Å; Y61-D64 WeakPolarHBondContact CB-OD2 3.3Å; Y61-D64 WeakPolarHBondContact CD2-OD2 3.21Å; Y61-D64 PolarHBondContact O-N 3.39Å; H62-D64 VanDerWaalsContact C-N 3.33Å; H62-D64 PolarHBondContact O-N 2.89Å; D64-K66 VanDerWaalsContact C-N 3.33Å; D64-K66 PolarHBondContact O-N 3.22Å; D64-R67 PolarHBondContact O-N 2.92Å; D64-R67 IonicContact OD1-CZ 3.7Å; D64-R67 IonicContact OD1-NH2 2.73Å; D64-R67 PolarHBondContact OD1-NH2 3.46Å; D64-A68 WeakPolarHBondContact O-CB 3.3Å; D64-A68 PolarHBondContact O-N 3.11Å
65	A	96.3	Very high	95.3	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.7	-42.2	173.7	0	0	0	0	0	111.5	A11 L13 F59 Y61 H62 A68 L69 W86	A11-A65 HydrophobicContact CB-CB 4.15Å; L13-A65 HydrophobicContact CD1-CB 4.42Å; L13-A65 WeakPolarHBondContact CD1-O 2.97Å; L13-A65 HydrophobicContact CD2-CB 4.25Å; L13-A65 HydrophobicContact CG-CB 4.2Å; F59-A65 HydrophobicContact CB-CB 4.05Å; F59-A65 HydrophobicContact CD2-CB 3.67Å; F59-A65 HydrophobicContact CE2-CB 4.42Å; F59-A65 HydrophobicContact CG-CB 4.02Å; Y61-A65 PolarHBondContact O-N 2.03Å; H62-A65 PolarHBondContact O-N 2.9Å; A65-A68 PolarHBondContact O-N 3.04Å; A65-L69 WeakPolarHBondContact O-CB 3.42Å; A65-L69 PolarHBondContact O-N 3.01Å; A65-W86 HydrophobicContact CB-CH2 3.78Å; A65-W86 HydrophobicContact CB-CZ3 3.68Å
66	K	94.8	Very high	95.1	Very high	97 Å²	97	59.9 Å²	59.9	42%	0.422	28%	0.284	S	S	.	.	H	α-helix	trans	-63.4	-46.5	175.1	178.1	163.8	173.6	41.8	0	111.3	H62 E63 D64 A68 L69 D70 W86	H62-K66 WeakPolarHBondContact O-CB 3.32Å; H62-K66 PolarHBondContact O-N 3.17Å; E63-K66 PolarHBondContact O-N 3.08Å; D64-K66 VanDerWaalsContact C-N 3.33Å; D64-K66 PolarHBondContact O-N 3.22Å; K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.37Å; K66-L69 WeakPolarHBondContact O-CB 3.46Å; K66-L69 PolarHBondContact O-N 2.04Å; K66-D70 WeakPolarHBondContact CG-OD2 3.24Å; K66-D70 IonicContact NZ-OD1 2.7Å; K66-D70 PolarHBondContact NZ-OD1 3.39Å; K66-D70 IonicContact NZ-OD2 3.32Å; K66-D70 PolarHBondContact NZ-OD2 2.97Å; K66-D70 WeakPolarHBondContact O-CB 3.44Å; K66-D70 PolarHBondContact O-N 2.99Å; K66-W86 HydrophobicContact CB-CH2 4.2Å; K66-W86 HydrophobicContact CB-CZ2 4.05Å
67	R	96.1	Very high	95	Very high	124 Å²	124	57.8 Å²	57.8	47%	0.468	28%	0.277	S	S	.	.	H	α-helix	trans	-57.2	-45.6	175.1	176.8	168.2	59.3	-165.7	-4.5	111.3	A34 E63 D64 D70 T71	A34-R67 PolarHBondContact O-NE 3.05Å; A34-R67 PolarHBondContact O-NH2 2.68Å; E63-R67 WeakPolarHBondContact O-CB 3.21Å; E63-R67 PolarHBondContact O-N 3.21Å; D64-R67 PolarHBondContact O-N 2.92Å; D64-R67 IonicContact OD1-CZ 3.7Å; D64-R67 IonicContact OD1-NH2 2.73Å; D64-R67 PolarHBondContact OD1-NH2 3.46Å; R67-D70 PolarHBondContact O-N 3.28Å; R67-T71 HydrophobicContact CG-CG2 4.43Å; R67-T71 WeakPolarHBondContact O-CB 3.26Å; R67-T71 WeakPolarHBondContact O-CG2 3.18Å; R67-T71 PolarHBondContact O-N 3.41Å; R67-T71 PolarHBondContact O-OG1 3.08Å
68	A	97.2	Very high	94.8	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-44.2	176.7	0	0	0	0	0	112	L13 F31 A34 F59 D64 A65 K66 D70 M72	L13-A68 HydrophobicContact CD1-CB 3.9Å; F31-A68 HydrophobicContact CD1-CB 4Å; F31-A68 HydrophobicContact CE1-CB 4.23Å; A34-A68 HydrophobicContact CB-CB 3.67Å; F59-A68 HydrophobicContact CE1-CB 4.48Å; F59-A68 HydrophobicContact CE2-CB 3.82Å; F59-A68 HydrophobicContact CZ-CB 3.54Å; D64-A68 WeakPolarHBondContact O-CB 3.3Å; D64-A68 PolarHBondContact O-N 3.11Å; A65-A68 PolarHBondContact O-N 3.04Å; K66-A68 VanDerWaalsContact C-N 3.33Å; K66-A68 PolarHBondContact O-N 3.37Å; A68-D70 PolarHBondContact O-N 3Å; A68-M72 HydrophobicContact CB-SD 4.05Å; A68-M72 WeakPolarHBondContact O-CA 3.47Å; A68-M72 WeakPolarHBondContact O-CB 3.48Å; A68-M72 PolarHBondContact O-N 2.84Å
69	L	94.7	Very high	94.6	Very high	27 Å²	27	62.5 Å²	62.5	14%	0.141	32%	0.315	C	S	.	.	H	α-helix	trans	-60.2	-44.3	175.3	179.6	68.1	0	0	0	112.1	L13 A65 K66 N73 I84 W86	L13-L69 HydrophobicContact CD2-CB 4.31Å; A65-L69 WeakPolarHBondContact O-CB 3.42Å; A65-L69 PolarHBondContact O-N 3.01Å; K66-L69 WeakPolarHBondContact O-CB 3.46Å; K66-L69 PolarHBondContact O-N 2.04Å; L69-N73 VanDerWaalsContact O-CB 3.25Å; L69-N73 WeakPolarHBondContact O-CB 3.32Å; L69-I84 HydrophobicContact CB-CG2 4.47Å; L69-I84 HydrophobicContact CD1-CB 3.96Å; L69-I84 HydrophobicContact CD1-CG2 3.63Å; L69-I84 WeakPolarHBondContact CD1-O 3.08Å; L69-W86 HydrophobicContact CD2-CD2 4.39Å; L69-W86 HydrophobicContact CD2-CG 4.38Å; L69-W86 HydrophobicContact CD2-CZ2 4.27Å; L69-W86 VanDerWaalsContact CD2-NE1 3.34Å
70	D	91.8	Very high	94.3	Very high	95 Å²	95	65.8 Å²	65.8	51%	0.508	33%	0.327	S	S	.	.	H	α-helix	trans	-75.1	-29.8	-175.2	-65.6	-19.2	0	0	0	112.5	K66 R67 A68	K66-D70 WeakPolarHBondContact CG-OD2 3.24Å; K66-D70 IonicContact NZ-OD1 2.7Å; K66-D70 PolarHBondContact NZ-OD1 3.39Å; K66-D70 IonicContact NZ-OD2 3.32Å; K66-D70 PolarHBondContact NZ-OD2 2.97Å; K66-D70 WeakPolarHBondContact O-CB 3.44Å; K66-D70 PolarHBondContact O-N 2.99Å; R67-D70 PolarHBondContact O-N 3.28Å; A68-D70 PolarHBondContact O-N 3Å
71	T	94	Very high	94.3	Very high	88 Å²	88	60 Å²	60	54%	0.54	31%	0.309	S	S	.	.	H	α-helix	trans	-107.2	-23.2	-172	60.2	0	0	0	0	115.2	R67	R67-T71 HydrophobicContact CG-CG2 4.43Å; R67-T71 WeakPolarHBondContact O-CB 3.26Å; R67-T71 WeakPolarHBondContact O-CG2 3.18Å; R67-T71 PolarHBondContact O-N 3.41Å; R67-T71 PolarHBondContact O-OG1 3.08Å
72	M	96	Very high	94.4	Very high	10 Å²	10	54 Å²	54	5%	0.049	29%	0.285	C	S	.	.	H	α-helix	trans	-112	-5.5	-173.9	-54	176.8	175.1	0	0	113.5	K30 F31 T33 A34 A68 F74 D75 I84	K30-M72 WeakPolarHBondContact O-CE 3.41Å; F31-M72 HydrophobicContact CD1-SD 4.07Å; F31-M72 HydrophobicContact CE1-SD 4.31Å; F31-M72 HydrophobicContact CG-SD 4.39Å; T33-M72 WeakPolarHBondContact OG1-CE 3.41Å; A34-M72 HydrophobicContact CB-CE 3.53Å; A34-M72 HydrophobicContact CB-SD 4.39Å; A68-M72 HydrophobicContact CB-SD 4.05Å; A68-M72 WeakPolarHBondContact O-CA 3.47Å; A68-M72 WeakPolarHBondContact O-CB 3.48Å; A68-M72 PolarHBondContact O-N 2.84Å; M72-F74 PolarHBondContact O-N 2.84Å; M72-D75 VanDerWaalsContact O-CB 3.29Å; M72-D75 WeakPolarHBondContact O-CB 3.3Å; M72-D75 PolarHBondContact O-N 3.05Å; M72-D75 VanDerWaalsContact O-N 3.1Å; M72-I84 HydrophobicContact CB-CD1 3.68Å; M72-I84 WeakPolarHBondContact O-CD1 3.31Å
73	N	94.7	Very high	94.5	Very high	26 Å²	26	52.3 Å²	52.3	14%	0.139	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	132.4	178.4	-166.6	21.9	0	0	0	109.5	L69 D75 I84	L69-N73 VanDerWaalsContact O-CB 3.25Å; L69-N73 WeakPolarHBondContact O-CB 3.32Å; N73-D75 PolarHBondContact O-N 2.95Å; N73-I84 HydrophobicContact CB-CB 4.22Å; N73-I84 HydrophobicContact CB-CG1 4.5Å; N73-I84 PolarHBondContact OD1-N 3.33Å; N73-I84 PolarHBondContact OD1-O 3.23Å
74	F	94.4	Very high	94.5	Very high	34 Å²	34	45 Å²	45	15%	0.149	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	-0.3	-172.1	-37.9	-56.9	0	0	0	116.4	M72 P81 M82 H112 Y116 C128	M72-F74 PolarHBondContact O-N 2.84Å; F74-P81 WeakPolarHBondContact O-CB 3.31Å; F74-M82 WeakPolarHBondContact CA-O 3.33Å; F74-M82 PolarHBondContact N-O 2.91Å; F74-H112 HydrophobicContact CB-CB 3.89Å; F74-H112 HydrophobicContact CD1-CB 3.41Å; F74-H112 VanDerWaalsContact CD1-CB 3.41Å; F74-H112 AromaticContact CD1-CD2 3.95Å; F74-H112 AromaticContact CD1-CG 3.87Å; F74-H112 HydrophobicContact CD2-CB 4.05Å; F74-H112 HydrophobicContact CE1-CB 3.92Å; F74-H112 HydrophobicContact CE2-CB 4.48Å; F74-H112 HydrophobicContact CG-CB 3.48Å; F74-H112 VanDerWaalsContact CG-CB 3.48Å; F74-H112 HydrophobicContact CZ-CB 4.43Å; F74-Y116 HydrophobicContact CE2-CD2 4.01Å; F74-Y116 AromaticContact CE2-CG 3.88Å; F74-Y116 HydrophobicContact CE2-CG 3.88Å; F74-Y116 AromaticContact CZ-CD2 3.86Å; F74-Y116 HydrophobicContact CZ-CD2 3.86Å; F74-Y116 HydrophobicContact CZ-CG 4.15Å; F74-C128 HydrophobicContact CE1-CB 4.26Å; F74-C128 HydrophobicContact CZ-CB 3.89Å
75	D	95.3	Very high	94.4	Very high	55 Å²	55	44.8 Å²	44.8	29%	0.294	24%	0.24	S	C	.	.			trans	-60.4	141.1	172.2	-85.8	4.2	0	0	0	111.1	K30 M72 N73 P81 M82	K30-D75 WeakPolarHBondContact CE-OD2 3.43Å; K30-D75 IonicContact NZ-OD2 3.53Å; K30-D75 PolarHBondContact NZ-OD2 2.84Å; M72-D75 VanDerWaalsContact O-CB 3.29Å; M72-D75 WeakPolarHBondContact O-CB 3.3Å; M72-D75 PolarHBondContact O-N 3.05Å; M72-D75 VanDerWaalsContact O-N 3.1Å; N73-D75 PolarHBondContact O-N 2.95Å; D75-P81 WeakPolarHBondContact O-CA 3.1Å; D75-M82 HydrophobicContact CB-CE 3.97Å; D75-M82 PolarHBondContact O-N 2.92Å
76	A	93.4	Very high	94.2	Very high	65 Å²	65	47.1 Å²	47.1	54%	0.537	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	131	174.8	0	0	0	0	0	111.2	R80	A76-R80 WeakPolarHBondContact CA-O 3.13Å
77	L	94.8	Very high	94	Very high	20 Å²	20	44 Å²	44	11%	0.105	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	118.8	166.1	-171.5	66	0	0	0	108.2	V22 L27 G79 R80 M82	V22-L77 HydrophobicContact CB-CD2 4.48Å; V22-L77 HydrophobicContact CG1-CD2 3.76Å; V22-L77 HydrophobicContact CG2-CD2 3.78Å; V22-L77 HydrophobicContact CG2-CG 3.95Å; L27-L77 HydrophobicContact CD2-CD2 3.75Å; L27-L77 HydrophobicContact CG-CD2 4.41Å; L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 2.99Å; L77-R80 PolarHBondContact N-O 3.29Å; L77-R80 PolarHBondContact O-N 3.48Å; L77-M82 HydrophobicContact CB-CE 4.1Å; L77-M82 HydrophobicContact CB-CG 3.84Å; L77-M82 HydrophobicContact CB-SD 3.6Å; L77-M82 VanDerWaalsContact CB-SD 3.6Å; L77-M82 HydrophobicContact CD2-SD 3.65Å; L77-M82 HydrophobicContact CG-SD 4.24Å
78	M	93.1	Very high	93.2	Very high	78 Å²	78	41.1 Å²	41.1	38%	0.384	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	45.2	-170.1	-56.7	-175.9	71.8	0	0	112.7	H19 D21 V22 Y26 R80	H19-M78 HydrophobicContact CB-CB 3.98Å; D21-M78 HydrophobicContact CB-CE 3.76Å; D21-M78 HydrophobicContact CB-SD 4.13Å; V22-M78 HydrophobicContact CG2-CG 4.12Å; V22-M78 HydrophobicContact CG2-SD 3.78Å; Y26-M78 HydrophobicContact CD2-SD 4.33Å; Y26-M78 HydrophobicContact CE2-SD 4.2Å; M78-R80 PolarHBondContact O-N 3.25Å
79	G	90.7	Very high	91.9	Very high	58 Å²	58	52.3 Å²	52.3	60%	0.598	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.3	2.2	177.6	0	0	0	0	0	115.4	L77 N136	L77-G79 VanDerWaalsContact C-N 3.29Å; L77-G79 PolarHBondContact O-N 2.99Å; G79-N136 PolarHBondContact O-ND2 2.86Å
80	R	91	Very high	90.6	Very high	73 Å²	73	55 Å²	55	28%	0.275	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	129.7	179	-159.3	173.8	-163.7	-166.5	8.1	111.6	D17 L18 H19 A76 L77 M78 M82	D17-R80 WeakPolarHBondContact O-CD 3.28Å; L18-R80 PolarHBondContact O-NH1 2.99Å; H19-R80 HydrophobicContact CB-CB 4.2Å; A76-R80 WeakPolarHBondContact CA-O 3.13Å; L77-R80 PolarHBondContact N-O 3.29Å; L77-R80 PolarHBondContact O-N 3.48Å; M78-R80 PolarHBondContact O-N 3.25Å; R80-M82 PolarHBondContact O-N 3.24Å
81	P	93.4	Very high	89.5	Confident	26 Å²	26	51.6 Å²	51.6	17%	0.169	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.4	178.7	27.3	-33.7	0	0	0	111	F74 D75 L132	F74-P81 WeakPolarHBondContact O-CB 3.31Å; D75-P81 WeakPolarHBondContact O-CA 3.1Å; P81-L132 HydrophobicContact CG-CD1 4.05Å
82	M	95.5	Very high	88.2	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.01	26%	0.26	C	S	.	.			trans	-83.4	145.6	176.5	-58.1	179.6	-70.9	0	0	110.8	V15 L18 L27 K30 F31 F74 D75 L77 R80	V15-M82 HydrophobicContact CG1-CB 4.16Å; V15-M82 HydrophobicContact CG1-CG 4.48Å; V15-M82 HydrophobicContact CG1-SD 4.17Å; L18-M82 HydrophobicContact CD2-CG 3.89Å; L18-M82 HydrophobicContact CD2-SD 4.11Å; L27-M82 HydrophobicContact CD2-SD 4.34Å; K30-M82 HydrophobicContact CG-CE 4.16Å; F31-M82 HydrophobicContact CE2-SD 4.31Å; F74-M82 WeakPolarHBondContact CA-O 3.33Å; F74-M82 PolarHBondContact N-O 2.91Å; D75-M82 HydrophobicContact CB-CE 3.97Å; D75-M82 PolarHBondContact O-N 2.92Å; L77-M82 HydrophobicContact CB-CE 4.1Å; L77-M82 HydrophobicContact CB-CG 3.84Å; L77-M82 HydrophobicContact CB-SD 3.6Å; L77-M82 VanDerWaalsContact CB-SD 3.6Å; L77-M82 HydrophobicContact CD2-SD 3.65Å; L77-M82 HydrophobicContact CG-SD 4.24Å; R80-M82 PolarHBondContact O-N 3.24Å
83	R	95.4	Very high	86.7	Confident	49 Å²	49	52 Å²	52	19%	0.185	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.9	170.9	-179.7	170.4	54.5	137.8	-0.1	110.5	V15 G16 D17 M85 S127 C128	V15-R83 CarbonylContact C-O 3.52Å; V15-R83 WeakPolarHBondContact CA-O 3.49Å; G16-R83 PolarHBondContact N-O 2.87Å; G16-R83 PolarHBondContact O-N 2.82Å; D17-R83 HydrophobicContact CB-CB 4.43Å; D17-R83 VanDerWaalsContact OD2-CB 3.31Å; D17-R83 WeakPolarHBondContact OD2-CB 3.21Å; D17-R83 IonicContact OD2-CZ 2.66Å; D17-R83 IonicContact OD2-NE 3.9Å; D17-R83 PolarHBondContact OD2-NE 2.8Å; D17-R83 IonicContact OD2-NH2 3.89Å; D17-R83 PolarHBondContact OD2-NH2 3.28Å; R83-M85 HydrophobicContact CG-CE 3.89Å; R83-S127 WeakPolarHBondContact CD-OG 3.3Å; R83-S127 PolarHBondContact NH1-OG 2.82Å; R83-C128 VanDerWaalsContact CD-O 3.26Å; R83-C128 WeakPolarHBondContact CD-O 3.22Å
84	I	95.6	Very high	85.4	Confident	2 Å²	2	55.1 Å²	55.1	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138	-178.5	-49.6	-180	0	0	0	109.2	L13 Y14 V15 F31 L69 M72 N73	L13-I84 HydrophobicContact CB-CG2 4.15Å; L13-I84 HydrophobicContact CD1-CG2 3.82Å; L13-I84 HydrophobicContact CD2-CG2 4.41Å; L13-I84 HydrophobicContact CG-CG2 4.35Å; Y14-I84 WeakPolarHBondContact O-CA 3.05Å; V15-I84 HydrophobicContact CG1-CG1 4.38Å; F31-I84 HydrophobicContact CE1-CD1 3.82Å; F31-I84 HydrophobicContact CZ-CD1 3.64Å; F31-I84 HydrophobicContact CZ-CG1 4.25Å; L69-I84 HydrophobicContact CB-CG2 4.47Å; L69-I84 HydrophobicContact CD1-CB 3.96Å; L69-I84 HydrophobicContact CD1-CG2 3.63Å; L69-I84 WeakPolarHBondContact CD1-O 3.08Å; M72-I84 HydrophobicContact CB-CD1 3.68Å; M72-I84 WeakPolarHBondContact O-CD1 3.31Å; N73-I84 HydrophobicContact CB-CB 4.22Å; N73-I84 HydrophobicContact CB-CG1 4.5Å; N73-I84 PolarHBondContact OD1-N 3.33Å; N73-I84 PolarHBondContact OD1-O 3.23Å
85	M	93.3	Very high	84	Confident	12 Å²	12	60.2 Å²	60.2	6%	0.059	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	163.2	171.2	62	-169.2	68.9	0	0	109.9	L13 Y14 R83 S87 L126	L13-M85 CarbonylContact C-O 3.46Å; L13-M85 WeakPolarHBondContact CA-O 3.22Å; Y14-M85 HydrophobicContact CD1-CE 4.06Å; Y14-M85 HydrophobicContact CD1-CG 3.71Å; Y14-M85 HydrophobicContact CD1-SD 3.82Å; Y14-M85 HydrophobicContact CE1-CE 4.24Å; Y14-M85 HydrophobicContact CE1-SD 4.35Å; Y14-M85 HydrophobicContact CG-CG 4.11Å; Y14-M85 HydrophobicContact CG-SD 4.4Å; Y14-M85 PolarHBondContact N-O 3.41Å; Y14-M85 PolarHBondContact O-N 3.06Å; R83-M85 HydrophobicContact CG-CE 3.89Å; M85-S87 PolarHBondContact O-N 3.28Å; M85-L126 VanDerWaalsContact CB-O 3.26Å; M85-L126 WeakPolarHBondContact CB-O 3.4Å
86	W	92.3	Very high	82.9	Confident	49 Å²	49	60.7 Å²	60.7	19%	0.186	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	135.8	168.6	-70.8	111.3	0	0	0	110.6	Y8 L13 H62 A65 K66 L69 Q88	Y8-W86 HydrophobicContact CD1-CB 4.27Å; Y8-W86 HydrophobicContact CD1-CG 4.28Å; Y8-W86 HydrophobicContact CE1-CB 4.25Å; Y8-W86 HydrophobicContact CE1-CG 4.35Å; L13-W86 HydrophobicContact CD2-CD2 4.16Å; L13-W86 HydrophobicContact CD2-CE3 3.71Å; L13-W86 HydrophobicContact CD2-CH2 4.49Å; L13-W86 HydrophobicContact CD2-CZ3 3.89Å; H62-W86 AromaticContact CE1-CH2 3.23Å; H62-W86 WeakPolarHBondContact CE1-CH2 3.42Å; H62-W86 AromaticContact CE1-CZ2 3.59Å; H62-W86 AromaticContact CE1-CZ3 3.8Å; H62-W86 AromaticContact ND1-CH2 3.54Å; H62-W86 AromaticContact ND1-CZ3 3.85Å; H62-W86 AromaticContact NE2-CH2 3.82Å; H62-W86 AromaticContact NE2-CZ2 3.95Å; A65-W86 HydrophobicContact CB-CH2 3.78Å; A65-W86 HydrophobicContact CB-CZ3 3.68Å; K66-W86 HydrophobicContact CB-CH2 4.2Å; K66-W86 HydrophobicContact CB-CZ2 4.05Å; L69-W86 HydrophobicContact CD2-CD2 4.39Å; L69-W86 HydrophobicContact CD2-CG 4.38Å; L69-W86 HydrophobicContact CD2-CZ2 4.27Å; L69-W86 VanDerWaalsContact CD2-NE1 3.34Å; W86-Q88 PolarHBondContact O-N 3.02Å; W86-Q88 VanDerWaalsContact O-N 3.09Å
87	S	90.4	Very high	82.1	Confident	32 Å²	32	58.7 Å²	58.7	22%	0.224	29%	0.294	C	S	.	.			trans	-67	111.3	175.3	-175.4	0	0	0	0	109.3	S12 Y56 M85	S12-S87 WeakPolarHBondContact O-CB 3.27Å; S12-S87 PolarHBondContact O-N 2.91Å; Y56-S87 WeakPolarHBondContact CE1-OG 3.39Å; M85-S87 PolarHBondContact O-N 3.28Å
88	Q	79.2	Confident	81.4	Confident	62 Å²	62	60.6 Å²	60.6	29%	0.29	31%	0.306	S	S	.	.			trans	-105.5	108.4	176.3	-158.4	174.7	27.8	0	0	108.8	W86 D90	W86-Q88 PolarHBondContact O-N 3.02Å; W86-Q88 VanDerWaalsContact O-N 3.09Å; Q88-D90 VanDerWaalsContact C-N 3.26Å; Q88-D90 WeakPolarHBondContact CG-O 3.08Å; Q88-D90 PolarHBondContact O-N 3.12Å
89	R	70.5	Confident	81.2	Confident	236 Å²	236	57 Å²	57	89%	0.891	29%	0.289	S	S	*	.	S	Bend	trans	-65.8	-32.6	178.4	-69.2	-172.7	179.9	-150	1.5	111.9	P91	R89-P91 VanDerWaalsContact O-CD 3.29Å; R89-P91 WeakPolarHBondContact O-CD 3.41Å
90	D	68	Low	81.3	Confident	83 Å²	83	55.4 Å²	55.4	44%	0.444	27%	0.267	S	S	.	.			trans	-84	111.2	173.8	-175.3	1.7	0	0	0	110.4	Q88 S92	Q88-D90 VanDerWaalsContact C-N 3.26Å; Q88-D90 WeakPolarHBondContact CG-O 3.08Å; Q88-D90 PolarHBondContact O-N 3.12Å; D90-S92 PolarHBondContact O-N 2.88Å; D90-S92 WeakPolarHBondContact OD1-CB 3.23Å; D90-S92 PolarHBondContact OD1-N 3.48Å; D90-S92 PolarHBondContact OD1-OG 2.91Å; D90-S92 PolarHBondContact OD2-OG 2.9Å
91	P	67.5	Low	81.5	Confident	24 Å²	24	51.9 Å²	51.9	16%	0.156	25%	0.254	C	S	.	.			trans	-75.7	-6.6	178.3	34.3	-36.5	0	0	0	113	R89 M93 R94 R95	R89-P91 VanDerWaalsContact O-CD 3.29Å; R89-P91 WeakPolarHBondContact O-CD 3.41Å; P91-M93 VanDerWaalsContact C-N 3.33Å; P91-M93 PolarHBondContact O-N 2.82Å; P91-R94 PolarHBondContact O-N 2.9Å; P91-R94 VanDerWaalsContact O-N 3.08Å; P91-R95 HydrophobicContact CB-CG 4.28Å; P91-R95 WeakPolarHBondContact O-CB 3.09Å; P91-R95 WeakPolarHBondContact O-CG 3.32Å; P91-R95 PolarHBondContact O-N 2.94Å
92	S	67.3	Low	81.5	Confident	45 Å²	45	52 Å²	52	32%	0.315	25%	0.251	S	S	.	.	H	α-helix	trans	-51.7	-48.4	-174.7	67.2	0	0	0	0	112.4	D90 R94 R95 S96	D90-S92 PolarHBondContact O-N 2.88Å; D90-S92 WeakPolarHBondContact OD1-CB 3.23Å; D90-S92 PolarHBondContact OD1-N 3.48Å; D90-S92 PolarHBondContact OD1-OG 2.91Å; D90-S92 PolarHBondContact OD2-OG 2.9Å; S92-R94 PolarHBondContact O-N 3.12Å; S92-R95 PolarHBondContact O-N 3.19Å; S92-S96 VanDerWaalsContact O-CB 3.3Å; S92-S96 WeakPolarHBondContact O-CB 3.34Å; S92-S96 PolarHBondContact O-N 2.67Å; S92-S96 PolarHBondContact O-OG 2.83Å
93	M	65	Low	81.3	Confident	61 Å²	61	51.9 Å²	51.9	30%	0.3	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-42.6	178.8	-72.2	-65.8	-67.8	0	0	112.2	P91 S96 H145	P91-M93 VanDerWaalsContact C-N 3.33Å; P91-M93 PolarHBondContact O-N 2.82Å; M93-S96 PolarHBondContact O-OG 2.97Å; M93-S96 VanDerWaalsContact O-OG 3.06Å; M93-H145 PolarHBondContact O-CE1 2.78Å; M93-H145 VanDerWaalsContact O-CE1 3.24Å
94	R	67.2	Low	81.2	Confident	92 Å²	92	55.4 Å²	55.4	35%	0.347	27%	0.268	S	S	.	.	H	α-helix	trans	-73	-30.7	177.9	-66.5	-170.7	-63	155.5	1.6	113.2	P91 S92	P91-R94 PolarHBondContact O-N 2.9Å; P91-R94 VanDerWaalsContact O-N 3.08Å; S92-R94 PolarHBondContact O-N 3.12Å
95	R	66.1	Low	81	Confident	140 Å²	140	59.1 Å²	59.1	53%	0.528	29%	0.287	S	S	.	.	H	α-helix	trans	-85	-29.1	-177.3	-73.9	-179.7	175	163.3	-4.5	113.2	P91 S92 G97 T378	P91-R95 HydrophobicContact CB-CG 4.28Å; P91-R95 WeakPolarHBondContact O-CB 3.09Å; P91-R95 WeakPolarHBondContact O-CG 3.32Å; P91-R95 PolarHBondContact O-N 2.94Å; S92-R95 PolarHBondContact O-N 3.19Å; R95-G97 PolarHBondContact O-N 2.96Å; R95-T378 PolarHBondContact NH1-OG1 3.28Å
96	S	72.2	Confident	80.8	Confident	66 Å²	66	58.7 Å²	58.7	46%	0.462	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-28	179.6	70.1	0	0	0	0	112.5	S92 M93 V98	S92-S96 VanDerWaalsContact O-CB 3.3Å; S92-S96 WeakPolarHBondContact O-CB 3.34Å; S92-S96 PolarHBondContact O-N 2.67Å; S92-S96 PolarHBondContact O-OG 2.83Å; M93-S96 PolarHBondContact O-OG 2.97Å; M93-S96 VanDerWaalsContact O-OG 3.06Å; S96-V98 PolarHBondContact O-N 3.35Å; S96-V98 WeakPolarHBondContact OG-CB 2.97Å; S96-V98 WeakPolarHBondContact OG-CG2 3.13Å; S96-V98 PolarHBondContact OG-N 3.46Å; S96-V98 VanDerWaalsContact OG-N 3.11Å
97	G	75.7	Confident	80.7	Confident	22 Å²	22	59.4 Å²	59.4	23%	0.227	29%	0.291	C	S	.	.			trans	70.3	3	-171.2	0	0	0	0	0	113.4	R95 G99 N100	R95-G97 PolarHBondContact O-N 2.96Å; G97-G99 PolarHBondContact O-N 2.92Å; G97-N100 VanDerWaalsContact O-CB 3.26Å; G97-N100 WeakPolarHBondContact O-CB 3.25Å; G97-N100 PolarHBondContact O-N 2.79Å
98	V	80.7	Confident	80.8	Confident	61 Å²	61	64.3 Å²	64.3	37%	0.37	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	127.8	177.3	175.9	0	0	0	0	108.6	S96 N100 H145 E149	S96-V98 PolarHBondContact O-N 3.35Å; S96-V98 WeakPolarHBondContact OG-CB 2.97Å; S96-V98 WeakPolarHBondContact OG-CG2 3.13Å; S96-V98 PolarHBondContact OG-N 3.46Å; S96-V98 VanDerWaalsContact OG-N 3.11Å; V98-N100 PolarHBondContact O-N 3.03Å; V98-H145 PolarHBondContact O-CD2 2.99Å; V98-H145 PolarHBondContact O-NE2 2.83Å; V98-E149 HydrophobicContact CG1-CB 3.77Å; V98-E149 HydrophobicContact CG1-CG 4.29Å
99	G	89.4	Confident	81.4	Confident	3 Å²	3	66.2 Å²	66.2	3%	0.031	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.6	-2.3	-174.3	0	0	0	0	0	114.6	G97 F146	G97-G99 PolarHBondContact O-N 2.92Å; G99-F146 PolarHBondContact O-N 3.17Å
100	N	92.5	Very high	82.3	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.123	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	126.5	-179.6	-163.8	-1.1	0	0	0	111.3	G97 V98 V144 H145 F174	G97-N100 VanDerWaalsContact O-CB 3.26Å; G97-N100 WeakPolarHBondContact O-CB 3.25Å; G97-N100 PolarHBondContact O-N 2.79Å; V98-N100 PolarHBondContact O-N 3.03Å; N100-V144 WeakPolarHBondContact CA-O 3.07Å; N100-V144 PolarHBondContact OD1-O 2.76Å; N100-H145 HydrophobicContact CB-CB 4.42Å; N100-F174 HydrophobicContact CB-CB 3.91Å; N100-F174 HydrophobicContact CB-CD1 4.47Å; N100-F174 HydrophobicContact CB-CG 4.45Å; N100-F174 WeakPolarHBondContact ND2-CD1 3.17Å; N100-F174 VanDerWaalsContact O-CB 3.31Å; N100-F174 WeakPolarHBondContact O-CB 3.46Å; N100-F174 PolarHBondContact O-N 2.83Å
101	I	94.3	Very high	83.3	Confident	0 Å²	0	55 Å²	55	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	149.7	-179.3	63.8	162.9	0	0	0	111.1	I103 F119 F143 V144 F146 A152 A155 I156 V171 G172	I101-I103 HydrophobicContact CD1-CD1 4.43Å; I101-I103 HydrophobicContact CD1-CG1 4.36Å; I101-F119 HydrophobicContact CD1-CD1 3.5Å; I101-F119 VanDerWaalsContact CD1-CD1 3.5Å; I101-F119 HydrophobicContact CD1-CE1 3.34Å; I101-F119 HydrophobicContact CD1-CZ 4.26Å; I101-F143 WeakPolarHBondContact O-CA 3.37Å; I101-V144 HydrophobicContact CD1-CB 4.06Å; I101-V144 HydrophobicContact CG1-CB 3.74Å; I101-V144 VanDerWaalsContact CG1-O 3.25Å; I101-V144 WeakPolarHBondContact CG1-O 2.99Å; I101-V144 PolarHBondContact N-O 3.36Å; I101-V144 PolarHBondContact O-N 3.32Å; I101-V144 VanDerWaalsContact O-N 3.12Å; I101-F146 HydrophobicContact CD1-CE2 3.8Å; I101-F146 HydrophobicContact CG1-CE2 4.17Å; I101-A152 HydrophobicContact CG2-CB 3.59Å; I101-A155 HydrophobicContact CD1-CB 4.1Å; I101-I156 HydrophobicContact CG2-CD1 3.86Å; I101-I156 HydrophobicContact CG2-CG1 3.94Å; I101-V171 HydrophobicContact CB-CG1 4.47Å; I101-V171 HydrophobicContact CD1-CG1 3.78Å; I101-G172 CarbonylContact C-O 3.5Å; I101-G172 VanDerWaalsContact CA-O 3.3Å; I101-G172 WeakPolarHBondContact CA-O 3.31Å; I101-G172 WeakPolarHBondContact CB-O 3.25Å
102	F	93	Very high	84.5	Confident	27 Å²	27	55.2 Å²	55.2	12%	0.118	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	131.3	175.4	170.9	-109	0	0	0	109.7	K104 Y141 F143 Y170 V171 G172	F102-K104 HydrophobicContact CD1-CB 4.47Å; F102-K104 HydrophobicContact CE1-CB 3.62Å; F102-K104 HydrophobicContact CE1-CD 4.18Å; F102-K104 HydrophobicContact CE1-CG 4.27Å; F102-K104 HydrophobicContact CZ-CB 3.83Å; F102-K104 HydrophobicContact CZ-CD 4.35Å; F102-K104 HydrophobicContact CZ-CG 4.22Å; F102-Y141 HydrophobicContact CD2-CD2 4.37Å; F102-Y141 AromaticContact CE2-CD2 3.57Å; F102-Y141 HydrophobicContact CE2-CD2 3.57Å; F102-Y141 HydrophobicContact CE2-CE2 4.37Å; F102-Y141 AromaticContact CE2-CG 3.86Å; F102-Y141 HydrophobicContact CE2-CG 3.86Å; F102-Y141 HydrophobicContact CZ-CD2 4.47Å; F102-Y141 HydrophobicContact CZ-CG 4.36Å; F102-F143 AromaticContact CD2-CD1 3.99Å; F102-F143 HydrophobicContact CD2-CD1 3.99Å; F102-F143 AromaticContact CD2-CE1 3.48Å; F102-F143 HydrophobicContact CD2-CE1 3.48Å; F102-F143 VanDerWaalsContact CD2-CE1 3.48Å; F102-F143 HydrophobicContact CD2-CZ 4.13Å; F102-F143 HydrophobicContact CE2-CE1 4.14Å; F102-F143 HydrophobicContact CE2-CZ 4.36Å; F102-F143 HydrophobicContact CG-CE1 4.45Å; F102-Y170 HydrophobicContact CD1-CD1 4.37Å; F102-Y170 HydrophobicContact CD1-CE1 4.22Å; F102-V171 WeakPolarHBondContact O-CA 3.36Å; F102-G172 PolarHBondContact N-O 2.83Å; F102-G172 PolarHBondContact O-N 3.25Å
103	I	92.8	Very high	85.6	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126	-179.3	-53.6	150.5	0	0	0	108.1	I101 L106 I115 F119 Y141 A142 V144 V169 Y170 V171	I101-I103 HydrophobicContact CD1-CD1 4.43Å; I101-I103 HydrophobicContact CD1-CG1 4.36Å; I103-L106 HydrophobicContact CG2-CD1 4.12Å; I103-L106 HydrophobicContact CG2-CD2 3.71Å; I103-L106 HydrophobicContact CG2-CG 3.96Å; I103-I115 HydrophobicContact CD1-CG2 4.03Å; I103-F119 HydrophobicContact CD1-CD2 3.94Å; I103-F119 HydrophobicContact CD1-CE1 4.06Å; I103-F119 HydrophobicContact CD1-CE2 3.32Å; I103-F119 HydrophobicContact CD1-CZ 3.39Å; I103-F119 HydrophobicContact CG1-CE1 4.3Å; I103-F119 HydrophobicContact CG1-CE2 4.08Å; I103-F119 HydrophobicContact CG1-CZ 3.66Å; I103-Y141 CarbonylContact O-C 3.58Å; I103-Y141 WeakPolarHBondContact O-CA 3.39Å; I103-Y141 WeakPolarHBondContact O-CB 3.39Å; I103-A142 HydrophobicContact CB-CB 4.35Å; I103-A142 HydrophobicContact CD1-CB 4.18Å; I103-A142 PolarHBondContact N-O 3.27Å; I103-A142 PolarHBondContact O-N 2.54Å; I103-V144 HydrophobicContact CD1-CG2 3.72Å; I103-V169 HydrophobicContact CG2-CB 4.47Å; I103-Y170 CarbonylContact C-O 3.5Å; I103-Y170 VanDerWaalsContact CA-O 3.27Å; I103-Y170 WeakPolarHBondContact CA-O 3.09Å; I103-V171 HydrophobicContact CG1-CG1 4.33Å; I103-V171 HydrophobicContact CG1-CG2 4.34Å; I103-V171 HydrophobicContact CG2-CG2 4.34Å
104	K	91.6	Very high	86.8	Confident	124 Å²	124	58.3 Å²	58.3	54%	0.539	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	160.1	-179.2	-173	-177.8	175.2	-170.1	0	110.7	F102 Y170	F102-K104 HydrophobicContact CD1-CB 4.47Å; F102-K104 HydrophobicContact CE1-CB 3.62Å; F102-K104 HydrophobicContact CE1-CD 4.18Å; F102-K104 HydrophobicContact CE1-CG 4.27Å; F102-K104 HydrophobicContact CZ-CB 3.83Å; F102-K104 HydrophobicContact CZ-CD 4.35Å; F102-K104 HydrophobicContact CZ-CG 4.22Å; K104-Y170 HydrophobicContact CB-CD1 4.21Å; K104-Y170 PolarHBondContact N-O 2.9Å; K104-Y170 PolarHBondContact O-N 2.85Å
105	N	91.5	Very high	88	Confident	79 Å²	79	53.9 Å²	53.9	42%	0.422	27%	0.274	S	S	.	.	S	Bend	trans	70.5	34.1	178.8	-162.5	37.5	0	0	0	112.7	G140 K167 K168	N105-G140 PolarHBondContact N-O 2.8Å; N105-K167 WeakPolarHBondContact O-CB 3.32Å; N105-K168 PolarHBondContact ND2-O 2.91Å
106	L	90.6	Very high	89.3	Confident	3 Å²	3	50.5 Å²	50.5	2%	0.016	26%	0.262	C	S	.	.			trans	-72.2	145.3	172.2	-64.5	174.2	0	0	0	110.1	I103 I110 I115 G140 A142 V169	I103-L106 HydrophobicContact CG2-CD1 4.12Å; I103-L106 HydrophobicContact CG2-CD2 3.71Å; I103-L106 HydrophobicContact CG2-CG 3.96Å; L106-I110 HydrophobicContact CB-CD1 4.32Å; L106-I110 HydrophobicContact CD2-CD1 4.04Å; L106-I115 HydrophobicContact CD1-CD1 3.85Å; L106-I115 HydrophobicContact CD1-CG1 4.4Å; L106-I115 HydrophobicContact CD2-CD1 3.75Å; L106-I115 HydrophobicContact CG-CD1 4.47Å; L106-G140 PolarHBondContact N-O 2.8Å; L106-A142 HydrophobicContact CD1-CB 3.56Å; L106-V169 HydrophobicContact CD2-CG1 3.86Å
107	E	90	Very high	90.1	Very high	65 Å²	65	52.1 Å²	52.1	30%	0.304	26%	0.262	S	S	.	.			trans	-66.8	140.1	165.2	-162.4	-178.1	-166	0	0	109.4	T109 I110 N165 K167	E107-T109 VanDerWaalsContact CG-OG1 3.31Å; E107-T109 WeakPolarHBondContact CG-OG1 3.29Å; E107-T109 PolarHBondContact O-N 3.15Å; E107-T109 PolarHBondContact OE2-OG1 2.83Å; E107-T109 VanDerWaalsContact OE2-OG1 3.09Å; E107-I110 HydrophobicContact CB-CD1 4.01Å; E107-I110 HydrophobicContact CB-CG1 4.12Å; E107-I110 WeakPolarHBondContact O-CB 3.13Å; E107-I110 PolarHBondContact O-N 3.37Å; E107-I110 VanDerWaalsContact O-N 3.12Å; E107-N165 HydrophobicContact CB-CB 4.46Å; E107-N165 WeakPolarHBondContact OE2-CB 3.35Å; E107-K167 HydrophobicContact CB-CD 4.12Å; E107-K167 HydrophobicContact CB-CG 4.44Å
108	K	91.9	Very high	90.7	Very high	134 Å²	134	53.1 Å²	53.1	58%	0.583	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-17.4	-174.3	-68.6	-170.9	175.1	-174.8	0	113.3	I110 V137 S138	K108-I110 VanDerWaalsContact C-N 3.33Å; K108-V137 HydrophobicContact CD-CG1 4.45Å; K108-S138 WeakPolarHBondContact CD-O 3.49Å; K108-S138 WeakPolarHBondContact CE-O 3.22Å; K108-S138 WeakPolarHBondContact CG-O 3.44Å; K108-S138 WeakPolarHBondContact O-CB 3.44Å
109	T	91.6	Very high	91.3	Very high	102 Å²	102	50.2 Å²	50.2	63%	0.626	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-16.4	175.8	52	0	0	0	0	113	E107 D111	E107-T109 VanDerWaalsContact CG-OG1 3.31Å; E107-T109 WeakPolarHBondContact CG-OG1 3.29Å; E107-T109 PolarHBondContact O-N 3.15Å; E107-T109 PolarHBondContact OE2-OG1 2.83Å; E107-T109 VanDerWaalsContact OE2-OG1 3.09Å; T109-D111 PolarHBondContact O-N 2.93Å
110	I	88.9	Confident	91.5	Very high	7 Å²	7	52.3 Å²	52.3	4%	0.036	26%	0.261	C	S	.	.			trans	-70.3	128.6	178.8	-64.8	170.2	0	0	0	109.5	L106 E107 K108 T114 I115 I130 I164 N165	L106-I110 HydrophobicContact CB-CD1 4.32Å; L106-I110 HydrophobicContact CD2-CD1 4.04Å; E107-I110 HydrophobicContact CB-CD1 4.01Å; E107-I110 HydrophobicContact CB-CG1 4.12Å; E107-I110 WeakPolarHBondContact O-CB 3.13Å; E107-I110 PolarHBondContact O-N 3.37Å; E107-I110 VanDerWaalsContact O-N 3.12Å; K108-I110 VanDerWaalsContact C-N 3.33Å; I110-T114 HydrophobicContact CG2-CG2 4.18Å; I110-I115 HydrophobicContact CG2-CD1 3.73Å; I110-I115 HydrophobicContact CG2-CG1 3.75Å; I110-I130 HydrophobicContact CG2-CD1 4.49Å; I110-I130 WeakPolarHBondContact O-CD1 3.44Å; I110-I164 HydrophobicContact CD1-CB 4.39Å; I110-I164 HydrophobicContact CD1-CG2 3.66Å; I110-N165 HydrophobicContact CD1-CB 4.37Å; I110-N165 HydrophobicContact CG1-CB 4.48Å
111	D	90.1	Very high	91.4	Very high	78 Å²	78	57.5 Å²	57.5	42%	0.417	29%	0.288	S	S	.	.			trans	-97.2	171.6	179.1	72.5	5.3	0	0	0	113.1	T109 K113 T114 I115 I130	T109-D111 PolarHBondContact O-N 2.93Å; D111-K113 VanDerWaalsContact C-N 3.27Å; D111-K113 PolarHBondContact O-N 2.84Å; D111-K113 PolarHBondContact OD1-N 3Å; D111-T114 PolarHBondContact O-N 3.36Å; D111-T114 VanDerWaalsContact OD1-CB 3.24Å; D111-T114 WeakPolarHBondContact OD1-CB 3.42Å; D111-T114 PolarHBondContact OD1-N 2.86Å; D111-T114 PolarHBondContact OD1-OG1 2.92Å; D111-I115 PolarHBondContact O-N 3.39Å; D111-I130 WeakPolarHBondContact O-CD1 3.37Å
112	H	91.7	Very high	91.3	Very high	27 Å²	27	59.6 Å²	59.6	13%	0.125	30%	0.297	C	S	.	.	H	α-helix	trans	-61.5	-36.5	-177.9	-68	81.3	0	0	0	112.6	F74 I115 Y116 I130	F74-H112 HydrophobicContact CB-CB 3.89Å; F74-H112 HydrophobicContact CD1-CB 3.41Å; F74-H112 VanDerWaalsContact CD1-CB 3.41Å; F74-H112 AromaticContact CD1-CD2 3.95Å; F74-H112 AromaticContact CD1-CG 3.87Å; F74-H112 HydrophobicContact CD2-CB 4.05Å; F74-H112 HydrophobicContact CE1-CB 3.92Å; F74-H112 HydrophobicContact CE2-CB 4.48Å; F74-H112 HydrophobicContact CG-CB 3.48Å; F74-H112 VanDerWaalsContact CG-CB 3.48Å; F74-H112 HydrophobicContact CZ-CB 4.43Å; H112-I115 PolarHBondContact O-N 3.15Å; H112-Y116 WeakPolarHBondContact O-CB 3.48Å; H112-Y116 PolarHBondContact O-N 2.79Å; H112-I130 PolarHBondContact CD2-N 3.34Å; H112-I130 VanDerWaalsContact CD2-N 3.26Å; H112-I130 PolarHBondContact NE2-N 3.09Å; H112-I130 VanDerWaalsContact NE2-N 3.12Å
