A0A077ZD90_TRITR Loading...

C2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZD90, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 529 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.4	Very low	39	Very low	231 Å²	231	170.1 Å²	170.1	100%	1.138	86%	0.861	S	S	*	*				0	92.8	0	-74	172.2	165.3	0	0	105.9
2	T	35.7	Very low	39	Very low	131 Å²	131	164.6 Å²	164.6	80%	0.804	86%	0.861	S	S	*	*				58.2	108.6	97.4	-17.2	0	0	0	0	108.4
3	E	39.4	Very low	39.7	Very low	183 Å²	183	156.7 Å²	156.7	86%	0.855	83%	0.828	S	S	*	*				-156.4	133.5	72.2	-77.8	163.9	169.7	0	0	111.2
4	R	34	Very low	40.6	Very low	242 Å²	242	152.1 Å²	152.1	91%	0.913	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-88.9	126.3	161.3	-78.1	-179.3	-179.2	172.3	-0.2	107.6
5	P	38.7	Very low	41.4	Very low	123 Å²	123	148.1 Å²	148.1	80%	0.799	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-88.5	143.2	162.7	20.5	-5.8	0	0	0	110.7
6	F	36.6	Very low	43.5	Very low	202 Å²	202	146.3 Å²	146.3	89%	0.886	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-58.5	138.6	-171.5	-84.3	-114.6	0	0	0	114.5
7	L	38.6	Very low	45.5	Very low	172 Å²	172	141.2 Å²	141.2	90%	0.901	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-80.7	117.8	159.1	-79.3	161.4	0	0	0	108.7
8	Q	40	Very low	47.4	Very low	181 Å²	181	134.6 Å²	134.6	85%	0.846	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-78.6	136	157.8	-87.5	-178.7	-26	0	0	108.8
9	P	40.2	Very low	49.3	Very low	125 Å²	125	134.4 Å²	134.4	81%	0.812	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-81.2	120.2	173.8	29.3	-24.6	0	0	0	109.9	S11	P9-S11 PolarHBondContact O-N 3.37Å
10	E	41.5	Very low	51.2	Low	194 Å²	194	130.7 Å²	130.7	91%	0.907	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-68.6	118.3	167.7	-74.6	-179.2	152.4	0	0	109.6	A12	E10-A12 PolarHBondContact O-N 2.96Å
11	S	42.1	Very low	53	Low	87 Å²	87	124.9 Å²	124.9	61%	0.608	66%	0.661	S	S	*	*			trans	-66.3	108	174.6	52.1	0	0	0	0	111.1	P9	P9-S11 PolarHBondContact O-N 3.37Å
12	A	39.3	Very low	55.1	Low	104 Å²	104	116.6 Å²	116.6	86%	0.86	62%	0.617	S	S	*	*			trans	-87	102	170.9	0	0	0	0	0	110.2	E10	E10-A12 PolarHBondContact O-N 2.96Å
13	S	47.6	Very low	57.7	Low	62 Å²	62	115 Å²	115	43%	0.434	60%	0.597	S	S	.	*			trans	-120.2	83.1	174.8	54.4	0	0	0	0	112.7	P15	S13-P15 WeakPolarHBondContact O-CD 2.93Å; S13-P15 VanDerWaalsContact O-N 3.09Å
14	D	52.3	Low	60.2	Low	92 Å²	92	106.3 Å²	106.3	49%	0.492	56%	0.557	S	S	.	*			trans	26.6	62.6	141.7	-152.7	5.6	0	0	0	119.3	D16 L17	D14-D16 VanDerWaalsContact C-N 3.32Å; D14-L17 VanDerWaalsContact OD1-CB 3.25Å; D14-L17 WeakPolarHBondContact OD1-CB 3.46Å; D14-L17 PolarHBondContact OD1-N 3.23Å
15	P	52.3	Low	63	Low	92 Å²	92	95 Å²	95	60%	0.597	52%	0.515	S	S	*	.	S	Bend	trans	-75.5	-22.4	171.7	31.1	-31.1	0	0	0	112.6	S13	S13-P15 WeakPolarHBondContact O-CD 2.93Å; S13-P15 VanDerWaalsContact O-N 3.09Å
16	D	75	Confident	65.5	Low	119 Å²	119	92 Å²	92	64%	0.636	50%	0.496	S	S	*	.	H	α-helix	trans	-74.7	-40.7	-170.5	-153.4	3.1	0	0	0	111.9	D14 V18 E19 E20	D14-D16 VanDerWaalsContact C-N 3.32Å; D16-V18 VanDerWaalsContact C-N 3.31Å; D16-V18 PolarHBondContact O-N 2.73Å; D16-E19 PolarHBondContact O-N 3.33Å; D16-E20 WeakPolarHBondContact O-CB 3.33Å; D16-E20 PolarHBondContact O-N 2.79Å
17	L	78.7	Confident	68.1	Low	60 Å²	60	85.1 Å²	85.1	31%	0.314	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-34.2	-178.3	-171.6	68.8	0	0	0	112.9	D14 T21 L150	D14-L17 VanDerWaalsContact OD1-CB 3.25Å; D14-L17 WeakPolarHBondContact OD1-CB 3.46Å; D14-L17 PolarHBondContact OD1-N 3.23Å; L17-T21 VanDerWaalsContact O-CB 3.28Å; L17-T21 WeakPolarHBondContact O-CB 3.45Å; L17-T21 PolarHBondContact O-N 3.38Å; L17-T21 PolarHBondContact O-OG1 3.34Å; L17-L150 HydrophobicContact CD1-CD1 4.14Å
18	V	78.4	Confident	70.7	Confident	23 Å²	23	77 Å²	77	14%	0.139	43%	0.425	C	S	.	.	H	α-helix	trans	-72.5	-44.2	-178.3	-177	0	0	0	0	110.9	D16 E20 T21 W22 M299	D16-V18 VanDerWaalsContact C-N 3.31Å; D16-V18 PolarHBondContact O-N 2.73Å; V18-E20 VanDerWaalsContact C-N 3.34Å; V18-T21 PolarHBondContact O-N 3.05Å; V18-W22 PolarHBondContact O-N 2.81Å; V18-M299 HydrophobicContact CB-CE 4.49Å; V18-M299 HydrophobicContact CG1-CE 3.24Å; V18-M299 HydrophobicContact CG1-CG 4.22Å; V18-M299 HydrophobicContact CG1-SD 4.04Å
19	E	84.3	Confident	73	Confident	131 Å²	131	70.4 Å²	70.4	61%	0.612	40%	0.397	S	S	*	.	H	α-helix	trans	-64.4	-40.6	175	-69.9	-170.3	175.1	0	0	111.3	D16 W22 Y23	D16-E19 PolarHBondContact O-N 3.33Å; E19-W22 PolarHBondContact O-N 2.95Å; E19-Y23 WeakPolarHBondContact O-CB 3.27Å; E19-Y23 PolarHBondContact O-N 3.25Å
20	E	86.5	Confident	75.5	Confident	60 Å²	60	66 Å²	66	28%	0.28	37%	0.365	S	S	.	.	H	α-helix	trans	-62.1	-45.7	173.7	178.6	166	-145.3	0	0	112	D16 V18 W22 Y23 L24 R188	D16-E20 WeakPolarHBondContact O-CB 3.33Å; D16-E20 PolarHBondContact O-N 2.79Å; V18-E20 VanDerWaalsContact C-N 3.34Å; E20-W22 VanDerWaalsContact C-N 3.31Å; E20-W22 PolarHBondContact O-N 3.44Å; E20-Y23 PolarHBondContact O-N 3.25Å; E20-L24 HydrophobicContact CG-CD1 3.93Å; E20-L24 HydrophobicContact CG-CG 4.34Å; E20-L24 WeakPolarHBondContact O-CB 3.49Å; E20-L24 WeakPolarHBondContact O-CG 3.4Å; E20-L24 PolarHBondContact O-N 3.2Å; E20-R188 IonicContact OE1-CZ 2.85Å; E20-R188 IonicContact OE1-NE 3.6Å; E20-R188 IonicContact OE1-NH1 2.72Å; E20-R188 PolarHBondContact OE1-NH1 3.33Å