113	K	90.7	Very high	91.3	Very high	123 Å²	123	59.3 Å²	59.3	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-66.8	-45.9	-177.4	-175.3	173	176.1	177.6	0	111.1	D111 I115 Y116 E117	D111-K113 VanDerWaalsContact C-N 3.27Å; D111-K113 PolarHBondContact O-N 2.84Å; D111-K113 PolarHBondContact OD1-N 3Å; K113-I115 VanDerWaalsContact C-N 3.33Å; K113-I115 PolarHBondContact O-N 3.12Å; K113-Y116 PolarHBondContact O-N 2.75Å; K113-Y116 VanDerWaalsContact O-N 3.13Å; K113-E117 WeakPolarHBondContact CE-OE1 3.48Å; K113-E117 HydrophobicContact CG-CG 4.39Å; K113-E117 WeakPolarHBondContact CG-OE1 3.01Å; K113-E117 WeakPolarHBondContact O-CB 3.41Å; K113-E117 WeakPolarHBondContact O-CG 3.42Å; K113-E117 PolarHBondContact O-N 2.79Å
114	T	90.3	Very high	91.2	Very high	48 Å²	48	63.3 Å²	63.3	29%	0.294	32%	0.324	S	S	.	.	H	α-helix	trans	-57.5	-44.9	175.8	-55.2	0	0	0	0	111.5	I110 D111 T118	I110-T114 HydrophobicContact CG2-CG2 4.18Å; D111-T114 PolarHBondContact O-N 3.36Å; D111-T114 VanDerWaalsContact OD1-CB 3.24Å; D111-T114 WeakPolarHBondContact OD1-CB 3.42Å; D111-T114 PolarHBondContact OD1-N 2.86Å; D111-T114 PolarHBondContact OD1-OG1 2.92Å; T114-T118 VanDerWaalsContact O-CB 3.32Å; T114-T118 WeakPolarHBondContact O-CB 3.5Å; T114-T118 PolarHBondContact O-N 3.32Å; T114-T118 PolarHBondContact O-OG1 3.04Å
115	I	92.7	Very high	91.3	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-64.8	-45.7	176.2	-63.5	-63	0	0	0	110.7	I103 L106 I110 D111 H112 K113 E117 T118 F119 C128 I130 A142 V144	I103-I115 HydrophobicContact CD1-CG2 4.03Å; L106-I115 HydrophobicContact CD1-CD1 3.85Å; L106-I115 HydrophobicContact CD1-CG1 4.4Å; L106-I115 HydrophobicContact CD2-CD1 3.75Å; L106-I115 HydrophobicContact CG-CD1 4.47Å; I110-I115 HydrophobicContact CG2-CD1 3.73Å; I110-I115 HydrophobicContact CG2-CG1 3.75Å; D111-I115 PolarHBondContact O-N 3.39Å; H112-I115 PolarHBondContact O-N 3.15Å; K113-I115 VanDerWaalsContact C-N 3.33Å; K113-I115 PolarHBondContact O-N 3.12Å; I115-E117 PolarHBondContact O-N 3.34Å; I115-T118 PolarHBondContact O-N 3.15Å; I115-F119 HydrophobicContact CG2-CD2 3.9Å; I115-F119 HydrophobicContact CG2-CE2 4.27Å; I115-F119 VanDerWaalsContact O-CD2 3.28Å; I115-F119 WeakPolarHBondContact O-CD2 3.47Å; I115-F119 PolarHBondContact O-N 3.34Å; I115-C128 VanDerWaalsContact CG2-SG 3.58Å; I115-I130 HydrophobicContact CG1-CD1 4.02Å; I115-I130 HydrophobicContact CG1-CG1 4.29Å; I115-A142 HydrophobicContact CG2-CB 4.34Å; I115-V144 HydrophobicContact CG2-CG2 3.72Å
116	Y	93.1	Very high	91.2	Very high	69 Å²	69	55.9 Å²	55.9	27%	0.271	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-50.1	-179.9	-175.6	-90.1	0	0	0	111.8	F74 H112 K113 T118 F119 S120 I125 C128	F74-Y116 HydrophobicContact CE2-CD2 4.01Å; F74-Y116 AromaticContact CE2-CG 3.88Å; F74-Y116 HydrophobicContact CE2-CG 3.88Å; F74-Y116 AromaticContact CZ-CD2 3.86Å; F74-Y116 HydrophobicContact CZ-CD2 3.86Å; F74-Y116 HydrophobicContact CZ-CG 4.15Å; H112-Y116 WeakPolarHBondContact O-CB 3.48Å; H112-Y116 PolarHBondContact O-N 2.79Å; K113-Y116 PolarHBondContact O-N 2.75Å; K113-Y116 VanDerWaalsContact O-N 3.13Å; Y116-T118 PolarHBondContact O-N 3.44Å; Y116-F119 PolarHBondContact O-N 2.7Å; Y116-S120 WeakPolarHBondContact O-CB 3.39Å; Y116-S120 PolarHBondContact O-N 3Å; Y116-S120 PolarHBondContact O-OG 3.23Å; Y116-I125 HydrophobicContact CD2-CB 4.26Å; Y116-I125 HydrophobicContact CD2-CD1 3.98Å; Y116-I125 HydrophobicContact CD2-CG2 3.97Å; Y116-I125 HydrophobicContact CE2-CB 3.71Å; Y116-I125 HydrophobicContact CE2-CD1 4.16Å; Y116-I125 HydrophobicContact CE2-CG2 3.71Å; Y116-I125 HydrophobicContact CG-CD1 4.43Å; Y116-I125 WeakPolarHBondContact O-CD1 3.25Å; Y116-C128 HydrophobicContact CD2-CB 3.87Å
117	E	89.2	Confident	91.3	Very high	99 Å²	99	56.4 Å²	56.4	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-41.1	179.3	-71.3	173.9	176.7	0	0	112.3	K113 I115 F119 S120 N121	K113-E117 WeakPolarHBondContact CE-OE1 3.48Å; K113-E117 HydrophobicContact CG-CG 4.39Å; K113-E117 WeakPolarHBondContact CG-OE1 3.01Å; K113-E117 WeakPolarHBondContact O-CB 3.41Å; K113-E117 WeakPolarHBondContact O-CG 3.42Å; K113-E117 PolarHBondContact O-N 2.79Å; I115-E117 PolarHBondContact O-N 3.34Å; E117-F119 PolarHBondContact O-N 3.11Å; E117-S120 WeakPolarHBondContact CA-OG 3.46Å; E117-S120 PolarHBondContact O-OG 3.49Å; E117-N121 PolarHBondContact O-ND2 2.98Å
118	T	88.8	Confident	91.5	Very high	43 Å²	43	53.3 Å²	53.3	26%	0.264	28%	0.279	S	S	.	.	H	α-helix	trans	-61	-48.1	177.7	-60.5	0	0	0	0	110.7	T114 I115 Y116 N121 I164	T114-T118 VanDerWaalsContact O-CB 3.32Å; T114-T118 WeakPolarHBondContact O-CB 3.5Å; T114-T118 PolarHBondContact O-N 3.32Å; T114-T118 PolarHBondContact O-OG1 3.04Å; I115-T118 PolarHBondContact O-N 3.15Å; Y116-T118 PolarHBondContact O-N 3.44Å; T118-N121 PolarHBondContact O-ND2 2.83Å; T118-I164 HydrophobicContact CG2-CD1 4.38Å
119	F	93.6	Very high	91.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-84.8	-20.2	-173	-77.9	-88.7	0	0	0	113.4	I101 I103 I115 Y116 E117 N121 F122 I125 V144 F146 A155 V159 V171	I101-F119 HydrophobicContact CD1-CD1 3.5Å; I101-F119 VanDerWaalsContact CD1-CD1 3.5Å; I101-F119 HydrophobicContact CD1-CE1 3.34Å; I101-F119 HydrophobicContact CD1-CZ 4.26Å; I103-F119 HydrophobicContact CD1-CD2 3.94Å; I103-F119 HydrophobicContact CD1-CE1 4.06Å; I103-F119 HydrophobicContact CD1-CE2 3.32Å; I103-F119 HydrophobicContact CD1-CZ 3.39Å; I103-F119 HydrophobicContact CG1-CE1 4.3Å; I103-F119 HydrophobicContact CG1-CE2 4.08Å; I103-F119 HydrophobicContact CG1-CZ 3.66Å; I115-F119 HydrophobicContact CG2-CD2 3.9Å; I115-F119 HydrophobicContact CG2-CE2 4.27Å; I115-F119 VanDerWaalsContact O-CD2 3.28Å; I115-F119 WeakPolarHBondContact O-CD2 3.47Å; I115-F119 PolarHBondContact O-N 3.34Å; Y116-F119 PolarHBondContact O-N 2.7Å; E117-F119 PolarHBondContact O-N 3.11Å; F119-N121 PolarHBondContact O-N 3.25Å; F119-N121 VanDerWaalsContact O-N 3.11Å; F119-F122 HydrophobicContact CD1-CD2 4.27Å; F119-F122 HydrophobicContact CD1-CE2 4.48Å; F119-F122 WeakPolarHBondContact O-CD2 3.36Å; F119-F122 PolarHBondContact O-N 3.18Å; F119-I125 HydrophobicContact CB-CD1 3.9Å; F119-V144 HydrophobicContact CB-CG1 4.04Å; F119-V144 HydrophobicContact CB-CG2 4.2Å; F119-V144 HydrophobicContact CD2-CG2 4.22Å; F119-V144 HydrophobicContact CG-CG2 4.09Å; F119-F146 HydrophobicContact CB-CZ 3.98Å; F119-F146 HydrophobicContact CD1-CE2 4.4Å; F119-F146 HydrophobicContact CD1-CZ 4.14Å; F119-F146 WeakPolarHBondContact O-CE1 3.43Å; F119-F146 WeakPolarHBondContact O-CZ 3.31Å; F119-A155 HydrophobicContact CD1-CB 3.91Å; F119-A155 HydrophobicContact CE1-CB 4.11Å; F119-V159 HydrophobicContact CE1-CB 4.37Å; F119-V159 HydrophobicContact CE1-CG1 4.34Å; F119-V159 HydrophobicContact CE1-CG2 4.3Å; F119-V159 HydrophobicContact CZ-CB 4.42Å; F119-V159 HydrophobicContact CZ-CG1 3.9Å; F119-V171 HydrophobicContact CE1-CG1 4.13Å; F119-V171 HydrophobicContact CE1-CG2 4.45Å; F119-V171 HydrophobicContact CZ-CG1 4.44Å; F119-V171 HydrophobicContact CZ-CG2 4.07Å
120	S	92.9	Very high	91.7	Very high	48 Å²	48	45 Å²	45	34%	0.336	24%	0.235	S	C	.	.	H	α-helix	trans	-61.4	-21.3	176.4	52.9	0	0	0	0	112.8	Y116 E117 F122 G123	Y116-S120 WeakPolarHBondContact O-CB 3.39Å; Y116-S120 PolarHBondContact O-N 3Å; Y116-S120 PolarHBondContact O-OG 3.23Å; E117-S120 WeakPolarHBondContact CA-OG 3.46Å; E117-S120 PolarHBondContact O-OG 3.49Å; S120-F122 PolarHBondContact O-N 2.85Å; S120-G123 PolarHBondContact O-N 3.49Å
121	N	90.2	Very high	91.8	Very high	131 Å²	131	45 Å²	45	70%	0.701	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-18	174.6	-64	-48.9	0	0	0	114	E117 T118 F119	E117-N121 PolarHBondContact O-ND2 2.98Å; T118-N121 PolarHBondContact O-ND2 2.83Å; F119-N121 PolarHBondContact O-N 3.25Å; F119-N121 VanDerWaalsContact O-N 3.11Å
122	F	92.4	Very high	91.9	Very high	44 Å²	44	43.1 Å²	43.1	19%	0.193	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-13	-179.2	-56.5	-74.3	0	0	0	113.5	F119 S120 F146 S151 K154 A155 H158 V159	F119-F122 HydrophobicContact CD1-CD2 4.27Å; F119-F122 HydrophobicContact CD1-CE2 4.48Å; F119-F122 WeakPolarHBondContact O-CD2 3.36Å; F119-F122 PolarHBondContact O-N 3.18Å; S120-F122 PolarHBondContact O-N 2.85Å; F122-F146 HydrophobicContact CB-CE1 4Å; F122-F146 HydrophobicContact CB-CZ 3.95Å; F122-S151 WeakPolarHBondContact O-CA 3.21Å; F122-S151 WeakPolarHBondContact O-CB 3.31Å; F122-S151 PolarHBondContact O-OG 2.72Å; F122-K154 HydrophobicContact CD1-CB 4.1Å; F122-A155 HydrophobicContact CB-CB 3.95Å; F122-A155 HydrophobicContact CD1-CB 4.31Å; F122-A155 HydrophobicContact CD2-CB 3.65Å; F122-A155 HydrophobicContact CE2-CB 4.28Å; F122-A155 HydrophobicContact CG-CB 3.68Å; F122-H158 HydrophobicContact CE1-CB 3.62Å; F122-H158 HydrophobicContact CZ-CB 4.01Å; F122-V159 HydrophobicContact CD2-CG2 4.46Å; F122-V159 HydrophobicContact CE1-CG2 4.32Å; F122-V159 HydrophobicContact CE2-CG2 3.36Å; F122-V159 HydrophobicContact CZ-CG2 3.27Å
123	G	92.5	Very high	91.6	Very high	22 Å²	22	44.3 Å²	44.3	23%	0.227	23%	0.232	C	C	.	.	S	Bend	trans	152.5	-179.7	178	0	0	0	0	0	113.4	S120 I125	S120-G123 PolarHBondContact O-N 3.49Å; G123-I125 PolarHBondContact O-N 2.57Å
124	N	91.7	Very high	91.3	Very high	83 Å²	83	47.8 Å²	47.8	44%	0.444	25%	0.251	S	S	.	.			trans	-66	128.3	-178.9	-170.8	30.5	0	0	0	111.4	F146 E147	N124-F146 WeakPolarHBondContact O-CA 3.37Å; N124-E147 HydrophobicContact CB-CB 4.23Å; N124-E147 WeakPolarHBondContact CB-OE2 3.41Å; N124-E147 PolarHBondContact ND2-OE2 2.91Å; N124-E147 PolarHBondContact O-N 2.72Å
125	I	92.5	Very high	91.1	Very high	12 Å²	12	50.2 Å²	50.2	6%	0.062	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.2	-179.4	-65.7	174.6	0	0	0	108.9	Y116 F119 G123 S127 C128 V144 H145 F146	Y116-I125 HydrophobicContact CD2-CB 4.26Å; Y116-I125 HydrophobicContact CD2-CD1 3.98Å; Y116-I125 HydrophobicContact CD2-CG2 3.97Å; Y116-I125 HydrophobicContact CE2-CB 3.71Å; Y116-I125 HydrophobicContact CE2-CD1 4.16Å; Y116-I125 HydrophobicContact CE2-CG2 3.71Å; Y116-I125 HydrophobicContact CG-CD1 4.43Å; Y116-I125 WeakPolarHBondContact O-CD1 3.25Å; F119-I125 HydrophobicContact CB-CD1 3.9Å; G123-I125 PolarHBondContact O-N 2.57Å; I125-S127 WeakPolarHBondContact CG2-O 3.32Å; I125-C128 HydrophobicContact CG2-CB 4.2Å; I125-V144 HydrophobicContact CD1-CG1 3.76Å; I125-V144 HydrophobicContact CG1-CG1 3.84Å; I125-V144 HydrophobicContact CG2-CG1 4.05Å; I125-H145 CarbonylContact C-O 3.57Å; I125-F146 HydrophobicContact CD1-CE1 4.43Å; I125-F146 HydrophobicContact CG1-CD1 4.02Å; I125-F146 HydrophobicContact CG1-CE1 3.81Å
126	L	90.9	Very high	90.8	Very high	35 Å²	35	53 Å²	53	18%	0.183	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-34.2	172.4	-61.1	-179.9	0	0	0	112.4	M85 H145 E147	M85-L126 VanDerWaalsContact CB-O 3.26Å; M85-L126 WeakPolarHBondContact CB-O 3.4Å; L126-H145 PolarHBondContact N-O 3.5Å; L126-E147 HydrophobicContact CD1-CB 4.4Å; L126-E147 HydrophobicContact CD2-CB 4.02Å; L126-E147 HydrophobicContact CD2-CG 4.23Å; L126-E147 HydrophobicContact CG-CB 4.04Å
127	S	92.2	Very high	90.6	Very high	14 Å²	14	52.9 Å²	52.9	10%	0.098	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	136.9	-178.2	167.1	0	0	0	0	110.5	R83 I125 H145	R83-S127 WeakPolarHBondContact CD-OG 3.3Å; R83-S127 PolarHBondContact NH1-OG 2.82Å; I125-S127 WeakPolarHBondContact CG2-O 3.32Å; S127-H145 PolarHBondContact N-O 2.89Å; S127-H145 PolarHBondContact O-N 3.42Å
128	C	93.3	Very high	90.8	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	142.1	168.9	177.4	0	0	0	0	109.1	F74 R83 I115 Y116 I125 F143 V144	F74-C128 HydrophobicContact CE1-CB 4.26Å; F74-C128 HydrophobicContact CZ-CB 3.89Å; R83-C128 VanDerWaalsContact CD-O 3.26Å; R83-C128 WeakPolarHBondContact CD-O 3.22Å; I115-C128 VanDerWaalsContact CG2-SG 3.58Å; Y116-C128 HydrophobicContact CD2-CB 3.87Å; I125-C128 HydrophobicContact CG2-CB 4.2Å; C128-F143 CarbonylContact C-O 3.48Å; C128-F143 WeakPolarHBondContact CA-O 3.17Å; C128-V144 HydrophobicContact CB-CG2 4.49Å
129	K	93.7	Very high	91	Very high	59 Å²	59	51.6 Å²	51.6	26%	0.257	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	132.5	178.3	179.7	172.8	175	171.5	0	111.6	D17 A142 F143	D17-K129 WeakPolarHBondContact OD1-CE 3.29Å; D17-K129 IonicContact OD1-NZ 3.55Å; D17-K129 PolarHBondContact OD1-NZ 3.36Å; D17-K129 IonicContact OD2-NZ 3.1Å; K129-A142 CarbonylContact O-C 3.59Å; K129-A142 WeakPolarHBondContact O-CA 3.36Å; K129-A142 WeakPolarHBondContact O-CB 3.13Å; K129-F143 PolarHBondContact N-O 3.08Å; K129-F143 PolarHBondContact O-N 2.95Å
130	I	94.2	Very high	90.9	Very high	3 Å²	3	52 Å²	52	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	136.8	161.4	-61.4	-175.2	0	0	0	108.4	I110 D111 H112 I115 L132 A142	I110-I130 HydrophobicContact CG2-CD1 4.49Å; I110-I130 WeakPolarHBondContact O-CD1 3.44Å; D111-I130 WeakPolarHBondContact O-CD1 3.37Å; H112-I130 PolarHBondContact CD2-N 3.34Å; H112-I130 VanDerWaalsContact CD2-N 3.26Å; H112-I130 PolarHBondContact NE2-N 3.09Å; H112-I130 VanDerWaalsContact NE2-N 3.12Å; I115-I130 HydrophobicContact CG1-CD1 4.02Å; I115-I130 HydrophobicContact CG1-CG1 4.29Å; I130-L132 HydrophobicContact CG2-CD2 4.13Å; I130-L132 PolarHBondContact O-N 2.77Å; I130-A142 HydrophobicContact CG1-CB 4.03Å
131	A	92	Very high	91	Very high	7 Å²	7	52.7 Å²	52.7	6%	0.058	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.4	174.3	0	0	0	0	0	110.4	K139 Y141 F143	A131-K139 HydrophobicContact CB-CB 4.31Å; A131-K139 HydrophobicContact CB-CD 4.32Å; A131-K139 VanDerWaalsContact O-CB 3.31Å; A131-K139 WeakPolarHBondContact O-CB 3.24Å; A131-K139 PolarHBondContact O-N 3.03Å; A131-Y141 HydrophobicContact CB-CD1 4.22Å; A131-Y141 HydrophobicContact CB-CD2 3.52Å; A131-Y141 HydrophobicContact CB-CE1 3.8Å; A131-Y141 HydrophobicContact CB-CE2 3.05Å; A131-Y141 HydrophobicContact CB-CG 4.1Å; A131-Y141 PolarHBondContact N-O 3.27Å; A131-F143 HydrophobicContact CB-CE2 4.45Å
132	L	90.6	Very high	91.2	Very high	37 Å²	37	46.5 Å²	46.5	19%	0.194	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	155.7	176.8	-52.9	179.4	0	0	0	110.8	P81 I130 N136 V137 K139	P81-L132 HydrophobicContact CG-CD1 4.05Å; I130-L132 HydrophobicContact CG2-CD2 4.13Å; I130-L132 PolarHBondContact O-N 2.77Å; L132-N136 HydrophobicContact CD1-CB 4.4Å; L132-V137 CarbonylContact C-O 3.59Å; L132-V137 VanDerWaalsContact CA-O 3.31Å; L132-V137 WeakPolarHBondContact CA-O 3.24Å; L132-K139 WeakPolarHBondContact O-CD 3.28Å; L132-K139 VanDerWaalsContact O-CE 3.26Å; L132-K139 WeakPolarHBondContact O-CE 3.39Å; L132-K139 PolarHBondContact O-NZ 2.97Å
133	D	87.3	Confident	91.3	Very high	52 Å²	52	46.3 Å²	46.3	28%	0.278	25%	0.247	S	C	.	.			trans	-82.5	-172.6	164	65.1	23.8	0	0	0	112.1	S135 N136 V137 K139	D133-S135 PolarHBondContact O-N 2.83Å; D133-S135 WeakPolarHBondContact OD1-CA 3.43Å; D133-S135 PolarHBondContact OD1-N 2.84Å; D133-N136 PolarHBondContact O-N 3.44Å; D133-N136 PolarHBondContact OD1-N 3.22Å; D133-V137 PolarHBondContact N-O 3.09Å; D133-V137 PolarHBondContact OD1-N 2.74Å; D133-K139 HydrophobicContact CB-CG 4.31Å
134	E	83.7	Confident	91.4	Very high	197 Å²	197	45.2 Å²	45.2	92%	0.921	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69	-23.8	-178.6	-65.4	174.9	-176.5	0	0	112.3	N136	E134-N136 VanDerWaalsContact C-N 3.29Å; E134-N136 PolarHBondContact O-N 3.15Å
135	S	86.4	Confident	91.5	Very high	98 Å²	98	41.8 Å²	41.8	69%	0.685	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.3	14.4	176.6	-55.4	0	0	0	0	112.8	D133 V137	D133-S135 PolarHBondContact O-N 2.83Å; D133-S135 WeakPolarHBondContact OD1-CA 3.43Å; D133-S135 PolarHBondContact OD1-N 2.84Å; S135-V137 PolarHBondContact O-N 2.56Å
136	N	85.2	Confident	91.5	Very high	60 Å²	60	41.2 Å²	41.2	32%	0.321	21%	0.214	S	C	.	.	S	Bend	trans	59.1	22.8	-175	-69.5	-36.2	0	0	0	115	G79 L132 D133 E134	G79-N136 PolarHBondContact O-ND2 2.86Å; L132-N136 HydrophobicContact CD1-CB 4.4Å; D133-N136 PolarHBondContact O-N 3.44Å; D133-N136 PolarHBondContact OD1-N 3.22Å; E134-N136 VanDerWaalsContact C-N 3.29Å; E134-N136 PolarHBondContact O-N 3.15Å
137	V	89.6	Confident	91.4	Very high	65 Å²	65	42.9 Å²	42.9	39%	0.394	22%	0.221	S	C	.	.			trans	-91.3	141.3	176.3	-178.2	0	0	0	0	110.3	K108 L132 D133 S135 K139	K108-V137 HydrophobicContact CD-CG1 4.45Å; L132-V137 CarbonylContact C-O 3.59Å; L132-V137 VanDerWaalsContact CA-O 3.31Å; L132-V137 WeakPolarHBondContact CA-O 3.24Å; D133-V137 PolarHBondContact N-O 3.09Å; D133-V137 PolarHBondContact OD1-N 2.74Å; S135-V137 PolarHBondContact O-N 2.56Å; V137-K139 PolarHBondContact O-N 2.73Å
138	S	93.4	Very high	91.3	Very high	9 Å²	9	49.9 Å²	49.9	6%	0.063	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.3	128.1	179.4	178.5	0	0	0	0	112.4	K108 G140	K108-S138 WeakPolarHBondContact CD-O 3.49Å; K108-S138 WeakPolarHBondContact CE-O 3.22Å; K108-S138 WeakPolarHBondContact CG-O 3.44Å; K108-S138 WeakPolarHBondContact O-CB 3.44Å; S138-G140 PolarHBondContact O-N 2.88Å; S138-G140 PolarHBondContact OG-N 3.27Å; S138-G140 VanDerWaalsContact OG-N 3.14Å
139	K	92.4	Very high	91.3	Very high	106 Å²	106	54.2 Å²	54.2	46%	0.461	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	1.8	170.6	-67.7	175.6	164.1	147.7	0	112.9	A131 L132 D133 V137 Y141	A131-K139 HydrophobicContact CB-CB 4.31Å; A131-K139 HydrophobicContact CB-CD 4.32Å; A131-K139 VanDerWaalsContact O-CB 3.31Å; A131-K139 WeakPolarHBondContact O-CB 3.24Å; A131-K139 PolarHBondContact O-N 3.03Å; L132-K139 WeakPolarHBondContact O-CD 3.28Å; L132-K139 VanDerWaalsContact O-CE 3.26Å; L132-K139 WeakPolarHBondContact O-CE 3.39Å; L132-K139 PolarHBondContact O-NZ 2.97Å; D133-K139 HydrophobicContact CB-CG 4.31Å; V137-K139 PolarHBondContact O-N 2.73Å; K139-Y141 HydrophobicContact CB-CD1 3.8Å; K139-Y141 HydrophobicContact CB-CE1 3.46Å; K139-Y141 VanDerWaalsContact CB-CE1 3.46Å; K139-Y141 HydrophobicContact CD-CE1 4.06Å; K139-Y141 HydrophobicContact CG-CE1 4.37Å; K139-Y141 WeakPolarHBondContact O-CD1 3.3Å
140	G	92.7	Very high	91.3	Very high	10 Å²	10	56.7 Å²	56.7	10%	0.103	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	76.6	21.4	176.6	0	0	0	0	0	114.8	N105 L106 S138	N105-G140 PolarHBondContact N-O 2.8Å; L106-G140 PolarHBondContact N-O 2.8Å; S138-G140 PolarHBondContact O-N 2.88Å; S138-G140 PolarHBondContact OG-N 3.27Å; S138-G140 VanDerWaalsContact OG-N 3.14Å
141	Y	93.8	Very high	91.4	Very high	62 Å²	62	57.1 Å²	57.1	24%	0.243	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	154.4	173.7	67.6	-93.5	0	0	0	112.2	F102 I103 A131 K139 F143	F102-Y141 HydrophobicContact CD2-CD2 4.37Å; F102-Y141 AromaticContact CE2-CD2 3.57Å; F102-Y141 HydrophobicContact CE2-CD2 3.57Å; F102-Y141 HydrophobicContact CE2-CE2 4.37Å; F102-Y141 AromaticContact CE2-CG 3.86Å; F102-Y141 HydrophobicContact CE2-CG 3.86Å; F102-Y141 HydrophobicContact CZ-CD2 4.47Å; F102-Y141 HydrophobicContact CZ-CG 4.36Å; I103-Y141 CarbonylContact O-C 3.58Å; I103-Y141 WeakPolarHBondContact O-CA 3.39Å; I103-Y141 WeakPolarHBondContact O-CB 3.39Å; A131-Y141 HydrophobicContact CB-CD1 4.22Å; A131-Y141 HydrophobicContact CB-CD2 3.52Å; A131-Y141 HydrophobicContact CB-CE1 3.8Å; A131-Y141 HydrophobicContact CB-CE2 3.05Å; A131-Y141 HydrophobicContact CB-CG 4.1Å; A131-Y141 PolarHBondContact N-O 3.27Å; K139-Y141 HydrophobicContact CB-CD1 3.8Å; K139-Y141 HydrophobicContact CB-CE1 3.46Å; K139-Y141 VanDerWaalsContact CB-CE1 3.46Å; K139-Y141 HydrophobicContact CD-CE1 4.06Å; K139-Y141 HydrophobicContact CG-CE1 4.37Å; K139-Y141 WeakPolarHBondContact O-CD1 3.3Å; Y141-F143 AromaticContact CD2-CE2 3.83Å; Y141-F143 HydrophobicContact CD2-CE2 3.83Å; Y141-F143 AromaticContact CD2-CZ 3.8Å; Y141-F143 HydrophobicContact CD2-CZ 3.8Å; Y141-F143 AromaticContact CE2-CE2 3.57Å; Y141-F143 HydrophobicContact CE2-CE2 3.57Å; Y141-F143 AromaticContact CE2-CZ 3.54Å; Y141-F143 HydrophobicContact CE2-CZ 3.54Å
142	A	94.9	Very high	91.5	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	166.4	-176.7	0	0	0	0	0	112.3	I103 L106 I115 K129 I130	I103-A142 HydrophobicContact CB-CB 4.35Å; I103-A142 HydrophobicContact CD1-CB 4.18Å; I103-A142 PolarHBondContact N-O 3.27Å; I103-A142 PolarHBondContact O-N 2.54Å; L106-A142 HydrophobicContact CD1-CB 3.56Å; I115-A142 HydrophobicContact CG2-CB 4.34Å; K129-A142 CarbonylContact O-C 3.59Å; K129-A142 WeakPolarHBondContact O-CA 3.36Å; K129-A142 WeakPolarHBondContact O-CB 3.13Å; I130-A142 HydrophobicContact CG1-CB 4.03Å
143	F	94.4	Very high	91.7	Very high	40 Å²	40	59.1 Å²	59.1	18%	0.175	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	133.5	175	-53.5	-80.9	0	0	0	109.3	I101 F102 C128 K129 A131 Y141 F174	I101-F143 WeakPolarHBondContact O-CA 3.37Å; F102-F143 AromaticContact CD2-CD1 3.99Å; F102-F143 HydrophobicContact CD2-CD1 3.99Å; F102-F143 AromaticContact CD2-CE1 3.48Å; F102-F143 HydrophobicContact CD2-CE1 3.48Å; F102-F143 VanDerWaalsContact CD2-CE1 3.48Å; F102-F143 HydrophobicContact CD2-CZ 4.13Å; F102-F143 HydrophobicContact CE2-CE1 4.14Å; F102-F143 HydrophobicContact CE2-CZ 4.36Å; F102-F143 HydrophobicContact CG-CE1 4.45Å; C128-F143 CarbonylContact C-O 3.48Å; C128-F143 WeakPolarHBondContact CA-O 3.17Å; K129-F143 PolarHBondContact N-O 3.08Å; K129-F143 PolarHBondContact O-N 2.95Å; A131-F143 HydrophobicContact CB-CE2 4.45Å; Y141-F143 AromaticContact CD2-CE2 3.83Å; Y141-F143 HydrophobicContact CD2-CE2 3.83Å; Y141-F143 AromaticContact CD2-CZ 3.8Å; Y141-F143 HydrophobicContact CD2-CZ 3.8Å; Y141-F143 AromaticContact CE2-CE2 3.57Å; Y141-F143 HydrophobicContact CE2-CE2 3.57Å; Y141-F143 AromaticContact CE2-CZ 3.54Å; Y141-F143 HydrophobicContact CE2-CZ 3.54Å; F143-F174 AromaticContact CD1-CD2 3.44Å; F143-F174 HydrophobicContact CD1-CD2 3.44Å; F143-F174 VanDerWaalsContact CD1-CD2 3.44Å; F143-F174 AromaticContact CD1-CE2 3.71Å; F143-F174 HydrophobicContact CD1-CE2 3.71Å; F143-F174 AromaticContact CE1-CD2 3.43Å; F143-F174 HydrophobicContact CE1-CD2 3.43Å; F143-F174 VanDerWaalsContact CE1-CD2 3.43Å; F143-F174 AromaticContact CE1-CE2 3.37Å; F143-F174 HydrophobicContact CE1-CE2 3.37Å; F143-F174 HydrophobicContact CZ-CE2 4.24Å
144	V	94.8	Very high	92	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	127.5	173.1	176.8	0	0	0	0	108	N100 I101 I103 I115 F119 I125 C128 F146	N100-V144 WeakPolarHBondContact CA-O 3.07Å; N100-V144 PolarHBondContact OD1-O 2.76Å; I101-V144 HydrophobicContact CD1-CB 4.06Å; I101-V144 HydrophobicContact CG1-CB 3.74Å; I101-V144 VanDerWaalsContact CG1-O 3.25Å; I101-V144 WeakPolarHBondContact CG1-O 2.99Å; I101-V144 PolarHBondContact N-O 3.36Å; I101-V144 PolarHBondContact O-N 3.32Å; I101-V144 VanDerWaalsContact O-N 3.12Å; I103-V144 HydrophobicContact CD1-CG2 3.72Å; I115-V144 HydrophobicContact CG2-CG2 3.72Å; F119-V144 HydrophobicContact CB-CG1 4.04Å; F119-V144 HydrophobicContact CB-CG2 4.2Å; F119-V144 HydrophobicContact CD2-CG2 4.22Å; F119-V144 HydrophobicContact CG-CG2 4.09Å; I125-V144 HydrophobicContact CD1-CG1 3.76Å; I125-V144 HydrophobicContact CG1-CG1 3.84Å; I125-V144 HydrophobicContact CG2-CG1 4.05Å; C128-V144 HydrophobicContact CB-CG2 4.49Å; V144-F146 HydrophobicContact CG1-CD2 4.17Å; V144-F146 HydrophobicContact CG1-CE1 4.44Å; V144-F146 HydrophobicContact CG1-CE2 3.78Å; V144-F146 HydrophobicContact CG1-CZ 3.94Å
145	H	93	Very high	92.5	Very high	10 Å²	10	51.6 Å²	51.6	5%	0.046	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	108.2	179.7	-170.6	-171.2	0	0	0	109.1	M93 V98 N100 I125 L126 S127	M93-H145 PolarHBondContact O-CE1 2.78Å; M93-H145 VanDerWaalsContact O-CE1 3.24Å; V98-H145 PolarHBondContact O-CD2 2.99Å; V98-H145 PolarHBondContact O-NE2 2.83Å; N100-H145 HydrophobicContact CB-CB 4.42Å; I125-H145 CarbonylContact C-O 3.57Å; L126-H145 PolarHBondContact N-O 3.5Å; S127-H145 PolarHBondContact N-O 2.89Å; S127-H145 PolarHBondContact O-N 3.42Å
146	F	93.5	Very high	92.9	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	152.4	174.8	-69.2	-79.9	0	0	0	111.7	G99 I101 F119 F122 N124 I125 V144 R148 A152 A155	G99-F146 PolarHBondContact O-N 3.17Å; I101-F146 HydrophobicContact CD1-CE2 3.8Å; I101-F146 HydrophobicContact CG1-CE2 4.17Å; F119-F146 HydrophobicContact CB-CZ 3.98Å; F119-F146 HydrophobicContact CD1-CE2 4.4Å; F119-F146 HydrophobicContact CD1-CZ 4.14Å; F119-F146 WeakPolarHBondContact O-CE1 3.43Å; F119-F146 WeakPolarHBondContact O-CZ 3.31Å; F122-F146 HydrophobicContact CB-CE1 4Å; F122-F146 HydrophobicContact CB-CZ 3.95Å; N124-F146 WeakPolarHBondContact O-CA 3.37Å; I125-F146 HydrophobicContact CD1-CE1 4.43Å; I125-F146 HydrophobicContact CG1-CD1 4.02Å; I125-F146 HydrophobicContact CG1-CE1 3.81Å; V144-F146 HydrophobicContact CG1-CD2 4.17Å; V144-F146 HydrophobicContact CG1-CE1 4.44Å; V144-F146 HydrophobicContact CG1-CE2 3.78Å; V144-F146 HydrophobicContact CG1-CZ 3.94Å; F146-R148 WeakPolarHBondContact CB-O 3.31Å; F146-R148 PolarHBondContact O-N 3.15Å; F146-A152 HydrophobicContact CD2-CB 3.84Å; F146-A155 HydrophobicContact CE2-CB 3.76Å; F146-A155 HydrophobicContact CZ-CB 3.88Å
147	E	89.2	Confident	93.2	Very high	70 Å²	70	49.7 Å²	49.7	33%	0.327	24%	0.237	S	C	.	.	S	Bend	trans	-64.4	-27.3	172.3	-173.4	172.9	-154.9	0	0	112.5	Y8 N124 L126	Y8-E147 PolarHBondContact OH-OE1 3.26Å; N124-E147 HydrophobicContact CB-CB 4.23Å; N124-E147 WeakPolarHBondContact CB-OE2 3.41Å; N124-E147 PolarHBondContact ND2-OE2 2.91Å; N124-E147 PolarHBondContact O-N 2.72Å; L126-E147 HydrophobicContact CD1-CB 4.4Å; L126-E147 HydrophobicContact CD2-CB 4.02Å; L126-E147 HydrophobicContact CD2-CG 4.23Å; L126-E147 HydrophobicContact CG-CB 4.04Å
148	R	90	Very high	93.1	Very high	162 Å²	162	52.3 Å²	52.3	61%	0.611	24%	0.244	S	C	*	.	S	Bend	trans	-126.2	141.6	-177.9	-60.1	-174.9	-178.9	-154.4	0.1	111.5	F146 E150 S151 A152	F146-R148 WeakPolarHBondContact CB-O 3.31Å; F146-R148 PolarHBondContact O-N 3.15Å; R148-E150 VanDerWaalsContact C-N 3.25Å; R148-E150 PolarHBondContact O-N 3.49Å; R148-S151 PolarHBondContact O-N 2.86Å; R148-A152 PolarHBondContact O-N 3.45Å
149	E	92.2	Very high	92.9	Very high	92 Å²	92	52.4 Å²	52.4	43%	0.43	25%	0.245	S	C	.	.	H	α-helix	trans	-61.5	-35.7	173.4	-166.1	174.4	-175.2	0	0	112.2	V98 S151 A152 Q153 K173	V98-E149 HydrophobicContact CG1-CB 3.77Å; V98-E149 HydrophobicContact CG1-CG 4.29Å; E149-S151 VanDerWaalsContact C-N 3.28Å; E149-S151 PolarHBondContact O-N 2.66Å; E149-A152 WeakPolarHBondContact O-CB 3.26Å; E149-A152 PolarHBondContact O-N 3.02Å; E149-A152 VanDerWaalsContact O-N 3.11Å; E149-Q153 PolarHBondContact O-N 2.62Å; E149-K173 IonicContact OE1-NZ 2.68Å; E149-K173 PolarHBondContact OE1-NZ 3.07Å
150	E	94.3	Very high	92.7	Very high	110 Å²	110	50.9 Å²	50.9	51%	0.514	24%	0.241	S	C	.	.	H	α-helix	trans	-57.2	-42	178	-168.2	-165.1	155.6	0	0	111.9	R148 Q153 K154	R148-E150 VanDerWaalsContact C-N 3.25Å; R148-E150 PolarHBondContact O-N 3.49Å; E150-Q153 PolarHBondContact O-N 2.97Å; E150-K154 WeakPolarHBondContact O-CG 3.38Å; E150-K154 PolarHBondContact O-N 3.02Å; E150-K154 WeakPolarHBondContact OE1-CE 3.26Å; E150-K154 IonicContact OE1-NZ 3.52Å; E150-K154 PolarHBondContact OE1-NZ 2.81Å
151	S	95.7	Very high	92	Very high	13 Å²	13	51.6 Å²	51.6	9%	0.091	25%	0.249	C	C	.	.	H	α-helix	trans	-64.5	-41.3	176.3	-66.7	0	0	0	0	112.1	F122 R148 E149 K154 A155	F122-S151 WeakPolarHBondContact O-CA 3.21Å; F122-S151 WeakPolarHBondContact O-CB 3.31Å; F122-S151 PolarHBondContact O-OG 2.72Å; R148-S151 PolarHBondContact O-N 2.86Å; E149-S151 VanDerWaalsContact C-N 3.28Å; E149-S151 PolarHBondContact O-N 2.66Å; S151-K154 PolarHBondContact O-N 2.98Å; S151-A155 WeakPolarHBondContact O-CB 3.5Å; S151-A155 PolarHBondContact O-N 2.97Å
152	A	95	Very high	91.5	Very high	5 Å²	5	53.9 Å²	53.9	4%	0.041	26%	0.263	C	S	.	.	H	α-helix	trans	-62.3	-42.8	173.5	0	0	0	0	0	112.2	I101 F146 R148 E149 A155 I156	I101-A152 HydrophobicContact CG2-CB 3.59Å; F146-A152 HydrophobicContact CD2-CB 3.84Å; R148-A152 PolarHBondContact O-N 3.45Å; E149-A152 WeakPolarHBondContact O-CB 3.26Å; E149-A152 PolarHBondContact O-N 3.02Å; E149-A152 VanDerWaalsContact O-N 3.11Å; A152-A155 PolarHBondContact O-N 3.14Å; A152-I156 VanDerWaalsContact O-CG1 3.28Å; A152-I156 WeakPolarHBondContact O-CG1 3.44Å; A152-I156 PolarHBondContact O-N 3.34Å
153	Q	94.1	Very high	90.7	Very high	81 Å²	81	60.6 Å²	60.6	38%	0.379	29%	0.293	S	S	.	.	H	α-helix	trans	-65.7	-41.9	178.2	-169.9	58	53.8	0	0	111.3	E149 E150 I156 T157	E149-Q153 PolarHBondContact O-N 2.62Å; E150-Q153 PolarHBondContact O-N 2.97Å; Q153-I156 PolarHBondContact O-N 2.63Å; Q153-T157 PolarHBondContact NE2-OG1 3.2Å; Q153-T157 WeakPolarHBondContact O-CB 3.29Å; Q153-T157 PolarHBondContact O-N 3.47Å; Q153-T157 PolarHBondContact O-OG1 2.92Å; Q153-T157 VanDerWaalsContact O-OG1 3.07Å
154	K	94.8	Very high	90	Very high	91 Å²	91	59.5 Å²	59.5	40%	0.396	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-48.6	172.3	-74.3	175	-174.9	169.9	0	111	F122 E150 S151 I156 T157 H158	F122-K154 HydrophobicContact CD1-CB 4.1Å; E150-K154 WeakPolarHBondContact O-CG 3.38Å; E150-K154 PolarHBondContact O-N 3.02Å; E150-K154 WeakPolarHBondContact OE1-CE 3.26Å; E150-K154 IonicContact OE1-NZ 3.52Å; E150-K154 PolarHBondContact OE1-NZ 2.81Å; S151-K154 PolarHBondContact O-N 2.98Å; K154-I156 PolarHBondContact O-N 3.16Å; K154-T157 PolarHBondContact O-N 2.77Å; K154-H158 PolarHBondContact O-N 3.34Å; K154-H158 PolarHBondContact O-ND1 2.96Å
155	A	93.3	Very high	89.2	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.6	-44.6	178.2	0	0	0	0	0	112.4	I101 F119 F122 F146 S151 A152 H158 V159	I101-A155 HydrophobicContact CD1-CB 4.1Å; F119-A155 HydrophobicContact CD1-CB 3.91Å; F119-A155 HydrophobicContact CE1-CB 4.11Å; F122-A155 HydrophobicContact CB-CB 3.95Å; F122-A155 HydrophobicContact CD1-CB 4.31Å; F122-A155 HydrophobicContact CD2-CB 3.65Å; F122-A155 HydrophobicContact CE2-CB 4.28Å; F122-A155 HydrophobicContact CG-CB 3.68Å; F146-A155 HydrophobicContact CE2-CB 3.76Å; F146-A155 HydrophobicContact CZ-CB 3.88Å; S151-A155 WeakPolarHBondContact O-CB 3.5Å; S151-A155 PolarHBondContact O-N 2.97Å; A152-A155 PolarHBondContact O-N 3.14Å; A155-H158 PolarHBondContact O-N 2.85Å; A155-V159 VanDerWaalsContact O-CB 3.28Å; A155-V159 WeakPolarHBondContact O-CB 3.4Å; A155-V159 WeakPolarHBondContact O-CG2 3.35Å; A155-V159 PolarHBondContact O-N 2.95Å
156	I	93.9	Very high	88.4	Confident	23 Å²	23	70.4 Å²	70.4	12%	0.118	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-50.1	176	-69.5	163.2	0	0	0	110.3	I101 A152 Q153 K154 H158 N160 V171 K173	I101-I156 HydrophobicContact CG2-CD1 3.86Å; I101-I156 HydrophobicContact CG2-CG1 3.94Å; A152-I156 VanDerWaalsContact O-CG1 3.28Å; A152-I156 WeakPolarHBondContact O-CG1 3.44Å; A152-I156 PolarHBondContact O-N 3.34Å; Q153-I156 PolarHBondContact O-N 2.63Å; K154-I156 PolarHBondContact O-N 3.16Å; I156-H158 VanDerWaalsContact C-N 3.32Å; I156-H158 PolarHBondContact O-N 3.13Å; I156-N160 WeakPolarHBondContact O-CB 3.41Å; I156-N160 PolarHBondContact O-N 3.29Å; I156-N160 VanDerWaalsContact O-N 3.13Å; I156-V171 HydrophobicContact CG1-CG1 4.04Å; I156-K173 HydrophobicContact CD1-CG 3.74Å
157	T	91.5	Very high	87.8	Confident	94 Å²	94	74.1 Å²	74.1	58%	0.577	36%	0.363	S	S	*	.	H	α-helix	trans	-61.9	-37.9	-177.1	-64.6	0	0	0	0	112.7	Q153 K154	Q153-T157 PolarHBondContact NE2-OG1 3.2Å; Q153-T157 WeakPolarHBondContact O-CB 3.29Å; Q153-T157 PolarHBondContact O-N 3.47Å; Q153-T157 PolarHBondContact O-OG1 2.92Å; Q153-T157 VanDerWaalsContact O-OG1 3.07Å; K154-T157 PolarHBondContact O-N 2.77Å
158	H	87.5	Confident	87.6	Confident	120 Å²	120	76.7 Å²	76.7	56%	0.556	37%	0.374	S	S	*	.	H	α-helix	trans	-93.6	-27.6	-173.4	-66.4	80.6	0	0	0	114.2	F122 K154 A155 I156 M162	F122-H158 HydrophobicContact CE1-CB 3.62Å; F122-H158 HydrophobicContact CZ-CB 4.01Å; K154-H158 PolarHBondContact O-N 3.34Å; K154-H158 PolarHBondContact O-ND1 2.96Å; A155-H158 PolarHBondContact O-N 2.85Å; I156-H158 VanDerWaalsContact C-N 3.32Å; I156-H158 PolarHBondContact O-N 3.13Å; H158-M162 WeakPolarHBondContact O-CG 3.43Å
159	V	89.9	Confident	87.6	Confident	12 Å²	12	69.1 Å²	69.1	7%	0.073	35%	0.345	C	S	.	.	H	α-helix	trans	-106.1	-24	-172.4	-170.9	0	0	0	0	112.6	F119 F122 A155 G161 M162 I164 V169 V171	F119-V159 HydrophobicContact CE1-CB 4.37Å; F119-V159 HydrophobicContact CE1-CG1 4.34Å; F119-V159 HydrophobicContact CE1-CG2 4.3Å; F119-V159 HydrophobicContact CZ-CB 4.42Å; F119-V159 HydrophobicContact CZ-CG1 3.9Å; F122-V159 HydrophobicContact CD2-CG2 4.46Å; F122-V159 HydrophobicContact CE1-CG2 4.32Å; F122-V159 HydrophobicContact CE2-CG2 3.36Å; F122-V159 HydrophobicContact CZ-CG2 3.27Å; A155-V159 VanDerWaalsContact O-CB 3.28Å; A155-V159 WeakPolarHBondContact O-CB 3.4Å; A155-V159 WeakPolarHBondContact O-CG2 3.35Å; A155-V159 PolarHBondContact O-N 2.95Å; V159-G161 PolarHBondContact O-N 2.92Å; V159-G161 VanDerWaalsContact O-N 3.12Å; V159-M162 WeakPolarHBondContact O-CB 3.24Å; V159-M162 PolarHBondContact O-N 3.33Å; V159-I164 HydrophobicContact CG1-CD1 4.27Å; V159-V169 HydrophobicContact CG1-CG2 4.07Å; V159-V171 HydrophobicContact CB-CG2 4.01Å; V159-V171 HydrophobicContact CG1-CG2 3.82Å
160	N	88	Confident	87.6	Confident	73 Å²	73	70.3 Å²	70.3	39%	0.39	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	120	179.8	-176.7	44	0	0	0	111	I156 Y170 V171	I156-N160 WeakPolarHBondContact O-CB 3.41Å; I156-N160 PolarHBondContact O-N 3.29Å; I156-N160 VanDerWaalsContact O-N 3.13Å; N160-Y170 WeakPolarHBondContact OD1-CD2 3.47Å; N160-V171 HydrophobicContact CB-CB 4.04Å; N160-V171 WeakPolarHBondContact CB-O 3.28Å; N160-V171 VanDerWaalsContact CG-O 3.26Å; N160-V171 PolarHBondContact OD1-N 2.91Å; N160-V171 PolarHBondContact OD1-O 3.33Å
161	G	77.9	Confident	87.4	Confident	26 Å²	26	65.1 Å²	65.1	27%	0.268	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.1	1.1	-177.3	0	0	0	0	0	115.1	V159 K168 V169	V159-G161 PolarHBondContact O-N 2.92Å; V159-G161 VanDerWaalsContact O-N 3.12Å; G161-K168 VanDerWaalsContact O-CE 3.24Å; G161-K168 WeakPolarHBondContact O-CE 3.46Å; G161-K168 WeakPolarHBondContact O-CG 3.41Å; G161-V169 WeakPolarHBondContact CA-O 3.33Å; G161-V169 PolarHBondContact N-O 2.92Å
162	M	83.8	Confident	87.2	Confident	109 Å²	109	64.7 Å²	64.7	54%	0.537	32%	0.32	S	S	.	.			trans	-78.4	165.7	171.9	-65	-64.6	-82	0	0	111.6	H158 V159 K168 V169	H158-M162 WeakPolarHBondContact O-CG 3.43Å; V159-M162 WeakPolarHBondContact O-CB 3.24Å; V159-M162 PolarHBondContact O-N 3.33Å; M162-K168 CarbonylContact O-C 3.55Å; M162-K168 WeakPolarHBondContact O-CA 3.48Å; M162-V169 WeakPolarHBondContact O-CG2 3.1Å; M162-V169 PolarHBondContact O-N 2.03Å
163	F	77.9	Confident	86.9	Confident	142 Å²	142	69.7 Å²	69.7	62%	0.623	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	129.9	175	-72.3	-96	0	0	0	111	K167 K168	F163-K167 WeakPolarHBondContact CA-O 3.32Å; F163-K168 HydrophobicContact CD1-CB 4.34Å; F163-K168 HydrophobicContact CE1-CB 4.03Å; F163-K168 HydrophobicContact CZ-CB 4.19Å
164	I	80.2	Confident	86.6	Confident	17 Å²	17	68.6 Å²	68.6	9%	0.087	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	119.8	166.5	-53.8	-176.4	0	0	0	106.6	I110 T118 V159 N166 K167 V169	I110-I164 HydrophobicContact CD1-CB 4.39Å; I110-I164 HydrophobicContact CD1-CG2 3.66Å; T118-I164 HydrophobicContact CG2-CD1 4.38Å; V159-I164 HydrophobicContact CG1-CD1 4.27Å; I164-N166 PolarHBondContact O-N 2.99Å; I164-K167 PolarHBondContact N-O 2.92Å; I164-K167 PolarHBondContact O-N 2.99Å; I164-K167 VanDerWaalsContact O-N 3.11Å; I164-V169 HydrophobicContact CB-CG1 3.83Å; I164-V169 HydrophobicContact CD1-CB 4.49Å; I164-V169 HydrophobicContact CD1-CG1 3.96Å; I164-V169 HydrophobicContact CD1-CG2 3.87Å; I164-V169 HydrophobicContact CG1-CG1 3.84Å; I164-V169 HydrophobicContact CG1-CG2 3.96Å
165	N	76.5	Confident	85.8	Confident	84 Å²	84	66.5 Å²	66.5	45%	0.449	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.7	61.7	-169.7	-68.1	3.3	0	0	0	113.5	E107 I110 K167	E107-N165 HydrophobicContact CB-CB 4.46Å; E107-N165 WeakPolarHBondContact OE2-CB 3.35Å; I110-N165 HydrophobicContact CD1-CB 4.37Å; I110-N165 HydrophobicContact CG1-CB 4.48Å; N165-K167 PolarHBondContact O-N 3.11Å
166	N	77.5	Confident	84.9	Confident	155 Å²	155	68.9 Å²	68.9	83%	0.829	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	7.9	177.8	-60.1	-21.5	0	0	0	116	I164	I164-N166 PolarHBondContact O-N 2.99Å
167	K	81.5	Confident	83.7	Confident	77 Å²	77	73.6 Å²	73.6	34%	0.335	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129	170.3	-68.8	-159.9	-179.5	-174.5	0	111.5	N105 E107 F163 I164 N165 V169	N105-K167 WeakPolarHBondContact O-CB 3.32Å; E107-K167 HydrophobicContact CB-CD 4.12Å; E107-K167 HydrophobicContact CB-CG 4.44Å; F163-K167 WeakPolarHBondContact CA-O 3.32Å; I164-K167 PolarHBondContact N-O 2.92Å; I164-K167 PolarHBondContact O-N 2.99Å; I164-K167 VanDerWaalsContact O-N 3.11Å; N165-K167 PolarHBondContact O-N 3.11Å; K167-V169 PolarHBondContact O-N 3.44Å; K167-V169 VanDerWaalsContact O-N 3.15Å
168	K	84.7	Confident	82.5	Confident	125 Å²	125	74.1 Å²	74.1	54%	0.543	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	107.6	171.1	-172.8	172.4	-175.9	173.3	0	109.5	N105 G161 M162 F163	N105-K168 PolarHBondContact ND2-O 2.91Å; G161-K168 VanDerWaalsContact O-CE 3.24Å; G161-K168 WeakPolarHBondContact O-CE 3.46Å; G161-K168 WeakPolarHBondContact O-CG 3.41Å; M162-K168 CarbonylContact O-C 3.55Å; M162-K168 WeakPolarHBondContact O-CA 3.48Å; F163-K168 HydrophobicContact CD1-CB 4.34Å; F163-K168 HydrophobicContact CE1-CB 4.03Å; F163-K168 HydrophobicContact CZ-CB 4.19Å
169	V	88.7	Confident	81.6	Confident	2 Å²	2	71.3 Å²	71.3	1%	0.012	36%	0.355	C	S	.	.			trans	-83.6	148.9	-176.9	-60	0	0	0	0	111.2	I103 L106 V159 G161 M162 I164 K167 V171	I103-V169 HydrophobicContact CG2-CB 4.47Å; L106-V169 HydrophobicContact CD2-CG1 3.86Å; V159-V169 HydrophobicContact CG1-CG2 4.07Å; G161-V169 WeakPolarHBondContact CA-O 3.33Å; G161-V169 PolarHBondContact N-O 2.92Å; M162-V169 WeakPolarHBondContact O-CG2 3.1Å; M162-V169 PolarHBondContact O-N 2.03Å; I164-V169 HydrophobicContact CB-CG1 3.83Å; I164-V169 HydrophobicContact CD1-CB 4.49Å; I164-V169 HydrophobicContact CD1-CG1 3.96Å; I164-V169 HydrophobicContact CD1-CG2 3.87Å; I164-V169 HydrophobicContact CG1-CG1 3.84Å; I164-V169 HydrophobicContact CG1-CG2 3.96Å; K167-V169 PolarHBondContact O-N 3.44Å; K167-V169 VanDerWaalsContact O-N 3.15Å; V169-V171 HydrophobicContact CG2-CG2 4.16Å
170	Y	92.2	Very high	80.7	Confident	117 Å²	117	75.1 Å²	75.1	46%	0.459	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132	166.6	169.6	-91.1	0	0	0	108.6	F102 I103 K104 N160	F102-Y170 HydrophobicContact CD1-CD1 4.37Å; F102-Y170 HydrophobicContact CD1-CE1 4.22Å; I103-Y170 CarbonylContact C-O 3.5Å; I103-Y170 VanDerWaalsContact CA-O 3.27Å; I103-Y170 WeakPolarHBondContact CA-O 3.09Å; K104-Y170 HydrophobicContact CB-CD1 4.21Å; K104-Y170 PolarHBondContact N-O 2.9Å; K104-Y170 PolarHBondContact O-N 2.85Å; N160-Y170 WeakPolarHBondContact OD1-CD2 3.47Å
171	V	91.1	Very high	79.3	Confident	1 Å²	1	78.7 Å²	78.7	1%	0.006	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	125.5	174.8	-171.4	0	0	0	0	108.5	I101 F102 I103 F119 I156 V159 N160 V169	I101-V171 HydrophobicContact CB-CG1 4.47Å; I101-V171 HydrophobicContact CD1-CG1 3.78Å; F102-V171 WeakPolarHBondContact O-CA 3.36Å; I103-V171 HydrophobicContact CG1-CG1 4.33Å; I103-V171 HydrophobicContact CG1-CG2 4.34Å; I103-V171 HydrophobicContact CG2-CG2 4.34Å; F119-V171 HydrophobicContact CE1-CG1 4.13Å; F119-V171 HydrophobicContact CE1-CG2 4.45Å; F119-V171 HydrophobicContact CZ-CG1 4.44Å; F119-V171 HydrophobicContact CZ-CG2 4.07Å; I156-V171 HydrophobicContact CG1-CG1 4.04Å; V159-V171 HydrophobicContact CB-CG2 4.01Å; V159-V171 HydrophobicContact CG1-CG2 3.82Å; N160-V171 HydrophobicContact CB-CB 4.04Å; N160-V171 WeakPolarHBondContact CB-O 3.28Å; N160-V171 VanDerWaalsContact CG-O 3.26Å; N160-V171 PolarHBondContact OD1-N 2.91Å; N160-V171 PolarHBondContact OD1-O 3.33Å; V169-V171 HydrophobicContact CG2-CG2 4.16Å
172	G	90.2	Very high	78.3	Confident	4 Å²	4	82.1 Å²	82.1	4%	0.041	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	174	179.3	0	0	0	0	0	111.7	I101 F102 F174	I101-G172 CarbonylContact C-O 3.5Å; I101-G172 VanDerWaalsContact CA-O 3.3Å; I101-G172 WeakPolarHBondContact CA-O 3.31Å; I101-G172 WeakPolarHBondContact CB-O 3.25Å; F102-G172 PolarHBondContact N-O 2.83Å; F102-G172 PolarHBondContact O-N 3.25Å; G172-F174 PolarHBondContact O-N 2.74Å
173	K	90.5	Very high	76.9	Confident	111 Å²	111	81.7 Å²	81.7	48%	0.483	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	140.8	171.8	-65.3	-163.4	178.8	-163.6	0	109.5	E149 I156 I175	E149-K173 IonicContact OE1-NZ 2.68Å; E149-K173 PolarHBondContact OE1-NZ 3.07Å; I156-K173 HydrophobicContact CD1-CG 3.74Å; K173-I175 PolarHBondContact O-N 3.02Å
174	F	86.6	Confident	75.7	Confident	57 Å²	57	79.5 Å²	79.5	25%	0.25	38%	0.379	C	S	.	.			trans	-64.3	125.8	174.3	168.6	-104.1	0	0	0	110	N100 F143 G172 P176	N100-F174 HydrophobicContact CB-CB 3.91Å; N100-F174 HydrophobicContact CB-CD1 4.47Å; N100-F174 HydrophobicContact CB-CG 4.45Å; N100-F174 WeakPolarHBondContact ND2-CD1 3.17Å; N100-F174 VanDerWaalsContact O-CB 3.31Å; N100-F174 WeakPolarHBondContact O-CB 3.46Å; N100-F174 PolarHBondContact O-N 2.83Å; F143-F174 AromaticContact CD1-CD2 3.44Å; F143-F174 HydrophobicContact CD1-CD2 3.44Å; F143-F174 VanDerWaalsContact CD1-CD2 3.44Å; F143-F174 AromaticContact CD1-CE2 3.71Å; F143-F174 HydrophobicContact CD1-CE2 3.71Å; F143-F174 AromaticContact CE1-CD2 3.43Å; F143-F174 HydrophobicContact CE1-CD2 3.43Å; F143-F174 VanDerWaalsContact CE1-CD2 3.43Å; F143-F174 AromaticContact CE1-CE2 3.37Å; F143-F174 HydrophobicContact CE1-CE2 3.37Å; F143-F174 HydrophobicContact CZ-CE2 4.24Å; G172-F174 PolarHBondContact O-N 2.74Å; F174-P176 HydrophobicContact CD1-CG 4.47Å; F174-P176 HydrophobicContact CE1-CB 4.4Å; F174-P176 HydrophobicContact CE1-CG 3.9Å
175	I	78.1	Confident	74.1	Confident	48 Å²	48	80.3 Å²	80.3	25%	0.246	39%	0.392	C	S	.	.			trans	-112.3	116.4	175.8	-60.4	179.3	0	0	0	107.7	K173 Q179 R180	K173-I175 PolarHBondContact O-N 3.02Å; I175-Q179 HydrophobicContact CG2-CB 3.62Å; I175-Q179 HydrophobicContact CG2-CG 3.67Å; I175-R180 HydrophobicContact CB-CG 3.96Å; I175-R180 HydrophobicContact CG2-CG 3.61Å; I175-R180 PolarHBondContact O-NE 2.78Å
176	P	74.8	Confident	72.7	Confident	49 Å²	49	81.5 Å²	81.5	32%	0.318	40%	0.395	S	S	.	.			trans	-51.6	146.9	176.7	-27.2	34.3	0	0	0	112.3	F174 T178 Q179 R180	F174-P176 HydrophobicContact CD1-CG 4.47Å; F174-P176 HydrophobicContact CE1-CB 4.4Å; F174-P176 HydrophobicContact CE1-CG 3.9Å; P176-T178 PolarHBondContact O-N 2.81Å; P176-T178 VanDerWaalsContact O-N 3.11Å; P176-Q179 PolarHBondContact O-N 2.83Å; P176-R180 PolarHBondContact O-N 2.79Å
177	Q	67.5	Low	71.3	Confident	123 Å²	123	77.2 Å²	77.2	58%	0.575	38%	0.377	S	S	*	.	H	α-helix	trans	-55.8	-33.7	-177.4	-171.4	-179.3	9.2	0	0	112.7	Q179 R180 K181	Q177-Q179 VanDerWaalsContact C-N 3.33Å; Q177-Q179 PolarHBondContact O-N 2.79Å; Q177-R180 PolarHBondContact O-N 2.87Å; Q177-K181 PolarHBondContact O-N 3.13Å; Q177-K181 VanDerWaalsContact O-N 3.11Å
178	T	67	Low	69.6	Low	105 Å²	105	77.1 Å²	77.1	64%	0.644	38%	0.383	S	S	*	.	H	α-helix	trans	-60.6	-38.6	174.7	48.7	0	0	0	0	112.6	P176	P176-T178 PolarHBondContact O-N 2.81Å; P176-T178 VanDerWaalsContact O-N 3.11Å
179	Q	69.1	Low	67.8	Low	60 Å²	60	76.3 Å²	76.3	28%	0.28	38%	0.384	S	S	.	.	H	α-helix	trans	-78.5	-36.7	177.5	-172.1	175.8	21.9	0	0	111.8	I175 P176 Q177 R182 Q183	I175-Q179 HydrophobicContact CG2-CB 3.62Å; I175-Q179 HydrophobicContact CG2-CG 3.67Å; P176-Q179 PolarHBondContact O-N 2.83Å; Q177-Q179 VanDerWaalsContact C-N 3.33Å; Q177-Q179 PolarHBondContact O-N 2.79Å; Q179-R182 PolarHBondContact O-N 2.83Å; Q179-Q183 PolarHBondContact O-N 3.17Å
180	R	71	Confident	65.8	Low	92 Å²	92	85.1 Å²	85.1	35%	0.347	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-42.1	176.2	-71	-170	-73.5	148.7	-0.3	113.6	I175 P176 Q177 R182 Q183 V184	I175-R180 HydrophobicContact CB-CG 3.96Å; I175-R180 HydrophobicContact CG2-CG 3.61Å; I175-R180 PolarHBondContact O-NE 2.78Å; P176-R180 PolarHBondContact O-N 2.79Å; Q177-R180 PolarHBondContact O-N 2.87Å; R180-R182 PolarHBondContact O-N 2.88Å; R180-Q183 PolarHBondContact O-N 2.85Å; R180-V184 PolarHBondContact O-N 3Å
181	K	58.9	Low	63.8	Low	149 Å²	149	84.5 Å²	84.5	65%	0.648	43%	0.43	S	S	*	.	H	α-helix	trans	-60.4	-28.5	178.4	-75.2	-175.3	177.6	-174.6	0	112.5	Q177 G185	Q177-K181 PolarHBondContact O-N 3.13Å; Q177-K181 VanDerWaalsContact O-N 3.11Å; K181-G185 PolarHBondContact O-N 2.95Å
182	R	55.8	Low	61.8	Low	98 Å²	98	92.1 Å²	92.1	37%	0.37	46%	0.463	S	S	.	.	H	α-helix	trans	-79.4	-40.7	179.7	-68.1	179.4	177.5	172.1	0.3	112.9	Q179 R180 V184 G185 E186 E231	Q179-R182 PolarHBondContact O-N 2.83Å; R180-R182 PolarHBondContact O-N 2.88Å; R182-V184 VanDerWaalsContact C-N 3.27Å; R182-V184 PolarHBondContact O-N 2.88Å; R182-G185 PolarHBondContact O-N 3.34Å; R182-E186 WeakPolarHBondContact O-CB 3.38Å; R182-E186 PolarHBondContact O-N 2.78Å; R182-E231 IonicContact CZ-OE1 3.25Å; R182-E231 IonicContact CZ-OE2 3.42Å; R182-E231 IonicContact NH1-OE1 2.66Å; R182-E231 PolarHBondContact NH1-OE1 2.88Å; R182-E231 IonicContact NH1-OE2 3.36Å; R182-E231 PolarHBondContact NH1-OE2 3.49Å; R182-E231 VanDerWaalsContact NH2-CD 3.34Å; R182-E231 IonicContact NH2-OE1 3.8Å; R182-E231 IonicContact NH2-OE2 2.74Å; R182-E231 PolarHBondContact NH2-OE2 2.76Å
183	Q	54.8	Low	60	Low	99 Å²	99	97 Å²	97	46%	0.463	49%	0.488	S	S	.	.	H	α-helix	trans	-60.4	-36.3	175.6	-72.6	-179.9	-17.1	0	0	112.4	Q179 R180 S187	Q179-Q183 PolarHBondContact O-N 3.17Å; R180-Q183 PolarHBondContact O-N 2.85Å; Q183-S187 WeakPolarHBondContact O-CB 3.28Å; Q183-S187 PolarHBondContact O-N 3.14Å; Q183-S187 PolarHBondContact O-OG 3.22Å
184	V	52.7	Low	57.7	Low	96 Å²	96	95.7 Å²	95.7	58%	0.582	50%	0.498	S	S	*	.	H	α-helix	trans	-67.9	-45.5	175.3	-179.8	0	0	0	0	110.9	R180 R182 E186 S187 T188	R180-V184 PolarHBondContact O-N 3Å; R182-V184 VanDerWaalsContact C-N 3.27Å; R182-V184 PolarHBondContact O-N 2.88Å; V184-E186 PolarHBondContact O-N 2.92Å; V184-S187 PolarHBondContact O-N 3.19Å; V184-S187 PolarHBondContact O-OG 2.85Å; V184-T188 PolarHBondContact O-N 2.96Å; V184-T188 VanDerWaalsContact O-N 3.14Å; V184-T188 PolarHBondContact O-OG1 3.28Å
185	G	47	Very low	55.6	Low	34 Å²	34	97.3 Å²	97.3	35%	0.351	52%	0.522	S	S	.	.	H	α-helix	trans	-62.2	-40.8	176.1	0	0	0	0	0	113.6	K181 R182 T188 L189	K181-G185 PolarHBondContact O-N 2.95Å; R182-G185 PolarHBondContact O-N 3.34Å; G185-T188 PolarHBondContact O-N 2.79Å; G185-L189 WeakPolarHBondContact O-CD1 3.43Å; G185-L189 PolarHBondContact O-N 3.47Å
186	E	46.3	Very low	53.7	Low	109 Å²	109	103.7 Å²	103.7	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-70.7	-36.6	177.1	-78.2	177.2	170.3	0	0	112.9	R182 V184 T188 L189 R190	R182-E186 WeakPolarHBondContact O-CB 3.38Å; R182-E186 PolarHBondContact O-N 2.78Å; V184-E186 PolarHBondContact O-N 2.92Å; E186-T188 VanDerWaalsContact C-N 3.27Å; E186-T188 PolarHBondContact O-N 3.37Å; E186-L189 PolarHBondContact O-N 3.03Å; E186-R190 WeakPolarHBondContact O-CB 3.19Å; E186-R190 WeakPolarHBondContact O-CG 3.28Å; E186-R190 PolarHBondContact O-N 2.85Å
187	S	48.9	Very low	51.9	Low	65 Å²	65	106.7 Å²	106.7	46%	0.455	57%	0.573	S	S	.	*	H	α-helix	trans	-63.9	-35.2	173.5	67.3	0	0	0	0	111.9	Q183 V184 S191	Q183-S187 WeakPolarHBondContact O-CB 3.28Å; Q183-S187 PolarHBondContact O-N 3.14Å; Q183-S187 PolarHBondContact O-OG 3.22Å; V184-S187 PolarHBondContact O-N 3.19Å; V184-S187 PolarHBondContact O-OG 2.85Å; S187-S191 PolarHBondContact O-N 3.1Å; S187-S191 PolarHBondContact O-OG 2.99Å
188	T	45.3	Very low	50.5	Low	76 Å²	76	107.3 Å²	107.3	47%	0.466	59%	0.585	S	S	.	*	H	α-helix	trans	-75.8	-29.4	177.1	-46	0	0	0	0	112	V184 G185 E186 K192	V184-T188 PolarHBondContact O-N 2.96Å; V184-T188 VanDerWaalsContact O-N 3.14Å; V184-T188 PolarHBondContact O-OG1 3.28Å; G185-T188 PolarHBondContact O-N 2.79Å; E186-T188 VanDerWaalsContact C-N 3.27Å; E186-T188 PolarHBondContact O-N 3.37Å; T188-K192 WeakPolarHBondContact O-CG 3.18Å
189	L	46.5	Very low	49	Very low	107 Å²	107	108.3 Å²	108.3	56%	0.56	60%	0.596	S	S	*	*	H	α-helix	trans	-77.2	-39	171.9	-102.5	98.5	0	0	0	113.1	G185 E186 S191 K192 N193	G185-L189 WeakPolarHBondContact O-CD1 3.43Å; G185-L189 PolarHBondContact O-N 3.47Å; E186-L189 PolarHBondContact O-N 3.03Å; L189-S191 VanDerWaalsContact C-N 3.35Å; L189-S191 PolarHBondContact O-N 3.11Å; L189-K192 PolarHBondContact O-N 3.33Å; L189-K192 VanDerWaalsContact O-N 3.09Å; L189-N193 PolarHBondContact O-N 3.17Å
190	R	48.6	Very low	47.6	Very low	188 Å²	188	110.5 Å²	110.5	71%	0.709	62%	0.618	S	S	*	*	H	α-helix	trans	-64.6	-37.3	178.5	-80.3	-177.5	177.8	-170.5	0.6	112	E186 K192 N193 A194	E186-R190 WeakPolarHBondContact O-CB 3.19Å; E186-R190 WeakPolarHBondContact O-CG 3.28Å; E186-R190 PolarHBondContact O-N 2.85Å; R190-K192 PolarHBondContact O-N 2.86Å; R190-N193 PolarHBondContact O-N 3Å; R190-A194 WeakPolarHBondContact O-CB 3.38Å; R190-A194 PolarHBondContact O-N 3.09Å
191	S	48.3	Very low	45.8	Very low	104 Å²	104	111.1 Å²	111.1	73%	0.727	64%	0.643	S	S	*	*	H	α-helix	trans	-68.9	-19.6	173.2	-64	0	0	0	0	113.8	S187 L189	S187-S191 PolarHBondContact O-N 3.1Å; S187-S191 PolarHBondContact O-OG 2.99Å; L189-S191 VanDerWaalsContact C-N 3.35Å; L189-S191 PolarHBondContact O-N 3.11Å
192	K	49.4	Very low	44.9	Very low	161 Å²	161	109.9 Å²	109.9	70%	0.7	65%	0.648	S	S	*	*	H	α-helix	trans	-90.9	-27.8	175.7	-72	-177.8	177.5	-176.3	0	113.4	T188 L189 R190	T188-K192 WeakPolarHBondContact O-CG 3.18Å; L189-K192 PolarHBondContact O-N 3.33Å; L189-K192 VanDerWaalsContact O-N 3.09Å; R190-K192 PolarHBondContact O-N 2.86Å
193	N	52.7	Low	44.1	Very low	106 Å²	106	111.5 Å²	111.5	57%	0.567	66%	0.664	S	S	*	*	H	α-helix	trans	-94.4	-8.9	-177.8	-69	-9	0	0	0	114.3	L189 R190 A195 Q196	L189-N193 PolarHBondContact O-N 3.17Å; R190-N193 PolarHBondContact O-N 3Å; N193-A195 PolarHBondContact O-N 3.46Å; N193-Q196 PolarHBondContact O-N 3.47Å
194	A	43.2	Very low	43.4	Very low	84 Å²	84	112.9 Å²	112.9	69%	0.694	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-0.3	177.2	0	0	0	0	0	114.6	R190	R190-A194 WeakPolarHBondContact O-CB 3.38Å; R190-A194 PolarHBondContact O-N 3.09Å
195	A	41.3	Very low	43.4	Very low	90 Å²	90	114.1 Å²	114.1	74%	0.744	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	0.2	177.3	0	0	0	0	0	114.2	N193	N193-A195 PolarHBondContact O-N 3.46Å
196	Q	39.5	Very low	44	Very low	183 Å²	183	117.6 Å²	117.6	86%	0.855	69%	0.693	S	S	*	*			trans	-143.1	84.6	179.9	-76.6	177.8	-10.5	0	0	110.7	N193	N193-Q196 PolarHBondContact O-N 3.47Å
197	S	37.3	Very low	45	Very low	112 Å²	112	114.5 Å²	114.5	78%	0.783	68%	0.682	S	S	*	*			trans	-142.2	80.7	165.2	65.2	0	0	0	0	110.3
198	T	37.2	Very low	46.7	Very low	135 Å²	135	114.6 Å²	114.6	83%	0.828	68%	0.682	S	S	*	*			trans	-90.8	122.1	155.4	35.8	0	0	0	0	108.1	S200	T198-S200 PolarHBondContact O-N 3.21Å
199	S	34.9	Very low	49	Very low	126 Å²	126	112.5 Å²	112.5	88%	0.881	67%	0.67	S	S	*	*			trans	-58.1	128.8	175.2	44.9	0	0	0	0	111.1
200	S	39.3	Very low	51.3	Low	106 Å²	106	107.4 Å²	107.4	74%	0.741	64%	0.644	S	S	*	*			trans	-132.1	114.7	160.9	24	0	0	0	0	108.1	T198 V202	T198-S200 PolarHBondContact O-N 3.21Å; S200-V202 PolarHBondContact O-N 3.2Å
201	A	33.7	Very low	53.3	Low	105 Å²	105	100.6 Å²	100.6	87%	0.868	62%	0.623	S	S	*	*			trans	-57.8	124	174.2	0	0	0	0	0	109.2	N203	A201-N203 PolarHBondContact O-N 3.48Å
202	V	40	Very low	55.4	Low	123 Å²	123	97 Å²	97	75%	0.745	60%	0.597	S	S	*	*			trans	-73	123.6	172	178.1	0	0	0	0	107.7	S200 T204	S200-V202 PolarHBondContact O-N 3.2Å; V202-T204 PolarHBondContact O-N 3.17Å
203	N	39.3	Very low	57.2	Low	132 Å²	132	91.9 Å²	91.9	71%	0.706	58%	0.584	S	S	*	*			trans	-43.7	124.7	178.9	-150.7	5.5	0	0	0	111.6	A201 D205	A201-N203 PolarHBondContact O-N 3.48Å; N203-D205 PolarHBondContact O-N 3.26Å
204	T	41.1	Very low	58.9	Low	128 Å²	128	88.8 Å²	88.8	79%	0.785	57%	0.569	S	S	*	*			trans	-77.5	19.2	-168.7	40.8	0	0	0	0	115.2	V202	V202-T204 PolarHBondContact O-N 3.17Å
205	D	51.1	Low	60.9	Low	122 Å²	122	89.7 Å²	89.7	65%	0.652	57%	0.567	S	S	*	*	S	Bend	trans	-103.3	110	-175.7	-69.9	-27.1	0	0	0	112.2	N203	N203-D205 PolarHBondContact O-N 3.26Å
206	N	60.9	Low	62.9	Low	107 Å²	107	86.3 Å²	86.3	57%	0.572	54%	0.538	S	S	*	.			trans	51	79.3	164.6	-70.2	-38.8	0	0	0	117.4	S208	N206-S208 PolarHBondContact O-N 2.92Å
207	V	67.5	Low	64.9	Low	45 Å²	45	79.1 Å²	79.1	27%	0.273	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-67.6	124.7	167.2	-176.6	0	0	0	0	110	Y343 R348	V207-Y343 HydrophobicContact CB-CD2 3.95Å; V207-Y343 HydrophobicContact CG1-CD2 4.42Å; V207-R348 HydrophobicContact CG1-CG 4.39Å
208	S	84.8	Confident	66.6	Low	66 Å²	66	77 Å²	77	46%	0.462	48%	0.484	S	S	.	.	P	Polyproline II helix	trans	-76.4	148.3	175.8	49.6	0	0	0	0	112.2	N206 V211	N206-S208 PolarHBondContact O-N 2.92Å; S208-V211 VanDerWaalsContact OG-CG2 3.24Å; S208-V211 WeakPolarHBondContact OG-CG2 3.2Å
209	C	93.2	Very high	67.6	Low	33 Å²	33	71.7 Å²	71.7	22%	0.223	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	162.5	169.9	61.6	0	0	0	0	111.5	V211 P349 C351	C209-V211 PolarHBondContact O-N 3.21Å; C209-V211 VanDerWaalsContact O-N 3.09Å; C209-P349 CarbonylContact C-O 3.57Å; C209-P349 WeakPolarHBondContact CA-O 3.2Å; C209-P349 HydrophobicContact CB-CG 4.03Å; C209-C351 HydrophobicContact CB-CB 3.98Å; C209-C351 WeakPolarHBondContact CB-SG 3.4Å; C209-C351 PolarHBondContact O-SG 2.59Å; C209-C351 WeakPolarHBondContact SG-CA 3.22Å; C209-C351 WeakPolarHBondContact SG-CB 3.41Å; C209-C351 CovalentContact SG-SG 2.05Å; C209-C351 PolarHBondContact SG-SG 2.92Å
210	G	93.3	Very high	68.4	Low	0 Å²	0	71.3 Å²	71.3	0%	0	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	10.6	170.1	0	0	0	0	0	114.8	P349 W435	G210-P349 PolarHBondContact N-O 3.05Å; G210-W435 VanDerWaalsContact CA-O 3.27Å; G210-W435 WeakPolarHBondContact CA-O 3.28Å; G210-W435 VanDerWaalsContact O-CD1 3.3Å; G210-W435 PolarHBondContact O-N 3.13Å
211	V	92.3	Very high	68.6	Low	45 Å²	45	73.8 Å²	73.8	27%	0.273	45%	0.45	S	S	.	.			trans	-104.7	134.8	178	-178.8	0	0	0	0	110.2	S208 C209 R348 V434	S208-V211 VanDerWaalsContact OG-CG2 3.24Å; S208-V211 WeakPolarHBondContact OG-CG2 3.2Å; C209-V211 PolarHBondContact O-N 3.21Å; C209-V211 VanDerWaalsContact O-N 3.09Å; V211-R348 VanDerWaalsContact O-CD 3.23Å; V211-R348 WeakPolarHBondContact O-CD 3.1Å; V211-V434 HydrophobicContact CG2-CG1 4.23Å
212	T	90.6	Very high	69.1	Low	29 Å²	29	74.7 Å²	74.7	18%	0.178	43%	0.431	C	S	.	.			trans	-112.7	140.2	175.8	-178.2	0	0	0	0	111.2	V214 S236	T212-V214 WeakPolarHBondContact CG2-O 3.15Å; T212-V214 PolarHBondContact OG1-N 3.02Å; T212-V214 PolarHBondContact OG1-O 2.86Å; T212-S236 VanDerWaalsContact CB-O 3.31Å; T212-S236 WeakPolarHBondContact CB-O 3.43Å; T212-S236 PolarHBondContact OG1-O 3.12Å
213	A	88.8	Confident	68.9	Low	52 Å²	52	73.2 Å²	73.2	43%	0.43	43%	0.432	S	S	.	.	S	Bend	trans	-80.8	-22.1	174.9	0	0	0	0	0	112.4	P345	A213-P345 HydrophobicContact CB-CB 3.61Å
214	V	87.6	Confident	68.6	Low	42 Å²	42	71.6 Å²	71.6	26%	0.255	43%	0.431	S	S	.	.	S	Bend	trans	-116.2	111.5	178	-178.9	0	0	0	0	107.5	T212 Q233 S236	T212-V214 WeakPolarHBondContact CG2-O 3.15Å; T212-V214 PolarHBondContact OG1-N 3.02Å; T212-V214 PolarHBondContact OG1-O 2.86Å; V214-Q233 HydrophobicContact CG1-CB 4.47Å; V214-Q233 HydrophobicContact CG1-CG 3.53Å; V214-S236 VanDerWaalsContact O-CA 3.27Å; V214-S236 WeakPolarHBondContact O-CA 3.34Å; V214-S236 WeakPolarHBondContact O-CB 3.15Å
215	P	85.5	Confident	68.2	Low	102 Å²	102	76.9 Å²	76.9	66%	0.662	44%	0.437	S	S	*	.			trans	-55.1	133.6	179.4	-26.3	34.7	0	0	0	111.4
216	P	83.5	Confident	67.6	Low	20 Å²	20	73.5 Å²	73.5	13%	0.13	42%	0.421	C	S	.	.			trans	-66.7	146.4	175	27.6	-31.8	0	0	0	109.4	I218 W435	P216-I218 PolarHBondContact O-N 2.83Å; P216-W435 HydrophobicContact CG-CZ2 3.68Å
217	N	81.8	Confident	67.1	Low	31 Å²	31	72.4 Å²	72.4	17%	0.166	42%	0.418	C	S	.	.			trans	-73.1	108.4	170.2	50.2	-19.8	0	0	0	109.6	Y222 W230 E231 Q233 Q386	N217-Y222 HydrophobicContact CB-CE2 4.49Å; N217-W230 PolarHBondContact O-NE1 3.49Å; N217-E231 PolarHBondContact ND2-O 3.27Å; N217-Q233 PolarHBondContact OD1-N 2.97Å; N217-Q386 PolarHBondContact O-NE2 3.49Å; N217-Q386 VanDerWaalsContact O-NE2 3.14Å; N217-Q386 PolarHBondContact OD1-NE2 3.25Å
218	I	73	Confident	66.9	Low	67 Å²	67	71.5 Å²	71.5	34%	0.344	41%	0.411	S	S	.	.			trans	-88	146.8	-179.2	-58.5	173	0	0	0	109.7	P216 T220	P216-I218 PolarHBondContact O-N 2.83Å; I218-T220 PolarHBondContact O-N 2.01Å
219	S	58.5	Low	66.3	Low	24 Å²	24	68.5 Å²	68.5	17%	0.168	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-64.5	-8.8	-166.6	81.2	0	0	0	0	116.1	L221 Y222 A223 W230 E388	S219-L221 PolarHBondContact O-N 2.83Å; S219-Y222 PolarHBondContact O-N 2.88Å; S219-A223 PolarHBondContact O-N 2.72Å; S219-W230 VanDerWaalsContact CB-CH2 3.45Å; S219-E388 WeakPolarHBondContact CB-OE2 3.44Å; S219-E388 PolarHBondContact OG-OE2 3.09Å
220	T	50.8	Low	65.9	Low	119 Å²	119	67.7 Å²	67.7	73%	0.73	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-59.1	-17.3	-179.6	47.5	0	0	0	0	113.7	I218	I218-T220 PolarHBondContact O-N 2.01Å
221	L	42.8	Very low	65.7	Low	157 Å²	157	69.5 Å²	69.5	82%	0.822	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	-100.2	-5.5	173.7	-80.4	150.4	0	0	0	115	S219	S219-L221 PolarHBondContact O-N 2.83Å
222	Y	45	Very low	65.6	Low	124 Å²	124	67.4 Å²	67.4	49%	0.486	38%	0.379	S	S	.	.			trans	-124.2	22	-175.8	-65.1	-76.2	0	0	0	113.3	N217 S219 S224	N217-Y222 HydrophobicContact CB-CE2 4.49Å; S219-Y222 PolarHBondContact O-N 2.88Å; Y222-S224 PolarHBondContact O-N 2.81Å
223	A	36.5	Very low	65.7	Low	92 Å²	92	70.3 Å²	70.3	76%	0.76	39%	0.39	S	S	*	.			trans	-62.7	15.2	-169.6	0	0	0	0	0	117.1	S219	S219-A223 PolarHBondContact O-N 2.72Å
224	S	33	Very low	65.9	Low	98 Å²	98	69.7 Å²	69.7	69%	0.685	38%	0.382	S	S	*	.	S	Bend	trans	-143.6	126	165.4	72.4	0	0	0	0	112.5	Y222	Y222-S224 PolarHBondContact O-N 2.81Å
225	R	31.7	Very low	66.2	Low	239 Å²	239	69.1 Å²	69.1	90%	0.902	38%	0.377	S	S	*	.			trans	81.1	13.6	160.1	-69.4	-176.2	-179.9	156.4	1.6	121.7	V227	R225-V227 PolarHBondContact O-N 3.01Å; R225-V227 VanDerWaalsContact O-N 3.11Å
226	V	39.4	Very low	66.6	Low	52 Å²	52	64.3 Å²	64.3	32%	0.315	35%	0.345	S	S	.	.			trans	-86.3	90.5	170.5	-155	0	0	0	0	110.8	G229	V226-G229 WeakPolarHBondContact CG1-O 3.27Å
227	V	50	Low	67.2	Low	84 Å²	84	64 Å²	64	51%	0.509	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	125.7	166.2	-172.3	0	0	0	0	107.1	R225 R415	R225-V227 PolarHBondContact O-N 3.01Å; R225-V227 VanDerWaalsContact O-N 3.11Å; V227-R415 HydrophobicContact CG1-CB 3.96Å
228	N	62.2	Low	67.9	Low	25 Å²	25	62.7 Å²	62.7	13%	0.134	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	29.4	177.6	-48.7	-35.3	0	0	0	119	I373 D374 R415 A448	N228-I373 HydrophobicContact CB-CB 4.26Å; N228-I373 VanDerWaalsContact CB-O 3.27Å; N228-I373 WeakPolarHBondContact CB-O 3.33Å; N228-I373 VanDerWaalsContact CG-O 3.3Å; N228-I373 VanDerWaalsContact ND2-C 3.33Å; N228-I373 PolarHBondContact ND2-O 3.08Å; N228-D374 WeakPolarHBondContact ND2-CA 3.12Å; N228-R415 PolarHBondContact N-O 3.33Å; N228-A448 WeakPolarHBondContact OD1-CB 3.32Å
229	G	73.5	Confident	69.1	Low	3 Å²	3	59.8 Å²	59.8	3%	0.031	32%	0.32	C	S	.	.			trans	78.7	178.7	175	0	0	0	0	0	113.7	V226 Q386	V226-G229 WeakPolarHBondContact CG1-O 3.27Å; G229-Q386 CarbonylContact C-O 3.56Å; G229-Q386 VanDerWaalsContact CA-O 3.28Å; G229-Q386 WeakPolarHBondContact CA-O 3.37Å
230	W	83.5	Confident	70.9	Confident	16 Å²	16	58.8 Å²	58.8	6%	0.061	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	163.7	-177.4	58.2	95.9	0	0	0	111.2	N217 S219 A232 Y366 M385 Q386 E388	N217-W230 PolarHBondContact O-NE1 3.49Å; S219-W230 VanDerWaalsContact CB-CH2 3.45Å; W230-A232 PolarHBondContact O-N 2.68Å; W230-Y366 AromaticContact CH2-CE1 3.61Å; W230-Y366 HydrophobicContact CH2-CE1 3.61Å; W230-Y366 HydrophobicContact CZ2-CD1 4.31Å; W230-Y366 AromaticContact CZ2-CE1 3.39Å; W230-Y366 HydrophobicContact CZ2-CE1 3.39Å; W230-M385 CarbonylContact O-C 3.54Å; W230-M385 WeakPolarHBondContact O-CA 3.4Å; W230-Q386 PolarHBondContact N-O 2.94Å; W230-Q386 VanDerWaalsContact NE1-NE2 3.13Å; W230-Q386 PolarHBondContact O-N 2.9Å; W230-E388 HydrophobicContact CH2-CB 3.81Å; W230-E388 HydrophobicContact CZ3-CB 4.35Å
231	E	89.5	Confident	73.2	Confident	38 Å²	38	53.1 Å²	53.1	18%	0.178	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	128.9	176.4	-174.4	179.4	145.5	0	0	110.4	R182 N217 H297 K383 M385	R182-E231 IonicContact CZ-OE1 3.25Å; R182-E231 IonicContact CZ-OE2 3.42Å; R182-E231 IonicContact NH1-OE1 2.66Å; R182-E231 PolarHBondContact NH1-OE1 2.88Å; R182-E231 IonicContact NH1-OE2 3.36Å; R182-E231 PolarHBondContact NH1-OE2 3.49Å; R182-E231 VanDerWaalsContact NH2-CD 3.34Å; R182-E231 IonicContact NH2-OE1 3.8Å; R182-E231 IonicContact NH2-OE2 2.74Å; R182-E231 PolarHBondContact NH2-OE2 2.76Å; N217-E231 PolarHBondContact ND2-O 3.27Å; E231-H297 IonicContact OE1-CE1 3.84Å; E231-H297 IonicContact OE1-NE2 3.34Å; E231-H297 PolarHBondContact OE1-NE2 3.47Å; E231-H297 VanDerWaalsContact OE1-NE2 3.1Å; E231-K383 VanDerWaalsContact CD-CD 3.46Å; E231-K383 HydrophobicContact CG-CB 3.94Å; E231-K383 WeakPolarHBondContact OE1-CD 3.47Å; E231-K383 WeakPolarHBondContact OE2-CD 3.31Å; E231-M385 HydrophobicContact CB-SD 4.01Å
232	A	91.5	Very high	75.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.008	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-62.1	145.2	171.8	0	0	0	0	0	109.9	W230 I237 H297 L384 Q386	W230-A232 PolarHBondContact O-N 2.68Å; A232-I237 HydrophobicContact CB-CD1 3.83Å; A232-I237 HydrophobicContact CB-CG1 4.36Å; A232-H297 PolarHBondContact O-CE1 2.67Å; A232-L384 HydrophobicContact CB-CB 4.44Å; A232-L384 HydrophobicContact CB-CD2 4.25Å; A232-L384 HydrophobicContact CB-CG 4.14Å; A232-L384 PolarHBondContact N-O 2.76Å; A232-Q386 HydrophobicContact CB-CB 4.43Å; A232-Q386 HydrophobicContact CB-CG 4.13Å
233	Q	92.3	Very high	78.1	Confident	90 Å²	90	42.3 Å²	42.3	42%	0.421	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-57.5	131.2	169.2	-177.9	65	12.2	0	0	108.5	V214 N217 H235 S236	V214-Q233 HydrophobicContact CG1-CB 4.47Å; V214-Q233 HydrophobicContact CG1-CG 3.53Å; N217-Q233 PolarHBondContact OD1-N 2.97Å; Q233-H235 PolarHBondContact O-N 3.4Å; Q233-S236 PolarHBondContact N-OG 3.09Å; Q233-S236 WeakPolarHBondContact O-CB 3.48Å; Q233-S236 PolarHBondContact O-N 3.03Å; Q233-S236 PolarHBondContact O-OG 2.68Å
234	P	93.1	Very high	80.8	Confident	40 Å²	40	40.8 Å²	40.8	26%	0.26	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	126.6	-176.2	-29.8	33.1	0	0	0	112.8	S236 H297	P234-S236 PolarHBondContact O-N 3.47Å; P234-S236 VanDerWaalsContact O-N 3.16Å; P234-H297 HydrophobicContact CB-CB 4.48Å