21	T	88.6	Confident	77.9	Confident	9 Å²	9	56.8 Å²	56.8	6%	0.055	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-45.5	177.9	-61.6	0	0	0	0	110.5	L17 V18 L24 L25 L148 F152	L17-T21 VanDerWaalsContact O-CB 3.28Å; L17-T21 WeakPolarHBondContact O-CB 3.45Å; L17-T21 PolarHBondContact O-N 3.38Å; L17-T21 PolarHBondContact O-OG1 3.34Å; V18-T21 PolarHBondContact O-N 3.05Å; T21-L24 PolarHBondContact O-N 2.95Å; T21-L25 HydrophobicContact CG2-CD1 4.09Å; T21-L25 WeakPolarHBondContact O-CB 3.38Å; T21-L25 WeakPolarHBondContact O-CG 3.49Å; T21-L25 PolarHBondContact O-N 2.76Å; T21-L148 WeakPolarHBondContact CG2-O 3.26Å; T21-F152 HydrophobicContact CG2-CE1 3.84Å; T21-F152 HydrophobicContact CG2-CZ 4.01Å
22	W	87.3	Confident	80.4	Confident	56 Å²	56	57 Å²	57	21%	0.212	31%	0.312	C	S	.	.	H	α-helix	trans	-61.9	-45.9	176.3	-173	-87	0	0	0	112.1	V18 E19 E20 L24 L25 S26 T108 M111 L300 R303	V18-W22 PolarHBondContact O-N 2.81Å; E19-W22 PolarHBondContact O-N 2.95Å; E20-W22 VanDerWaalsContact C-N 3.31Å; E20-W22 PolarHBondContact O-N 3.44Å; W22-L24 VanDerWaalsContact C-N 3.35Å; W22-L24 PolarHBondContact O-N 2.95Å; W22-L25 PolarHBondContact O-N 3.08Å; W22-S26 PolarHBondContact O-N 3.03Å; W22-T108 HydrophobicContact CH2-CG2 4.21Å; W22-M111 HydrophobicContact CD2-CE 4.26Å; W22-M111 HydrophobicContact CE3-CE 3.91Å; W22-M111 HydrophobicContact CE3-SD 4.23Å; W22-M111 HydrophobicContact CH2-CE 3.13Å; W22-M111 HydrophobicContact CH2-SD 4.34Å; W22-M111 HydrophobicContact CZ2-CE 3.48Å; W22-M111 VanDerWaalsContact CZ2-CE 3.48Å; W22-M111 HydrophobicContact CZ3-CE 3.36Å; W22-M111 HydrophobicContact CZ3-SD 3.98Å; W22-L300 HydrophobicContact CH2-CD2 4.26Å; W22-L300 HydrophobicContact CZ3-CD2 3.65Å; W22-R303 VanDerWaalsContact CZ2-NH1 3.29Å; W22-R303 VanDerWaalsContact NE1-NH1 3.14Å
23	Y	90.1	Very high	83	Confident	97 Å²	97	52.2 Å²	52.2	38%	0.38	27%	0.271	S	S	.	.	H	α-helix	trans	-58.5	-47.7	177.5	175.3	-100.8	0	0	0	110.9	E19 E20 S26 Q27 I184	E19-Y23 WeakPolarHBondContact O-CB 3.27Å; E19-Y23 PolarHBondContact O-N 3.25Å; E20-Y23 PolarHBondContact O-N 3.25Å; Y23-S26 WeakPolarHBondContact O-CB 2.95Å; Y23-S26 PolarHBondContact O-N 2.66Å; Y23-S26 PolarHBondContact O-OG 2.72Å; Y23-Q27 WeakPolarHBondContact O-CG 2.92Å; Y23-Q27 PolarHBondContact O-N 3.22Å; Y23-I184 HydrophobicContact CE1-CG2 4.36Å
24	L	92.4	Very high	85.2	Confident	2 Å²	2	52 Å²	52	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-41.6	178.3	-71.3	172.3	0	0	0	112.6	E20 T21 W22 S26 Q27 V28 L150 F152 F185 R188 V189	E20-L24 HydrophobicContact CG-CD1 3.93Å; E20-L24 HydrophobicContact CG-CG 4.34Å; E20-L24 WeakPolarHBondContact O-CB 3.49Å; E20-L24 WeakPolarHBondContact O-CG 3.4Å; E20-L24 PolarHBondContact O-N 3.2Å; T21-L24 PolarHBondContact O-N 2.95Å; W22-L24 VanDerWaalsContact C-N 3.35Å; W22-L24 PolarHBondContact O-N 2.95Å; L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 2.85Å; L24-Q27 WeakPolarHBondContact O-CB 3.16Å; L24-Q27 PolarHBondContact O-N 3.11Å; L24-V28 PolarHBondContact O-N 3.27Å; L24-L150 HydrophobicContact CD1-CD1 4.42Å; L24-L150 HydrophobicContact CD1-CD2 3.86Å; L24-F152 HydrophobicContact CB-CE2 3.75Å; L24-F152 HydrophobicContact CB-CZ 3.97Å; L24-F152 HydrophobicContact CD1-CE2 4.31Å; L24-F185 HydrophobicContact CB-CD2 4.25Å; L24-F185 HydrophobicContact CB-CE2 4.42Å; L24-F185 HydrophobicContact CD2-CD2 4.17Å; L24-F185 WeakPolarHBondContact O-CD2 3.29Å; L24-R188 HydrophobicContact CD2-CB 4.25Å; L24-V189 HydrophobicContact CD1-CG2 4.23Å; L24-V189 HydrophobicContact CD2-CG2 4.49Å
25	L	92.9	Very high	87.2	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.026	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-39.3	175	-77	171.6	0	0	0	111.7	T21 W22 Q27 V28 V106 M111 L148 F152 L178	T21-L25 HydrophobicContact CG2-CD1 4.09Å; T21-L25 WeakPolarHBondContact O-CB 3.38Å; T21-L25 WeakPolarHBondContact O-CG 3.49Å; T21-L25 PolarHBondContact O-N 2.76Å; W22-L25 PolarHBondContact O-N 3.08Å; L25-Q27 PolarHBondContact O-N 3.24Å; L25-Q27 VanDerWaalsContact O-N 3.16Å; L25-V28 HydrophobicContact CD2-CG2 4.5Å; L25-V28 WeakPolarHBondContact O-CB 3.22Å; L25-V28 PolarHBondContact O-N 2.9Å; L25-V106 HydrophobicContact CB-CG1 4.4Å; L25-V106 WeakPolarHBondContact O-CB 3.3Å; L25-M111 HydrophobicContact CB-SD 4.23Å; L25-M111 HydrophobicContact CD1-SD 3.83Å; L25-L148 HydrophobicContact CD1-CD2 4.42Å; L25-L148 HydrophobicContact CD2-CD2 4.45Å; L25-F152 HydrophobicContact CD1-CE1 4.22Å; L25-F152 HydrophobicContact CD2-CD1 3.79Å; L25-F152 HydrophobicContact CD2-CE1 3.55Å; L25-F152 HydrophobicContact CD2-CG 4.45Å; L25-F152 HydrophobicContact CD2-CZ 4.05Å; L25-F152 HydrophobicContact CG-CD1 4.4Å; L25-F152 HydrophobicContact CG-CE1 3.65Å; L25-F152 HydrophobicContact CG-CZ 3.87Å; L25-L178 HydrophobicContact CD2-CD1 3.79Å