235	H	93.3	Very high	83.6	Confident	30 Å²	30	36.3 Å²	36.3	14%	0.139	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.5	17	-177.7	-45.4	-66.1	0	0	0	116.8	Q233 I237 G295 E303 F305 H346	Q233-H235 PolarHBondContact O-N 3.4Å; H235-I237 PolarHBondContact O-N 2.88Å; H235-G295 PolarHBondContact CE1-O 3.07Å; H235-E303 IonicContact CE1-OE1 2.86Å; H235-E303 PolarHBondContact CE1-OE1 3.33Å; H235-E303 IonicContact NE2-OE1 3.52Å; H235-F305 AromaticContact CE1-CD2 3.78Å; H235-F305 AromaticContact NE2-CD2 3.62Å; H235-F305 AromaticContact NE2-CE2 3.84Å; H235-H346 HydrophobicContact CB-CB 4.39Å; H235-H346 AromaticContact CD2-CD2 3.77Å; H235-H346 AromaticContact CG-CD2 3.58Å
236	S	94.5	Very high	86.4	Confident	1 Å²	1	27.1 Å²	27.1	1%	0.007	14%	0.139	C	C	.	.	S	Bend	trans	-70.8	-14.2	174.1	60.4	0	0	0	0	114.5	T212 V214 Q233 P234 P238	T212-S236 VanDerWaalsContact CB-O 3.31Å; T212-S236 WeakPolarHBondContact CB-O 3.43Å; T212-S236 PolarHBondContact OG1-O 3.12Å; V214-S236 VanDerWaalsContact O-CA 3.27Å; V214-S236 WeakPolarHBondContact O-CA 3.34Å; V214-S236 WeakPolarHBondContact O-CB 3.15Å; Q233-S236 PolarHBondContact N-OG 3.09Å; Q233-S236 WeakPolarHBondContact O-CB 3.48Å; Q233-S236 PolarHBondContact O-N 3.03Å; Q233-S236 PolarHBondContact O-OG 2.68Å; P234-S236 PolarHBondContact O-N 3.47Å; P234-S236 VanDerWaalsContact O-N 3.16Å; S236-P238 VanDerWaalsContact C-CD 3.45Å; S236-P238 VanDerWaalsContact O-CD 3.26Å; S236-P238 WeakPolarHBondContact O-CD 3.12Å
237	I	95.7	Very high	88.5	Confident	13 Å²	13	26 Å²	26	7%	0.067	13%	0.131	C	C	.	.			trans	-119	71.6	-178.7	-47.6	-178.1	0	0	0	109.1	A232 H235 W239 Q240 L384 Q386	A232-I237 HydrophobicContact CB-CD1 3.83Å; A232-I237 HydrophobicContact CB-CG1 4.36Å; H235-I237 PolarHBondContact O-N 2.88Å; I237-W239 HydrophobicContact CG2-CD2 4.27Å; I237-W239 HydrophobicContact CG2-CG 4.35Å; I237-W239 HydrophobicContact CG2-CZ2 3.91Å; I237-W239 PolarHBondContact O-N 3.48Å; I237-W239 VanDerWaalsContact O-N 3.09Å; I237-Q240 HydrophobicContact CB-CB 4.38Å; I237-Q240 HydrophobicContact CG2-CB 3.94Å; I237-Q240 WeakPolarHBondContact O-CB 3.14Å; I237-Q240 PolarHBondContact O-N 3.06Å; I237-Q240 VanDerWaalsContact O-N 3.07Å; I237-L384 HydrophobicContact CB-CD2 4.16Å; I237-L384 HydrophobicContact CD1-CD2 4.17Å; I237-L384 HydrophobicContact CG1-CD2 4.46Å; I237-Q386 HydrophobicContact CD1-CB 4.24Å
238	P	96.6	Very high	89.8	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.019	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-7.5	-167.9	31.3	-39.6	0	0	0	114.5	S236 T347 R348	S236-P238 VanDerWaalsContact C-CD 3.45Å; S236-P238 VanDerWaalsContact O-CD 3.26Å; S236-P238 WeakPolarHBondContact O-CD 3.12Å; P238-T347 WeakPolarHBondContact O-CA 3.35Å; P238-R348 CarbonylContact C-O 3.5Å; P238-R348 VanDerWaalsContact C-O 3.29Å; P238-R348 HydrophobicContact CB-CB 4.05Å; P238-R348 HydrophobicContact CB-CG 4.41Å; P238-R348 HydrophobicContact CG-CB 3.92Å; P238-R348 HydrophobicContact CG-CG 4.45Å; P238-R348 PolarHBondContact O-N 2.91Å; P238-R348 VanDerWaalsContact O-O 3.11Å
239	W	97.7	Very high	90.4	Very high	6 Å²	6	31.6 Å²	31.6	2%	0.023	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-14.8	173.3	48.4	82.8	0	0	0	113.6	I237 V241 S258 L259 R348 V350 W435	I237-W239 HydrophobicContact CG2-CD2 4.27Å; I237-W239 HydrophobicContact CG2-CG 4.35Å; I237-W239 HydrophobicContact CG2-CZ2 3.91Å; I237-W239 PolarHBondContact O-N 3.48Å; I237-W239 VanDerWaalsContact O-N 3.09Å; W239-V241 PolarHBondContact O-N 3.39Å; W239-S258 CarbonylContact O-C 3.52Å; W239-S258 VanDerWaalsContact O-CA 3.3Å; W239-S258 WeakPolarHBondContact O-CA 3.48Å; W239-L259 HydrophobicContact CB-CB 4.39Å; W239-L259 PolarHBondContact O-N 3.05Å; W239-R348 WeakPolarHBondContact CA-O 2.94Å; W239-R348 WeakPolarHBondContact CB-O 3Å; W239-R348 PolarHBondContact N-O 2.92Å; W239-R348 VanDerWaalsContact N-O 3.15Å; W239-V350 HydrophobicContact CB-CB 3.93Å; W239-V350 HydrophobicContact CB-CG1 4.43Å; W239-V350 HydrophobicContact CD2-CB 3.78Å; W239-V350 HydrophobicContact CD2-CG2 4.2Å; W239-V350 HydrophobicContact CE3-CB 4.24Å; W239-V350 HydrophobicContact CG-CB 3.62Å; W239-V350 HydrophobicContact CG-CG1 4.38Å; W239-V350 HydrophobicContact CG-CG2 4.39Å; W239-W435 HydrophobicContact CH2-CB 3.37Å; W239-W435 AromaticContact CH2-CD1 3.39Å; W239-W435 HydrophobicContact CH2-CD2 4.1Å; W239-W435 AromaticContact CH2-CG 3.29Å; W239-W435 HydrophobicContact CH2-CG 3.29Å; W239-W435 HydrophobicContact CZ2-CB 3.64Å; W239-W435 HydrophobicContact CZ2-CD2 4.14Å; W239-W435 AromaticContact CZ2-CG 3.68Å; W239-W435 HydrophobicContact CZ2-CG 3.68Å; W239-W435 HydrophobicContact CZ3-CB 4Å; W239-W435 HydrophobicContact CZ3-CG 4.24Å
240	Q	97.3	Very high	90.4	Very high	3 Å²	3	34.4 Å²	34.4	1%	0.014	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.3	-179.1	-175.6	71.4	41	0	0	110	I237 S368 W370 L384 P426	I237-Q240 HydrophobicContact CB-CB 4.38Å; I237-Q240 HydrophobicContact CG2-CB 3.94Å; I237-Q240 WeakPolarHBondContact O-CB 3.14Å; I237-Q240 PolarHBondContact O-N 3.06Å; I237-Q240 VanDerWaalsContact O-N 3.07Å; Q240-S368 PolarHBondContact NE2-O 2.68Å; Q240-S368 PolarHBondContact OE1-O 2.93Å; Q240-S368 PolarHBondContact OE1-OG 2.67Å; Q240-W370 HydrophobicContact CG-CH2 3.77Å; Q240-W370 HydrophobicContact CG-CZ3 3.72Å; Q240-L384 HydrophobicContact CB-CD2 4.14Å; Q240-L384 HydrophobicContact CG-CD1 3.75Å; Q240-L384 HydrophobicContact CG-CD2 4.01Å; Q240-P426 VanDerWaalsContact OE1-CD 3.23Å
241	V	97.4	Very high	90	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	158.8	169.7	-48.8	0	0	0	0	111	W239 L243 G256 G257 L259 V271 V292 T293 V294	W239-V241 PolarHBondContact O-N 3.39Å; V241-L243 HydrophobicContact CG2-CD1 3.67Å; V241-G256 WeakPolarHBondContact O-CA 3.35Å; V241-G257 VanDerWaalsContact CG2-C 3.45Å; V241-G257 VanDerWaalsContact CG2-CA 3.48Å; V241-G257 PolarHBondContact N-O 3.45Å; V241-G257 PolarHBondContact O-N 2.89Å; V241-L259 HydrophobicContact CG1-CD1 4.43Å; V241-L259 HydrophobicContact CG1-CD2 4.15Å; V241-L259 HydrophobicContact CG1-CG 3.71Å; V241-V271 HydrophobicContact CG1-CG2 4.45Å; V241-V271 HydrophobicContact CG2-CG1 3.62Å; V241-V271 HydrophobicContact CG2-CG2 4.39Å; V241-V292 HydrophobicContact CB-CG1 3.7Å; V241-V292 HydrophobicContact CG1-CG1 4.19Å; V241-V292 HydrophobicContact CG2-CG1 3.74Å; V241-T293 WeakPolarHBondContact CA-O 3.48Å; V241-V294 HydrophobicContact CB-CG1 4.47Å; V241-V294 HydrophobicContact CG1-CB 4.5Å; V241-V294 HydrophobicContact CG1-CG1 3.72Å
242	R	95.7	Very high	89.7	Confident	53 Å²	53	40.2 Å²	40.2	20%	0.2	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.6	169.9	-172.7	-179.2	-177.1	-150.9	3.2	109.6	V292 T293 L296 L299 W370	R242-V292 CarbonylContact O-C 3.53Å; R242-V292 WeakPolarHBondContact O-CA 3.36Å; R242-T293 PolarHBondContact N-O 2.58Å; R242-T293 PolarHBondContact O-N 2.67Å; R242-L296 HydrophobicContact CB-CD2 4.06Å; R242-L299 VanDerWaalsContact CD-CD2 3.5Å; R242-W370 HydrophobicContact CB-CE3 4.18Å; R242-W370 HydrophobicContact CB-CH2 4.44Å; R242-W370 HydrophobicContact CB-CZ3 3.77Å; R242-W370 HydrophobicContact CG-CE3 4.37Å; R242-W370 HydrophobicContact CG-CZ3 4.46Å
243	L	95.3	Very high	89.3	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	132.9	169.2	-80.4	59.6	0	0	0	108.7	V241 V245 F254 C255 V271 S273 C277 I290 E291 V292 I335	V241-L243 HydrophobicContact CG2-CD1 3.67Å; L243-V245 HydrophobicContact CB-CG2 4.49Å; L243-F254 VanDerWaalsContact O-CA 3.31Å; L243-F254 WeakPolarHBondContact O-CA 3.32Å; L243-C255 HydrophobicContact CB-CB 4.01Å; L243-C255 HydrophobicContact CD2-CB 4.26Å; L243-C255 PolarHBondContact N-O 2.69Å; L243-C255 PolarHBondContact O-N 3.37Å; L243-C255 VanDerWaalsContact O-N 3.13Å; L243-V271 HydrophobicContact CD1-CG1 4.36Å; L243-S273 WeakPolarHBondContact CD2-OG 3.36Å; L243-C277 HydrophobicContact CD2-CB 4.39Å; L243-I290 HydrophobicContact CG-CG2 4.35Å; L243-E291 CarbonylContact C-O 3.43Å; L243-E291 WeakPolarHBondContact CA-O 3.38Å; L243-V292 HydrophobicContact CD1-CG1 4.43Å; L243-V292 HydrophobicContact CD1-CG2 4.25Å; L243-V292 HydrophobicContact CG-CG2 4.24Å; L243-I335 HydrophobicContact CD2-CD1 3.63Å; L243-I335 HydrophobicContact CG-CD1 4.29Å
244	K	93.7	Very high	89.2	Confident	60 Å²	60	41 Å²	41	26%	0.261	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	111.8	166.6	173.1	-179.4	163.1	-140.9	0	107.6	Y252 F254 E291	K244-Y252 HydrophobicContact CD-CD1 4.39Å; K244-Y252 HydrophobicContact CG-CD1 4.02Å; K244-Y252 HydrophobicContact CG-CG 4.48Å; K244-F254 HydrophobicContact CB-CD1 4.05Å; K244-F254 HydrophobicContact CB-CE1 3.86Å; K244-F254 HydrophobicContact CD-CE1 4.1Å; K244-F254 HydrophobicContact CG-CD1 4.3Å; K244-F254 HydrophobicContact CG-CE1 3.68Å; K244-F254 HydrophobicContact CG-CZ 4.44Å; K244-E291 HydrophobicContact CB-CB 4.3Å; K244-E291 WeakPolarHBondContact CD-OE2 3.45Å; K244-E291 PolarHBondContact N-O 2.86Å; K244-E291 IonicContact NZ-OE2 3.54Å; K244-E291 PolarHBondContact NZ-OE2 3.3Å; K244-E291 PolarHBondContact O-N 3.45Å
245	V	91.5	Very high	89.1	Confident	3 Å²	3	39.7 Å²	39.7	2%	0.018	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	112.3	-174.2	-177	0	0	0	0	108.2	L243 I247 Y252 G253 I285 I290	L243-V245 HydrophobicContact CB-CG2 4.49Å; V245-I247 PolarHBondContact O-N 3Å; V245-Y252 CarbonylContact O-C 3.33Å; V245-Y252 VanDerWaalsContact O-CA 3.28Å; V245-Y252 WeakPolarHBondContact O-CA 3.31Å; V245-G253 PolarHBondContact N-O 3.4Å; V245-G253 PolarHBondContact O-N 2.79Å; V245-I285 HydrophobicContact CG1-CB 4.32Å; V245-I285 HydrophobicContact CG1-CG1 4.04Å; V245-I285 HydrophobicContact CG1-CG2 4.05Å; V245-I290 HydrophobicContact CG1-CG1 4.36Å; V245-I290 HydrophobicContact CG2-CG1 4.34Å; V245-I290 HydrophobicContact CG2-CG2 4.41Å
246	N	89.8	Confident	89.2	Confident	46 Å²	46	38.3 Å²	38.3	25%	0.246	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	106	174.5	177.9	-32.3	0	0	0	108.7	F248 Y252 R289	N246-F248 VanDerWaalsContact OD1-C 3.27Å; N246-F248 PolarHBondContact OD1-O 3.36Å; N246-F248 VanDerWaalsContact OD1-O 3.08Å; N246-Y252 HydrophobicContact CB-CD1 4.08Å; N246-Y252 HydrophobicContact CB-CE1 4.03Å; N246-R289 HydrophobicContact CB-CB 4.2Å; N246-R289 WeakPolarHBondContact CB-O 3.42Å; N246-R289 PolarHBondContact N-O 3.49Å; N246-R289 PolarHBondContact O-NE 3.33Å; N246-R289 PolarHBondContact O-NH2 3.18Å; N246-R289 PolarHBondContact OD1-NH2 2.85Å
247	I	83.9	Confident	89.3	Confident	28 Å²	28	38.3 Å²	38.3	14%	0.144	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	-43.8	-178.7	-56.5	178.9	0	0	0	110.1	V245 V251 V280 L281 R289	V245-I247 PolarHBondContact O-N 3Å; I247-V251 HydrophobicContact CB-CG1 4.35Å; I247-V251 PolarHBondContact N-O 3.29Å; I247-V280 HydrophobicContact CD1-CG1 4.46Å; I247-V280 HydrophobicContact CG1-CG2 4.25Å; I247-V280 HydrophobicContact CG2-CG2 3.93Å; I247-L281 HydrophobicContact CG2-CD1 3.73Å; I247-L281 HydrophobicContact CG2-CG 4.46Å; I247-R289 PolarHBondContact O-NH1 3.25Å; I247-R289 PolarHBondContact O-NH2 2.89Å
248	F	77.3	Confident	89.4	Confident	108 Å²	108	37.8 Å²	37.8	47%	0.474	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	164.7	169.8	-62.4	-66.7	0	0	0	109.1	N246 G250 V251 L281	N246-F248 VanDerWaalsContact OD1-C 3.27Å; N246-F248 PolarHBondContact OD1-O 3.36Å; N246-F248 VanDerWaalsContact OD1-O 3.08Å; F248-G250 PolarHBondContact O-N 3.14Å; F248-V251 HydrophobicContact CB-CB 4.3Å; F248-V251 HydrophobicContact CB-CG2 4.47Å; F248-V251 PolarHBondContact N-O 3.25Å; F248-V251 PolarHBondContact O-N 3.43Å; F248-V251 VanDerWaalsContact O-O 3.08Å; F248-L281 HydrophobicContact CD2-CD1 4.24Å; F248-L281 HydrophobicContact CE1-CD1 4.46Å; F248-L281 HydrophobicContact CE2-CD1 3.11Å; F248-L281 HydrophobicContact CZ-CD1 3.24Å
249	P	76.3	Confident	89.5	Confident	120 Å²	120	37.7 Å²	37.7	78%	0.779	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	118.4	171.6	-27.5	36.1	0	0	0	111.6	V251	P249-V251 VanDerWaalsContact C-N 3.34Å; P249-V251 PolarHBondContact O-N 3.3Å
250	G	71.8	Confident	89.5	Confident	61 Å²	61	37.4 Å²	37.4	63%	0.629	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	-9.7	-178.2	0	0	0	0	0	116.3	F248	F248-G250 PolarHBondContact O-N 3.14Å
251	V	75.1	Confident	89.2	Confident	76 Å²	76	38.5 Å²	38.5	46%	0.461	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	118	-179.3	-175.9	0	0	0	0	110.3	I247 F248 P249	I247-V251 HydrophobicContact CB-CG1 4.35Å; I247-V251 PolarHBondContact N-O 3.29Å; F248-V251 HydrophobicContact CB-CB 4.3Å; F248-V251 HydrophobicContact CB-CG2 4.47Å; F248-V251 PolarHBondContact N-O 3.25Å; F248-V251 PolarHBondContact O-N 3.43Å; F248-V251 VanDerWaalsContact O-O 3.08Å; P249-V251 VanDerWaalsContact C-N 3.34Å; P249-V251 PolarHBondContact O-N 3.3Å
252	Y	82.9	Confident	88.8	Confident	100 Å²	100	40.3 Å²	40.3	39%	0.392	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	136.4	-175.3	-54.7	-83.1	0	0	0	111.7	K244 V245 N246	K244-Y252 HydrophobicContact CD-CD1 4.39Å; K244-Y252 HydrophobicContact CG-CD1 4.02Å; K244-Y252 HydrophobicContact CG-CG 4.48Å; V245-Y252 CarbonylContact O-C 3.33Å; V245-Y252 VanDerWaalsContact O-CA 3.28Å; V245-Y252 WeakPolarHBondContact O-CA 3.31Å; N246-Y252 HydrophobicContact CB-CD1 4.08Å; N246-Y252 HydrophobicContact CB-CE1 4.03Å
253	G	83.3	Confident	88.3	Confident	21 Å²	21	43.4 Å²	43.4	22%	0.216	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	152.7	162.6	0	0	0	0	0	110.7	V245	V245-G253 PolarHBondContact N-O 3.4Å; V245-G253 PolarHBondContact O-N 2.79Å
254	F	90.3	Very high	87.7	Confident	88 Å²	88	51.7 Å²	51.7	39%	0.386	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	139.9	176.5	-60.6	-77.7	0	0	0	110.8	L243 K244	L243-F254 VanDerWaalsContact O-CA 3.31Å; L243-F254 WeakPolarHBondContact O-CA 3.32Å; K244-F254 HydrophobicContact CB-CD1 4.05Å; K244-F254 HydrophobicContact CB-CE1 3.86Å; K244-F254 HydrophobicContact CD-CE1 4.1Å; K244-F254 HydrophobicContact CG-CD1 4.3Å; K244-F254 HydrophobicContact CG-CE1 3.68Å; K244-F254 HydrophobicContact CG-CZ 4.44Å
255	C	92.9	Very high	87.4	Confident	12 Å²	12	50.1 Å²	50.1	8%	0.081	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	163.2	175.6	-84.6	0	0	0	0	110.4	L243 C277 S423	L243-C255 HydrophobicContact CB-CB 4.01Å; L243-C255 HydrophobicContact CD2-CB 4.26Å; L243-C255 PolarHBondContact N-O 2.69Å; L243-C255 PolarHBondContact O-N 3.37Å; L243-C255 VanDerWaalsContact O-N 3.13Å; C255-C277 HydrophobicContact CB-CB 3.71Å; C255-C277 WeakPolarHBondContact CB-SG 3.41Å; C255-C277 WeakPolarHBondContact SG-CB 3.25Å; C255-C277 CovalentContact SG-SG 2.03Å; C255-C277 PolarHBondContact SG-SG 3.22Å; C255-S423 CarbonylContact C-O 3.5Å; C255-S423 VanDerWaalsContact CA-O 3.32Å; C255-S423 WeakPolarHBondContact CA-O 3.41Å; C255-S423 WeakPolarHBondContact CB-O 3.38Å; C255-S423 PolarHBondContact SG-O 3.35Å
256	G	94.3	Very high	87.4	Confident	1 Å²	1	56 Å²	56	1%	0.01	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	177.3	162.7	0	0	0	0	0	112.7	V241 S273 S423 G424	V241-G256 WeakPolarHBondContact O-CA 3.35Å; G256-S273 PolarHBondContact O-OG 3.26Å; G256-S423 PolarHBondContact N-O 3.32Å; G256-G424 VanDerWaalsContact C-C 3.45Å; G256-G424 CarbonylContact C-O 3.48Å; G256-G424 CarbonylContact O-C 3.54Å
257	G	97.1	Very high	87.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.4	175.3	173.4	0	0	0	0	0	110	V241 L272 G424	V241-G257 VanDerWaalsContact CG2-C 3.45Å; V241-G257 VanDerWaalsContact CG2-CA 3.48Å; V241-G257 PolarHBondContact N-O 3.45Å; V241-G257 PolarHBondContact O-N 2.89Å; G257-L272 CarbonylContact C-O 3.56Å; G257-L272 VanDerWaalsContact CA-O 3.24Å; G257-L272 WeakPolarHBondContact CA-O 3.39Å; G257-G424 VanDerWaalsContact CA-O 3.25Å; G257-G424 WeakPolarHBondContact CA-O 3.36Å; G257-G424 PolarHBondContact N-O 3.17Å
258	S	98.3	Very high	88.1	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.014	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	131.8	175.8	-56.4	0	0	0	0	111.3	W239 I260 V271 L272 P426	W239-S258 CarbonylContact O-C 3.52Å; W239-S258 VanDerWaalsContact O-CA 3.3Å; W239-S258 WeakPolarHBondContact O-CA 3.48Å; S258-I260 PolarHBondContact O-N 3.08Å; S258-V271 CarbonylContact O-C 3.52Å; S258-V271 VanDerWaalsContact O-CA 3.28Å; S258-V271 WeakPolarHBondContact O-CA 3.32Å; S258-L272 PolarHBondContact N-O 3.07Å; S258-L272 PolarHBondContact O-N 3.11Å; S258-P426 WeakPolarHBondContact OG-CB 3.48Å
259	L	98	Very high	89	Confident	1 Å²	1	50 Å²	50	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	129.3	161.7	-70.6	171	0	0	0	108.6	W239 V241 T268 V271 V294 V341 P349 V350	W239-L259 HydrophobicContact CB-CB 4.39Å; W239-L259 PolarHBondContact O-N 3.05Å; V241-L259 HydrophobicContact CG1-CD1 4.43Å; V241-L259 HydrophobicContact CG1-CD2 4.15Å; V241-L259 HydrophobicContact CG1-CG 3.71Å; L259-T268 HydrophobicContact CB-CG2 4.23Å; L259-T268 HydrophobicContact CD2-CG2 3.87Å; L259-V271 HydrophobicContact CD2-CG2 3.87Å; L259-V294 HydrophobicContact CD1-CG1 4.28Å; L259-V294 HydrophobicContact CD2-CG1 4.18Å; L259-V294 HydrophobicContact CG-CG1 4.47Å; L259-V341 HydrophobicContact CD1-CG1 4.2Å; L259-V341 HydrophobicContact CD2-CB 4.47Å; L259-V341 HydrophobicContact CD2-CG2 4.26Å; L259-P349 CarbonylContact O-C 3.56Å; L259-P349 WeakPolarHBondContact O-CA 3.43Å; L259-V350 PolarHBondContact O-N 3.25Å
260	I	96.6	Very high	90	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-123.8	161.5	178.3	59.7	161.1	0	0	0	110.8	S258 T268 L270 L272 V334 V350 L352 L437 I466	S258-I260 PolarHBondContact O-N 3.08Å; I260-T268 WeakPolarHBondContact O-CB 3.45Å; I260-T268 WeakPolarHBondContact O-CG2 2.91Å; I260-T268 PolarHBondContact O-OG1 3.25Å; I260-L270 HydrophobicContact CD1-CB 4.2Å; I260-L270 HydrophobicContact CG1-CB 3.77Å; I260-L270 PolarHBondContact N-O 3Å; I260-L270 VanDerWaalsContact N-O 3.08Å; I260-L272 HydrophobicContact CD1-CB 4.22Å; I260-L272 HydrophobicContact CG1-CB 4.49Å; I260-L272 HydrophobicContact CG2-CB 3.8Å; I260-V334 HydrophobicContact CD1-CG1 4.38Å; I260-V350 HydrophobicContact CG2-CG1 4.25Å; I260-L352 HydrophobicContact CB-CD2 4.45Å; I260-L352 HydrophobicContact CG2-CD2 3.97Å; I260-L437 HydrophobicContact CG2-CD2 4.38Å; I260-I466 HydrophobicContact CD1-CG2 3.86Å
261	Q	91	Very high	91.2	Very high	27 Å²	27	41.5 Å²	41.5	13%	0.126	22%	0.215	C	C	.	.			trans	-132.4	128.3	178.9	-176.2	179.1	34	0	0	109.9	K263 Y343 P349	Q261-K263 WeakPolarHBondContact CG-O 2.91Å; Q261-K263 PolarHBondContact NE2-O 3.5Å; Q261-Y343 VanDerWaalsContact CD-OH 3.27Å; Q261-Y343 WeakPolarHBondContact CG-OH 3.47Å; Q261-Y343 PolarHBondContact NE2-OH 3.49Å; Q261-P349 HydrophobicContact CB-CB 3.73Å; Q261-P349 HydrophobicContact CB-CG 3.67Å; Q261-P349 HydrophobicContact CG-CG 4.46Å
262	L	90.2	Very high	92.2	Very high	37 Å²	37	37.9 Å²	37.9	19%	0.194	19%	0.193	C	C	.	.	S	Bend	trans	-102.9	-23.7	175.6	-59.4	-176.6	0	0	0	113	L270 L352 I466 R467 G470	L262-L270 HydrophobicContact CD1-CD1 3.54Å; L262-L270 HydrophobicContact CG-CD1 3.79Å; L262-L352 HydrophobicContact CD2-CD1 3.63Å; L262-I466 HydrophobicContact CD2-CG2 4.17Å; L262-R467 HydrophobicContact CD2-CG 4.16Å; L262-G470 VanDerWaalsContact CD1-CA 3.5Å
263	K	84.9	Confident	92.9	Very high	118 Å²	118	33.1 Å²	33.1	51%	0.513	18%	0.175	S	C	.	.	S	Bend	trans	-138.2	146.7	178.5	-64.1	-177.9	-175.8	160	0	109	Q261 Q474	Q261-K263 WeakPolarHBondContact CG-O 2.91Å; Q261-K263 PolarHBondContact NE2-O 3.5Å; K263-Q474 VanDerWaalsContact CD-OE1 3.22Å
264	K	83.2	Confident	93.5	Very high	177 Å²	177	32.1 Å²	32.1	77%	0.77	16%	0.164	S	C	*	.			trans	-56.5	145.6	173.1	-66.9	-175	178.9	-178.5	0	110.1
265	G	86.8	Confident	93.7	Very high	26 Å²	26	28 Å²	28	27%	0.268	15%	0.146	S	C	.	.	S	Bend	trans	173.9	-174.1	-177.2	0	0	0	0	0	111.9	Y343	G265-Y343 WeakPolarHBondContact O-CD2 3.13Å; G265-Y343 VanDerWaalsContact O-CE2 3.22Å; G265-Y343 WeakPolarHBondContact O-CE2 3.37Å
266	N	91.4	Very high	93.6	Very high	127 Å²	127	29.3 Å²	29.3	68%	0.679	15%	0.151	S	C	*	.	S	Bend	trans	-104.7	9.5	179.1	64.1	-1.1	0	0	0	113.1	Y343	N266-Y343 PolarHBondContact O-N 2.61Å
267	G	93.4	Very high	93.5	Very high	16 Å²	16	29.6 Å²	29.6	17%	0.165	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.6	169.3	179.8	0	0	0	0	0	112.6	V341 Y343	G267-V341 CarbonylContact C-O 3.58Å; G267-V341 WeakPolarHBondContact CA-O 3.24Å; G267-Y343 VanDerWaalsContact C-CE1 3.46Å; G267-Y343 PolarHBondContact O-OH 2.9Å
268	T	94.9	Very high	93.2	Very high	9 Å²	9	29.7 Å²	29.7	6%	0.055	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	150.9	173.4	-170.8	0	0	0	0	111.2	L259 I260 L270 V341 Y343	L259-T268 HydrophobicContact CB-CG2 4.23Å; L259-T268 HydrophobicContact CD2-CG2 3.87Å; I260-T268 WeakPolarHBondContact O-CB 3.45Å; I260-T268 WeakPolarHBondContact O-CG2 2.91Å; I260-T268 PolarHBondContact O-OG1 3.25Å; T268-L270 PolarHBondContact OG1-N 2.78Å; T268-L270 VanDerWaalsContact OG1-N 3.11Å; T268-V341 PolarHBondContact N-O 3.32Å; T268-V341 WeakPolarHBondContact O-CB 3.23Å; T268-V341 PolarHBondContact O-N 2.69Å; T268-Y343 HydrophobicContact CG2-CE1 3.86Å
269	N	95.9	Very high	92.8	Very high	32 Å²	32	32.3 Å²	32.3	17%	0.171	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	17.6	168.6	63.6	-4.8	0	0	0	111.5	K336 L337	N269-K336 CarbonylContact O-C 3.32Å; N269-K336 WeakPolarHBondContact O-CA 3.31Å; N269-L337 HydrophobicContact CB-CB 4.23Å; N269-L337 PolarHBondContact O-N 2.8Å
270	L	96.7	Very high	92.1	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.6	-175.7	-60	179.8	0	0	0	111.3	I260 L262 T268 V334 I335 W473	I260-L270 HydrophobicContact CD1-CB 4.2Å; I260-L270 HydrophobicContact CG1-CB 3.77Å; I260-L270 PolarHBondContact N-O 3Å; I260-L270 VanDerWaalsContact N-O 3.08Å; L262-L270 HydrophobicContact CD1-CD1 3.54Å; L262-L270 HydrophobicContact CG-CD1 3.79Å; T268-L270 PolarHBondContact OG1-N 2.78Å; T268-L270 VanDerWaalsContact OG1-N 3.11Å; L270-V334 HydrophobicContact CD2-CG1 4.34Å; L270-I335 WeakPolarHBondContact CA-O 3.49Å; L270-W473 HydrophobicContact CD2-CE3 3.82Å; L270-W473 HydrophobicContact CD2-CZ3 4.14Å
271	V	97.7	Very high	91.3	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.1	175.2	169.2	0	0	0	0	108.8	V241 L243 S258 L259 V292 V334 I335 L337	V241-V271 HydrophobicContact CG1-CG2 4.45Å; V241-V271 HydrophobicContact CG2-CG1 3.62Å; V241-V271 HydrophobicContact CG2-CG2 4.39Å; L243-V271 HydrophobicContact CD1-CG1 4.36Å; S258-V271 CarbonylContact O-C 3.52Å; S258-V271 VanDerWaalsContact O-CA 3.28Å; S258-V271 WeakPolarHBondContact O-CA 3.32Å; L259-V271 HydrophobicContact CD2-CG2 3.87Å; V271-V292 HydrophobicContact CG2-CG1 4.19Å; V271-V334 CarbonylContact O-C 3.53Å; V271-V334 WeakPolarHBondContact O-CA 3.31Å; V271-I335 HydrophobicContact CB-CB 4.23Å; V271-I335 PolarHBondContact N-O 3.26Å; V271-I335 PolarHBondContact O-N 2.81Å; V271-L337 HydrophobicContact CG2-CD1 4.05Å; V271-L337 HydrophobicContact CG2-CD2 4.24Å; V271-L337 HydrophobicContact CG2-CG 4.24Å
272	L	97.4	Very high	90.8	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.9	170.3	-161.9	67.8	0	0	0	109.3	G257 S258 I260 F332 I333 V334 L437 I440 V459 I466	G257-L272 CarbonylContact C-O 3.56Å; G257-L272 VanDerWaalsContact CA-O 3.24Å; G257-L272 WeakPolarHBondContact CA-O 3.39Å; S258-L272 PolarHBondContact N-O 3.07Å; S258-L272 PolarHBondContact O-N 3.11Å; I260-L272 HydrophobicContact CD1-CB 4.22Å; I260-L272 HydrophobicContact CG1-CB 4.49Å; I260-L272 HydrophobicContact CG2-CB 3.8Å; L272-F332 HydrophobicContact CD1-CD2 4.32Å; L272-I333 WeakPolarHBondContact CA-O 3.26Å; L272-V334 HydrophobicContact CD1-CG2 3.89Å; L272-L437 HydrophobicContact CD2-CD2 3.69Å; L272-I440 HydrophobicContact CD1-CD1 4.39Å; L272-I440 HydrophobicContact CD2-CD1 3.72Å; L272-I440 HydrophobicContact CD2-CG1 4.24Å; L272-I440 HydrophobicContact CG-CD1 3.69Å; L272-I440 HydrophobicContact CG-CG1 4.43Å; L272-V459 HydrophobicContact CD2-CG1 4.28Å; L272-V459 HydrophobicContact CD2-CG2 4.31Å; L272-I466 HydrophobicContact CD1-CD1 3.89Å; L272-I466 HydrophobicContact CD1-CG1 4.01Å; L272-I466 HydrophobicContact CD1-CG2 4.49Å; L272-I466 HydrophobicContact CD2-CD1 3.87Å
273	S	96.6	Very high	90.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-173	177.8	-172	0	0	0	0	109.8	L243 G256 F332 I333 G424	L243-S273 WeakPolarHBondContact CD2-OG 3.36Å; G256-S273 PolarHBondContact O-OG 3.26Å; S273-F332 CarbonylContact O-C 3.55Å; S273-F332 WeakPolarHBondContact O-CA 3.37Å; S273-I333 PolarHBondContact N-O 3.39Å; S273-I333 PolarHBondContact O-N 3.25Å; S273-G424 WeakPolarHBondContact OG-CA 3.36Å
274	A	95.1	Very high	90.8	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.238	C	C	.	.			trans	-85.3	146	176.1	0	0	0	0	0	111.1	H276 C277 I333 I440	A274-H276 VanDerWaalsContact C-N 3.33Å; A274-H276 WeakPolarHBondContact CB-ND1 2.96Å; A274-C277 WeakPolarHBondContact O-CB 3.2Å; A274-C277 PolarHBondContact O-N 3.11Å; A274-I333 VanDerWaalsContact O-CG2 3.32Å; A274-I333 WeakPolarHBondContact O-CG2 3.41Å; A274-I440 HydrophobicContact CB-CG2 4.07Å
275	A	94.5	Very high	91.1	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-66.7	-36.6	178.1	0	0	0	0	0	112	C277 A278 Y279 W284 Y323 D331	A275-C277 PolarHBondContact O-N 3.3Å; A275-C277 VanDerWaalsContact O-N 3.09Å; A275-A278 PolarHBondContact O-N 2.92Å; A275-Y279 PolarHBondContact O-N 3.48Å; A275-W284 HydrophobicContact CB-CH2 4.07Å; A275-Y323 HydrophobicContact CB-CD1 3.98Å; A275-Y323 HydrophobicContact CB-CD2 3.77Å; A275-Y323 HydrophobicContact CB-CE2 4.46Å; A275-Y323 HydrophobicContact CB-CG 3.48Å; A275-Y323 VanDerWaalsContact CB-CG 3.48Å; A275-D331 WeakPolarHBondContact CA-OD1 3.39Å; A275-D331 WeakPolarHBondContact CB-OD1 3.42Å; A275-D331 PolarHBondContact N-OD1 2.84Å
276	H	91.2	Very high	91.4	Very high	41 Å²	41	44 Å²	44	19%	0.19	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-61.9	-17.6	178.4	78.6	-105.1	0	0	0	113.6	A274 A278 Y323 D331 S423 S442	A274-H276 VanDerWaalsContact C-N 3.33Å; A274-H276 WeakPolarHBondContact CB-ND1 2.96Å; H276-A278 VanDerWaalsContact C-N 3.33Å; H276-Y323 HydrophobicContact CB-CE1 4.17Å; H276-Y323 HydrophobicContact CB-CE2 4.3Å; H276-Y323 VanDerWaalsContact CB-OH 3.24Å; H276-Y323 WeakPolarHBondContact CB-OH 3.47Å; H276-D331 IonicContact CE1-OD2 2.67Å; H276-D331 IonicContact CG-OD1 3.17Å; H276-D331 IonicContact CG-OD2 3.88Å; H276-D331 PolarHBondContact N-OD1 2.91Å; H276-D331 IonicContact ND1-OD1 2.81Å; H276-D331 PolarHBondContact ND1-OD1 2.79Å; H276-D331 IonicContact ND1-OD2 3.06Å; H276-D331 PolarHBondContact ND1-OD2 3.06Å; H276-S423 WeakPolarHBondContact NE2-CB 3.43Å; H276-S423 PolarHBondContact NE2-OG 2.9Å; H276-S442 PolarHBondContact CE1-O 3.46Å; H276-S442 VanDerWaalsContact CE1-O 3.22Å
277	C	91.9	Very high	91.5	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.041	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-69	-30.3	172.6	-63.9	0	0	0	0	112.8	L243 C255 A274 A275	L243-C277 HydrophobicContact CD2-CB 4.39Å; C255-C277 HydrophobicContact CB-CB 3.71Å; C255-C277 WeakPolarHBondContact CB-SG 3.41Å; C255-C277 WeakPolarHBondContact SG-CB 3.25Å; C255-C277 CovalentContact SG-SG 2.03Å; C255-C277 PolarHBondContact SG-SG 3.22Å; A274-C277 WeakPolarHBondContact O-CB 3.2Å; A274-C277 PolarHBondContact O-N 3.11Å; A275-C277 PolarHBondContact O-N 3.3Å; A275-C277 VanDerWaalsContact O-N 3.09Å
278	A	91.6	Very high	91.5	Very high	2 Å²	2	43.7 Å²	43.7	2%	0.017	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-11.9	178.2	0	0	0	0	0	113.2	A275 H276 W284 I285 I290 Y314 I333	A275-A278 PolarHBondContact O-N 2.92Å; H276-A278 VanDerWaalsContact C-N 3.33Å; A278-W284 HydrophobicContact CB-CE3 4.1Å; A278-W284 HydrophobicContact CB-CZ3 4.11Å; A278-I285 PolarHBondContact O-N 2.78Å; A278-I290 HydrophobicContact CB-CD1 4.01Å; A278-Y314 HydrophobicContact CB-CE1 4.2Å; A278-Y314 HydrophobicContact CB-CE2 4.33Å; A278-I333 HydrophobicContact CB-CD1 3.63Å
279	Y	90.1	Very high	91.4	Very high	57 Å²	57	46.8 Å²	46.8	22%	0.224	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	97.4	174.6	-173	-92.2	0	0	0	110.6	A275 K282 G283 W284 Y323 P325	A275-Y279 PolarHBondContact O-N 3.48Å; Y279-K282 VanDerWaalsContact CZ-C 3.43Å; Y279-K282 VanDerWaalsContact OH-CA 3.31Å; Y279-K282 WeakPolarHBondContact OH-CA 3.46Å; Y279-K282 PolarHBondContact OH-O 3.39Å; Y279-K282 VanDerWaalsContact OH-O 3.13Å; Y279-G283 CarbonylContact C-O 3.55Å; Y279-G283 WeakPolarHBondContact CA-O 3.49Å; Y279-W284 AromaticContact CD2-CD1 3.97Å; Y279-W284 AromaticContact CD2-CD2 3.94Å; Y279-W284 HydrophobicContact CD2-CD2 3.94Å; Y279-W284 AromaticContact CD2-CE2 3.73Å; Y279-W284 HydrophobicContact CD2-CG 4.11Å; Y279-W284 HydrophobicContact CD2-CZ2 4.23Å; Y279-W284 AromaticContact CD2-NE1 3.73Å; Y279-Y323 HydrophobicContact CD1-CD1 4.34Å; Y279-Y323 AromaticContact CD1-CE1 3.83Å; Y279-Y323 HydrophobicContact CD1-CE1 3.83Å; Y279-Y323 HydrophobicContact CG-CD1 4.14Å; Y279-Y323 HydrophobicContact CG-CE1 4.01Å; Y279-P325 HydrophobicContact CD1-CB 4.05Å; Y279-P325 HydrophobicContact CE1-CB 3.59Å; Y279-P325 HydrophobicContact CE1-CG 3.74Å
280	V	82.3	Confident	91.4	Very high	30 Å²	30	45.3 Å²	45.3	18%	0.182	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	148.3	-178.9	-56	0	0	0	0	109.8	I247 K282 G283 I285	I247-V280 HydrophobicContact CD1-CG1 4.46Å; I247-V280 HydrophobicContact CG1-CG2 4.25Å; I247-V280 HydrophobicContact CG2-CG2 3.93Å; V280-K282 PolarHBondContact O-N 3.35Å; V280-K282 VanDerWaalsContact O-N 3.17Å; V280-G283 PolarHBondContact N-O 2.97Å; V280-G283 PolarHBondContact O-N 3.33Å; V280-I285 HydrophobicContact CG2-CD1 3.48Å; V280-I285 VanDerWaalsContact CG2-CD1 3.48Å; V280-I285 HydrophobicContact CG2-CG1 3.45Å; V280-I285 VanDerWaalsContact CG2-CG1 3.45Å
281	L	80.6	Confident	91.4	Very high	125 Å²	125	47.9 Å²	47.9	65%	0.654	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.9	39	178.3	-54.5	171.8	0	0	0	113.5	I247 F248 G283	I247-L281 HydrophobicContact CG2-CD1 3.73Å; I247-L281 HydrophobicContact CG2-CG 4.46Å; F248-L281 HydrophobicContact CD2-CD1 4.24Å; F248-L281 HydrophobicContact CE1-CD1 4.46Å; F248-L281 HydrophobicContact CE2-CD1 3.11Å; F248-L281 HydrophobicContact CZ-CD1 3.24Å; L281-G283 PolarHBondContact O-N 3.24Å
282	K	81.4	Confident	91.4	Very high	186 Å²	186	47.9 Å²	47.9	81%	0.809	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.1	19.1	-177.2	-54.8	-179.4	178.7	179.2	0	114.9	Y279 V280	Y279-K282 VanDerWaalsContact CZ-C 3.43Å; Y279-K282 VanDerWaalsContact OH-CA 3.31Å; Y279-K282 WeakPolarHBondContact OH-CA 3.46Å; Y279-K282 PolarHBondContact OH-O 3.39Å; Y279-K282 VanDerWaalsContact OH-O 3.13Å; V280-K282 PolarHBondContact O-N 3.35Å; V280-K282 VanDerWaalsContact O-N 3.17Å
283	G	85.4	Confident	91.4	Very high	30 Å²	30	48.6 Å²	48.6	31%	0.309	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	161.2	179.8	0	0	0	0	0	114	Y279 V280 L281	Y279-G283 CarbonylContact C-O 3.55Å; Y279-G283 WeakPolarHBondContact CA-O 3.49Å; V280-G283 PolarHBondContact N-O 2.97Å; V280-G283 PolarHBondContact O-N 3.33Å; L281-G283 PolarHBondContact O-N 3.24Å
284	W	89.7	Confident	91.5	Very high	118 Å²	118	48.7 Å²	48.7	45%	0.447	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	126.5	176.8	-72.4	101.8	0	0	0	110.7	A275 A278 Y279 Y314 Y323 I333	A275-W284 HydrophobicContact CB-CH2 4.07Å; A278-W284 HydrophobicContact CB-CE3 4.1Å; A278-W284 HydrophobicContact CB-CZ3 4.11Å; Y279-W284 AromaticContact CD2-CD1 3.97Å; Y279-W284 AromaticContact CD2-CD2 3.94Å; Y279-W284 HydrophobicContact CD2-CD2 3.94Å; Y279-W284 AromaticContact CD2-CE2 3.73Å; Y279-W284 HydrophobicContact CD2-CG 4.11Å; Y279-W284 HydrophobicContact CD2-CZ2 4.23Å; Y279-W284 AromaticContact CD2-NE1 3.73Å; W284-Y314 WeakPolarHBondContact CB-OH 3.49Å; W284-Y314 HydrophobicContact CD2-CE2 4.39Å; W284-Y314 AromaticContact CE3-CE2 3.58Å; W284-Y314 HydrophobicContact CE3-CE2 3.58Å; W284-Y314 AromaticContact CE3-CZ 3.94Å; W284-Y314 AromaticContact CZ3-CE2 3.98Å; W284-Y314 HydrophobicContact CZ3-CE2 3.98Å; W284-Y323 HydrophobicContact CH2-CD1 4.49Å; W284-I333 HydrophobicContact CZ3-CD1 3.87Å
285	I	89.1	Confident	91.5	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.067	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-73.1	137.8	177	-66.8	-66.8	0	0	0	110.1	V245 A278 V280 R289 I290 Y314	V245-I285 HydrophobicContact CG1-CB 4.32Å; V245-I285 HydrophobicContact CG1-CG1 4.04Å; V245-I285 HydrophobicContact CG1-CG2 4.05Å; A278-I285 PolarHBondContact O-N 2.78Å; V280-I285 HydrophobicContact CG2-CD1 3.48Å; V280-I285 VanDerWaalsContact CG2-CD1 3.48Å; V280-I285 HydrophobicContact CG2-CG1 3.45Å; V280-I285 VanDerWaalsContact CG2-CG1 3.45Å; I285-R289 HydrophobicContact CG2-CB 3.57Å; I285-R289 HydrophobicContact CG2-CG 4.37Å; I285-I290 HydrophobicContact CG2-CG1 4.31Å; I285-Y314 PolarHBondContact N-OH 3.33Å; I285-Y314 WeakPolarHBondContact O-CE1 3.49Å; I285-Y314 VanDerWaalsContact O-CZ 3.26Å; I285-Y314 PolarHBondContact O-OH 3.27Å
286	Q	92.3	Very high	91.5	Very high	131 Å²	131	49.4 Å²	49.4	61%	0.612	24%	0.238	S	C	*	.	P	Polyproline II helix	trans	-59	138.1	175.6	-67.8	177.3	2.2	0	0	111.3	Q288 R289	Q286-Q288 VanDerWaalsContact C-N 3.25Å; Q286-Q288 PolarHBondContact O-N 2.97Å; Q286-Q288 VanDerWaalsContact O-N 3.11Å; Q286-R289 HydrophobicContact CB-CG 4.27Å; Q286-R289 WeakPolarHBondContact O-CB 3.28Å; Q286-R289 PolarHBondContact O-N 3.35Å
287	P	93.7	Very high	91.7	Very high	28 Å²	28	47.9 Å²	47.9	18%	0.182	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-51.2	-40.6	-176	-28.3	34.2	0	0	0	114.3	R289 I290 A311 Y314	P287-R289 PolarHBondContact O-N 3.44Å; P287-I290 WeakPolarHBondContact O-CB 3.01Å; P287-I290 PolarHBondContact O-N 2.87Å; P287-A311 CarbonylContact C-O 3.54Å; P287-A311 HydrophobicContact CB-CB 4.35Å; P287-A311 WeakPolarHBondContact O-CB 2.96Å; P287-Y314 HydrophobicContact CB-CD1 4.15Å; P287-Y314 HydrophobicContact CB-CE1 4.39Å; P287-Y314 HydrophobicContact CG-CD1 3.93Å; P287-Y314 HydrophobicContact CG-CE1 3.94Å
288	Q	93.1	Very high	91.7	Very high	108 Å²	108	48.2 Å²	48.2	51%	0.505	23%	0.232	S	C	.	.	G	3₁₀ helix	trans	-64.7	-12.8	-176.7	-61.1	75.8	15.5	0	0	113.6	Q286	Q286-Q288 VanDerWaalsContact C-N 3.25Å; Q286-Q288 PolarHBondContact O-N 2.97Å; Q286-Q288 VanDerWaalsContact O-N 3.11Å
289	R	94.1	Very high	91.7	Very high	73 Å²	73	49.1 Å²	49.1	28%	0.275	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-90.5	0.3	176.1	-58.2	-178.2	68.9	-169.7	4.7	112.9	N246 I247 I285 Q286 P287	N246-R289 HydrophobicContact CB-CB 4.2Å; N246-R289 WeakPolarHBondContact CB-O 3.42Å; N246-R289 PolarHBondContact N-O 3.49Å; N246-R289 PolarHBondContact O-NE 3.33Å; N246-R289 PolarHBondContact O-NH2 3.18Å; N246-R289 PolarHBondContact OD1-NH2 2.85Å; I247-R289 PolarHBondContact O-NH1 3.25Å; I247-R289 PolarHBondContact O-NH2 2.89Å; I285-R289 HydrophobicContact CG2-CB 3.57Å; I285-R289 HydrophobicContact CG2-CG 4.37Å; Q286-R289 HydrophobicContact CB-CG 4.27Å; Q286-R289 WeakPolarHBondContact O-CB 3.28Å; Q286-R289 PolarHBondContact O-N 3.35Å; P287-R289 PolarHBondContact O-N 3.44Å
290	I	95.1	Very high	91.6	Very high	1 Å²	1	54.5 Å²	54.5	1%	0.005	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	117.1	176.1	-55	177.2	0	0	0	108.4	L243 V245 A278 I285 P287 V292 K310 A311 Y314	L243-I290 HydrophobicContact CG-CG2 4.35Å; V245-I290 HydrophobicContact CG1-CG1 4.36Å; V245-I290 HydrophobicContact CG2-CG1 4.34Å; V245-I290 HydrophobicContact CG2-CG2 4.41Å; A278-I290 HydrophobicContact CB-CD1 4.01Å; I285-I290 HydrophobicContact CG2-CG1 4.31Å; P287-I290 WeakPolarHBondContact O-CB 3.01Å; P287-I290 PolarHBondContact O-N 2.87Å; I290-V292 HydrophobicContact CG2-CG2 4.38Å; I290-K310 WeakPolarHBondContact O-CA 3.5Å; I290-A311 HydrophobicContact CB-CB 4.07Å; I290-A311 HydrophobicContact CG2-CB 4.43Å; I290-A311 PolarHBondContact O-N 3.43Å; I290-Y314 HydrophobicContact CD1-CD1 3.86Å; I290-Y314 HydrophobicContact CD1-CE1 3.78Å
291	E	97.2	Very high	91.8	Very high	56 Å²	56	53.9 Å²	53.9	26%	0.262	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	133.8	170.6	-70.6	175.7	166.4	0	0	108.9	L243 K244 T308 K310	L243-E291 CarbonylContact C-O 3.43Å; L243-E291 WeakPolarHBondContact CA-O 3.38Å; K244-E291 HydrophobicContact CB-CB 4.3Å; K244-E291 WeakPolarHBondContact CD-OE2 3.45Å; K244-E291 PolarHBondContact N-O 2.86Å; K244-E291 IonicContact NZ-OE2 3.54Å; K244-E291 PolarHBondContact NZ-OE2 3.3Å; K244-E291 PolarHBondContact O-N 3.45Å; E291-T308 HydrophobicContact CB-CG2 3.85Å; E291-T308 HydrophobicContact CG-CG2 4.28Å; E291-K310 HydrophobicContact CG-CG 4.26Å
292	V	97.9	Very high	92.1	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	121.6	176.2	-177.9	0	0	0	0	109.2	V241 R242 L243 V271 I290 V294 T308 I309 L337	V241-V292 HydrophobicContact CB-CG1 3.7Å; V241-V292 HydrophobicContact CG1-CG1 4.19Å; V241-V292 HydrophobicContact CG2-CG1 3.74Å; R242-V292 CarbonylContact O-C 3.53Å; R242-V292 WeakPolarHBondContact O-CA 3.36Å; L243-V292 HydrophobicContact CD1-CG1 4.43Å; L243-V292 HydrophobicContact CD1-CG2 4.25Å; L243-V292 HydrophobicContact CG-CG2 4.24Å; V271-V292 HydrophobicContact CG2-CG1 4.19Å; I290-V292 HydrophobicContact CG2-CG2 4.38Å; V292-V294 HydrophobicContact CG1-CG1 4.43Å; V292-T308 CarbonylContact O-C 3.51Å; V292-T308 WeakPolarHBondContact O-CA 3.17Å; V292-I309 PolarHBondContact N-O 3Å; V292-I309 PolarHBondContact O-N 3.24Å; V292-L337 HydrophobicContact CB-CD2 3.71Å; V292-L337 HydrophobicContact CG1-CD2 4.23Å; V292-L337 HydrophobicContact CG2-CD2 3.66Å
293	T	97.3	Very high	92.5	Very high	16 Å²	16	48.3 Å²	48.3	10%	0.098	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.3	175.4	-52.4	0	0	0	0	110.4	V241 R242 L296 R306 K307 T308	V241-T293 WeakPolarHBondContact CA-O 3.48Å; R242-T293 PolarHBondContact N-O 2.58Å; R242-T293 PolarHBondContact O-N 2.67Å; T293-L296 HydrophobicContact CG2-CB 4.2Å; T293-L296 HydrophobicContact CG2-CD1 4.49Å; T293-L296 HydrophobicContact CG2-CD2 4.02Å; T293-R306 HydrophobicContact CG2-CG 3.64Å; T293-K307 CarbonylContact C-O 3.56Å; T293-K307 WeakPolarHBondContact CA-O 3.4Å; T293-T308 PolarHBondContact OG1-OG1 3.36Å
294	V	97.5	Very high	92.7	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.012	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	164.8	176.9	-52.6	0	0	0	0	110.9	V241 L259 V292 L296 R306 K307 V341 T347	V241-V294 HydrophobicContact CB-CG1 4.47Å; V241-V294 HydrophobicContact CG1-CB 4.5Å; V241-V294 HydrophobicContact CG1-CG1 3.72Å; L259-V294 HydrophobicContact CD1-CG1 4.28Å; L259-V294 HydrophobicContact CD2-CG1 4.18Å; L259-V294 HydrophobicContact CG-CG1 4.47Å; V292-V294 HydrophobicContact CG1-CG1 4.43Å; V294-L296 PolarHBondContact O-N 3.45Å; V294-R306 WeakPolarHBondContact O-CA 3.47Å; V294-K307 HydrophobicContact CG2-CB 3.94Å; V294-K307 PolarHBondContact N-O 3.31Å; V294-K307 PolarHBondContact O-N 2.9Å; V294-K307 VanDerWaalsContact O-N 3.14Å; V294-V341 HydrophobicContact CG1-CG2 4.08Å; V294-V341 HydrophobicContact CG2-CG1 4.02Å; V294-V341 HydrophobicContact CG2-CG2 4.3Å; V294-T347 HydrophobicContact CB-CG2 4.14Å; V294-T347 HydrophobicContact CG2-CG2 3.85Å
295	G	95.5	Very high	92.8	Very high	4 Å²	4	50.5 Å²	50.5	4%	0.041	26%	0.256	C	S	.	.	S	Bend	trans	67.3	21.1	175.1	0	0	0	0	0	114.2	H235	H235-G295 PolarHBondContact CE1-O 3.07Å
296	L	94.4	Very high	93.1	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.058	27%	0.268	C	S	.	.			trans	-99.6	133.7	-172.1	-176.4	69.2	0	0	0	110.8	R242 T293 V294 D298 L299 E303 R306 W370	R242-L296 HydrophobicContact CB-CD2 4.06Å; T293-L296 HydrophobicContact CG2-CB 4.2Å; T293-L296 HydrophobicContact CG2-CD1 4.49Å; T293-L296 HydrophobicContact CG2-CD2 4.02Å; V294-L296 PolarHBondContact O-N 3.45Å; L296-D298 WeakPolarHBondContact CD1-O 3.29Å; L296-L299 HydrophobicContact CD2-CD2 3.62Å; L296-L299 HydrophobicContact CG-CD2 4.38Å; L296-E303 WeakPolarHBondContact CD1-OE2 3.39Å; L296-R306 HydrophobicContact CD1-CG 4.28Å; L296-R306 VanDerWaalsContact CD1-CZ 3.46Å; L296-W370 HydrophobicContact CB-CH2 4.1Å; L296-W370 HydrophobicContact CB-CZ2 4.08Å; L296-W370 HydrophobicContact CD2-CH2 3.94Å; L296-W370 HydrophobicContact CD2-CZ2 3.86Å; L296-W370 HydrophobicContact CG-CH2 4.08Å; L296-W370 HydrophobicContact CG-CZ2 3.72Å; L296-W370 WeakPolarHBondContact O-CZ2 3.26Å
297	H	94.7	Very high	93.2	Very high	8 Å²	8	51.6 Å²	51.6	4%	0.037	26%	0.255	C	S	.	.	S	Bend	trans	-117.2	-49.5	166.4	-178.4	64.8	0	0	0	111.4	E231 A232 P234 E303 W370 K383 L384	E231-H297 IonicContact OE1-CE1 3.84Å; E231-H297 IonicContact OE1-NE2 3.34Å; E231-H297 PolarHBondContact OE1-NE2 3.47Å; E231-H297 VanDerWaalsContact OE1-NE2 3.1Å; A232-H297 PolarHBondContact O-CE1 2.67Å; P234-H297 HydrophobicContact CB-CB 4.48Å; H297-E303 VanDerWaalsContact CB-OE1 3.25Å; H297-E303 WeakPolarHBondContact CB-OE1 3.27Å; H297-E303 PolarHBondContact N-OE1 2.82Å; H297-E303 PolarHBondContact N-OE2 2.79Å; H297-W370 PolarHBondContact O-NE1 3.35Å; H297-K383 CarbonylContact O-C 3.29Å; H297-K383 WeakPolarHBondContact O-CA 2.89Å; H297-L384 PolarHBondContact O-N 3.28Å
298	D	93.5	Very high	93.4	Very high	14 Å²	14	53.6 Å²	53.6	8%	0.075	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-108.1	117.3	179.9	-168.9	-27	0	0	0	110	L296 F300 G301 E303 R306 S382 K383	L296-D298 WeakPolarHBondContact CD1-O 3.29Å; D298-F300 PolarHBondContact O-N 2.87Å; D298-F300 VanDerWaalsContact O-N 3.09Å; D298-F300 PolarHBondContact OD1-N 3.24Å; D298-G301 PolarHBondContact O-N 3.08Å; D298-G301 VanDerWaalsContact O-N 3.12Å; D298-G301 PolarHBondContact OD1-N 3.06Å; D298-E303 PolarHBondContact N-OE2 2.95Å; D298-R306 PolarHBondContact O-NH2 3.31Å; D298-S382 CarbonylContact C-O 3.43Å; D298-S382 WeakPolarHBondContact CA-O 3.48Å; D298-S382 PolarHBondContact OD1-OG 3.11Å; D298-K383 HydrophobicContact CB-CG 4.25Å; D298-K383 WeakPolarHBondContact OD2-CE 3.14Å
299	L	89.8	Confident	93.6	Very high	20 Å²	20	48.5 Å²	48.5	11%	0.105	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-31.3	-179.8	-63	-172	0	0	0	113	R242 L296 R306 W370 S382	R242-L299 VanDerWaalsContact CD-CD2 3.5Å; L296-L299 HydrophobicContact CD2-CD2 3.62Å; L296-L299 HydrophobicContact CG-CD2 4.38Å; L299-R306 VanDerWaalsContact C-NH2 3.26Å; L299-R306 PolarHBondContact O-NH2 2.92Å; L299-W370 HydrophobicContact CD1-CB 3.98Å; L299-W370 HydrophobicContact CD1-CG 3.99Å; L299-W370 HydrophobicContact CD2-CB 4.37Å; L299-W370 HydrophobicContact CD2-CD2 3.69Å; L299-W370 HydrophobicContact CD2-CE3 4.41Å; L299-W370 HydrophobicContact CD2-CG 3.65Å; L299-W370 HydrophobicContact CD2-CZ2 4.37Å; L299-W370 HydrophobicContact CG-CB 4.4Å; L299-W370 VanDerWaalsContact CG-CD1 3.48Å; L299-W370 HydrophobicContact CG-CD2 4.4Å; L299-W370 HydrophobicContact CG-CG 3.86Å; L299-S382 WeakPolarHBondContact CG-O 3.35Å; L299-S382 PolarHBondContact N-O 2.92Å
300	F	89.7	Confident	93.8	Very high	170 Å²	170	50.3 Å²	50.3	75%	0.746	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-2	-177.4	-51.2	-61.2	0	0	0	113.2	D298 S382	D298-F300 PolarHBondContact O-N 2.87Å; D298-F300 VanDerWaalsContact O-N 3.09Å; D298-F300 PolarHBondContact OD1-N 3.24Å; F300-S382 VanDerWaalsContact CD2-CB 3.47Å
301	G	86.1	Confident	93.9	Very high	18 Å²	18	50.3 Å²	50.3	19%	0.186	25%	0.254	C	S	.	.	S	Bend	trans	-72.4	146.3	174.7	0	0	0	0	0	112.3	D298 E303 R306	D298-G301 PolarHBondContact O-N 3.08Å; D298-G301 VanDerWaalsContact O-N 3.12Å; D298-G301 PolarHBondContact OD1-N 3.06Å; G301-E303 PolarHBondContact O-N 3.4Å; G301-R306 PolarHBondContact O-NH1 2.86Å; G301-R306 PolarHBondContact O-NH2 2.91Å
302	D	87.1	Confident	93.9	Very high	167 Å²	167	49.8 Å²	49.8	89%	0.893	26%	0.256	S	S	*	.			trans	-84.8	98.3	164.3	-172.3	21.3	0	0	0	108.2
303	E	88.5	Confident	93.7	Very high	26 Å²	26	51.2 Å²	51.2	12%	0.121	27%	0.266	C	S	.	.			trans	-111.7	121.1	-173	-63.1	-172.2	101.1	0	0	110.2	H235 L296 H297 D298 G301 F305 R306	H235-E303 IonicContact CE1-OE1 2.86Å; H235-E303 PolarHBondContact CE1-OE1 3.33Å; H235-E303 IonicContact NE2-OE1 3.52Å; L296-E303 WeakPolarHBondContact CD1-OE2 3.39Å; H297-E303 VanDerWaalsContact CB-OE1 3.25Å; H297-E303 WeakPolarHBondContact CB-OE1 3.27Å; H297-E303 PolarHBondContact N-OE1 2.82Å; H297-E303 PolarHBondContact N-OE2 2.79Å; D298-E303 PolarHBondContact N-OE2 2.95Å; G301-E303 PolarHBondContact O-N 3.4Å; E303-F305 PolarHBondContact O-N 3.39Å; E303-R306 HydrophobicContact CB-CB 4.26Å; E303-R306 WeakPolarHBondContact O-CB 3.44Å; E303-R306 PolarHBondContact O-N 2.98Å
304	P	90.5	Very high	93.5	Very high	111 Å²	111	52 Å²	52	72%	0.721	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.3	-171.5	26	-35.4	0	0	0	114
305	F	91.7	Very high	93.2	Very high	84 Å²	84	53.7 Å²	53.7	37%	0.368	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-6.5	-179.5	-39.1	-60.4	0	0	0	112.9	H235 E303 K307 H346	H235-F305 AromaticContact CE1-CD2 3.78Å; H235-F305 AromaticContact NE2-CD2 3.62Å; H235-F305 AromaticContact NE2-CE2 3.84Å; E303-F305 PolarHBondContact O-N 3.39Å; F305-K307 PolarHBondContact O-N 3.49Å; F305-H346 HydrophobicContact CB-CB 4.04Å; F305-H346 AromaticContact CD1-CE1 3.87Å; F305-H346 AromaticContact CD1-ND1 3.51Å; F305-H346 HydrophobicContact CD2-CB 4.27Å; F305-H346 AromaticContact CD2-CD2 3.84Å; F305-H346 AromaticContact CD2-CE1 3.89Å; F305-H346 AromaticContact CD2-CG 3.68Å; F305-H346 AromaticContact CD2-ND1 3.73Å; F305-H346 AromaticContact CD2-NE2 3.99Å; F305-H346 AromaticContact CE1-CE1 3.51Å; F305-H346 AromaticContact CE1-ND1 3.66Å; F305-H346 AromaticContact CE2-CD2 3.87Å; F305-H346 AromaticContact CE2-CE1 3.54Å; F305-H346 AromaticContact CE2-ND1 3.87Å; F305-H346 AromaticContact CE2-NE2 3.56Å; F305-H346 HydrophobicContact CG-CB 4.12Å; F305-H346 AromaticContact CG-CG 3.75Å; F305-H346 AromaticContact CG-ND1 3.54Å; F305-H346 AromaticContact CZ-CE1 3.33Å; F305-H346 WeakPolarHBondContact CZ-CE1 3.25Å; F305-H346 AromaticContact CZ-ND1 3.83Å; F305-H346 AromaticContact CZ-NE2 3.75Å
306	R	94.7	Very high	92	Very high	88 Å²	88	53.8 Å²	53.8	33%	0.332	28%	0.277	S	S	.	.			trans	-65.8	123.6	179.4	179.4	-169.6	-73.1	-160.9	-11.1	109.5	T293 V294 L296 D298 L299 G301 E303	T293-R306 HydrophobicContact CG2-CG 3.64Å; V294-R306 WeakPolarHBondContact O-CA 3.47Å; L296-R306 HydrophobicContact CD1-CG 4.28Å; L296-R306 VanDerWaalsContact CD1-CZ 3.46Å; D298-R306 PolarHBondContact O-NH2 3.31Å; L299-R306 VanDerWaalsContact C-NH2 3.26Å; L299-R306 PolarHBondContact O-NH2 2.92Å; G301-R306 PolarHBondContact O-NH1 2.86Å; G301-R306 PolarHBondContact O-NH2 2.91Å; E303-R306 HydrophobicContact CB-CB 4.26Å; E303-R306 WeakPolarHBondContact O-CB 3.44Å; E303-R306 PolarHBondContact O-N 2.98Å
307	K	96	Very high	90.2	Very high	78 Å²	78	54 Å²	54	34%	0.339	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	130.1	171.2	-171.8	176.9	178.3	-176.7	0	110.3	T293 V294 F305 I309 E339	T293-K307 CarbonylContact C-O 3.56Å; T293-K307 WeakPolarHBondContact CA-O 3.4Å; V294-K307 HydrophobicContact CG2-CB 3.94Å; V294-K307 PolarHBondContact N-O 3.31Å; V294-K307 PolarHBondContact O-N 2.9Å; V294-K307 VanDerWaalsContact O-N 3.14Å; F305-K307 PolarHBondContact O-N 3.49Å; K307-I309 HydrophobicContact CD-CD1 4.03Å; K307-I309 HydrophobicContact CD-CG1 4.19Å; K307-I309 HydrophobicContact CG-CD1 4.28Å; K307-I309 HydrophobicContact CG-CG1 4Å; K307-E339 VanDerWaalsContact CE-OE2 3.28Å; K307-E339 WeakPolarHBondContact CE-OE2 3.38Å; K307-E339 IonicContact NZ-OE2 2.58Å; K307-E339 PolarHBondContact NZ-OE2 2.8Å
308	T	97.1	Very high	88	Confident	70 Å²	70	58 Å²	58	43%	0.429	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	127.5	175.1	-61.5	0	0	0	0	109.8	E291 V292 T293	E291-T308 HydrophobicContact CB-CG2 3.85Å; E291-T308 HydrophobicContact CG-CG2 4.28Å; V292-T308 CarbonylContact O-C 3.51Å; V292-T308 WeakPolarHBondContact O-CA 3.17Å; T293-T308 PolarHBondContact OG1-OG1 3.36Å
309	I	97.9	Very high	86.3	Confident	2 Å²	2	62.4 Å²	62.4	1%	0.01	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	137.8	-175.6	-52.5	171	0	0	0	108.4	V292 K307 L337 S338 E339 V341	V292-I309 PolarHBondContact N-O 3Å; V292-I309 PolarHBondContact O-N 3.24Å; K307-I309 HydrophobicContact CD-CD1 4.03Å; K307-I309 HydrophobicContact CD-CG1 4.19Å; K307-I309 HydrophobicContact CG-CD1 4.28Å; K307-I309 HydrophobicContact CG-CG1 4Å; I309-L337 HydrophobicContact CD1-CD1 4.28Å; I309-L337 HydrophobicContact CG2-CB 3.93Å; I309-S338 WeakPolarHBondContact CG2-OG 3.39Å; I309-E339 HydrophobicContact CD1-CB 4.37Å; I309-E339 HydrophobicContact CG2-CB 3.94Å; I309-E339 HydrophobicContact CG2-CG 4.39Å; I309-V341 HydrophobicContact CD1-CG2 3.46Å; I309-V341 VanDerWaalsContact CD1-CG2 3.46Å
310	K	97.9	Very high	84.2	Confident	111 Å²	111	71.2 Å²	71.2	48%	0.483	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	151.4	176.9	-68.9	-176.5	179.6	179.6	0	111.3	I290 E291 S338	I290-K310 WeakPolarHBondContact O-CA 3.5Å; E291-K310 HydrophobicContact CG-CG 4.26Å; K310-S338 PolarHBondContact O-N 3.1Å; K310-S338 PolarHBondContact O-OG 2.66Å
311	A	97.1	Very high	82.7	Confident	1 Å²	1	66 Å²	66	1%	0.008	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132	166.7	0	0	0	0	0	110.5	P287 I290 I335 K336	P287-A311 CarbonylContact C-O 3.54Å; P287-A311 HydrophobicContact CB-CB 4.35Å; P287-A311 WeakPolarHBondContact O-CB 2.96Å; I290-A311 HydrophobicContact CB-CB 4.07Å; I290-A311 HydrophobicContact CG2-CB 4.43Å; I290-A311 PolarHBondContact O-N 3.43Å; A311-I335 HydrophobicContact CB-CG2 3.45Å; A311-I335 VanDerWaalsContact CB-CG2 3.45Å; A311-K336 CarbonylContact C-O 3.48Å; A311-K336 WeakPolarHBondContact CA-O 3.17Å
312	S	96.3	Very high	82.2	Confident	45 Å²	45	67.2 Å²	67.2	32%	0.315	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-35.1	172	59.9	0	0	0	0	111.6	K336 L337	S312-K336 PolarHBondContact N-O 3.12Å; S312-K336 PolarHBondContact OG-O 3.44Å; S312-L337 PolarHBondContact OG-O 3.13Å
313	S	94.4	Very high	82.4	Confident	30 Å²	30	60.6 Å²	60.6	21%	0.21	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	166.3	176.3	56.8	0	0	0	0	110.2	K336 W473	S313-K336 PolarHBondContact N-O 3.09Å; S313-K336 PolarHBondContact O-N 3.36Å; S313-K336 WeakPolarHBondContact OG-CB 3.19Å; S313-W473 WeakPolarHBondContact OG-CZ2 2.91Å; S313-W473 PolarHBondContact OG-NE1 2.73Å
314	Y	93.5	Very high	82.4	Confident	33 Å²	33	62.2 Å²	62.2	13%	0.129	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	157.4	167.9	63.3	-111.1	0	0	0	110.3	A278 W284 I285 P287 I290 I333 V334	A278-Y314 HydrophobicContact CB-CE1 4.2Å; A278-Y314 HydrophobicContact CB-CE2 4.33Å; W284-Y314 WeakPolarHBondContact CB-OH 3.49Å; W284-Y314 HydrophobicContact CD2-CE2 4.39Å; W284-Y314 AromaticContact CE3-CE2 3.58Å; W284-Y314 HydrophobicContact CE3-CE2 3.58Å; W284-Y314 AromaticContact CE3-CZ 3.94Å; W284-Y314 AromaticContact CZ3-CE2 3.98Å; W284-Y314 HydrophobicContact CZ3-CE2 3.98Å; I285-Y314 PolarHBondContact N-OH 3.33Å; I285-Y314 WeakPolarHBondContact O-CE1 3.49Å; I285-Y314 VanDerWaalsContact O-CZ 3.26Å; I285-Y314 PolarHBondContact O-OH 3.27Å; P287-Y314 HydrophobicContact CB-CD1 4.15Å; P287-Y314 HydrophobicContact CB-CE1 4.39Å; P287-Y314 HydrophobicContact CG-CD1 3.93Å; P287-Y314 HydrophobicContact CG-CE1 3.94Å; I290-Y314 HydrophobicContact CD1-CD1 3.86Å; I290-Y314 HydrophobicContact CD1-CE1 3.78Å; Y314-I333 HydrophobicContact CD1-CD1 4.33Å; Y314-I333 HydrophobicContact CD2-CD1 3.09Å; Y314-I333 HydrophobicContact CD2-CG1 3.79Å; Y314-I333 HydrophobicContact CE2-CD1 3.6Å; Y314-I333 HydrophobicContact CG-CD1 3.51Å; Y314-I333 HydrophobicContact CG-CG1 4.13Å; Y314-V334 CarbonylContact C-O 3.53Å; Y314-V334 WeakPolarHBondContact CA-O 3.41Å; Y314-V334 VanDerWaalsContact CB-O 3.32Å; Y314-V334 WeakPolarHBondContact CB-O 3.18Å
315	L	90.6	Very high	82.2	Confident	37 Å²	37	59.8 Å²	59.8	19%	0.194	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	139.3	175	-69.7	171.8	0	0	0	109.5	S318 V334 I469 W473	L315-S318 WeakPolarHBondContact CD2-OG 3.39Å; L315-V334 PolarHBondContact N-O 3.01Å; L315-V334 PolarHBondContact O-N 3.36Å; L315-I469 HydrophobicContact CB-CD1 3.99Å; L315-I469 HydrophobicContact CB-CG1 4.07Å; L315-I469 HydrophobicContact CB-CG2 3.83Å; L315-I469 HydrophobicContact CD1-CG1 4.4Å; L315-I469 HydrophobicContact CD1-CG2 4.06Å; L315-I469 HydrophobicContact CG-CG2 4.49Å; L315-W473 HydrophobicContact CB-CH2 4.11Å; L315-W473 HydrophobicContact CB-CZ2 4.07Å; L315-W473 HydrophobicContact CD1-CH2 4.4Å; L315-W473 HydrophobicContact CD1-CZ2 3.69Å; L315-W473 HydrophobicContact CG-CH2 4.16Å; L315-W473 HydrophobicContact CG-CZ2 3.59Å
316	G	71.2	Confident	82	Confident	5 Å²	5	63.1 Å²	63.1	5%	0.052	34%	0.337	C	S	.	.	S	Bend	trans	-149.2	12.1	-175	0	0	0	0	0	115.6	F332	G316-F332 WeakPolarHBondContact CA-O 3.28Å
317	G	56.4	Low	81.7	Confident	15 Å²	15	62.4 Å²	62.4	16%	0.155	34%	0.343	C	S	.	.			trans	145.2	58.1	175.9	0	0	0	0	0	114.1	N319 A322	G317-N319 PolarHBondContact O-N 3.11Å; G317-A322 WeakPolarHBondContact O-CA 3.04Å; G317-A322 WeakPolarHBondContact O-CB 3.48Å; G317-A322 PolarHBondContact O-N 3.22Å
318	S	49.1	Very low	81.4	Confident	92 Å²	92	59.3 Å²	59.3	64%	0.643	33%	0.332	S	S	*	.	S	Bend	trans	-71.5	27.2	-170.1	-33	0	0	0	0	116.3	L315	L315-S318 WeakPolarHBondContact CD2-OG 3.39Å
319	N	57.1	Low	81.1	Confident	107 Å²	107	57.7 Å²	57.7	57%	0.572	32%	0.321	S	S	*	.	S	Bend	trans	-156.6	-164.5	175.7	58.3	28.5	0	0	0	109.5	G317 N321 A322	G317-N319 PolarHBondContact O-N 3.11Å; N319-N321 CarbonylContact O-C 3.54Å; N319-N321 PolarHBondContact O-N 2.89Å; N319-N321 PolarHBondContact OD1-N 3.3Å; N319-N321 PolarHBondContact OD1-ND2 3.41Å; N319-A322 WeakPolarHBondContact O-CB 3.35Å; N319-A322 PolarHBondContact O-N 2.87Å
320	K	45.9	Very low	80.8	Confident	206 Å²	206	58.1 Å²	58.1	90%	0.896	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-40.9	-21.2	178	173	176.1	174.8	178.8	0	115.7	A322	K320-A322 VanDerWaalsContact C-N 3.33Å
321	N	57.6	Low	80.7	Confident	60 Å²	60	52.9 Å²	52.9	32%	0.321	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	29.8	174.8	-47.8	-64.4	0	0	0	113.9	N319 N330 R465	N319-N321 CarbonylContact O-C 3.54Å; N319-N321 PolarHBondContact O-N 2.89Å; N319-N321 PolarHBondContact OD1-N 3.3Å; N319-N321 PolarHBondContact OD1-ND2 3.41Å; N321-N330 WeakPolarHBondContact O-CB 3.4Å; N321-N330 PolarHBondContact O-ND2 2.74Å; N321-R465 VanDerWaalsContact CB-NH1 3.25Å
322	A	76.6	Confident	80.6	Confident	43 Å²	43	52.9 Å²	52.9	36%	0.355	30%	0.3	S	S	.	.			trans	-63.5	155.2	172.5	0	0	0	0	0	111.1	G317 N319 K320 N324 N330	G317-A322 WeakPolarHBondContact O-CA 3.04Å; G317-A322 WeakPolarHBondContact O-CB 3.48Å; G317-A322 PolarHBondContact O-N 3.22Å; N319-A322 WeakPolarHBondContact O-CB 3.35Å; N319-A322 PolarHBondContact O-N 2.87Å; K320-A322 VanDerWaalsContact C-N 3.33Å; A322-N324 PolarHBondContact O-N 2.95Å; A322-N330 PolarHBondContact O-ND2 3.42Å; A322-N330 VanDerWaalsContact O-ND2 3.1Å
323	Y	89.6	Confident	80.5	Confident	28 Å²	28	50.8 Å²	50.8	11%	0.11	29%	0.285	C	S	.	.			trans	-51.1	126.1	165.2	171.6	-118.7	0	0	0	110	A275 H276 Y279 W284 P325 N329 D331	A275-Y323 HydrophobicContact CB-CD1 3.98Å; A275-Y323 HydrophobicContact CB-CD2 3.77Å; A275-Y323 HydrophobicContact CB-CE2 4.46Å; A275-Y323 HydrophobicContact CB-CG 3.48Å; A275-Y323 VanDerWaalsContact CB-CG 3.48Å; H276-Y323 HydrophobicContact CB-CE1 4.17Å; H276-Y323 HydrophobicContact CB-CE2 4.3Å; H276-Y323 VanDerWaalsContact CB-OH 3.24Å; H276-Y323 WeakPolarHBondContact CB-OH 3.47Å; Y279-Y323 HydrophobicContact CD1-CD1 4.34Å; Y279-Y323 AromaticContact CD1-CE1 3.83Å; Y279-Y323 HydrophobicContact CD1-CE1 3.83Å; Y279-Y323 HydrophobicContact CG-CD1 4.14Å; Y279-Y323 HydrophobicContact CG-CE1 4.01Å; W284-Y323 HydrophobicContact CH2-CD1 4.49Å; Y323-P325 HydrophobicContact CE1-CB 3.88Å; Y323-N329 WeakPolarHBondContact CA-O 3.48Å; Y323-D331 HydrophobicContact CD2-CB 3.83Å; Y323-D331 HydrophobicContact CE2-CB 3.74Å
324	N	89.9	Confident	80.5	Confident	61 Å²	61	49.3 Å²	49.3	33%	0.326	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-104.1	108	175	-179.2	-20.1	0	0	0	109.3	A322 N326 T327 A328 N329	A322-N324 PolarHBondContact O-N 2.95Å; N324-N326 PolarHBondContact O-N 3.39Å; N324-N326 WeakPolarHBondContact OD1-CB 3.08Å; N324-N326 PolarHBondContact OD1-N 3.49Å; N324-T327 WeakPolarHBondContact CB-OG1 3.29Å; N324-T327 PolarHBondContact ND2-OG1 2.8Å; N324-T327 PolarHBondContact O-N 2.92Å; N324-A328 VanDerWaalsContact O-CA 3.29Å; N324-A328 WeakPolarHBondContact O-CA 3.37Å; N324-A328 PolarHBondContact O-N 2.9Å; N324-N329 HydrophobicContact CB-CB 4.22Å; N324-N329 PolarHBondContact N-O 2.92Å; N324-N329 PolarHBondContact O-N 2.84Å
325	P	86.9	Confident	80.6	Confident	59 Å²	59	47.8 Å²	47.8	38%	0.383	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.9	-175.5	28	-36.1	0	0	0	114.4	Y279 Y323	Y279-P325 HydrophobicContact CD1-CB 4.05Å; Y279-P325 HydrophobicContact CE1-CB 3.59Å; Y279-P325 HydrophobicContact CE1-CG 3.74Å; Y323-P325 HydrophobicContact CE1-CB 3.88Å
326	N	86.7	Confident	80.9	Confident	154 Å²	154	47.6 Å²	47.6	82%	0.824	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-27.8	179.3	-62.4	-28.7	0	0	0	112.5	N324	N324-N326 PolarHBondContact O-N 3.39Å; N324-N326 WeakPolarHBondContact OD1-CB 3.08Å; N324-N326 PolarHBondContact OD1-N 3.49Å
327	T	88.5	Confident	82.1	Confident	74 Å²	74	47.4 Å²	47.4	45%	0.454	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.7	-4.8	-175.3	55.5	0	0	0	0	113	N324 N329 M406	N324-T327 WeakPolarHBondContact CB-OG1 3.29Å; N324-T327 PolarHBondContact ND2-OG1 2.8Å; N324-T327 PolarHBondContact O-N 2.92Å; T327-N329 PolarHBondContact O-N 3.32Å; T327-N329 VanDerWaalsContact O-N 3.12Å; T327-N329 WeakPolarHBondContact OG1-CB 3.35Å; T327-N329 PolarHBondContact OG1-N 3.35Å; T327-M406 WeakPolarHBondContact O-CE 3.37Å
328	A	89.3	Confident	84.1	Confident	13 Å²	13	49.9 Å²	49.9	11%	0.107	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	19.9	-166	0	0	0	0	0	114	N324 D331 M406 W443	N324-A328 VanDerWaalsContact O-CA 3.29Å; N324-A328 WeakPolarHBondContact O-CA 3.37Å; N324-A328 PolarHBondContact O-N 2.9Å; A328-D331 VanDerWaalsContact O-CB 3.25Å; A328-D331 WeakPolarHBondContact O-CB 3.3Å; A328-D331 PolarHBondContact O-N 3.07Å; A328-M406 HydrophobicContact CB-CE 4.19Å; A328-M406 WeakPolarHBondContact O-CE 3.18Å; A328-W443 VanDerWaalsContact CB-CD1 3.48Å; A328-W443 HydrophobicContact CB-CG 4.38Å
329	N	90.7	Very high	86.3	Confident	35 Å²	35	50 Å²	50	19%	0.187	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-69.4	140.9	180	-163.6	12.4	0	0	0	110.8	Y323 N324 T327 D331 T405 M406	Y323-N329 WeakPolarHBondContact CA-O 3.48Å; N324-N329 HydrophobicContact CB-CB 4.22Å; N324-N329 PolarHBondContact N-O 2.92Å; N324-N329 PolarHBondContact O-N 2.84Å; T327-N329 PolarHBondContact O-N 3.32Å; T327-N329 VanDerWaalsContact O-N 3.12Å; T327-N329 WeakPolarHBondContact OG1-CB 3.35Å; T327-N329 PolarHBondContact OG1-N 3.35Å; N329-D331 VanDerWaalsContact C-N 3.34Å; N329-T405 WeakPolarHBondContact OD1-CB 3.21Å; N329-T405 WeakPolarHBondContact OD1-CG2 3.4Å; N329-T405 PolarHBondContact OD1-OG1 3.24Å; N329-M406 HydrophobicContact CB-CE 4.25Å
330	N	92.7	Very high	88.1	Confident	11 Å²	11	48.6 Å²	48.6	6%	0.059	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	39.4	-173.5	-48.3	-65.3	0	0	0	113.9	N321 A322 F332 F462 R465	N321-N330 WeakPolarHBondContact O-CB 3.4Å; N321-N330 PolarHBondContact O-ND2 2.74Å; A322-N330 PolarHBondContact O-ND2 3.42Å; A322-N330 VanDerWaalsContact O-ND2 3.1Å; N330-F332 VanDerWaalsContact C-N 3.26Å; N330-F332 PolarHBondContact O-N 3.08Å; N330-F462 HydrophobicContact CB-CE1 4.2Å; N330-F462 HydrophobicContact CB-CZ 4.27Å; N330-F462 WeakPolarHBondContact OD1-CE1 3.4Å; N330-R465 PolarHBondContact OD1-NH1 2.87Å
331	D	94.1	Very high	90.5	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	22%	0.224	C	C	.	.			trans	-78	66.6	-178.5	-172.6	26.6	0	0	0	113.6	A275 H276 Y323 A328 N329 S442 T457	A275-D331 WeakPolarHBondContact CA-OD1 3.39Å; A275-D331 WeakPolarHBondContact CB-OD1 3.42Å; A275-D331 PolarHBondContact N-OD1 2.84Å; H276-D331 IonicContact CE1-OD2 2.67Å; H276-D331 IonicContact CG-OD1 3.17Å; H276-D331 IonicContact CG-OD2 3.88Å; H276-D331 PolarHBondContact N-OD1 2.91Å; H276-D331 IonicContact ND1-OD1 2.81Å; H276-D331 PolarHBondContact ND1-OD1 2.79Å; H276-D331 IonicContact ND1-OD2 3.06Å; H276-D331 PolarHBondContact ND1-OD2 3.06Å; Y323-D331 HydrophobicContact CD2-CB 3.83Å; Y323-D331 HydrophobicContact CE2-CB 3.74Å; A328-D331 VanDerWaalsContact O-CB 3.25Å; A328-D331 WeakPolarHBondContact O-CB 3.3Å; A328-D331 PolarHBondContact O-N 3.07Å; N329-D331 VanDerWaalsContact C-N 3.34Å; D331-S442 WeakPolarHBondContact OD2-CB 3.37Å; D331-S442 PolarHBondContact OD2-OG 2.9Å; D331-T457 PolarHBondContact O-OG1 3.29Å
332	F	94.7	Very high	92.3	Very high	1 Å²	1	39.4 Å²	39.4	0%	0.004	23%	0.23	C	C	.	.			trans	-139	154.1	171.8	77.1	-73.9	0	0	0	111.5	L272 S273 G316 N330 I440 T457 F462 R465 I466 I469	L272-F332 HydrophobicContact CD1-CD2 4.32Å; S273-F332 CarbonylContact O-C 3.55Å; S273-F332 WeakPolarHBondContact O-CA 3.37Å; G316-F332 WeakPolarHBondContact CA-O 3.28Å; N330-F332 VanDerWaalsContact C-N 3.26Å; N330-F332 PolarHBondContact O-N 3.08Å; F332-I440 HydrophobicContact CB-CD1 3.71Å; F332-T457 HydrophobicContact CB-CG2 4.06Å; F332-F462 HydrophobicContact CD1-CB 4.44Å; F332-F462 AromaticContact CD1-CD1 3.59Å; F332-F462 HydrophobicContact CD1-CD1 3.59Å; F332-F462 HydrophobicContact CD1-CD2 4.17Å; F332-F462 AromaticContact CD1-CE1 3.75Å; F332-F462 HydrophobicContact CD1-CE1 3.75Å; F332-F462 HydrophobicContact CD1-CE2 4.35Å; F332-F462 AromaticContact CD1-CG 3.8Å; F332-F462 HydrophobicContact CD1-CG 3.8Å; F332-F462 HydrophobicContact CD1-CZ 4.14Å; F332-F462 HydrophobicContact CE1-CB 4.34Å; F332-F462 AromaticContact CE1-CD1 3.14Å; F332-F462 HydrophobicContact CE1-CD1 3.14Å; F332-F462 AromaticContact CE1-CE1 3.4Å; F332-F462 HydrophobicContact CE1-CE1 3.4Å; F332-F462 VanDerWaalsContact CE1-CE1 3.4Å; F332-F462 AromaticContact CE1-CG 3.77Å; F332-F462 HydrophobicContact CE1-CG 3.77Å; F332-F462 HydrophobicContact CE1-CZ 4.24Å; F332-F462 HydrophobicContact CE2-CB 4.46Å; F332-F462 HydrophobicContact CG-CD1 4.48Å; F332-F462 HydrophobicContact CG-CG 4.33Å; F332-F462 HydrophobicContact CZ-CB 4.34Å; F332-F462 AromaticContact CZ-CD1 3.71Å; F332-F462 HydrophobicContact CZ-CD1 3.71Å; F332-F462 HydrophobicContact CZ-CE1 4.36Å; F332-F462 HydrophobicContact CZ-CG 4.23Å; F332-R465 HydrophobicContact CZ-CB 4.25Å; F332-I466 HydrophobicContact CD2-CG1 4.14Å; F332-I466 HydrophobicContact CE2-CG1 4.02Å; F332-I469 HydrophobicContact CE2-CD1 4.25Å
333	I	94.4	Very high	93.1	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	135.1	173.9	-157.3	170.4	0	0	0	109.9	L272 S273 A274 A278 W284 Y314 I335	L272-I333 WeakPolarHBondContact CA-O 3.26Å; S273-I333 PolarHBondContact N-O 3.39Å; S273-I333 PolarHBondContact O-N 3.25Å; A274-I333 VanDerWaalsContact O-CG2 3.32Å; A274-I333 WeakPolarHBondContact O-CG2 3.41Å; A278-I333 HydrophobicContact CB-CD1 3.63Å; W284-I333 HydrophobicContact CZ3-CD1 3.87Å; Y314-I333 HydrophobicContact CD1-CD1 4.33Å; Y314-I333 HydrophobicContact CD2-CD1 3.09Å; Y314-I333 HydrophobicContact CD2-CG1 3.79Å; Y314-I333 HydrophobicContact CE2-CD1 3.6Å; Y314-I333 HydrophobicContact CG-CD1 3.51Å; Y314-I333 HydrophobicContact CG-CG1 4.13Å; I333-I335 HydrophobicContact CG2-CD1 4.21Å; I333-I335 HydrophobicContact CG2-CG1 4.06Å
334	V	95.5	Very high	93.3	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	127.3	167	-165.6	0	0	0	0	106.9	I260 L270 V271 L272 Y314 L315 I466 I469 W473	I260-V334 HydrophobicContact CD1-CG1 4.38Å; L270-V334 HydrophobicContact CD2-CG1 4.34Å; V271-V334 CarbonylContact O-C 3.53Å; V271-V334 WeakPolarHBondContact O-CA 3.31Å; L272-V334 HydrophobicContact CD1-CG2 3.89Å; Y314-V334 CarbonylContact C-O 3.53Å; Y314-V334 WeakPolarHBondContact CA-O 3.41Å; Y314-V334 VanDerWaalsContact CB-O 3.32Å; Y314-V334 WeakPolarHBondContact CB-O 3.18Å; L315-V334 PolarHBondContact N-O 3.01Å; L315-V334 PolarHBondContact O-N 3.36Å; V334-I466 HydrophobicContact CG2-CB 4.41Å; V334-I466 HydrophobicContact CG2-CG1 4.21Å; V334-I466 HydrophobicContact CG2-CG2 4.15Å; V334-I469 HydrophobicContact CB-CG2 3.74Å; V334-I469 HydrophobicContact CG1-CG2 4.17Å; V334-I469 HydrophobicContact CG2-CB 4.25Å; V334-I469 HydrophobicContact CG2-CD1 4.03Å; V334-I469 HydrophobicContact CG2-CG2 3.92Å; V334-W473 HydrophobicContact CB-CH2 4.38Å; V334-W473 HydrophobicContact CB-CZ3 4.05Å; V334-W473 HydrophobicContact CG1-CZ3 3.77Å; V334-W473 VanDerWaalsContact O-CH2 3.29Å; V334-W473 WeakPolarHBondContact O-CH2 3.45Å
335	I	95.8	Very high	93.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.8	178.7	-59.8	172.4	0	0	0	107.8	L243 L270 V271 A311 I333 L337	L243-I335 HydrophobicContact CD2-CD1 3.63Å; L243-I335 HydrophobicContact CG-CD1 4.29Å; L270-I335 WeakPolarHBondContact CA-O 3.49Å; V271-I335 HydrophobicContact CB-CB 4.23Å; V271-I335 PolarHBondContact N-O 3.26Å; V271-I335 PolarHBondContact O-N 2.81Å; A311-I335 HydrophobicContact CB-CG2 3.45Å; A311-I335 VanDerWaalsContact CB-CG2 3.45Å; I333-I335 HydrophobicContact CG2-CD1 4.21Å; I333-I335 HydrophobicContact CG2-CG1 4.06Å; I335-L337 HydrophobicContact CG2-CD2 4.39Å
336	K	96.3	Very high	93.7	Very high	32 Å²	32	38.3 Å²	38.3	14%	0.139	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	121.1	168.6	-168.3	-176.5	-176.1	171.9	0	108.6	N269 A311 S312 S313 W473	N269-K336 CarbonylContact O-C 3.32Å; N269-K336 WeakPolarHBondContact O-CA 3.31Å; A311-K336 CarbonylContact C-O 3.48Å; A311-K336 WeakPolarHBondContact CA-O 3.17Å; S312-K336 PolarHBondContact N-O 3.12Å; S312-K336 PolarHBondContact OG-O 3.44Å; S313-K336 PolarHBondContact N-O 3.09Å; S313-K336 PolarHBondContact O-N 3.36Å; S313-K336 WeakPolarHBondContact OG-CB 3.19Å; K336-W473 HydrophobicContact CB-CD2 4.03Å; K336-W473 HydrophobicContact CB-CE3 3.75Å; K336-W473 HydrophobicContact CB-CH2 4.21Å; K336-W473 HydrophobicContact CB-CZ2 4.43Å; K336-W473 HydrophobicContact CB-CZ3 3.85Å; K336-W473 HydrophobicContact CD-CB 3.86Å; K336-W473 HydrophobicContact CD-CD2 4.04Å; K336-W473 HydrophobicContact CD-CE3 4.39Å; K336-W473 HydrophobicContact CD-CG 3.82Å; K336-W473 HydrophobicContact CG-CD2 4.44Å; K336-W473 HydrophobicContact CG-CE3 4.31Å; K336-W473 PolarHBondContact NZ-O 2.82Å
337	L	97.4	Very high	94.1	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	153.9	173.4	-57.8	-179	0	0	0	110.7	N269 V271 V292 I309 S312 I335 E339 V341	N269-L337 HydrophobicContact CB-CB 4.23Å; N269-L337 PolarHBondContact O-N 2.8Å; V271-L337 HydrophobicContact CG2-CD1 4.05Å; V271-L337 HydrophobicContact CG2-CD2 4.24Å; V271-L337 HydrophobicContact CG2-CG 4.24Å; V292-L337 HydrophobicContact CB-CD2 3.71Å; V292-L337 HydrophobicContact CG1-CD2 4.23Å; V292-L337 HydrophobicContact CG2-CD2 3.66Å; I309-L337 HydrophobicContact CD1-CD1 4.28Å; I309-L337 HydrophobicContact CG2-CB 3.93Å; S312-L337 PolarHBondContact OG-O 3.13Å; I335-L337 HydrophobicContact CG2-CD2 4.39Å; L337-E339 WeakPolarHBondContact CB-O 3.2Å; L337-E339 PolarHBondContact O-N 3.37Å; L337-V341 HydrophobicContact CD1-CG2 3.69Å
338	S	96.8	Very high	94.4	Very high	67 Å²	67	29.7 Å²	29.7	47%	0.469	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	-20.8	174.4	58.7	0	0	0	0	113.2	I309 K310	I309-S338 WeakPolarHBondContact CG2-OG 3.39Å; K310-S338 PolarHBondContact O-N 3.1Å; K310-S338 PolarHBondContact O-OG 2.66Å
339	E	95.7	Very high	94.8	Very high	94 Å²	94	29.1 Å²	29.1	44%	0.439	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	151.7	-179.4	-65	171.4	-137.8	0	0	110.5	K307 I309 L337	K307-E339 VanDerWaalsContact CE-OE2 3.28Å; K307-E339 WeakPolarHBondContact CE-OE2 3.38Å; K307-E339 IonicContact NZ-OE2 2.58Å; K307-E339 PolarHBondContact NZ-OE2 2.8Å; I309-E339 HydrophobicContact CD1-CB 4.37Å; I309-E339 HydrophobicContact CG2-CB 3.94Å; I309-E339 HydrophobicContact CG2-CG 4.39Å; L337-E339 WeakPolarHBondContact CB-O 3.2Å; L337-E339 PolarHBondContact O-N 3.37Å
340	T	95.8	Very high	95.1	Very high	78 Å²	78	27.4 Å²	27.4	48%	0.479	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	130.4	170.8	-59.9	0	0	0	0	110.1	P342	T340-P342 WeakPolarHBondContact O-CD 3.44Å
341	V	95.9	Very high	95.3	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.012	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	114.3	168.5	179	0	0	0	0	107.7	L259 G267 T268 V294 I309 L337 T347	L259-V341 HydrophobicContact CD1-CG1 4.2Å; L259-V341 HydrophobicContact CD2-CB 4.47Å; L259-V341 HydrophobicContact CD2-CG2 4.26Å; G267-V341 CarbonylContact C-O 3.58Å; G267-V341 WeakPolarHBondContact CA-O 3.24Å; T268-V341 PolarHBondContact N-O 3.32Å; T268-V341 WeakPolarHBondContact O-CB 3.23Å; T268-V341 PolarHBondContact O-N 2.69Å; V294-V341 HydrophobicContact CG1-CG2 4.08Å; V294-V341 HydrophobicContact CG2-CG1 4.02Å; V294-V341 HydrophobicContact CG2-CG2 4.3Å; I309-V341 HydrophobicContact CD1-CG2 3.46Å; I309-V341 VanDerWaalsContact CD1-CG2 3.46Å; L337-V341 HydrophobicContact CD1-CG2 3.69Å; V341-T347 HydrophobicContact CG1-CG2 4.1Å
342	P	94.5	Very high	95.4	Very high	71 Å²	71	29 Å²	29	46%	0.461	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	148.1	175.7	29.5	-34.5	0	0	0	110.3	T340 T344 T347	T340-P342 WeakPolarHBondContact O-CD 3.44Å; P342-T344 PolarHBondContact O-N 2.89Å; P342-T347 PolarHBondContact O-OG1 3.2Å
343	Y	94	Very high	95.4	Very high	25 Å²	25	29 Å²	29	10%	0.098	16%	0.163	C	C	.	.			trans	-76.4	122.4	175	-62.4	-25.9	0	0	0	111	V207 Q261 G265 N266 G267 T268 T347 P349	V207-Y343 HydrophobicContact CB-CD2 3.95Å; V207-Y343 HydrophobicContact CG1-CD2 4.42Å; Q261-Y343 VanDerWaalsContact CD-OH 3.27Å; Q261-Y343 WeakPolarHBondContact CG-OH 3.47Å; Q261-Y343 PolarHBondContact NE2-OH 3.49Å; G265-Y343 WeakPolarHBondContact O-CD2 3.13Å; G265-Y343 VanDerWaalsContact O-CE2 3.22Å; G265-Y343 WeakPolarHBondContact O-CE2 3.37Å; N266-Y343 PolarHBondContact O-N 2.61Å; G267-Y343 VanDerWaalsContact C-CE1 3.46Å; G267-Y343 PolarHBondContact O-OH 2.9Å; T268-Y343 HydrophobicContact CG2-CE1 3.86Å; Y343-T347 VanDerWaalsContact CA-O 3.26Å; Y343-T347 WeakPolarHBondContact CA-O 3.13Å; Y343-P349 VanDerWaalsContact CE1-CD 3.49Å; Y343-P349 HydrophobicContact CE1-CG 3.89Å; Y343-P349 HydrophobicContact CE2-CG 4.4Å
344	T	92.9	Very high	95.3	Very high	47 Å²	47	32.3 Å²	32.3	29%	0.288	18%	0.181	S	C	.	.	B	Isolated β-bridge	trans	-131.4	173.1	176	74.9	0	0	0	0	108.8	P342 H346 T347 R348	P342-T344 PolarHBondContact O-N 2.89Å; T344-H346 PolarHBondContact O-N 2.99Å; T344-H346 PolarHBondContact OG1-N 2.87Å; T344-H346 VanDerWaalsContact OG1-N 3.11Å; T344-T347 PolarHBondContact N-O 2.83Å; T344-T347 VanDerWaalsContact N-O 3.12Å; T344-T347 PolarHBondContact N-OG1 3.3Å; T344-T347 PolarHBondContact O-N 3.24Å; T344-T347 PolarHBondContact OG1-N 2.95Å; T344-T347 VanDerWaalsContact OG1-N 3.15Å; T344-T347 PolarHBondContact OG1-OG1 3.45Å; T344-R348 WeakPolarHBondContact O-CG 3.47Å; T344-R348 PolarHBondContact O-NE 3.05Å
345	P	92	Very high	95	Very high	59 Å²	59	34.7 Å²	34.7	38%	0.383	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-22.6	168.4	-31.3	39.6	0	0	0	114.9	A213	A213-P345 HydrophobicContact CB-CB 3.61Å
346	H	93.7	Very high	94.7	Very high	37 Å²	37	43.7 Å²	43.7	17%	0.171	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.9	-6.7	-173.4	-43.9	99.2	0	0	0	113.9	H235 F305 T344	H235-H346 HydrophobicContact CB-CB 4.39Å; H235-H346 AromaticContact CD2-CD2 3.77Å; H235-H346 AromaticContact CG-CD2 3.58Å; F305-H346 HydrophobicContact CB-CB 4.04Å; F305-H346 AromaticContact CD1-CE1 3.87Å; F305-H346 AromaticContact CD1-ND1 3.51Å; F305-H346 HydrophobicContact CD2-CB 4.27Å; F305-H346 AromaticContact CD2-CD2 3.84Å; F305-H346 AromaticContact CD2-CE1 3.89Å; F305-H346 AromaticContact CD2-CG 3.68Å; F305-H346 AromaticContact CD2-ND1 3.73Å; F305-H346 AromaticContact CD2-NE2 3.99Å; F305-H346 AromaticContact CE1-CE1 3.51Å; F305-H346 AromaticContact CE1-ND1 3.66Å; F305-H346 AromaticContact CE2-CD2 3.87Å; F305-H346 AromaticContact CE2-CE1 3.54Å; F305-H346 AromaticContact CE2-ND1 3.87Å; F305-H346 AromaticContact CE2-NE2 3.56Å; F305-H346 HydrophobicContact CG-CB 4.12Å; F305-H346 AromaticContact CG-CG 3.75Å; F305-H346 AromaticContact CG-ND1 3.54Å; F305-H346 AromaticContact CZ-CE1 3.33Å; F305-H346 WeakPolarHBondContact CZ-CE1 3.25Å; F305-H346 AromaticContact CZ-ND1 3.83Å; F305-H346 AromaticContact CZ-NE2 3.75Å; T344-H346 PolarHBondContact O-N 2.99Å; T344-H346 PolarHBondContact OG1-N 2.87Å; T344-H346 VanDerWaalsContact OG1-N 3.11Å
347	T	95.1	Very high	94.4	Very high	6 Å²	6	47 Å²	47	4%	0.037	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-137.9	90.1	-178.6	51.1	0	0	0	0	109.6	P238 V294 V341 P342 Y343 T344	P238-T347 WeakPolarHBondContact O-CA 3.35Å; V294-T347 HydrophobicContact CB-CG2 4.14Å; V294-T347 HydrophobicContact CG2-CG2 3.85Å; V341-T347 HydrophobicContact CG1-CG2 4.1Å; P342-T347 PolarHBondContact O-OG1 3.2Å; Y343-T347 VanDerWaalsContact CA-O 3.26Å; Y343-T347 WeakPolarHBondContact CA-O 3.13Å; T344-T347 PolarHBondContact N-O 2.83Å; T344-T347 VanDerWaalsContact N-O 3.12Å; T344-T347 PolarHBondContact N-OG1 3.3Å; T344-T347 PolarHBondContact O-N 3.24Å; T344-T347 PolarHBondContact OG1-N 2.95Å; T344-T347 VanDerWaalsContact OG1-N 3.15Å; T344-T347 PolarHBondContact OG1-OG1 3.45Å
348	R	95.3	Very high	94.1	Very high	41 Å²	41	52.2 Å²	52.2	16%	0.155	29%	0.285	C	S	.	.			trans	-134.9	152.1	-179.2	-65.6	-172.5	172.7	173.6	-5.2	110	V207 V211 P238 W239 T344	V207-R348 HydrophobicContact CG1-CG 4.39Å; V211-R348 VanDerWaalsContact O-CD 3.23Å; V211-R348 WeakPolarHBondContact O-CD 3.1Å; P238-R348 CarbonylContact C-O 3.5Å; P238-R348 VanDerWaalsContact C-O 3.29Å; P238-R348 HydrophobicContact CB-CB 4.05Å; P238-R348 HydrophobicContact CB-CG 4.41Å; P238-R348 HydrophobicContact CG-CB 3.92Å; P238-R348 HydrophobicContact CG-CG 4.45Å; P238-R348 PolarHBondContact O-N 2.91Å; P238-R348 VanDerWaalsContact O-O 3.11Å; W239-R348 WeakPolarHBondContact CA-O 2.94Å; W239-R348 WeakPolarHBondContact CB-O 3Å; W239-R348 PolarHBondContact N-O 2.92Å; W239-R348 VanDerWaalsContact N-O 3.15Å; T344-R348 WeakPolarHBondContact O-CG 3.47Å; T344-R348 PolarHBondContact O-NE 3.05Å
349	P	97.1	Very high	93.9	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-80.3	151.4	179.6	34.1	-33.1	0	0	0	111.1	C209 G210 L259 Q261 Y343	C209-P349 CarbonylContact C-O 3.57Å; C209-P349 WeakPolarHBondContact CA-O 3.2Å; C209-P349 HydrophobicContact CB-CG 4.03Å; G210-P349 PolarHBondContact N-O 3.05Å; L259-P349 CarbonylContact O-C 3.56Å; L259-P349 WeakPolarHBondContact O-CA 3.43Å; Q261-P349 HydrophobicContact CB-CB 3.73Å; Q261-P349 HydrophobicContact CB-CG 3.67Å; Q261-P349 HydrophobicContact CG-CG 4.46Å; Y343-P349 VanDerWaalsContact CE1-CD 3.49Å; Y343-P349 HydrophobicContact CE1-CG 3.89Å; Y343-P349 HydrophobicContact CE2-CG 4.4Å
350	V	97.4	Very high	93.7	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-78.4	148.6	164.7	65.8	0	0	0	0	109.3	W239 L259 I260 A428 W435 L437	W239-V350 HydrophobicContact CB-CB 3.93Å; W239-V350 HydrophobicContact CB-CG1 4.43Å; W239-V350 HydrophobicContact CD2-CB 3.78Å; W239-V350 HydrophobicContact CD2-CG2 4.2Å; W239-V350 HydrophobicContact CE3-CB 4.24Å; W239-V350 HydrophobicContact CG-CB 3.62Å; W239-V350 HydrophobicContact CG-CG1 4.38Å; W239-V350 HydrophobicContact CG-CG2 4.39Å; L259-V350 PolarHBondContact O-N 3.25Å; I260-V350 HydrophobicContact CG2-CG1 4.25Å; V350-A428 HydrophobicContact CG2-CB 4.31Å; V350-W435 HydrophobicContact CG2-CB 4.4Å; V350-W435 WeakPolarHBondContact CG2-O 3.28Å; V350-L437 HydrophobicContact CB-CB 4.42Å; V350-L437 HydrophobicContact CG1-CB 3.66Å; V350-L437 HydrophobicContact CG1-CD1 4.48Å; V350-L437 HydrophobicContact CG1-CD2 3.9Å; V350-L437 HydrophobicContact CG1-CG 4.23Å; V350-L437 HydrophobicContact CG2-CB 3.88Å
351	C	96.4	Very high	93.4	Very high	14 Å²	14	47.7 Å²	47.7	10%	0.095	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-70.4	144.4	174.5	-68.2	0	0	0	0	110.9	C209 W435 V436 L437	C209-C351 HydrophobicContact CB-CB 3.98Å; C209-C351 WeakPolarHBondContact CB-SG 3.4Å; C209-C351 PolarHBondContact O-SG 2.59Å; C209-C351 WeakPolarHBondContact SG-CA 3.22Å; C209-C351 WeakPolarHBondContact SG-CB 3.41Å; C209-C351 CovalentContact SG-SG 2.05Å; C209-C351 PolarHBondContact SG-SG 2.92Å; C351-W435 WeakPolarHBondContact CB-O 3.48Å; C351-W435 PolarHBondContact N-O 3.36Å; C351-V436 HydrophobicContact CB-CG2 4.09Å; C351-V436 WeakPolarHBondContact O-CA 3.25Å; C351-L437 PolarHBondContact O-N 3.4Å
352	L	96	Very high	92.8	Very high	30 Å²	30	53.6 Å²	53.6	16%	0.157	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-89.1	140	168.4	-67.7	179	0	0	0	109.4	I260 L262 L437 V459 I463 I466	I260-L352 HydrophobicContact CB-CD2 4.45Å; I260-L352 HydrophobicContact CG2-CD2 3.97Å; L262-L352 HydrophobicContact CD2-CD1 3.63Å; L352-L437 HydrophobicContact CD2-CD2 4.42Å; L352-V459 HydrophobicContact CD2-CG1 4.26Å; L352-I463 HydrophobicContact CB-CD1 3.82Å; L352-I463 HydrophobicContact CD1-CD1 4.29Å; L352-I463 HydrophobicContact CD2-CD1 4.21Å; L352-I463 HydrophobicContact CG-CD1 4.34Å; L352-I466 HydrophobicContact CD1-CG2 4.28Å
353	P	95.2	Very high	92.5	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.013	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-67.1	157.6	179.5	25.7	-35	0	0	0	112.1	V436 L437 Y438 V459 P460 I463	P353-V436 HydrophobicContact CB-CG1 3.76Å; P353-V436 HydrophobicContact CG-CG1 4.39Å; P353-L437 WeakPolarHBondContact CD-O 3.49Å; P353-L437 WeakPolarHBondContact CG-O 3.14Å; P353-Y438 HydrophobicContact CB-CD1 4.21Å; P353-Y438 HydrophobicContact CB-CE1 3.8Å; P353-Y438 HydrophobicContact CG-CD1 4.47Å; P353-V459 HydrophobicContact CG-CG1 4.22Å; P353-P460 HydrophobicContact CB-CG 4.14Å; P353-P460 HydrophobicContact CG-CB 4.37Å; P353-P460 HydrophobicContact CG-CG 3.71Å; P353-I463 HydrophobicContact CG-CD1 4.11Å; P353-I463 HydrophobicContact CG-CG1 4.34Å
354	D	91.7	Very high	92.2	Very high	71 Å²	71	56.4 Å²	56.4	38%	0.38	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-74.8	122.5	163.2	-169.5	-35.4	0	0	0	108.5	K356 E357	D354-K356 PolarHBondContact O-N 3.15Å; D354-K356 WeakPolarHBondContact OD1-CB 3.36Å; D354-K356 PolarHBondContact OD1-N 2.75Å; D354-E357 HydrophobicContact CB-CB 4.34Å; D354-E357 HydrophobicContact CB-CG 3.93Å; D354-E357 PolarHBondContact O-N 2.79Å; D354-E357 VanDerWaalsContact O-N 3.08Å
355	P	90.5	Very high	92.1	Very high	49 Å²	49	54.2 Å²	54.2	32%	0.318	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-13.3	179.5	26.7	-36	0	0	0	113.9	P460 I463	P355-P460 WeakPolarHBondContact CB-O 3.25Å; P355-I463 HydrophobicContact CB-CB 4.23Å; P355-I463 HydrophobicContact CB-CG1 4.48Å; P355-I463 HydrophobicContact CG-CB 4.26Å; P355-I463 HydrophobicContact CG-CG2 4.15Å
356	K	89.8	Confident	92.1	Very high	190 Å²	190	51.7 Å²	51.7	83%	0.826	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-16.6	177	-59.8	179.1	-180	179.6	0	113.4	D354	D354-K356 PolarHBondContact O-N 3.15Å; D354-K356 WeakPolarHBondContact OD1-CB 3.36Å; D354-K356 PolarHBondContact OD1-N 2.75Å
357	E	88.9	Confident	92	Very high	103 Å²	103	50 Å²	50	48%	0.481	25%	0.254	S	S	.	.	S	Bend	trans	-78.9	140.8	178.7	-76	-180	-178.8	0	0	110.8	D354	D354-E357 HydrophobicContact CB-CB 4.34Å; D354-E357 HydrophobicContact CB-CG 3.93Å; D354-E357 PolarHBondContact O-N 2.79Å; D354-E357 VanDerWaalsContact O-N 3.08Å
358	P	90.9	Very high	91.9	Very high	111 Å²	111	49.9 Å²	49.9	72%	0.721	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-64	155	174.9	28.3	-34.4	0	0	0	111
359	L	92.9	Very high	91.7	Very high	40 Å²	40	48 Å²	48	21%	0.209	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-59.6	138	172.9	-70	176.1	0	0	0	110.3	F361 I391 L407 Y438 P460	L359-F361 VanDerWaalsContact C-N 3.26Å; L359-F361 HydrophobicContact CB-CE1 4.34Å; L359-F361 HydrophobicContact CB-CE2 4.13Å; L359-F361 HydrophobicContact CB-CZ 3.99Å; L359-F361 HydrophobicContact CD1-CZ 4.38Å; L359-F361 WeakPolarHBondContact O-CD2 3.3Å; L359-F361 PolarHBondContact O-N 2.86Å; L359-I391 HydrophobicContact CB-CG2 4.36Å; L359-I391 HydrophobicContact CD1-CG2 4.24Å; L359-I391 HydrophobicContact CD2-CD1 4.44Å; L359-L407 HydrophobicContact CD1-CD2 4.48Å; L359-L407 HydrophobicContact CD2-CD2 4.14Å; L359-Y438 HydrophobicContact CD2-CD1 3.87Å; L359-Y438 HydrophobicContact CD2-CE1 4.49Å; L359-P460 HydrophobicContact CD2-CG 3.92Å
360	P	92	Very high	91.3	Very high	11 Å²	11	48.9 Å²	48.9	7%	0.071	25%	0.25	C	S	.	.			trans	-80.9	71.5	-176.3	34.7	-39.9	0	0	0	111	K363 I391 C429 M431 Y438	P360-K363 HydrophobicContact CB-CB 3.99Å; P360-K363 HydrophobicContact CB-CG 3.64Å; P360-K363 WeakPolarHBondContact O-CB 3.44Å; P360-K363 PolarHBondContact O-N 2.68Å; P360-I391 HydrophobicContact CG-CD1 3.91Å; P360-C429 HydrophobicContact CG-CB 4.24Å; P360-M431 HydrophobicContact CB-CE 4.11Å; P360-M431 HydrophobicContact CB-SD 3.74Å; P360-M431 HydrophobicContact CG-SD 4.33Å; P360-Y438 VanDerWaalsContact CD-CZ 3.48Å; P360-Y438 HydrophobicContact CG-CD1 4.08Å; P360-Y438 HydrophobicContact CG-CD2 3.8Å; P360-Y438 HydrophobicContact CG-CE1 3.86Å; P360-Y438 HydrophobicContact CG-CE2 3.53Å; P360-Y438 HydrophobicContact CG-CG 4.05Å
361	F	90	Very high	90.1	Very high	93 Å²	93	48.9 Å²	48.9	41%	0.408	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	144.5	174.2	-59.1	-69.7	0	0	0	111	L359 K363 I391 P393	L359-F361 VanDerWaalsContact C-N 3.26Å; L359-F361 HydrophobicContact CB-CE1 4.34Å; L359-F361 HydrophobicContact CB-CE2 4.13Å; L359-F361 HydrophobicContact CB-CZ 3.99Å; L359-F361 HydrophobicContact CD1-CZ 4.38Å; L359-F361 WeakPolarHBondContact O-CD2 3.3Å; L359-F361 PolarHBondContact O-N 2.86Å; F361-K363 PolarHBondContact O-N 2.87Å; F361-I391 HydrophobicContact CD1-CG2 4.08Å; F361-I391 HydrophobicContact CE1-CG2 4.02Å; F361-P393 HydrophobicContact CD1-CG 4.43Å
362	N	82.3	Confident	88.2	Confident	125 Å²	125	48.5 Å²	48.5	67%	0.668	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	13.1	-179	-53.7	-29.7	0	0	0	115.4
363	K	88.8	Confident	86.6	Confident	108 Å²	108	49.4 Å²	49.4	47%	0.47	25%	0.252	S	S	.	.			trans	-87.2	145.7	169.1	-63.3	-58.1	-172.8	178.6	0	110.3	P360 F361 C365 M431	P360-K363 HydrophobicContact CB-CB 3.99Å; P360-K363 HydrophobicContact CB-CG 3.64Å; P360-K363 WeakPolarHBondContact O-CB 3.44Å; P360-K363 PolarHBondContact O-N 2.68Å; F361-K363 PolarHBondContact O-N 2.87Å; K363-C365 PolarHBondContact O-N 2.99Å; K363-C365 PolarHBondContact O-SG 2.85Å; K363-M431 HydrophobicContact CG-SD 4.26Å
364	T	86.8	Confident	84.8	Confident	48 Å²	48	50.2 Å²	50.2	29%	0.294	26%	0.256	S	S	.	.			trans	-66.9	117.7	173.3	-58.5	0	0	0	0	109.6	Y366 E388 Q430	T364-Y366 HydrophobicContact CG2-CD2 4.35Å; T364-Y366 HydrophobicContact CG2-CE2 3.59Å; T364-E388 HydrophobicContact CG2-CG 4.04Å; T364-Q430 PolarHBondContact O-N 2.8Å
365	C	92.2	Very high	83.3	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	157.4	170.8	-47.4	0	0	0	0	109.5	K363 E388 A389 L427 A428 C429	K363-C365 PolarHBondContact O-N 2.99Å; K363-C365 PolarHBondContact O-SG 2.85Å; C365-E388 WeakPolarHBondContact O-CA 3.11Å; C365-A389 CarbonylContact C-O 3.51Å; C365-A389 WeakPolarHBondContact CA-O 3.02Å; C365-A389 VanDerWaalsContact CB-O 3.31Å; C365-A389 WeakPolarHBondContact CB-O 3.46Å; C365-A389 PolarHBondContact N-O 3.4Å; C365-A389 PolarHBondContact O-N 2.98Å; C365-A389 VanDerWaalsContact O-O 3.07Å; C365-L427 HydrophobicContact CB-CD1 3.7Å; C365-L427 HydrophobicContact CB-CG 4.12Å; C365-A428 CarbonylContact C-O 3.57Å; C365-A428 VanDerWaalsContact CA-O 3.22Å; C365-A428 WeakPolarHBondContact CA-O 3.31Å; C365-C429 HydrophobicContact CB-CB 3.98Å; C365-C429 WeakPolarHBondContact CB-SG 3.26Å; C365-C429 WeakPolarHBondContact SG-CB 3.46Å; C365-C429 CovalentContact SG-SG 2.04Å; C365-C429 PolarHBondContact SG-SG 3.02Å
366	Y	91.9	Very high	81.8	Confident	7 Å²	7	53.4 Å²	53.4	3%	0.027	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	137.7	172.3	-71.4	-79.5	0	0	0	110.5	W230 T364 Q386 V387 E388 L427 A428 W435	W230-Y366 AromaticContact CH2-CE1 3.61Å; W230-Y366 HydrophobicContact CH2-CE1 3.61Å; W230-Y366 HydrophobicContact CZ2-CD1 4.31Å; W230-Y366 AromaticContact CZ2-CE1 3.39Å; W230-Y366 HydrophobicContact CZ2-CE1 3.39Å; T364-Y366 HydrophobicContact CG2-CD2 4.35Å; T364-Y366 HydrophobicContact CG2-CE2 3.59Å; Y366-Q386 HydrophobicContact CD1-CB 4.39Å; Y366-Q386 HydrophobicContact CD1-CG 4.41Å; Y366-V387 VanDerWaalsContact CA-O 3.31Å; Y366-V387 WeakPolarHBondContact CA-O 3.27Å; Y366-E388 HydrophobicContact CD1-CB 4.21Å; Y366-E388 HydrophobicContact CE1-CB 3.67Å; Y366-E388 HydrophobicContact CE1-CG 4.19Å; Y366-L427 WeakPolarHBondContact O-CA 3.43Å; Y366-A428 PolarHBondContact N-O 3.17Å; Y366-A428 PolarHBondContact O-N 3.11Å; Y366-W435 AromaticContact CD2-CH2 3.33Å; Y366-W435 HydrophobicContact CD2-CH2 3.33Å; Y366-W435 HydrophobicContact CD2-CZ2 4.46Å; Y366-W435 AromaticContact CD2-CZ3 3.56Å; Y366-W435 HydrophobicContact CD2-CZ3 3.56Å; Y366-W435 AromaticContact CE2-CH2 3.65Å; Y366-W435 HydrophobicContact CE2-CH2 3.65Å; Y366-W435 HydrophobicContact CE2-CZ3 4.28Å
367	T	91.9	Very high	80.3	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	138.2	158.7	-66	0	0	0	0	109.5	Q386 V387 A418 P426 L427 V441 Y456	T367-Q386 CarbonylContact O-C 3.51Å; T367-Q386 WeakPolarHBondContact O-CA 3.39Å; T367-V387 PolarHBondContact N-O 2.83Å; T367-V387 PolarHBondContact O-N 3Å; T367-A418 HydrophobicContact CG2-CB 3.7Å; T367-P426 VanDerWaalsContact CA-O 3.22Å; T367-P426 WeakPolarHBondContact CA-O 3.46Å; T367-P426 WeakPolarHBondContact CG2-O 3.23Å; T367-P426 PolarHBondContact OG1-O 2.9Å; T367-L427 WeakPolarHBondContact OG1-CD1 3.49Å; T367-V441 HydrophobicContact CG2-CG2 3.42Å; T367-V441 VanDerWaalsContact CG2-CG2 3.42Å; T367-Y456 HydrophobicContact CG2-CE1 4.44Å; T367-Y456 VanDerWaalsContact OG1-CE1 3.3Å; T367-Y456 WeakPolarHBondContact OG1-CE1 3.47Å; T367-Y456 PolarHBondContact OG1-OH 2.86Å
368	S	92.4	Very high	79	Confident	4 Å²	4	43.2 Å²	43.2	3%	0.028	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	146.5	-179.6	52.3	0	0	0	0	112.6	Q240 M385 P426	Q240-S368 PolarHBondContact NE2-O 2.68Å; Q240-S368 PolarHBondContact OE1-O 2.93Å; Q240-S368 PolarHBondContact OE1-OG 2.67Å; S368-M385 WeakPolarHBondContact CA-O 3.42Å; S368-M385 WeakPolarHBondContact CB-O 3.49Å; S368-P426 WeakPolarHBondContact OG-CG 3.49Å
369	G	91.5	Very high	77.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.01	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.3	-178.7	-179.8	0	0	0	0	0	113.4	M385 D422	G369-M385 PolarHBondContact N-O 2.89Å; G369-M385 PolarHBondContact O-N 2.87Å; G369-D422 VanDerWaalsContact CA-OD1 3.24Å; G369-D422 WeakPolarHBondContact CA-OD1 3.44Å
370	W	87.6	Confident	76.8	Confident	18 Å²	18	44 Å²	44	7%	0.068	24%	0.235	C	C	.	.	S	Bend	trans	-107.8	23.2	173.9	-62.1	-89.9	0	0	0	110.9	Q240 R242 L296 H297 L299 K383 L384	Q240-W370 HydrophobicContact CG-CH2 3.77Å; Q240-W370 HydrophobicContact CG-CZ3 3.72Å; R242-W370 HydrophobicContact CB-CE3 4.18Å; R242-W370 HydrophobicContact CB-CH2 4.44Å; R242-W370 HydrophobicContact CB-CZ3 3.77Å; R242-W370 HydrophobicContact CG-CE3 4.37Å; R242-W370 HydrophobicContact CG-CZ3 4.46Å; L296-W370 HydrophobicContact CB-CH2 4.1Å; L296-W370 HydrophobicContact CB-CZ2 4.08Å; L296-W370 HydrophobicContact CD2-CH2 3.94Å; L296-W370 HydrophobicContact CD2-CZ2 3.86Å; L296-W370 HydrophobicContact CG-CH2 4.08Å; L296-W370 HydrophobicContact CG-CZ2 3.72Å; L296-W370 WeakPolarHBondContact O-CZ2 3.26Å; H297-W370 PolarHBondContact O-NE1 3.35Å; L299-W370 HydrophobicContact CD1-CB 3.98Å; L299-W370 HydrophobicContact CD1-CG 3.99Å; L299-W370 HydrophobicContact CD2-CB 4.37Å; L299-W370 HydrophobicContact CD2-CD2 3.69Å; L299-W370 HydrophobicContact CD2-CE3 4.41Å; L299-W370 HydrophobicContact CD2-CG 3.65Å; L299-W370 HydrophobicContact CD2-CZ2 4.37Å; L299-W370 HydrophobicContact CG-CB 4.4Å; L299-W370 VanDerWaalsContact CG-CD1 3.48Å; L299-W370 HydrophobicContact CG-CD2 4.4Å; L299-W370 HydrophobicContact CG-CG 3.86Å; W370-K383 VanDerWaalsContact CD1-C 3.41Å; W370-L384 HydrophobicContact CD2-CD1 4.01Å; W370-L384 HydrophobicContact CE3-CD1 4.1Å; W370-L384 HydrophobicContact CH2-CD1 3.96Å; W370-L384 HydrophobicContact CZ2-CB 3.91Å; W370-L384 HydrophobicContact CZ2-CD1 3.86Å; W370-L384 HydrophobicContact CZ2-CG 4.32Å; W370-L384 HydrophobicContact CZ3-CD1 4.08Å; W370-L384 VanDerWaalsContact NE1-N 3.16Å
371	G	72	Confident	76.3	Confident	1 Å²	1	44 Å²	44	1%	0.01	24%	0.236	C	C	.	.			trans	-69.7	171.8	175.5	0	0	0	0	0	112.6	I373 P381 F420 D422	G371-I373 PolarHBondContact O-N 3.48Å; G371-P381 WeakPolarHBondContact O-CD 3.5Å; G371-P381 VanDerWaalsContact O-CG 3.29Å; G371-P381 WeakPolarHBondContact O-CG 3.42Å; G371-F420 CarbonylContact C-O 3.58Å; G371-F420 WeakPolarHBondContact CA-O 3.42Å; G371-D422 VanDerWaalsContact CA-OD1 3.23Å; G371-D422 WeakPolarHBondContact CA-OD1 3.46Å; G371-D422 PolarHBondContact N-OD1 3.33Å
372	S	57	Low	76.1	Confident	5 Å²	5	41.4 Å²	41.4	4%	0.035	23%	0.229	C	C	.	.			trans	-61.5	136.8	-172.8	162.7	0	0	0	0	112.1	D374 G377 I379 C419 F420	S372-D374 PolarHBondContact OG-N 2.75Å; S372-D374 PolarHBondContact OG-O 3.41Å; S372-D374 VanDerWaalsContact OG-O 3.08Å; S372-D374 PolarHBondContact OG-OD1 3Å; S372-G377 WeakPolarHBondContact OG-CA 3.21Å; S372-G377 PolarHBondContact OG-N 2.76Å; S372-I379 CarbonylContact C-O 3.47Å; S372-I379 WeakPolarHBondContact CA-O 3.16Å; S372-C419 WeakPolarHBondContact O-CB 3.37Å; S372-C419 PolarHBondContact O-SG 3.27Å; S372-F420 PolarHBondContact N-O 3.38Å
373	I	62.3	Low	76.5	Confident	49 Å²	49	36.8 Å²	36.8	25%	0.251	20%	0.203	S	C	.	.	S	Bend	trans	-102.7	21.7	178.8	60.1	164.5	0	0	0	112.2	N228 G371 I379 P381 M385	N228-I373 HydrophobicContact CB-CB 4.26Å; N228-I373 VanDerWaalsContact CB-O 3.27Å; N228-I373 WeakPolarHBondContact CB-O 3.33Å; N228-I373 VanDerWaalsContact CG-O 3.3Å; N228-I373 VanDerWaalsContact ND2-C 3.33Å; N228-I373 PolarHBondContact ND2-O 3.08Å; G371-I373 PolarHBondContact O-N 3.48Å; I373-I379 HydrophobicContact CD1-CB 4.46Å; I373-I379 HydrophobicContact CD1-CG2 3.64Å; I373-I379 HydrophobicContact CG1-CB 3.76Å; I373-I379 HydrophobicContact CG1-CG2 3.44Å; I373-I379 VanDerWaalsContact CG1-CG2 3.44Å; I373-I379 WeakPolarHBondContact CG1-O 3.34Å; I373-I379 PolarHBondContact N-O 3.36Å; I373-P381 HydrophobicContact CG2-CB 4.11Å; I373-P381 HydrophobicContact CG2-CG 3.75Å; I373-M385 HydrophobicContact CG2-CE 4.16Å; I373-M385 HydrophobicContact CG2-CG 3.84Å
374	D	57.9	Low	76.7	Confident	19 Å²	19	31.8 Å²	31.8	10%	0.102	18%	0.182	C	C	.	.	S	Bend	trans	-138	151.2	173.5	69.7	-49.7	0	0	0	110.9	N228 S372 N376 G377 T378 I379	N228-D374 WeakPolarHBondContact ND2-CA 3.12Å; S372-D374 PolarHBondContact OG-N 2.75Å; S372-D374 PolarHBondContact OG-O 3.41Å; S372-D374 VanDerWaalsContact OG-O 3.08Å; S372-D374 PolarHBondContact OG-OD1 3Å; D374-N376 PolarHBondContact O-N 2.92Å; D374-G377 PolarHBondContact O-N 3.35Å; D374-T378 PolarHBondContact OD1-N 3.35Å; D374-T378 PolarHBondContact OD2-N 3.28Å; D374-T378 PolarHBondContact OD2-OG1 3.45Å; D374-I379 HydrophobicContact CB-CB 4.37Å; D374-I379 HydrophobicContact CB-CD1 3.94Å; D374-I379 HydrophobicContact CB-CG1 4.08Å; D374-I379 WeakPolarHBondContact OD1-CB 3.49Å; D374-I379 PolarHBondContact OD1-N 2.79Å
375	V	59.1	Low	76.9	Confident	58 Å²	58	31 Å²	31	35%	0.352	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-28.5	-177.7	-178.3	0	0	0	0	111.9	A448	V375-A448 HydrophobicContact CG2-CB 4.37Å
376	N	59.9	Low	76.7	Confident	130 Å²	130	31.2 Å²	31.2	70%	0.695	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.3	-177.4	-62	-19	0	0	0	114.2	D374 T378	D374-N376 PolarHBondContact O-N 2.92Å; N376-T378 HydrophobicContact CB-CG2 3.9Å; N376-T378 PolarHBondContact O-N 3Å
377	G	59.1	Low	76.4	Confident	24 Å²	24	31.2 Å²	31.2	25%	0.247	18%	0.177	C	C	.	.	S	Bend	trans	79.4	11.2	-179.9	0	0	0	0	0	115.3	S372 D374	S372-G377 WeakPolarHBondContact OG-CA 3.21Å; S372-G377 PolarHBondContact OG-N 2.76Å; D374-G377 PolarHBondContact O-N 3.35Å
378	T	60.5	Low	76.1	Confident	54 Å²	54	32.2 Å²	32.2	33%	0.331	18%	0.181	S	C	.	.			trans	-99.9	-23.2	-164.9	70.8	0	0	0	0	115.5	R95 D374 N376	R95-T378 PolarHBondContact NH1-OG1 3.28Å; D374-T378 PolarHBondContact OD1-N 3.35Å; D374-T378 PolarHBondContact OD2-N 3.28Å; D374-T378 PolarHBondContact OD2-OG1 3.45Å; N376-T378 HydrophobicContact CB-CG2 3.9Å; N376-T378 PolarHBondContact O-N 3Å
379	I	65.1	Low	75.9	Confident	49 Å²	49	32.1 Å²	32.1	25%	0.251	18%	0.181	S	C	.	.			trans	-102.7	105.9	-178.1	-54.5	179.2	0	0	0	108.3	S372 I373 D374	S372-I379 CarbonylContact C-O 3.47Å; S372-I379 WeakPolarHBondContact CA-O 3.16Å; I373-I379 HydrophobicContact CD1-CB 4.46Å; I373-I379 HydrophobicContact CD1-CG2 3.64Å; I373-I379 HydrophobicContact CG1-CB 3.76Å; I373-I379 HydrophobicContact CG1-CG2 3.44Å; I373-I379 VanDerWaalsContact CG1-CG2 3.44Å; I373-I379 WeakPolarHBondContact CG1-O 3.34Å; I373-I379 PolarHBondContact N-O 3.36Å; D374-I379 HydrophobicContact CB-CB 4.37Å; D374-I379 HydrophobicContact CB-CD1 3.94Å; D374-I379 HydrophobicContact CB-CG1 4.08Å; D374-I379 WeakPolarHBondContact OD1-CB 3.49Å; D374-I379 PolarHBondContact OD1-N 2.79Å
380	L	72.8	Confident	75.9	Confident	118 Å²	118	34.7 Å²	34.7	62%	0.618	19%	0.192	S	C	*	.			trans	-94.3	120	172.1	-61.8	175.4	0	0	0	109.5
381	P	81.4	Confident	76	Confident	13 Å²	13	33.8 Å²	33.8	8%	0.084	19%	0.189	C	C	.	.			trans	-70.3	138.1	176	33.1	-36.2	0	0	0	109.5	G371 I373 K383 M385	G371-P381 WeakPolarHBondContact O-CD 3.5Å; G371-P381 VanDerWaalsContact O-CG 3.29Å; G371-P381 WeakPolarHBondContact O-CG 3.42Å; I373-P381 HydrophobicContact CG2-CB 4.11Å; I373-P381 HydrophobicContact CG2-CG 3.75Å; P381-K383 VanDerWaalsContact C-N 3.27Å; P381-M385 HydrophobicContact CB-CG 3.55Å; P381-M385 HydrophobicContact CB-SD 3.97Å; P381-M385 HydrophobicContact CG-CG 3.44Å; P381-M385 VanDerWaalsContact CG-CG 3.44Å
382	S	86.8	Confident	76.9	Confident	37 Å²	37	34.5 Å²	34.5	26%	0.259	19%	0.193	S	C	.	.	S	Bend	trans	-75	-22.7	170.7	72.4	0	0	0	0	112.1	D298 L299 F300	D298-S382 CarbonylContact C-O 3.43Å; D298-S382 WeakPolarHBondContact CA-O 3.48Å; D298-S382 PolarHBondContact OD1-OG 3.11Å; L299-S382 WeakPolarHBondContact CG-O 3.35Å; L299-S382 PolarHBondContact N-O 2.92Å; F300-S382 VanDerWaalsContact CD2-CB 3.47Å
383	K	90.5	Very high	78.5	Confident	29 Å²	29	36.3 Å²	36.3	13%	0.126	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-104.3	151.7	-176.1	-61.6	-175.2	179.6	-172	0	110.4	E231 H297 D298 W370 P381 M385	E231-K383 VanDerWaalsContact CD-CD 3.46Å; E231-K383 HydrophobicContact CG-CB 3.94Å; E231-K383 WeakPolarHBondContact OE1-CD 3.47Å; E231-K383 WeakPolarHBondContact OE2-CD 3.31Å; H297-K383 CarbonylContact O-C 3.29Å; H297-K383 WeakPolarHBondContact O-CA 2.89Å; D298-K383 HydrophobicContact CB-CG 4.25Å; D298-K383 WeakPolarHBondContact OD2-CE 3.14Å; W370-K383 VanDerWaalsContact CD1-C 3.41Å; P381-K383 VanDerWaalsContact C-N 3.27Å; K383-M385 PolarHBondContact O-N 2.72Å
384	L	92.3	Very high	79.6	Confident	3 Å²	3	37.9 Å²	37.9	2%	0.016	21%	0.207	C	C	.	.			trans	-62.3	121.8	-179.8	-177.9	61.2	0	0	0	108.9	A232 I237 Q240 H297 W370	A232-L384 HydrophobicContact CB-CB 4.44Å; A232-L384 HydrophobicContact CB-CD2 4.25Å; A232-L384 HydrophobicContact CB-CG 4.14Å; A232-L384 PolarHBondContact N-O 2.76Å; I237-L384 HydrophobicContact CB-CD2 4.16Å; I237-L384 HydrophobicContact CD1-CD2 4.17Å; I237-L384 HydrophobicContact CG1-CD2 4.46Å; Q240-L384 HydrophobicContact CB-CD2 4.14Å; Q240-L384 HydrophobicContact CG-CD1 3.75Å; Q240-L384 HydrophobicContact CG-CD2 4.01Å; H297-L384 PolarHBondContact O-N 3.28Å; W370-L384 HydrophobicContact CD2-CD1 4.01Å; W370-L384 HydrophobicContact CE3-CD1 4.1Å; W370-L384 HydrophobicContact CH2-CD1 3.96Å; W370-L384 HydrophobicContact CZ2-CB 3.91Å; W370-L384 HydrophobicContact CZ2-CD1 3.86Å; W370-L384 HydrophobicContact CZ2-CG 4.32Å; W370-L384 HydrophobicContact CZ3-CD1 4.08Å; W370-L384 VanDerWaalsContact NE1-N 3.16Å
385	M	90.3	Very high	80.9	Confident	30 Å²	30	44.3 Å²	44.3	15%	0.148	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	155.7	174.7	-56.4	-59.2	-71.2	0	0	109.4	W230 E231 S368 G369 I373 P381 K383	W230-M385 CarbonylContact O-C 3.54Å; W230-M385 WeakPolarHBondContact O-CA 3.4Å; E231-M385 HydrophobicContact CB-SD 4.01Å; S368-M385 WeakPolarHBondContact CA-O 3.42Å; S368-M385 WeakPolarHBondContact CB-O 3.49Å; G369-M385 PolarHBondContact N-O 2.89Å; G369-M385 PolarHBondContact O-N 2.87Å; I373-M385 HydrophobicContact CG2-CE 4.16Å; I373-M385 HydrophobicContact CG2-CG 3.84Å; P381-M385 HydrophobicContact CB-CG 3.55Å; P381-M385 HydrophobicContact CB-SD 3.97Å; P381-M385 HydrophobicContact CG-CG 3.44Å; P381-M385 VanDerWaalsContact CG-CG 3.44Å; K383-M385 PolarHBondContact O-N 2.72Å
386	Q	89.4	Confident	82.2	Confident	5 Å²	5	45.6 Å²	45.6	2%	0.023	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	150.4	168.1	63	175.2	-14.3	0	0	110.9	N217 G229 W230 A232 I237 Y366 T367	N217-Q386 PolarHBondContact O-NE2 3.49Å; N217-Q386 VanDerWaalsContact O-NE2 3.14Å; N217-Q386 PolarHBondContact OD1-NE2 3.25Å; G229-Q386 CarbonylContact C-O 3.56Å; G229-Q386 VanDerWaalsContact CA-O 3.28Å; G229-Q386 WeakPolarHBondContact CA-O 3.37Å; W230-Q386 PolarHBondContact N-O 2.94Å; W230-Q386 VanDerWaalsContact NE1-NE2 3.13Å; W230-Q386 PolarHBondContact O-N 2.9Å; A232-Q386 HydrophobicContact CB-CB 4.43Å; A232-Q386 HydrophobicContact CB-CG 4.13Å; I237-Q386 HydrophobicContact CD1-CB 4.24Å; Y366-Q386 HydrophobicContact CD1-CB 4.39Å; Y366-Q386 HydrophobicContact CD1-CG 4.41Å; T367-Q386 CarbonylContact O-C 3.51Å; T367-Q386 WeakPolarHBondContact O-CA 3.39Å
387	V	85.4	Confident	83.3	Confident	8 Å²	8	40.1 Å²	40.1	5%	0.048	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	133.1	178.6	65.5	0	0	0	0	109.2	Y366 T367 K416	Y366-V387 VanDerWaalsContact CA-O 3.31Å; Y366-V387 WeakPolarHBondContact CA-O 3.27Å; T367-V387 PolarHBondContact N-O 2.83Å; T367-V387 PolarHBondContact O-N 3Å; V387-K416 HydrophobicContact CG2-CB 3.64Å; V387-K416 HydrophobicContact CG2-CD 4.46Å; V387-K416 HydrophobicContact CG2-CG 4.32Å
388	E	86	Confident	83.9	Confident	21 Å²	21	42 Å²	42	10%	0.098	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	138.2	173.9	-172.3	171.1	177.4	0	0	110.6	S219 W230 T364 C365 Y366 L411	S219-E388 WeakPolarHBondContact CB-OE2 3.44Å; S219-E388 PolarHBondContact OG-OE2 3.09Å; W230-E388 HydrophobicContact CH2-CB 3.81Å; W230-E388 HydrophobicContact CZ3-CB 4.35Å; T364-E388 HydrophobicContact CG2-CG 4.04Å; C365-E388 WeakPolarHBondContact O-CA 3.11Å; Y366-E388 HydrophobicContact CD1-CB 4.21Å; Y366-E388 HydrophobicContact CE1-CB 3.67Å; Y366-E388 HydrophobicContact CE1-CG 4.19Å; E388-L411 HydrophobicContact CB-CD1 4.01Å; E388-L411 HydrophobicContact CG-CD1 3.96Å
389	A	88.1	Confident	84.5	Confident	3 Å²	3	45 Å²	45	3%	0.025	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	156.2	176.1	0	0	0	0	0	109.8	C365 A409 L427	C365-A389 CarbonylContact C-O 3.51Å; C365-A389 WeakPolarHBondContact CA-O 3.02Å; C365-A389 VanDerWaalsContact CB-O 3.31Å; C365-A389 WeakPolarHBondContact CB-O 3.46Å; C365-A389 PolarHBondContact N-O 3.4Å; C365-A389 PolarHBondContact O-N 2.98Å; C365-A389 VanDerWaalsContact O-O 3.07Å; A389-A409 HydrophobicContact CB-CB 4.18Å; A389-L427 HydrophobicContact CB-CD1 3.96Å
390	Q	89.6	Confident	85.2	Confident	54 Å²	54	51.7 Å²	51.7	25%	0.252	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141	169.1	-66.4	178.6	2.5	0	0	108.7	L392 A409 G410 L411	Q390-L392 PolarHBondContact O-N 3.12Å; Q390-A409 CarbonylContact O-C 3.46Å; Q390-A409 WeakPolarHBondContact O-CA 3.43Å; Q390-A409 VanDerWaalsContact O-CB 3.3Å; Q390-A409 WeakPolarHBondContact O-CB 3.47Å; Q390-G410 PolarHBondContact N-O 2.85Å; Q390-G410 VanDerWaalsContact N-O 3.15Å; Q390-G410 PolarHBondContact O-N 3.43Å; Q390-L411 HydrophobicContact CB-CD2 4.36Å; Q390-L411 HydrophobicContact CG-CD2 3.72Å
391	I	91.5	Very high	85.8	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.7	171.2	-62.1	177.3	0	0	0	107.8	L359 P360 F361 L407 L427 Y438	L359-I391 HydrophobicContact CB-CG2 4.36Å; L359-I391 HydrophobicContact CD1-CG2 4.24Å; L359-I391 HydrophobicContact CD2-CD1 4.44Å; P360-I391 HydrophobicContact CG-CD1 3.91Å; F361-I391 HydrophobicContact CD1-CG2 4.08Å; F361-I391 HydrophobicContact CE1-CG2 4.02Å; I391-L407 HydrophobicContact CG1-CD1 4.47Å; I391-L427 HydrophobicContact CD1-CD2 4.49Å; I391-L427 HydrophobicContact CG1-CD2 4.01Å; I391-Y438 HydrophobicContact CD1-CD1 4.48Å; I391-Y438 HydrophobicContact CD1-CG 4.1Å
392	L	90.1	Very high	86.2	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	147.3	-178.7	-57.6	179.2	0	0	0	110.7	Q390 M396 C408 L412 P453	Q390-L392 PolarHBondContact O-N 3.12Å; L392-M396 HydrophobicContact CB-CB 4.18Å; L392-M396 HydrophobicContact CD1-CB 4.49Å; L392-M396 HydrophobicContact CD2-CE 4.4Å; L392-C408 HydrophobicContact CB-CB 4.42Å; L392-C408 PolarHBondContact N-O 3.37Å; L392-L412 HydrophobicContact CD1-CD1 4.39Å; L392-L412 HydrophobicContact CD1-CD2 3.99Å; L392-L412 HydrophobicContact CD1-CG 4.07Å; L392-P453 HydrophobicContact CD1-CB 3.62Å; L392-P453 HydrophobicContact CD1-CG 3.96Å
393	P	89.6	Confident	86.3	Confident	42 Å²	42	51.9 Å²	51.9	27%	0.273	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-50.5	146.9	162.7	-24.8	33.8	0	0	0	111.3	F361 E395 M396	F361-P393 HydrophobicContact CD1-CG 4.43Å; P393-E395 VanDerWaalsContact CB-OE2 3.31Å; P393-E395 WeakPolarHBondContact CB-OE2 3.47Å; P393-E395 PolarHBondContact O-N 2.9Å; P393-E395 VanDerWaalsContact O-N 3.17Å; P393-M396 HydrophobicContact CB-CG 4.41Å; P393-M396 HydrophobicContact CB-SD 4.41Å; P393-M396 HydrophobicContact CG-SD 3.94Å; P393-M396 WeakPolarHBondContact O-CB 3.26Å; P393-M396 PolarHBondContact O-N 3.24Å
394	Y	86.8	Confident	86.3	Confident	82 Å²	82	56.5 Å²	56.5	32%	0.322	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-58.2	-33.4	-175.8	171.9	-103.5	0	0	0	112.4	M396 C397 I401 N403	Y394-M396 PolarHBondContact O-N 3.26Å; Y394-C397 VanDerWaalsContact O-CB 3.24Å; Y394-C397 WeakPolarHBondContact O-CB 3.45Å; Y394-C397 PolarHBondContact O-N 2.99Å; Y394-C397 VanDerWaalsContact O-N 3.08Å; Y394-I401 HydrophobicContact CD2-CD1 4.41Å; Y394-I401 HydrophobicContact CD2-CG1 3.89Å; Y394-I401 HydrophobicContact CE2-CD1 4.43Å; Y394-I401 HydrophobicContact CE2-CG1 3.45Å; Y394-I401 VanDerWaalsContact CE2-CG1 3.45Å; Y394-I401 WeakPolarHBondContact CE2-O 3.26Å; Y394-I401 PolarHBondContact OH-O 3.12Å; Y394-N403 HydrophobicContact CD1-CB 4.27Å; Y394-N403 HydrophobicContact CD2-CB 3.34Å; Y394-N403 HydrophobicContact CE1-CB 4.42Å; Y394-N403 HydrophobicContact CE2-CB 3.5Å; Y394-N403 VanDerWaalsContact CE2-CB 3.5Å; Y394-N403 HydrophobicContact CG-CB 3.75Å
395	E	84.9	Confident	86.4	Confident	155 Å²	155	56.6 Å²	56.6	72%	0.724	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-66.8	-18.4	-179.7	-56.5	70.5	-149.6	0	0	112.6	P393	P393-E395 VanDerWaalsContact CB-OE2 3.31Å; P393-E395 WeakPolarHBondContact CB-OE2 3.47Å; P393-E395 PolarHBondContact O-N 2.9Å; P393-E395 VanDerWaalsContact O-N 3.17Å
396	M	85.8	Confident	86.5	Confident	84 Å²	84	55.6 Å²	55.6	41%	0.414	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-93.2	1.7	177.7	-60.9	179.5	64.3	0	0	112.5	L392 P393 Y394 L412	L392-M396 HydrophobicContact CB-CB 4.18Å; L392-M396 HydrophobicContact CD1-CB 4.49Å; L392-M396 HydrophobicContact CD2-CE 4.4Å; P393-M396 HydrophobicContact CB-CG 4.41Å; P393-M396 HydrophobicContact CB-SD 4.41Å; P393-M396 HydrophobicContact CG-SD 3.94Å; P393-M396 WeakPolarHBondContact O-CB 3.26Å; P393-M396 PolarHBondContact O-N 3.24Å; Y394-M396 PolarHBondContact O-N 3.26Å; M396-L412 HydrophobicContact CE-CD1 3.26Å; M396-L412 HydrophobicContact CE-CG 4.39Å
397	C	83.6	Confident	86.7	Confident	16 Å²	16	55.8 Å²	55.8	11%	0.108	27%	0.266	C	S	.	.	S	Bend	trans	-73.4	130.8	169.4	-68.7	0	0	0	0	110.7	Y394 R399 I401 C408	Y394-C397 VanDerWaalsContact O-CB 3.24Å; Y394-C397 WeakPolarHBondContact O-CB 3.45Å; Y394-C397 PolarHBondContact O-N 2.99Å; Y394-C397 VanDerWaalsContact O-N 3.08Å; C397-R399 PolarHBondContact O-N 3.14Å; C397-I401 HydrophobicContact CB-CD1 4.33Å; C397-I401 WeakPolarHBondContact SG-CD1 3.45Å; C397-C408 HydrophobicContact CB-CB 4.24Å; C397-C408 WeakPolarHBondContact CB-SG 3.43Å; C397-C408 WeakPolarHBondContact SG-CB 3.44Å; C397-C408 CovalentContact SG-SG 2.03Å; C397-C408 PolarHBondContact SG-SG 3.29Å
398	D	72.4	Confident	87	Confident	63 Å²	63	55.5 Å²	55.5	34%	0.337	27%	0.265	S	S	.	.	S	Bend	trans	-62.9	-5.1	178.9	-88.7	21.6	0	0	0	116	R445 T451 S452	D398-R445 PolarHBondContact O-NH2 3.48Å; D398-T451 VanDerWaalsContact OD1-O 3.06Å; D398-S452 WeakPolarHBondContact OD2-CA 3.34Å; D398-S452 WeakPolarHBondContact OD2-CB 3.22Å; D398-S452 PolarHBondContact OD2-OG 2.94Å
399	R	72.6	Confident	87.2	Confident	118 Å²	118	54.5 Å²	54.5	45%	0.445	26%	0.26	S	S	.	.	S	Bend	trans	-148.3	153.6	-176.2	-69.8	-172.9	173.7	171.7	2.7	109.6	C397 I401 W443 R445	C397-R399 PolarHBondContact O-N 3.14Å; R399-I401 HydrophobicContact CB-CG2 4.46Å; R399-I401 PolarHBondContact O-N 2.83Å; R399-W443 HydrophobicContact CB-CH2 4.49Å; R399-R445 VanDerWaalsContact CG-NH2 3.32Å
400	E	79	Confident	86.9	Confident	189 Å²	189	54.6 Å²	54.6	88%	0.883	26%	0.261	S	S	*	.			trans	-60.8	109	161.7	-66.4	-173.2	168.4	0	0	108.8
401	I	85.9	Confident	86.4	Confident	14 Å²	14	53.2 Å²	53.2	7%	0.072	26%	0.256	C	S	.	.			trans	-111.3	164	170.6	67.5	174.5	0	0	0	108.4	Y394 C397 R399 N403 M406 C408 W443 V455	Y394-I401 HydrophobicContact CD2-CD1 4.41Å; Y394-I401 HydrophobicContact CD2-CG1 3.89Å; Y394-I401 HydrophobicContact CE2-CD1 4.43Å; Y394-I401 HydrophobicContact CE2-CG1 3.45Å; Y394-I401 VanDerWaalsContact CE2-CG1 3.45Å; Y394-I401 WeakPolarHBondContact CE2-O 3.26Å; Y394-I401 PolarHBondContact OH-O 3.12Å; C397-I401 HydrophobicContact CB-CD1 4.33Å; C397-I401 WeakPolarHBondContact SG-CD1 3.45Å; R399-I401 HydrophobicContact CB-CG2 4.46Å; R399-I401 PolarHBondContact O-N 2.83Å; I401-N403 PolarHBondContact O-N 2.85Å; I401-N403 VanDerWaalsContact O-N 3.08Å; I401-M406 HydrophobicContact CB-CB 4.19Å; I401-M406 HydrophobicContact CB-SD 3.82Å; I401-M406 HydrophobicContact CD1-CB 3.78Å; I401-M406 HydrophobicContact CG1-CB 4.22Å; I401-M406 HydrophobicContact CG2-SD 4.33Å; I401-C408 VanDerWaalsContact CD1-SG 3.53Å; I401-W443 HydrophobicContact CG2-CH2 4.22Å; I401-W443 HydrophobicContact CG2-CZ2 3.85Å; I401-V455 HydrophobicContact CD1-CG1 4.21Å; I401-V455 HydrophobicContact CG2-CG1 4.32Å; I401-V455 HydrophobicContact CG2-CG2 4.07Å
402	N	89.4	Confident	85.3	Confident	66 Å²	66	56.9 Å²	56.9	35%	0.353	28%	0.275	S	S	.	.			trans	-77.2	102.3	171.8	-176.6	-39.3	0	0	0	109	K404 T405 M406	N402-K404 PolarHBondContact O-N 2.78Å; N402-K404 WeakPolarHBondContact OD1-CB 3.37Å; N402-K404 PolarHBondContact OD1-N 3.5Å; N402-T405 VanDerWaalsContact CB-OG1 3.3Å; N402-T405 WeakPolarHBondContact CB-OG1 3.31Å; N402-T405 PolarHBondContact O-N 3.01Å; N402-T405 PolarHBondContact OD1-N 3.15Å; N402-M406 WeakPolarHBondContact O-CB 3.37Å; N402-M406 PolarHBondContact O-N 2.98Å
403	N	89.3	Confident	83.9	Confident	92 Å²	92	59.2 Å²	59.2	49%	0.492	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-11.9	-176.7	70.7	-7.1	0	0	0	115.3	Y394 I401	Y394-N403 HydrophobicContact CD1-CB 4.27Å; Y394-N403 HydrophobicContact CD2-CB 3.34Å; Y394-N403 HydrophobicContact CE1-CB 4.42Å; Y394-N403 HydrophobicContact CE2-CB 3.5Å; Y394-N403 VanDerWaalsContact CE2-CB 3.5Å; Y394-N403 HydrophobicContact CG-CB 3.75Å; I401-N403 PolarHBondContact O-N 2.85Å; I401-N403 VanDerWaalsContact O-N 3.08Å
404	K	91.2	Very high	82.5	Confident	126 Å²	126	60.9 Å²	60.9	55%	0.548	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-48.3	172.9	-61.6	-176.8	178.1	178.4	0	110.9	N402 N458 Y461	N402-K404 PolarHBondContact O-N 2.78Å; N402-K404 WeakPolarHBondContact OD1-CB 3.37Å; N402-K404 PolarHBondContact OD1-N 3.5Å; K404-N458 PolarHBondContact O-ND2 3.38Å; K404-Y461 HydrophobicContact CB-CD2 3.99Å; K404-Y461 HydrophobicContact CB-CE2 3.82Å; K404-Y461 HydrophobicContact CD-CE2 4.4Å; K404-Y461 WeakPolarHBondContact O-CB 3.28Å
405	T	92.9	Very high	81.2	Confident	5 Å²	5	63.6 Å²	63.6	3%	0.031	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-14	-170.9	57.6	0	0	0	0	113.8	N329 N402 N458 Y461 F462	N329-T405 WeakPolarHBondContact OD1-CB 3.21Å; N329-T405 WeakPolarHBondContact OD1-CG2 3.4Å; N329-T405 PolarHBondContact OD1-OG1 3.24Å; N402-T405 VanDerWaalsContact CB-OG1 3.3Å; N402-T405 WeakPolarHBondContact CB-OG1 3.31Å; N402-T405 PolarHBondContact O-N 3.01Å; N402-T405 PolarHBondContact OD1-N 3.15Å; T405-N458 PolarHBondContact O-N 3.45Å; T405-Y461 HydrophobicContact CG2-CD1 3.86Å; T405-Y461 HydrophobicContact CG2-CE1 3.57Å; T405-F462 HydrophobicContact CG2-CE1 4.44Å; T405-F462 HydrophobicContact CG2-CE2 4.45Å; T405-F462 HydrophobicContact CG2-CZ 3.71Å; T405-F462 WeakPolarHBondContact O-CE2 3.05Å
406	M	93.9	Very high	80.2	Confident	9 Å²	9	58 Å²	58	4%	0.044	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	152.9	-177.2	-59.8	174	178.9	0	0	110.8	T327 A328 N329 I401 N402 V455 Y456	T327-M406 WeakPolarHBondContact O-CE 3.37Å; A328-M406 HydrophobicContact CB-CE 4.19Å; A328-M406 WeakPolarHBondContact O-CE 3.18Å; N329-M406 HydrophobicContact CB-CE 4.25Å; I401-M406 HydrophobicContact CB-CB 4.19Å; I401-M406 HydrophobicContact CB-SD 3.82Å; I401-M406 HydrophobicContact CD1-CB 3.78Å; I401-M406 HydrophobicContact CG1-CB 4.22Å; I401-M406 HydrophobicContact CG2-SD 4.33Å; N402-M406 WeakPolarHBondContact O-CB 3.37Å; N402-M406 PolarHBondContact O-N 2.98Å; M406-V455 HydrophobicContact CB-CG1 3.86Å; M406-V455 HydrophobicContact CG-CG1 4.14Å; M406-V455 HydrophobicContact SD-CG1 3.98Å; M406-Y456 CarbonylContact C-O 3.58Å; M406-Y456 VanDerWaalsContact CA-O 3.26Å; M406-Y456 WeakPolarHBondContact CA-O 3.33Å
407	L	93.7	Very high	79.3	Confident	8 Å²	8	54.6 Å²	54.6	4%	0.042	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	158.5	169.6	63.6	82.1	0	0	0	109.7	L359 I391 A409 L427 Y438 V455 Y456 N458	L359-L407 HydrophobicContact CD1-CD2 4.48Å; L359-L407 HydrophobicContact CD2-CD2 4.14Å; I391-L407 HydrophobicContact CG1-CD1 4.47Å; L407-A409 HydrophobicContact CD1-CB 4.44Å; L407-L427 HydrophobicContact CD1-CD2 3.82Å; L407-Y438 WeakPolarHBondContact CD2-O 3.45Å; L407-V455 WeakPolarHBondContact O-CA 3.31Å; L407-Y456 HydrophobicContact CD1-CD2 4.08Å; L407-Y456 HydrophobicContact CD1-CG 4.16Å; L407-Y456 PolarHBondContact N-O 3.26Å; L407-Y456 PolarHBondContact O-N 2.97Å; L407-N458 HydrophobicContact CB-CB 4.5Å; L407-N458 HydrophobicContact CD2-CB 4.2Å; L407-N458 HydrophobicContact CG-CB 4.47Å
408	C	91.2	Very high	78.3	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.014	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	142.9	171.8	-64.2	0	0	0	0	110.5	L392 C397 I401 P453 V454	L392-C408 HydrophobicContact CB-CB 4.42Å; L392-C408 PolarHBondContact N-O 3.37Å; C397-C408 HydrophobicContact CB-CB 4.24Å; C397-C408 WeakPolarHBondContact CB-SG 3.43Å; C397-C408 WeakPolarHBondContact SG-CB 3.44Å; C397-C408 CovalentContact SG-SG 2.03Å; C397-C408 PolarHBondContact SG-SG 3.29Å; I401-C408 VanDerWaalsContact CD1-SG 3.53Å; C408-P453 HydrophobicContact CB-CB 4.02Å; C408-P453 HydrophobicContact CB-CG 3.95Å; C408-V454 WeakPolarHBondContact CA-O 3.22Å
409	A	89.8	Confident	78	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149	167.8	0	0	0	0	0	111.6	A389 Q390 L407 L427 V454 Y456	A389-A409 HydrophobicContact CB-CB 4.18Å; Q390-A409 CarbonylContact O-C 3.46Å; Q390-A409 WeakPolarHBondContact O-CA 3.43Å; Q390-A409 VanDerWaalsContact O-CB 3.3Å; Q390-A409 WeakPolarHBondContact O-CB 3.47Å; L407-A409 HydrophobicContact CD1-CB 4.44Å; A409-L427 HydrophobicContact CB-CD1 4.16Å; A409-L427 HydrophobicContact CB-CD2 3.57Å; A409-V454 PolarHBondContact N-O 3.19Å; A409-V454 PolarHBondContact O-N 2.92Å; A409-V454 VanDerWaalsContact O-N 3.08Å; A409-Y456 HydrophobicContact CB-CD2 3.99Å; A409-Y456 HydrophobicContact CB-CE2 3.61Å
410	G	82	Confident	77.3	Confident	5 Å²	5	52.6 Å²	52.6	5%	0.052	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.6	178.9	178.7	0	0	0	0	0	111	Q390	Q390-G410 PolarHBondContact N-O 2.85Å; Q390-G410 VanDerWaalsContact N-O 3.15Å; Q390-G410 PolarHBondContact O-N 3.43Å
411	L	79	Confident	76.4	Confident	25 Å²	25	44.8 Å²	44.8	13%	0.131	24%	0.237	C	C	.	.			trans	-115.7	97.5	167.8	-69.6	174.1	0	0	0	107	E388 Q390 G413 E414 K416	E388-L411 HydrophobicContact CB-CD1 4.01Å; E388-L411 HydrophobicContact CG-CD1 3.96Å; Q390-L411 HydrophobicContact CB-CD2 4.36Å; Q390-L411 HydrophobicContact CG-CD2 3.72Å; L411-G413 PolarHBondContact O-N 3.48Å; L411-E414 HydrophobicContact CB-CB 4.03Å; L411-E414 HydrophobicContact CB-CG 4.11Å; L411-E414 VanDerWaalsContact CD1-OE2 3.31Å; L411-E414 WeakPolarHBondContact CD1-OE2 3.34Å; L411-E414 WeakPolarHBondContact O-CB 3.31Å; L411-E414 PolarHBondContact O-N 2.74Å; L411-K416 HydrophobicContact CD1-CD 4.46Å
412	L	67.6	Low	75.9	Confident	78 Å²	78	44.9 Å²	44.9	41%	0.408	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	140	-177.8	-62.4	-173.8	0	0	0	110.8	L392 M396 E414	L392-L412 HydrophobicContact CD1-CD1 4.39Å; L392-L412 HydrophobicContact CD1-CD2 3.99Å; L392-L412 HydrophobicContact CD1-CG 4.07Å; M396-L412 HydrophobicContact CE-CD1 3.26Å; M396-L412 HydrophobicContact CE-CG 4.39Å; L412-E414 PolarHBondContact O-N 3.39Å
413	G	60.2	Low	75.8	Confident	65 Å²	65	43 Å²	43	67%	0.67	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	82.8	-13.6	-173	0	0	0	0	0	114.2	L411 P450	L411-G413 PolarHBondContact O-N 3.48Å; G413-P450 PolarHBondContact N-O 3.21Å
414	E	61.5	Low	75.9	Confident	77 Å²	77	38.6 Å²	38.6	36%	0.36	21%	0.206	S	C	.	.	S	Bend	trans	-101.6	140.3	173.2	-56.8	-163.5	167.7	0	0	111.3	L411 L412 K416	L411-E414 HydrophobicContact CB-CB 4.03Å; L411-E414 HydrophobicContact CB-CG 4.11Å; L411-E414 VanDerWaalsContact CD1-OE2 3.31Å; L411-E414 WeakPolarHBondContact CD1-OE2 3.34Å; L411-E414 WeakPolarHBondContact O-CB 3.31Å; L411-E414 PolarHBondContact O-N 2.74Å; L412-E414 PolarHBondContact O-N 3.39Å; E414-K416 HydrophobicContact CB-CB 4.39Å; E414-K416 HydrophobicContact CB-CG 4.31Å; E414-K416 PolarHBondContact O-N 2.88Å; E414-K416 IonicContact OE1-NZ 2.67Å; E414-K416 WeakPolarHBondContact OE2-CD 3.38Å; E414-K416 WeakPolarHBondContact OE2-CE 3.31Å; E414-K416 IonicContact OE2-NZ 3.37Å; E414-K416 PolarHBondContact OE2-NZ 2.8Å
415	R	59.5	Low	76.1	Confident	139 Å²	139	32.6 Å²	32.6	53%	0.525	18%	0.18	S	C	.	.	S	Bend	trans	-82.9	62.9	172.5	-67	-178.4	178	-110	3.4	110.2	V227 N228 A448 P450	V227-R415 HydrophobicContact CG1-CB 3.96Å; N228-R415 PolarHBondContact N-O 3.33Å; R415-A448 WeakPolarHBondContact CA-O 3.46Å; R415-A448 HydrophobicContact CB-CB 4.26Å; R415-A448 WeakPolarHBondContact CB-O 3.39Å; R415-P450 HydrophobicContact CG-CB 4.25Å; R415-P450 HydrophobicContact CG-CG 4.48Å
416	K	63.9	Low	76.2	Confident	36 Å²	36	32.4 Å²	32.4	16%	0.157	18%	0.179	C	C	.	.			trans	-136	115	-177.7	-70.4	-172.3	-163.1	155	0	109.9	V387 L411 E414	V387-K416 HydrophobicContact CG2-CB 3.64Å; V387-K416 HydrophobicContact CG2-CD 4.46Å; V387-K416 HydrophobicContact CG2-CG 4.32Å; L411-K416 HydrophobicContact CD1-CD 4.46Å; E414-K416 HydrophobicContact CB-CB 4.39Å; E414-K416 HydrophobicContact CB-CG 4.31Å; E414-K416 PolarHBondContact O-N 2.88Å; E414-K416 IonicContact OE1-NZ 2.67Å; E414-K416 WeakPolarHBondContact OE2-CD 3.38Å; E414-K416 WeakPolarHBondContact OE2-CE 3.31Å; E414-K416 IonicContact OE2-NZ 3.37Å; E414-K416 PolarHBondContact OE2-NZ 2.8Å
417	S	66.5	Low	76.3	Confident	14 Å²	14	32 Å²	32	10%	0.098	18%	0.177	C	C	.	.			trans	-157.8	166.5	172.7	82	0	0	0	0	111.5	A448	S417-A448 WeakPolarHBondContact OG-CA 3.28Å; S417-A448 PolarHBondContact OG-N 3.48Å
418	A	62.1	Low	76.5	Confident	5 Å²	5	31.7 Å²	31.7	4%	0.041	18%	0.176	C	C	.	.			trans	-60	153.8	162.8	0	0	0	0	0	110.4	T367 D422 V441 V454	T367-A418 HydrophobicContact CG2-CB 3.7Å; A418-D422 HydrophobicContact CB-CB 4.19Å; A418-V441 HydrophobicContact CB-CG1 3.96Å; A418-V441 HydrophobicContact CB-CG2 4.02Å; A418-V454 HydrophobicContact CB-CG1 4.19Å; A418-V454 HydrophobicContact CB-CG2 4.31Å
419	C	67.4	Low	76.6	Confident	14 Å²	14	31.6 Å²	31.6	10%	0.095	18%	0.175	C	C	.	.			trans	-141.6	-173.9	-177.8	-170.3	0	0	0	0	112.1	S372 G421 D422 C447	S372-C419 WeakPolarHBondContact O-CB 3.37Å; S372-C419 PolarHBondContact O-SG 3.27Å; C419-G421 PolarHBondContact O-N 2.93Å; C419-D422 PolarHBondContact N-OD2 3.49Å; C419-D422 WeakPolarHBondContact O-CB 3.24Å; C419-D422 PolarHBondContact O-N 3.4Å; C419-C447 WeakPolarHBondContact CA-SG 3.41Å; C419-C447 HydrophobicContact CB-CB 3.66Å; C419-C447 WeakPolarHBondContact CB-SG 3.42Å; C419-C447 WeakPolarHBondContact SG-CB 3.21Å; C419-C447 CovalentContact SG-SG 2.01Å; C419-C447 PolarHBondContact SG-SG 3.36Å
420	F	57.3	Low	76.7	Confident	136 Å²	136	34.9 Å²	34.9	60%	0.596	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.6	123	178.9	-66	-73.1	0	0	0	112.2	G371 S372 C447	G371-F420 CarbonylContact C-O 3.58Å; G371-F420 WeakPolarHBondContact CA-O 3.42Å; S372-F420 PolarHBondContact N-O 3.38Å; F420-C447 VanDerWaalsContact CD2-SG 3.57Å
421	G	59.8	Low	77.1	Confident	25 Å²	25	36.5 Å²	36.5	26%	0.258	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.6	-11.4	-178.2	0	0	0	0	0	114.4	C419 S423	C419-G421 PolarHBondContact O-N 2.93Å; G421-S423 VanDerWaalsContact C-N 3.3Å
422	D	75.2	Confident	77.4	Confident	15 Å²	15	42.9 Å²	42.9	8%	0.08	23%	0.232	C	C	.	.			trans	-84.2	-9.3	167.6	-59.6	-38.8	0	0	0	112.2	G369 G371 A418 C419 G424 G425 V441	G369-D422 VanDerWaalsContact CA-OD1 3.24Å; G369-D422 WeakPolarHBondContact CA-OD1 3.44Å; G371-D422 VanDerWaalsContact CA-OD1 3.23Å; G371-D422 WeakPolarHBondContact CA-OD1 3.46Å; G371-D422 PolarHBondContact N-OD1 3.33Å; A418-D422 HydrophobicContact CB-CB 4.19Å; C419-D422 PolarHBondContact N-OD2 3.49Å; C419-D422 WeakPolarHBondContact O-CB 3.24Å; C419-D422 PolarHBondContact O-N 3.4Å; D422-G424 PolarHBondContact O-N 2.84Å; D422-G425 VanDerWaalsContact O-CA 3.31Å; D422-G425 WeakPolarHBondContact O-CA 3.5Å; D422-G425 PolarHBondContact O-N 2.77Å; D422-V441 HydrophobicContact CB-CG1 4.22Å; D422-V441 HydrophobicContact CB-CG2 4.38Å; D422-V441 VanDerWaalsContact O-CB 3.28Å; D422-V441 WeakPolarHBondContact O-CB 3.15Å
423	S	87.2	Confident	78.2	Confident	26 Å²	26	45.8 Å²	45.8	18%	0.182	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-39.1	125.2	173.5	-76	0	0	0	0	112.6	C255 G256 H276 G421 G425	C255-S423 CarbonylContact C-O 3.5Å; C255-S423 VanDerWaalsContact CA-O 3.32Å; C255-S423 WeakPolarHBondContact CA-O 3.41Å; C255-S423 WeakPolarHBondContact CB-O 3.38Å; C255-S423 PolarHBondContact SG-O 3.35Å; G256-S423 PolarHBondContact N-O 3.32Å; H276-S423 WeakPolarHBondContact NE2-CB 3.43Å; H276-S423 PolarHBondContact NE2-OG 2.9Å; G421-S423 VanDerWaalsContact C-N 3.3Å; S423-G425 PolarHBondContact O-N 3.06Å
424	G	92.1	Very high	79.7	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	81	-9.5	-176.2	0	0	0	0	0	115.4	G256 G257 S273 D422 V441	G256-G424 VanDerWaalsContact C-C 3.45Å; G256-G424 CarbonylContact C-O 3.48Å; G256-G424 CarbonylContact O-C 3.54Å; G257-G424 VanDerWaalsContact CA-O 3.25Å; G257-G424 WeakPolarHBondContact CA-O 3.36Å; G257-G424 PolarHBondContact N-O 3.17Å; S273-G424 WeakPolarHBondContact OG-CA 3.36Å; D422-G424 PolarHBondContact O-N 2.84Å; G424-V441 PolarHBondContact N-O 3.25Å
425	G	94.2	Very high	81.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.214	C	C	.	.			trans	-66.8	163.4	174.8	0	0	0	0	0	113.3	D422 S423 I440 V441	D422-G425 VanDerWaalsContact O-CA 3.31Å; D422-G425 WeakPolarHBondContact O-CA 3.5Å; D422-G425 PolarHBondContact O-N 2.77Å; S423-G425 PolarHBondContact O-N 3.06Å; G425-I440 WeakPolarHBondContact O-CA 3.32Å; G425-V441 PolarHBondContact O-N 3.42Å
426	P	96.8	Very high	83.1	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	150.9	-177.6	27.7	-32.9	0	0	0	113.3	Q240 S258 T367 S368 A428 L437	Q240-P426 VanDerWaalsContact OE1-CD 3.23Å; S258-P426 WeakPolarHBondContact OG-CB 3.48Å; T367-P426 VanDerWaalsContact CA-O 3.22Å; T367-P426 WeakPolarHBondContact CA-O 3.46Å; T367-P426 WeakPolarHBondContact CG2-O 3.23Å; T367-P426 PolarHBondContact OG1-O 2.9Å; S368-P426 WeakPolarHBondContact OG-CG 3.49Å; P426-A428 HydrophobicContact CB-CB 4.44Å; P426-L437 HydrophobicContact CB-CD1 3.46Å; P426-L437 VanDerWaalsContact CB-CD1 3.46Å
427	L	95.9	Very high	84.7	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	96.3	146.2	179.6	71.5	0	0	0	107	C365 Y366 T367 A389 I391 L407 A409 Y438 G439 Y456	C365-L427 HydrophobicContact CB-CD1 3.7Å; C365-L427 HydrophobicContact CB-CG 4.12Å; Y366-L427 WeakPolarHBondContact O-CA 3.43Å; T367-L427 WeakPolarHBondContact OG1-CD1 3.49Å; A389-L427 HydrophobicContact CB-CD1 3.96Å; I391-L427 HydrophobicContact CD1-CD2 4.49Å; I391-L427 HydrophobicContact CG1-CD2 4.01Å; L407-L427 HydrophobicContact CD1-CD2 3.82Å; A409-L427 HydrophobicContact CB-CD1 4.16Å; A409-L427 HydrophobicContact CB-CD2 3.57Å; L427-Y438 PolarHBondContact O-N 3.49Å; L427-G439 PolarHBondContact N-O 3.04Å; L427-G439 PolarHBondContact O-N 3.48Å; L427-Y456 HydrophobicContact CB-CD1 3.68Å; L427-Y456 HydrophobicContact CB-CE1 3.67Å; L427-Y456 HydrophobicContact CB-CG 4.44Å; L427-Y456 HydrophobicContact CD1-CE1 4.18Å; L427-Y456 HydrophobicContact CD2-CD1 4.18Å; L427-Y456 HydrophobicContact CD2-CD2 4.26Å; L427-Y456 HydrophobicContact CD2-CE1 4.3Å; L427-Y456 HydrophobicContact CD2-CE2 4.41Å; L427-Y456 HydrophobicContact CD2-CG 4.16Å; L427-Y456 HydrophobicContact CG-CD1 4.43Å; L427-Y456 HydrophobicContact CG-CE1 4.27Å
428	A	96.5	Very high	86.1	Confident	3 Å²	3	33.5 Å²	33.5	3%	0.025	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	126	-177.6	0	0	0	0	0	110.1	V350 C365 Y366 P426 W435 V436	V350-A428 HydrophobicContact CG2-CB 4.31Å; C365-A428 CarbonylContact C-O 3.57Å; C365-A428 VanDerWaalsContact CA-O 3.22Å; C365-A428 WeakPolarHBondContact CA-O 3.31Å; Y366-A428 PolarHBondContact N-O 3.17Å; Y366-A428 PolarHBondContact O-N 3.11Å; P426-A428 HydrophobicContact CB-CB 4.44Å; A428-W435 HydrophobicContact CB-CE3 3.99Å; A428-W435 WeakPolarHBondContact O-CZ3 3.41Å; A428-V436 CarbonylContact C-O 3.56Å; A428-V436 VanDerWaalsContact CA-O 3.31Å; A428-V436 WeakPolarHBondContact CA-O 3.48Å
429	C	95	Very high	87.8	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	142.5	178.6	-51.9	0	0	0	0	110.3	P360 C365 M431 V436 Y438	P360-C429 HydrophobicContact CG-CB 4.24Å; C365-C429 HydrophobicContact CB-CB 3.98Å; C365-C429 WeakPolarHBondContact CB-SG 3.26Å; C365-C429 WeakPolarHBondContact SG-CB 3.46Å; C365-C429 CovalentContact SG-SG 2.04Å; C365-C429 PolarHBondContact SG-SG 3.02Å; C429-M431 PolarHBondContact O-N 3.09Å; C429-V436 PolarHBondContact N-O 2.94Å; C429-V436 PolarHBondContact O-N 3.46Å; C429-Y438 HydrophobicContact CB-CD2 3.72Å; C429-Y438 HydrophobicContact CB-CE2 4.01Å
430	Q	91.3	Very high	89.2	Confident	69 Å²	69	32.7 Å²	32.7	32%	0.322	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	116.9	177.4	-166.7	178.6	12.8	0	0	110.2	T364 W435	T364-Q430 PolarHBondContact O-N 2.8Å; Q430-W435 HydrophobicContact CB-CD2 4.49Å; Q430-W435 HydrophobicContact CB-CE3 4.28Å; Q430-W435 HydrophobicContact CB-CH2 3.92Å; Q430-W435 HydrophobicContact CB-CZ2 4.19Å; Q430-W435 HydrophobicContact CB-CZ3 3.98Å; Q430-W435 HydrophobicContact CG-CZ2 4.33Å
431	M	90.4	Very high	90.9	Very high	39 Å²	39	26.5 Å²	26.5	19%	0.192	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	117.9	-179.7	-60	-60.8	-71.2	0	0	108.6	P360 K363 C429 N433 V434 V436 Y438	P360-M431 HydrophobicContact CB-CE 4.11Å; P360-M431 HydrophobicContact CB-SD 3.74Å; P360-M431 HydrophobicContact CG-SD 4.33Å; K363-M431 HydrophobicContact CG-SD 4.26Å; C429-M431 PolarHBondContact O-N 3.09Å; M431-N433 VanDerWaalsContact C-N 3.26Å; M431-N433 PolarHBondContact O-N 3.37Å; M431-N433 VanDerWaalsContact O-N 3.11Å; M431-V434 PolarHBondContact N-O 2.9Å; M431-V434 WeakPolarHBondContact O-CG2 3.42Å; M431-V434 PolarHBondContact O-N 3.46Å; M431-V434 VanDerWaalsContact O-O 3.04Å; M431-V436 HydrophobicContact CB-CG2 3.92Å; M431-V436 HydrophobicContact CG-CB 4.26Å; M431-V436 HydrophobicContact CG-CG2 3.97Å; M431-Y438 HydrophobicContact CG-CE2 4.05Å
432	N	85.9	Confident	92.5	Very high	159 Å²	159	25.7 Å²	25.7	85%	0.85	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.4	46.5	176.4	-58.7	-28.5	0	0	0	113.7	V434	N432-V434 VanDerWaalsContact C-N 3.26Å; N432-V434 PolarHBondContact O-N 3.32Å
433	N	83.4	Confident	92.9	Very high	138 Å²	138	28 Å²	28	74%	0.738	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.4	10.2	-177.2	-59.9	-31.6	0	0	0	117.1	M431	M431-N433 VanDerWaalsContact C-N 3.26Å; M431-N433 PolarHBondContact O-N 3.37Å; M431-N433 VanDerWaalsContact O-N 3.11Å
434	V	91.9	Very high	92.4	Very high	45 Å²	45	28.5 Å²	28.5	27%	0.273	16%	0.155	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	151.7	168.4	-61.4	0	0	0	0	111.4	V211 M431 N432 V436	V211-V434 HydrophobicContact CG2-CG1 4.23Å; M431-V434 PolarHBondContact N-O 2.9Å; M431-V434 WeakPolarHBondContact O-CG2 3.42Å; M431-V434 PolarHBondContact O-N 3.46Å; M431-V434 VanDerWaalsContact O-O 3.04Å; N432-V434 VanDerWaalsContact C-N 3.26Å; N432-V434 PolarHBondContact O-N 3.32Å; V434-V436 HydrophobicContact CG2-CG2 4.19Å
435	W	94.9	Very high	91.4	Very high	13 Å²	13	34.3 Å²	34.3	5%	0.049	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	124.3	176.3	-68.2	89.5	0	0	0	110.9	G210 P216 W239 V350 C351 Y366 A428 Q430	G210-W435 VanDerWaalsContact CA-O 3.27Å; G210-W435 WeakPolarHBondContact CA-O 3.28Å; G210-W435 VanDerWaalsContact O-CD1 3.3Å; G210-W435 PolarHBondContact O-N 3.13Å; P216-W435 HydrophobicContact CG-CZ2 3.68Å; W239-W435 HydrophobicContact CH2-CB 3.37Å; W239-W435 AromaticContact CH2-CD1 3.39Å; W239-W435 HydrophobicContact CH2-CD2 4.1Å; W239-W435 AromaticContact CH2-CG 3.29Å; W239-W435 HydrophobicContact CH2-CG 3.29Å; W239-W435 HydrophobicContact CZ2-CB 3.64Å; W239-W435 HydrophobicContact CZ2-CD2 4.14Å; W239-W435 AromaticContact CZ2-CG 3.68Å; W239-W435 HydrophobicContact CZ2-CG 3.68Å; W239-W435 HydrophobicContact CZ3-CB 4Å; W239-W435 HydrophobicContact CZ3-CG 4.24Å; V350-W435 HydrophobicContact CG2-CB 4.4Å; V350-W435 WeakPolarHBondContact CG2-O 3.28Å; C351-W435 WeakPolarHBondContact CB-O 3.48Å; C351-W435 PolarHBondContact N-O 3.36Å; Y366-W435 AromaticContact CD2-CH2 3.33Å; Y366-W435 HydrophobicContact CD2-CH2 3.33Å; Y366-W435 HydrophobicContact CD2-CZ2 4.46Å; Y366-W435 AromaticContact CD2-CZ3 3.56Å; Y366-W435 HydrophobicContact CD2-CZ3 3.56Å; Y366-W435 AromaticContact CE2-CH2 3.65Å; Y366-W435 HydrophobicContact CE2-CH2 3.65Å; Y366-W435 HydrophobicContact CE2-CZ3 4.28Å; A428-W435 HydrophobicContact CB-CE3 3.99Å; A428-W435 WeakPolarHBondContact O-CZ3 3.41Å; Q430-W435 HydrophobicContact CB-CD2 4.49Å; Q430-W435 HydrophobicContact CB-CE3 4.28Å; Q430-W435 HydrophobicContact CB-CH2 3.92Å; Q430-W435 HydrophobicContact CB-CZ2 4.19Å; Q430-W435 HydrophobicContact CB-CZ3 3.98Å; Q430-W435 HydrophobicContact CG-CZ2 4.33Å
436	V	96.9	Very high	90.1	Very high	13 Å²	13	40.2 Å²	40.2	8%	0.079	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132.4	-176.4	-175.2	0	0	0	0	109.9	C351 P353 A428 C429 M431 V434 Y438	C351-V436 HydrophobicContact CB-CG2 4.09Å; C351-V436 WeakPolarHBondContact O-CA 3.25Å; P353-V436 HydrophobicContact CB-CG1 3.76Å; P353-V436 HydrophobicContact CG-CG1 4.39Å; A428-V436 CarbonylContact C-O 3.56Å; A428-V436 VanDerWaalsContact CA-O 3.31Å; A428-V436 WeakPolarHBondContact CA-O 3.48Å; C429-V436 PolarHBondContact N-O 2.94Å; C429-V436 PolarHBondContact O-N 3.46Å; M431-V436 HydrophobicContact CB-CG2 3.92Å; M431-V436 HydrophobicContact CG-CB 4.26Å; M431-V436 HydrophobicContact CG-CG2 3.97Å; V434-V436 HydrophobicContact CG2-CG2 4.19Å; V436-Y438 HydrophobicContact CB-CD2 4.22Å; V436-Y438 HydrophobicContact CB-CE2 3.69Å; V436-Y438 HydrophobicContact CG1-CD2 4.11Å; V436-Y438 HydrophobicContact CG1-CE2 3.59Å; V436-Y438 WeakPolarHBondContact O-CD2 3.43Å; V436-Y438 PolarHBondContact O-N 3.05Å
437	L	97.7	Very high	88.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	101.9	-175.9	-176.9	68.1	0	0	0	111.6	I260 L272 V350 C351 L352 P353 P426 G439 V459	I260-L437 HydrophobicContact CG2-CD2 4.38Å; L272-L437 HydrophobicContact CD2-CD2 3.69Å; V350-L437 HydrophobicContact CB-CB 4.42Å; V350-L437 HydrophobicContact CG1-CB 3.66Å; V350-L437 HydrophobicContact CG1-CD1 4.48Å; V350-L437 HydrophobicContact CG1-CD2 3.9Å; V350-L437 HydrophobicContact CG1-CG 4.23Å; V350-L437 HydrophobicContact CG2-CB 3.88Å; C351-L437 PolarHBondContact O-N 3.4Å; L352-L437 HydrophobicContact CD2-CD2 4.42Å; P353-L437 WeakPolarHBondContact CD-O 3.49Å; P353-L437 WeakPolarHBondContact CG-O 3.14Å; P426-L437 HydrophobicContact CB-CD1 3.46Å; P426-L437 VanDerWaalsContact CB-CD1 3.46Å; L437-G439 VanDerWaalsContact CD1-O 3.24Å; L437-G439 WeakPolarHBondContact CD1-O 3.49Å; L437-V459 HydrophobicContact CD2-CG2 4.45Å; L437-V459 HydrophobicContact CG-CG2 4.23Å; L437-V459 WeakPolarHBondContact O-CB 3.41Å; L437-V459 WeakPolarHBondContact O-CG1 3.33Å
438	Y	97.5	Very high	87	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-27.2	179.2	-77.5	-85.2	0	0	0	113.5	P353 L359 P360 I391 L407 L427 C429 M431 V436 V459 P460	P353-Y438 HydrophobicContact CB-CD1 4.21Å; P353-Y438 HydrophobicContact CB-CE1 3.8Å; P353-Y438 HydrophobicContact CG-CD1 4.47Å; L359-Y438 HydrophobicContact CD2-CD1 3.87Å; L359-Y438 HydrophobicContact CD2-CE1 4.49Å; P360-Y438 VanDerWaalsContact CD-CZ 3.48Å; P360-Y438 HydrophobicContact CG-CD1 4.08Å; P360-Y438 HydrophobicContact CG-CD2 3.8Å; P360-Y438 HydrophobicContact CG-CE1 3.86Å; P360-Y438 HydrophobicContact CG-CE2 3.53Å; P360-Y438 HydrophobicContact CG-CG 4.05Å; I391-Y438 HydrophobicContact CD1-CD1 4.48Å; I391-Y438 HydrophobicContact CD1-CG 4.1Å; L407-Y438 WeakPolarHBondContact CD2-O 3.45Å; L427-Y438 PolarHBondContact O-N 3.49Å; C429-Y438 HydrophobicContact CB-CD2 3.72Å; C429-Y438 HydrophobicContact CB-CE2 4.01Å; M431-Y438 HydrophobicContact CG-CE2 4.05Å; V436-Y438 HydrophobicContact CB-CD2 4.22Å; V436-Y438 HydrophobicContact CB-CE2 3.69Å; V436-Y438 HydrophobicContact CG1-CD2 4.11Å; V436-Y438 HydrophobicContact CG1-CE2 3.59Å; V436-Y438 WeakPolarHBondContact O-CD2 3.43Å; V436-Y438 PolarHBondContact O-N 3.05Å; Y438-V459 WeakPolarHBondContact O-CB 3.36Å; Y438-V459 PolarHBondContact O-N 2.87Å; Y438-P460 HydrophobicContact CD1-CG 3.75Å; Y438-P460 HydrophobicContact CE1-CG 4.24Å; Y438-P460 VanDerWaalsContact O-CD 3.31Å; Y438-P460 WeakPolarHBondContact O-CD 3.39Å
439	G	96.7	Very high	85.3	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	158	-177.3	0	0	0	0	0	114	L427 L437 T457	L427-G439 PolarHBondContact N-O 3.04Å; L427-G439 PolarHBondContact O-N 3.48Å; L437-G439 VanDerWaalsContact CD1-O 3.24Å; L437-G439 WeakPolarHBondContact CD1-O 3.49Å; G439-T457 VanDerWaalsContact CA-O 3.3Å; G439-T457 WeakPolarHBondContact CA-O 3.39Å
440	I	96.5	Very high	83.6	Confident	3 Å²	3	43.1 Å²	43.1	2%	0.015	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.1	167.6	-57.8	162.9	0	0	0	107	L272 A274 F332 G425 S442 Y456 T457 V459	L272-I440 HydrophobicContact CD1-CD1 4.39Å; L272-I440 HydrophobicContact CD2-CD1 3.72Å; L272-I440 HydrophobicContact CD2-CG1 4.24Å; L272-I440 HydrophobicContact CG-CD1 3.69Å; L272-I440 HydrophobicContact CG-CG1 4.43Å; A274-I440 HydrophobicContact CB-CG2 4.07Å; F332-I440 HydrophobicContact CB-CD1 3.71Å; G425-I440 WeakPolarHBondContact O-CA 3.32Å; I440-S442 PolarHBondContact O-N 2.87Å; I440-S442 VanDerWaalsContact O-N 3.15Å; I440-Y456 CarbonylContact O-C 3.5Å; I440-Y456 WeakPolarHBondContact O-CA 3.29Å; I440-Y456 WeakPolarHBondContact O-CB 3.35Å; I440-T457 PolarHBondContact N-O 3.38Å; I440-T457 PolarHBondContact O-N 3.3Å; I440-V459 HydrophobicContact CD1-CG2 3.95Å; I440-V459 HydrophobicContact CG1-CG2 3.66Å
441	V	94.3	Very high	82.4	Confident	6 Å²	6	44 Å²	44	4%	0.036	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.7	120.8	179.3	178.5	0	0	0	0	109.4	T367 A418 D422 G424 G425 Y456	T367-V441 HydrophobicContact CG2-CG2 3.42Å; T367-V441 VanDerWaalsContact CG2-CG2 3.42Å; A418-V441 HydrophobicContact CB-CG1 3.96Å; A418-V441 HydrophobicContact CB-CG2 4.02Å; D422-V441 HydrophobicContact CB-CG1 4.22Å; D422-V441 HydrophobicContact CB-CG2 4.38Å; D422-V441 VanDerWaalsContact O-CB 3.28Å; D422-V441 WeakPolarHBondContact O-CB 3.15Å; G424-V441 PolarHBondContact N-O 3.25Å; G425-V441 PolarHBondContact O-N 3.42Å; V441-Y456 HydrophobicContact CB-CD1 4.41Å; V441-Y456 HydrophobicContact CB-CE1 4.3Å; V441-Y456 HydrophobicContact CG2-CD1 4.02Å; V441-Y456 HydrophobicContact CG2-CE1 3.52Å
442	S	91.4	Very high	81.5	Confident	7 Å²	7	42.7 Å²	42.7	5%	0.049	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	-68.1	-175.8	-175.6	0	0	0	0	111.2	H276 D331 I440 V455	H276-S442 PolarHBondContact CE1-O 3.46Å; H276-S442 VanDerWaalsContact CE1-O 3.22Å; D331-S442 WeakPolarHBondContact OD2-CB 3.37Å; D331-S442 PolarHBondContact OD2-OG 2.9Å; I440-S442 PolarHBondContact O-N 2.87Å; I440-S442 VanDerWaalsContact O-N 3.15Å; S442-V455 WeakPolarHBondContact CB-O 3.36Å; S442-V455 PolarHBondContact N-O 2.91Å
443	W	84.6	Confident	81.3	Confident	65 Å²	65	35.7 Å²	35.7	25%	0.246	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	165.4	-178.2	63.4	-83.5	0	0	0	112.9	A328 R399 I401 V455	A328-W443 VanDerWaalsContact CB-CD1 3.48Å; A328-W443 HydrophobicContact CB-CG 4.38Å; R399-W443 HydrophobicContact CB-CH2 4.49Å; I401-W443 HydrophobicContact CG2-CH2 4.22Å; I401-W443 HydrophobicContact CG2-CZ2 3.85Å; W443-V455 HydrophobicContact CD2-CB 4.07Å; W443-V455 HydrophobicContact CD2-CG2 4.24Å; W443-V455 HydrophobicContact CE3-CG2 4.45Å; W443-V455 HydrophobicContact CG-CB 4.32Å; W443-V455 HydrophobicContact CH2-CG2 3.96Å; W443-V455 HydrophobicContact CZ2-CB 4.08Å; W443-V455 HydrophobicContact CZ2-CG1 4.09Å; W443-V455 HydrophobicContact CZ2-CG2 3.73Å; W443-V455 HydrophobicContact CZ3-CG2 4.32Å; W443-V455 PolarHBondContact N-O 3.31Å; W443-V455 VanDerWaalsContact N-O 3.12Å; W443-V455 WeakPolarHBondContact O-CA 3.32Å; W443-V455 WeakPolarHBondContact O-CB 3.47Å; W443-V455 PolarHBondContact O-N 3.44Å
444	G	77.1	Confident	81.5	Confident	36 Å²	36	29.3 Å²	29.3	37%	0.371	16%	0.158	S	C	.	.			trans	-155.5	163.5	174	0	0	0	0	0	110.5
445	R	70.7	Confident	81.5	Confident	122 Å²	122	27.5 Å²	27.5	46%	0.46	15%	0.147	S	C	.	.	S	Bend	trans	-69.4	-51.6	175.6	-69.9	-169.5	-172	-160.5	3.7	111.2	D398 R399	D398-R445 PolarHBondContact O-NH2 3.48Å; R399-R445 VanDerWaalsContact CG-NH2 3.32Å
446	E	66.5	Low	81.5	Confident	124 Å²	124	27 Å²	27	58%	0.579	15%	0.145	S	C	*	.	S	Bend	trans	-146.3	142.1	-172.4	-67.5	176.4	-166.6	0	0	107.9
447	C	66.2	Low	81.4	Confident	8 Å²	8	26.4 Å²	26.4	5%	0.054	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	136	172.6	-61.7	0	0	0	0	110.2	C419 F420 S449	C419-C447 WeakPolarHBondContact CA-SG 3.41Å; C419-C447 HydrophobicContact CB-CB 3.66Å; C419-C447 WeakPolarHBondContact CB-SG 3.42Å; C419-C447 WeakPolarHBondContact SG-CB 3.21Å; C419-C447 CovalentContact SG-SG 2.01Å; C419-C447 PolarHBondContact SG-SG 3.36Å; F420-C447 VanDerWaalsContact CD2-SG 3.57Å; C447-S449 PolarHBondContact O-N 3.37Å
448	A	61.1	Low	81.3	Confident	2 Å²	2	27.1 Å²	27.1	2%	0.017	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	35.6	176.3	0	0	0	0	0	114.1	N228 V375 R415 S417	N228-A448 WeakPolarHBondContact OD1-CB 3.32Å; V375-A448 HydrophobicContact CG2-CB 4.37Å; R415-A448 WeakPolarHBondContact CA-O 3.46Å; R415-A448 HydrophobicContact CB-CB 4.26Å; R415-A448 WeakPolarHBondContact CB-O 3.39Å; S417-A448 WeakPolarHBondContact OG-CA 3.28Å; S417-A448 PolarHBondContact OG-N 3.48Å
449	S	60.8	Low	81.2	Confident	13 Å²	13	27 Å²	27	9%	0.091	15%	0.145	C	C	.	.			trans	-64.6	127.5	168.7	177.4	0	0	0	0	109.3	C447 T451 S452	C447-S449 PolarHBondContact O-N 3.37Å; S449-T451 PolarHBondContact O-N 3.45Å; S449-T451 PolarHBondContact OG-N 2.71Å; S449-T451 PolarHBondContact OG-OG1 3.12Å; S449-S452 WeakPolarHBondContact OG-CB 3.4Å; S449-S452 PolarHBondContact OG-N 3.44Å; S449-S452 PolarHBondContact OG-OG 3.11Å
450	P	60.7	Low	81.2	Confident	42 Å²	42	27.7 Å²	27.7	27%	0.273	15%	0.149	S	C	.	.	S	Bend	trans	-68.4	-16.8	176.4	28.5	-33.2	0	0	0	112.5	G413 R415	G413-P450 PolarHBondContact N-O 3.21Å; R415-P450 HydrophobicContact CG-CB 4.25Å; R415-P450 HydrophobicContact CG-CG 4.48Å
451	T	64.9	Low	81.1	Confident	88 Å²	88	32 Å²	32	54%	0.54	17%	0.166	S	C	.	.	S	Bend	trans	-110.6	-28.2	-177.5	57.5	0	0	0	0	112.8	D398 S449 P453	D398-T451 VanDerWaalsContact OD1-O 3.06Å; S449-T451 PolarHBondContact O-N 3.45Å; S449-T451 PolarHBondContact OG-N 2.71Å; S449-T451 PolarHBondContact OG-OG1 3.12Å; T451-P453 WeakPolarHBondContact O-CD 3.39Å
452	S	71.2	Confident	81	Confident	11 Å²	11	31.8 Å²	31.8	8%	0.077	17%	0.165	C	C	.	.			trans	-102.4	108.3	-172.7	-52.9	0	0	0	0	112.2	D398 S449	D398-S452 WeakPolarHBondContact OD2-CA 3.34Å; D398-S452 WeakPolarHBondContact OD2-CB 3.22Å; D398-S452 PolarHBondContact OD2-OG 2.94Å; S449-S452 WeakPolarHBondContact OG-CB 3.4Å; S449-S452 PolarHBondContact OG-N 3.44Å; S449-S452 PolarHBondContact OG-OG 3.11Å
453	P	83.1	Confident	81.1	Confident	11 Å²	11	31.5 Å²	31.5	7%	0.071	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-67.6	160	174.2	30	-35.1	0	0	0	111.5	L392 C408 T451	L392-P453 HydrophobicContact CD1-CB 3.62Å; L392-P453 HydrophobicContact CD1-CG 3.96Å; C408-P453 HydrophobicContact CB-CB 4.02Å; C408-P453 HydrophobicContact CB-CG 3.95Å; T451-P453 WeakPolarHBondContact O-CD 3.39Å
454	V	87	Confident	81.5	Confident	5 Å²	5	33.8 Å²	33.8	3%	0.03	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	141.7	173.2	171	0	0	0	0	109.1	C408 A409 A418 Y456	C408-V454 WeakPolarHBondContact CA-O 3.22Å; A409-V454 PolarHBondContact N-O 3.19Å; A409-V454 PolarHBondContact O-N 2.92Å; A409-V454 VanDerWaalsContact O-N 3.08Å; A418-V454 HydrophobicContact CB-CG1 4.19Å; A418-V454 HydrophobicContact CB-CG2 4.31Å; V454-Y456 HydrophobicContact CB-CD2 4.4Å; V454-Y456 HydrophobicContact CB-CE2 3.61Å; V454-Y456 HydrophobicContact CG1-CD2 4.04Å; V454-Y456 HydrophobicContact CG1-CE1 4.44Å; V454-Y456 HydrophobicContact CG1-CE2 3.5Å; V454-Y456 VanDerWaalsContact O-CD2 3.25Å; V454-Y456 WeakPolarHBondContact O-CD2 3.43Å; V454-Y456 WeakPolarHBondContact O-CE2 3.34Å
455	V	91.5	Very high	82.2	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.042	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	130	175.9	-176.6	0	0	0	0	109.2	I401 M406 L407 S442 W443	I401-V455 HydrophobicContact CD1-CG1 4.21Å; I401-V455 HydrophobicContact CG2-CG1 4.32Å; I401-V455 HydrophobicContact CG2-CG2 4.07Å; M406-V455 HydrophobicContact CB-CG1 3.86Å; M406-V455 HydrophobicContact CG-CG1 4.14Å; M406-V455 HydrophobicContact SD-CG1 3.98Å; L407-V455 WeakPolarHBondContact O-CA 3.31Å; S442-V455 WeakPolarHBondContact CB-O 3.36Å; S442-V455 PolarHBondContact N-O 2.91Å; W443-V455 HydrophobicContact CD2-CB 4.07Å; W443-V455 HydrophobicContact CD2-CG2 4.24Å; W443-V455 HydrophobicContact CE3-CG2 4.45Å; W443-V455 HydrophobicContact CG-CB 4.32Å; W443-V455 HydrophobicContact CH2-CG2 3.96Å; W443-V455 HydrophobicContact CZ2-CB 4.08Å; W443-V455 HydrophobicContact CZ2-CG1 4.09Å; W443-V455 HydrophobicContact CZ2-CG2 3.73Å; W443-V455 HydrophobicContact CZ3-CG2 4.32Å; W443-V455 PolarHBondContact N-O 3.31Å; W443-V455 VanDerWaalsContact N-O 3.12Å; W443-V455 WeakPolarHBondContact O-CA 3.32Å; W443-V455 WeakPolarHBondContact O-CB 3.47Å; W443-V455 PolarHBondContact O-N 3.44Å
456	Y	94.4	Very high	83.2	Confident	1 Å²	1	29.1 Å²	29.1	0%	0.004	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	152.3	179.5	-60.7	-105.7	0	0	0	109.5	T367 M406 L407 A409 L427 I440 V441 V454 N458	T367-Y456 HydrophobicContact CG2-CE1 4.44Å; T367-Y456 VanDerWaalsContact OG1-CE1 3.3Å; T367-Y456 WeakPolarHBondContact OG1-CE1 3.47Å; T367-Y456 PolarHBondContact OG1-OH 2.86Å; M406-Y456 CarbonylContact C-O 3.58Å; M406-Y456 VanDerWaalsContact CA-O 3.26Å; M406-Y456 WeakPolarHBondContact CA-O 3.33Å; L407-Y456 HydrophobicContact CD1-CD2 4.08Å; L407-Y456 HydrophobicContact CD1-CG 4.16Å; L407-Y456 PolarHBondContact N-O 3.26Å; L407-Y456 PolarHBondContact O-N 2.97Å; A409-Y456 HydrophobicContact CB-CD2 3.99Å; A409-Y456 HydrophobicContact CB-CE2 3.61Å; L427-Y456 HydrophobicContact CB-CD1 3.68Å; L427-Y456 HydrophobicContact CB-CE1 3.67Å; L427-Y456 HydrophobicContact CB-CG 4.44Å; L427-Y456 HydrophobicContact CD1-CE1 4.18Å; L427-Y456 HydrophobicContact CD2-CD1 4.18Å; L427-Y456 HydrophobicContact CD2-CD2 4.26Å; L427-Y456 HydrophobicContact CD2-CE1 4.3Å; L427-Y456 HydrophobicContact CD2-CE2 4.41Å; L427-Y456 HydrophobicContact CD2-CG 4.16Å; L427-Y456 HydrophobicContact CG-CD1 4.43Å; L427-Y456 HydrophobicContact CG-CE1 4.27Å; I440-Y456 CarbonylContact O-C 3.5Å; I440-Y456 WeakPolarHBondContact O-CA 3.29Å; I440-Y456 WeakPolarHBondContact O-CB 3.35Å; V441-Y456 HydrophobicContact CB-CD1 4.41Å; V441-Y456 HydrophobicContact CB-CE1 4.3Å; V441-Y456 HydrophobicContact CG2-CD1 4.02Å; V441-Y456 HydrophobicContact CG2-CE1 3.52Å; V454-Y456 HydrophobicContact CB-CD2 4.4Å; V454-Y456 HydrophobicContact CB-CE2 3.61Å; V454-Y456 HydrophobicContact CG1-CD2 4.04Å; V454-Y456 HydrophobicContact CG1-CE1 4.44Å; V454-Y456 HydrophobicContact CG1-CE2 3.5Å; V454-Y456 VanDerWaalsContact O-CD2 3.25Å; V454-Y456 WeakPolarHBondContact O-CD2 3.43Å; V454-Y456 WeakPolarHBondContact O-CE2 3.34Å; Y456-N458 PolarHBondContact O-N 2.83Å
457	T	95.3	Very high	84.5	Confident	1 Å²	1	28.2 Å²	28.2	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.9	167.1	-57.6	0	0	0	0	109.6	D331 F332 G439 I440 V459 F462	D331-T457 PolarHBondContact O-OG1 3.29Å; F332-T457 HydrophobicContact CB-CG2 4.06Å; G439-T457 VanDerWaalsContact CA-O 3.3Å; G439-T457 WeakPolarHBondContact CA-O 3.39Å; I440-T457 PolarHBondContact N-O 3.38Å; I440-T457 PolarHBondContact O-N 3.3Å; T457-V459 PolarHBondContact O-N 3.43Å; T457-F462 HydrophobicContact CG2-CD2 3.64Å; T457-F462 HydrophobicContact CG2-CE2 3.32Å; T457-F462 HydrophobicContact CG2-CZ 4.21Å
458	N	95.5	Very high	85.6	Confident	15 Å²	15	35.7 Å²	35.7	8%	0.08	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	90.7	-177.6	-177.7	8.1	0	0	0	111.1	K404 T405 L407 Y456 P460 Y461 F462	K404-N458 PolarHBondContact O-ND2 3.38Å; T405-N458 PolarHBondContact O-N 3.45Å; L407-N458 HydrophobicContact CB-CB 4.5Å; L407-N458 HydrophobicContact CD2-CB 4.2Å; L407-N458 HydrophobicContact CG-CB 4.47Å; Y456-N458 PolarHBondContact O-N 2.83Å; N458-P460 WeakPolarHBondContact OD1-CD 3.48Å; N458-Y461 WeakPolarHBondContact O-CB 3.45Å; N458-Y461 PolarHBondContact O-N 3.42Å; N458-Y461 VanDerWaalsContact O-N 3.1Å; N458-F462 WeakPolarHBondContact O-CD2 3.45Å
459	V	96.5	Very high	87	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.006	18%	0.178	C	C	.	.	H	α-helix	trans	-55.3	-44.1	-174.8	176.1	0	0	0	0	113.3	L272 L352 P353 L437 Y438 I440 T457 Y461 F462 I463 I466	L272-V459 HydrophobicContact CD2-CG1 4.28Å; L272-V459 HydrophobicContact CD2-CG2 4.31Å; L352-V459 HydrophobicContact CD2-CG1 4.26Å; P353-V459 HydrophobicContact CG-CG1 4.22Å; L437-V459 HydrophobicContact CD2-CG2 4.45Å; L437-V459 HydrophobicContact CG-CG2 4.23Å; L437-V459 WeakPolarHBondContact O-CB 3.41Å; L437-V459 WeakPolarHBondContact O-CG1 3.33Å; Y438-V459 WeakPolarHBondContact O-CB 3.36Å; Y438-V459 PolarHBondContact O-N 2.87Å; I440-V459 HydrophobicContact CD1-CG2 3.95Å; I440-V459 HydrophobicContact CG1-CG2 3.66Å; T457-V459 PolarHBondContact O-N 3.43Å; V459-Y461 PolarHBondContact O-N 2.62Å; V459-Y461 VanDerWaalsContact O-N 3.16Å; V459-F462 PolarHBondContact O-N 2.96Å; V459-I463 HydrophobicContact CG1-CD1 3.92Å; V459-I463 PolarHBondContact O-N 3.21Å; V459-I466 HydrophobicContact CG1-CD1 4.26Å
460	P	95.7	Very high	88.3	Confident	13 Å²	13	36 Å²	36	8%	0.084	17%	0.174	C	C	.	.	H	α-helix	trans	-46.3	-42.7	173.5	-31.5	32.5	0	0	0	114.3	P353 P355 L359 Y438 N458 F462 I463	P353-P460 HydrophobicContact CB-CG 4.14Å; P353-P460 HydrophobicContact CG-CB 4.37Å; P353-P460 HydrophobicContact CG-CG 3.71Å; P355-P460 WeakPolarHBondContact CB-O 3.25Å; L359-P460 HydrophobicContact CD2-CG 3.92Å; Y438-P460 HydrophobicContact CD1-CG 3.75Å; Y438-P460 HydrophobicContact CE1-CG 4.24Å; Y438-P460 VanDerWaalsContact O-CD 3.31Å; Y438-P460 WeakPolarHBondContact O-CD 3.39Å; N458-P460 WeakPolarHBondContact OD1-CD 3.48Å; P460-F462 PolarHBondContact O-N 3.35Å; P460-I463 PolarHBondContact O-N 2.85Å
461	Y	94	Very high	89.5	Confident	95 Å²	95	37.2 Å²	37.2	37%	0.373	18%	0.178	S	C	.	.	H	α-helix	trans	-66.3	-25.3	179.7	-178.9	-98.8	0	0	0	113.4	K404 T405 N458 V459 R465	K404-Y461 HydrophobicContact CB-CD2 3.99Å; K404-Y461 HydrophobicContact CB-CE2 3.82Å; K404-Y461 HydrophobicContact CD-CE2 4.4Å; K404-Y461 WeakPolarHBondContact O-CB 3.28Å; T405-Y461 HydrophobicContact CG2-CD1 3.86Å; T405-Y461 HydrophobicContact CG2-CE1 3.57Å; N458-Y461 WeakPolarHBondContact O-CB 3.45Å; N458-Y461 PolarHBondContact O-N 3.42Å; N458-Y461 VanDerWaalsContact O-N 3.1Å; V459-Y461 PolarHBondContact O-N 2.62Å; V459-Y461 VanDerWaalsContact O-N 3.16Å; Y461-R465 PolarHBondContact OH-NH2 3.17Å
462	F	93.7	Very high	90.5	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	18%	0.179	C	C	.	.	H	α-helix	trans	-100.4	-1.7	-176	-64.1	-74	0	0	0	114.4	N330 F332 T405 T457 N458 V459 P460 D464 R465 I466	N330-F462 HydrophobicContact CB-CE1 4.2Å; N330-F462 HydrophobicContact CB-CZ 4.27Å; N330-F462 WeakPolarHBondContact OD1-CE1 3.4Å; F332-F462 HydrophobicContact CD1-CB 4.44Å; F332-F462 AromaticContact CD1-CD1 3.59Å; F332-F462 HydrophobicContact CD1-CD1 3.59Å; F332-F462 HydrophobicContact CD1-CD2 4.17Å; F332-F462 AromaticContact CD1-CE1 3.75Å; F332-F462 HydrophobicContact CD1-CE1 3.75Å; F332-F462 HydrophobicContact CD1-CE2 4.35Å; F332-F462 AromaticContact CD1-CG 3.8Å; F332-F462 HydrophobicContact CD1-CG 3.8Å; F332-F462 HydrophobicContact CD1-CZ 4.14Å; F332-F462 HydrophobicContact CE1-CB 4.34Å; F332-F462 AromaticContact CE1-CD1 3.14Å; F332-F462 HydrophobicContact CE1-CD1 3.14Å; F332-F462 AromaticContact CE1-CE1 3.4Å; F332-F462 HydrophobicContact CE1-CE1 3.4Å; F332-F462 VanDerWaalsContact CE1-CE1 3.4Å; F332-F462 AromaticContact CE1-CG 3.77Å; F332-F462 HydrophobicContact CE1-CG 3.77Å; F332-F462 HydrophobicContact CE1-CZ 4.24Å; F332-F462 HydrophobicContact CE2-CB 4.46Å; F332-F462 HydrophobicContact CG-CD1 4.48Å; F332-F462 HydrophobicContact CG-CG 4.33Å; F332-F462 HydrophobicContact CZ-CB 4.34Å; F332-F462 AromaticContact CZ-CD1 3.71Å; F332-F462 HydrophobicContact CZ-CD1 3.71Å; F332-F462 HydrophobicContact CZ-CE1 4.36Å; F332-F462 HydrophobicContact CZ-CG 4.23Å; T405-F462 HydrophobicContact CG2-CE1 4.44Å; T405-F462 HydrophobicContact CG2-CE2 4.45Å; T405-F462 HydrophobicContact CG2-CZ 3.71Å; T405-F462 WeakPolarHBondContact O-CE2 3.05Å; T457-F462 HydrophobicContact CG2-CD2 3.64Å; T457-F462 HydrophobicContact CG2-CE2 3.32Å; T457-F462 HydrophobicContact CG2-CZ 4.21Å; N458-F462 WeakPolarHBondContact O-CD2 3.45Å; V459-F462 PolarHBondContact O-N 2.96Å; P460-F462 PolarHBondContact O-N 3.35Å; F462-D464 VanDerWaalsContact C-N 3.33Å; F462-D464 PolarHBondContact O-N 3.49Å; F462-R465 WeakPolarHBondContact O-CA 3.42Å; F462-R465 WeakPolarHBondContact O-CB 3.33Å; F462-R465 PolarHBondContact O-N 2.7Å; F462-I466 HydrophobicContact CB-CD1 3.97Å; F462-I466 HydrophobicContact CB-CG1 4.28Å; F462-I466 WeakPolarHBondContact O-CG1 3.18Å; F462-I466 PolarHBondContact O-N 3.06Å
463	I	93.4	Very high	91.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-52.3	-47.2	-174.4	-69.4	-59.5	0	0	0	113	L352 P353 P355 V459 P460 R465 I466 R467	L352-I463 HydrophobicContact CB-CD1 3.82Å; L352-I463 HydrophobicContact CD1-CD1 4.29Å; L352-I463 HydrophobicContact CD2-CD1 4.21Å; L352-I463 HydrophobicContact CG-CD1 4.34Å; P353-I463 HydrophobicContact CG-CD1 4.11Å; P353-I463 HydrophobicContact CG-CG1 4.34Å; P355-I463 HydrophobicContact CB-CB 4.23Å; P355-I463 HydrophobicContact CB-CG1 4.48Å; P355-I463 HydrophobicContact CG-CB 4.26Å; P355-I463 HydrophobicContact CG-CG2 4.15Å; V459-I463 HydrophobicContact CG1-CD1 3.92Å; V459-I463 PolarHBondContact O-N 3.21Å; P460-I463 PolarHBondContact O-N 2.85Å; I463-R465 VanDerWaalsContact C-N 3.29Å; I463-R465 PolarHBondContact O-N 3.32Å; I463-I466 PolarHBondContact O-N 2.87Å; I463-R467 HydrophobicContact CG2-CG 4.31Å; I463-R467 VanDerWaalsContact CG2-CZ 3.46Å; I463-R467 WeakPolarHBondContact O-CB 3.21Å; I463-R467 WeakPolarHBondContact O-CG 3.48Å; I463-R467 PolarHBondContact O-N 3.33Å
464	D	91.8	Very high	90.6	Very high	113 Å²	113	42.8 Å²	42.8	60%	0.604	19%	0.188	S	C	*	.	H	α-helix	trans	-64.7	-35.7	-179.2	-69.7	-22.1	0	0	0	112.2	F462 K468	F462-D464 VanDerWaalsContact C-N 3.33Å; F462-D464 PolarHBondContact O-N 3.49Å; D464-K468 VanDerWaalsContact O-CB 3.28Å; D464-K468 WeakPolarHBondContact O-CB 3.38Å; D464-K468 PolarHBondContact O-N 2.98Å
465	R	91.2	Very high	89.6	Confident	60 Å²	60	45.8 Å²	45.8	23%	0.226	21%	0.214	C	C	.	.	H	α-helix	trans	-70.8	-42.9	175.7	-58	-171.8	-159.3	166.9	4	111.1	N321 N330 F332 Y461 F462 I463 K468 I469	N321-R465 VanDerWaalsContact CB-NH1 3.25Å; N330-R465 PolarHBondContact OD1-NH1 2.87Å; F332-R465 HydrophobicContact CZ-CB 4.25Å; Y461-R465 PolarHBondContact OH-NH2 3.17Å; F462-R465 WeakPolarHBondContact O-CA 3.42Å; F462-R465 WeakPolarHBondContact O-CB 3.33Å; F462-R465 PolarHBondContact O-N 2.7Å; I463-R465 VanDerWaalsContact C-N 3.29Å; I463-R465 PolarHBondContact O-N 3.32Å; R465-K468 PolarHBondContact O-N 3.36Å; R465-I469 WeakPolarHBondContact O-CB 3.29Å; R465-I469 VanDerWaalsContact O-CG1 3.29Å; R465-I469 WeakPolarHBondContact O-CG1 3.42Å; R465-I469 PolarHBondContact O-N 3.41Å
466	I	93.3	Very high	87.8	Confident	1 Å²	1	51.6 Å²	51.6	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-59.7	-47.5	176.3	-67	164.3	0	0	0	109.8	I260 L262 L272 F332 V334 L352 V459 F462 I463 I469 G470	I260-I466 HydrophobicContact CD1-CG2 3.86Å; L262-I466 HydrophobicContact CD2-CG2 4.17Å; L272-I466 HydrophobicContact CD1-CD1 3.89Å; L272-I466 HydrophobicContact CD1-CG1 4.01Å; L272-I466 HydrophobicContact CD1-CG2 4.49Å; L272-I466 HydrophobicContact CD2-CD1 3.87Å; F332-I466 HydrophobicContact CD2-CG1 4.14Å; F332-I466 HydrophobicContact CE2-CG1 4.02Å; V334-I466 HydrophobicContact CG2-CB 4.41Å; V334-I466 HydrophobicContact CG2-CG1 4.21Å; V334-I466 HydrophobicContact CG2-CG2 4.15Å; L352-I466 HydrophobicContact CD1-CG2 4.28Å; V459-I466 HydrophobicContact CG1-CD1 4.26Å; F462-I466 HydrophobicContact CB-CD1 3.97Å; F462-I466 HydrophobicContact CB-CG1 4.28Å; F462-I466 WeakPolarHBondContact O-CG1 3.18Å; F462-I466 PolarHBondContact O-N 3.06Å; I463-I466 PolarHBondContact O-N 2.87Å; I466-I469 PolarHBondContact O-N 3.21Å; I466-G470 PolarHBondContact O-N 3.18Å
467	R	92.4	Very high	85.7	Confident	104 Å²	104	55.3 Å²	55.3	39%	0.392	27%	0.266	S	S	.	.	H	α-helix	trans	-60.4	-46.7	175.6	-75.1	174.8	176	162.7	0	111.7	L262 I463 I469 G470 N471	L262-R467 HydrophobicContact CD2-CG 4.16Å; I463-R467 HydrophobicContact CG2-CG 4.31Å; I463-R467 VanDerWaalsContact CG2-CZ 3.46Å; I463-R467 WeakPolarHBondContact O-CB 3.21Å; I463-R467 WeakPolarHBondContact O-CG 3.48Å; I463-R467 PolarHBondContact O-N 3.33Å; R467-I469 VanDerWaalsContact C-N 3.34Å; R467-I469 PolarHBondContact O-N 2.74Å; R467-G470 PolarHBondContact O-N 2.89Å; R467-N471 WeakPolarHBondContact O-CB 3.24Å; R467-N471 PolarHBondContact O-N 3.1Å; R467-N471 PolarHBondContact O-ND2 2.87Å
468	K	90.5	Very high	83	Confident	166 Å²	166	62.3 Å²	62.3	72%	0.722	30%	0.302	S	S	*	.	H	α-helix	trans	-59.1	-43.9	177.2	-175.1	174.8	-178.2	173.2	0	112.1	D464 R465 R472	D464-K468 VanDerWaalsContact O-CB 3.28Å; D464-K468 WeakPolarHBondContact O-CB 3.38Å; D464-K468 PolarHBondContact O-N 2.98Å; R465-K468 PolarHBondContact O-N 3.36Å; K468-R472 PolarHBondContact O-N 3.37Å; K468-R472 VanDerWaalsContact O-N 3.15Å
469	I	90.5	Very high	80	Confident	20 Å²	20	72.3 Å²	72.3	10%	0.103	35%	0.354	C	S	.	.	H	α-helix	trans	-62.3	-53.6	177.5	-73.1	164.8	0	0	0	110.8	L315 F332 V334 R465 I466 R467 N471 R472 W473	L315-I469 HydrophobicContact CB-CD1 3.99Å; L315-I469 HydrophobicContact CB-CG1 4.07Å; L315-I469 HydrophobicContact CB-CG2 3.83Å; L315-I469 HydrophobicContact CD1-CG1 4.4Å; L315-I469 HydrophobicContact CD1-CG2 4.06Å; L315-I469 HydrophobicContact CG-CG2 4.49Å; F332-I469 HydrophobicContact CE2-CD1 4.25Å; V334-I469 HydrophobicContact CB-CG2 3.74Å; V334-I469 HydrophobicContact CG1-CG2 4.17Å; V334-I469 HydrophobicContact CG2-CB 4.25Å; V334-I469 HydrophobicContact CG2-CD1 4.03Å; V334-I469 HydrophobicContact CG2-CG2 3.92Å; R465-I469 WeakPolarHBondContact O-CB 3.29Å; R465-I469 VanDerWaalsContact O-CG1 3.29Å; R465-I469 WeakPolarHBondContact O-CG1 3.42Å; R465-I469 PolarHBondContact O-N 3.41Å; I466-I469 PolarHBondContact O-N 3.21Å; R467-I469 VanDerWaalsContact C-N 3.34Å; R467-I469 PolarHBondContact O-N 2.74Å; I469-N471 PolarHBondContact O-N 2.9Å; I469-R472 WeakPolarHBondContact O-CB 3.11Å; I469-R472 PolarHBondContact O-N 3.2Å; I469-W473 HydrophobicContact CG2-CD2 4.42Å; I469-W473 HydrophobicContact CG2-CE3 3.92Å; I469-W473 HydrophobicContact CG2-CH2 3.65Å; I469-W473 HydrophobicContact CG2-CZ2 4.22Å; I469-W473 HydrophobicContact CG2-CZ3 3.5Å; I469-W473 PolarHBondContact O-N 3.49Å
470	G	86.8	Confident	79.1	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-69.4	-35.3	-176.6	0	0	0	0	0	113.3	L262 I466 R467 R472 W473 Q474	L262-G470 VanDerWaalsContact CD1-CA 3.5Å; I466-G470 PolarHBondContact O-N 3.18Å; R467-G470 PolarHBondContact O-N 2.89Å; G470-R472 VanDerWaalsContact C-N 3.33Å; G470-R472 PolarHBondContact O-N 3.36Å; G470-W473 PolarHBondContact O-N 2.63Å; G470-Q474 WeakPolarHBondContact O-CG 3.48Å; G470-Q474 PolarHBondContact O-N 2.7Å; G470-Q474 VanDerWaalsContact O-N 3.07Å
471	N	86.4	Confident	78.3	Confident	68 Å²	68	79.2 Å²	79.2	36%	0.364	39%	0.387	S	S	.	.	H	α-helix	trans	-62.8	-39.2	174.6	-74.9	-22.4	0	0	0	111.9	R467 I469 W473 Q474 A475	R467-N471 WeakPolarHBondContact O-CB 3.24Å; R467-N471 PolarHBondContact O-N 3.1Å; R467-N471 PolarHBondContact O-ND2 2.87Å; I469-N471 PolarHBondContact O-N 2.9Å; N471-W473 VanDerWaalsContact C-N 3.26Å; N471-W473 PolarHBondContact O-N 3.41Å; N471-Q474 PolarHBondContact O-N 3.02Å; N471-A475 PolarHBondContact O-N 3.19Å
472	R	86.6	Confident	77.4	Confident	151 Å²	151	78.3 Å²	78.3	57%	0.57	39%	0.387	S	S	*	.	H	α-helix	trans	-56.6	-42.9	174.3	-175.8	-179.5	-179.1	-179.7	0.7	111.2	K468 I469 G470 H476	K468-R472 PolarHBondContact O-N 3.37Å; K468-R472 VanDerWaalsContact O-N 3.15Å; I469-R472 WeakPolarHBondContact O-CB 3.11Å; I469-R472 PolarHBondContact O-N 3.2Å; G470-R472 VanDerWaalsContact C-N 3.33Å; G470-R472 PolarHBondContact O-N 3.36Å; R472-H476 PolarHBondContact O-CD2 2.95Å
473	W	84.4	Confident	76.4	Confident	26 Å²	26	82.8 Å²	82.8	10%	0.098	41%	0.41	C	S	.	.	H	α-helix	trans	-77	-21.2	-179.4	-73.2	-32.2	0	0	0	115.6	L270 S313 L315 V334 K336 I469 G470 N471 S477	L270-W473 HydrophobicContact CD2-CE3 3.82Å; L270-W473 HydrophobicContact CD2-CZ3 4.14Å; S313-W473 WeakPolarHBondContact OG-CZ2 2.91Å; S313-W473 PolarHBondContact OG-NE1 2.73Å; L315-W473 HydrophobicContact CB-CH2 4.11Å; L315-W473 HydrophobicContact CB-CZ2 4.07Å; L315-W473 HydrophobicContact CD1-CH2 4.4Å; L315-W473 HydrophobicContact CD1-CZ2 3.69Å; L315-W473 HydrophobicContact CG-CH2 4.16Å; L315-W473 HydrophobicContact CG-CZ2 3.59Å; V334-W473 HydrophobicContact CB-CH2 4.38Å; V334-W473 HydrophobicContact CB-CZ3 4.05Å; V334-W473 HydrophobicContact CG1-CZ3 3.77Å; V334-W473 VanDerWaalsContact O-CH2 3.29Å; V334-W473 WeakPolarHBondContact O-CH2 3.45Å; K336-W473 HydrophobicContact CB-CD2 4.03Å; K336-W473 HydrophobicContact CB-CE3 3.75Å; K336-W473 HydrophobicContact CB-CH2 4.21Å; K336-W473 HydrophobicContact CB-CZ2 4.43Å; K336-W473 HydrophobicContact CB-CZ3 3.85Å; K336-W473 HydrophobicContact CD-CB 3.86Å; K336-W473 HydrophobicContact CD-CD2 4.04Å; K336-W473 HydrophobicContact CD-CE3 4.39Å; K336-W473 HydrophobicContact CD-CG 3.82Å; K336-W473 HydrophobicContact CG-CD2 4.44Å; K336-W473 HydrophobicContact CG-CE3 4.31Å; K336-W473 PolarHBondContact NZ-O 2.82Å; I469-W473 HydrophobicContact CG2-CD2 4.42Å; I469-W473 HydrophobicContact CG2-CE3 3.92Å; I469-W473 HydrophobicContact CG2-CH2 3.65Å; I469-W473 HydrophobicContact CG2-CZ2 4.22Å; I469-W473 HydrophobicContact CG2-CZ3 3.5Å; I469-W473 PolarHBondContact O-N 3.49Å; G470-W473 PolarHBondContact O-N 2.63Å; N471-W473 VanDerWaalsContact C-N 3.26Å; N471-W473 PolarHBondContact O-N 3.41Å; W473-S477 PolarHBondContact O-OG 3.09Å
474	Q	71.8	Confident	75.4	Confident	51 Å²	51	88 Å²	88	24%	0.238	44%	0.435	C	S	.	.	H	α-helix	trans	-83.3	-31.4	174.2	-71.3	-177.8	-15.5	0	0	112	K263 G470 N471 H476 S477	K263-Q474 VanDerWaalsContact CD-OE1 3.22Å; G470-Q474 WeakPolarHBondContact O-CG 3.48Å; G470-Q474 PolarHBondContact O-N 2.7Å; G470-Q474 VanDerWaalsContact O-N 3.07Å; N471-Q474 PolarHBondContact O-N 3.02Å; Q474-H476 VanDerWaalsContact C-N 3.3Å; Q474-H476 PolarHBondContact O-N 2.66Å; Q474-S477 PolarHBondContact O-N 3.03Å
475	A	65.6	Low	74.3	Confident	68 Å²	68	86.3 Å²	86.3	56%	0.562	42%	0.424	S	S	*	.	H	α-helix	trans	-67	-29.5	177	0	0	0	0	0	113	N471 S477	N471-A475 PolarHBondContact O-N 3.19Å; A475-S477 VanDerWaalsContact C-N 3.29Å; A475-S477 PolarHBondContact O-N 3.36Å
476	H	54.6	Low	73.1	Confident	128 Å²	128	88.2 Å²	88.2	59%	0.593	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	13.6	178.5	-67.5	-61.1	0	0	0	114.6	R472 Q474	R472-H476 PolarHBondContact O-CD2 2.95Å; Q474-H476 VanDerWaalsContact C-N 3.3Å; Q474-H476 PolarHBondContact O-N 2.66Å
477	S	49.4	Very low	71.5	Confident	79 Å²	79	94.9 Å²	94.9	55%	0.552	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.8	14.7	177.1	-62.2	0	0	0	0	113.1	W473 Q474 A475	W473-S477 PolarHBondContact O-OG 3.09Å; Q474-S477 PolarHBondContact O-N 3.03Å; A475-S477 VanDerWaalsContact C-N 3.29Å; A475-S477 PolarHBondContact O-N 3.36Å
478	I	39.4	Very low	69.8	Low	148 Å²	148	94.2 Å²	94.2	76%	0.759	48%	0.478	S	S	*	.			trans	-121.6	18.4	-179.1	-51.1	177.9	0	0	0	111.4
479	L	31.2	Very low	67.9	Low	225 Å²	225	87.6 Å²	87.6	100%	1.178	46%	0.456	S	S	*	.			trans	-128.1	0	164.4	-70.9	168.4	0	0	0	107.2

Retrieved 479 of 479 residues in 134.4 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).