26	S	90.5	Very high	89	Confident	58 Å²	58	46.5 Å²	46.5	41%	0.406	23%	0.225	S	C	.	.	H	α-helix	trans	-62.1	-21.9	176.2	81.4	0	0	0	0	113.6	W22 Y23 L24	W22-S26 PolarHBondContact O-N 3.03Å; Y23-S26 WeakPolarHBondContact O-CB 2.95Å; Y23-S26 PolarHBondContact O-N 2.66Å; Y23-S26 PolarHBondContact O-OG 2.72Å; L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 2.85Å
27	Q	91.4	Very high	89.8	Confident	58 Å²	58	40.9 Å²	40.9	27%	0.271	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.1	177.6	-59.4	-61.8	-50.6	0	0	112.8	Y23 L24 L25 T29 S180 F185	Y23-Q27 WeakPolarHBondContact O-CG 2.92Å; Y23-Q27 PolarHBondContact O-N 3.22Å; L24-Q27 WeakPolarHBondContact O-CB 3.16Å; L24-Q27 PolarHBondContact O-N 3.11Å; L25-Q27 PolarHBondContact O-N 3.24Å; L25-Q27 VanDerWaalsContact O-N 3.16Å; Q27-T29 PolarHBondContact O-N 3.41Å; Q27-S180 VanDerWaalsContact O-CB 3.24Å; Q27-S180 WeakPolarHBondContact O-CB 3.34Å; Q27-S180 PolarHBondContact O-OG 3.25Å; Q27-F185 HydrophobicContact CB-CB 4.2Å; Q27-F185 HydrophobicContact CB-CD2 4.31Å
28	V	92.4	Very high	90.4	Very high	3 Å²	3	38 Å²	38	2%	0.018	18%	0.18	C	C	.	.			trans	-65.3	132.5	-178	172.2	0	0	0	0	110.6	L24 L25 L104 V106 L178 F185	L24-V28 PolarHBondContact O-N 3.27Å; L25-V28 HydrophobicContact CD2-CG2 4.5Å; L25-V28 WeakPolarHBondContact O-CB 3.22Å; L25-V28 PolarHBondContact O-N 2.9Å; V28-L104 HydrophobicContact CG1-CD1 3.84Å; V28-V106 HydrophobicContact CB-CG2 3.7Å; V28-V106 HydrophobicContact CG1-CG2 3.83Å; V28-L178 HydrophobicContact CG1-CB 3.9Å; V28-L178 HydrophobicContact CG1-CD1 4.36Å; V28-L178 HydrophobicContact CG1-CD2 4.24Å; V28-L178 HydrophobicContact CG1-CG 4.4Å; V28-L178 HydrophobicContact CG2-CB 4.02Å; V28-L178 HydrophobicContact CG2-CD1 4.19Å; V28-F185 HydrophobicContact CG2-CD2 4.26Å; V28-F185 HydrophobicContact CG2-CE2 3.52Å; V28-F185 HydrophobicContact CG2-CZ 3.96Å
29	T	90.1	Very high	91	Very high	42 Å²	42	40 Å²	40	26%	0.258	19%	0.186	S	C	.	.			trans	-117.9	-14.2	-178.8	62.7	0	0	0	0	113.9	Q27 L104 G179 S180 R181	Q27-T29 PolarHBondContact O-N 3.41Å; T29-L104 CarbonylContact C-O 3.58Å; T29-L104 VanDerWaalsContact CA-O 3.28Å; T29-L104 WeakPolarHBondContact CA-O 3.26Å; T29-L104 PolarHBondContact O-N 3.04Å; T29-G179 PolarHBondContact N-O 2.74Å; T29-S180 WeakPolarHBondContact OG1-CA 3.16Å; T29-R181 PolarHBondContact OG1-N 3.25Å
30	F	91.8	Very high	91.2	Very high	33 Å²	33	34.2 Å²	34.2	15%	0.145	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	157.6	179.1	60.6	-100.3	0	0	0	112.9	K32 V101 F102 L103 G179	F30-K32 HydrophobicContact CD2-CG 3.88Å; F30-K32 HydrophobicContact CE2-CD 3.98Å; F30-K32 VanDerWaalsContact CE2-CE 3.47Å; F30-K32 HydrophobicContact CE2-CG 3.84Å; F30-V101 HydrophobicContact CB-CG1 3.81Å; F30-V101 HydrophobicContact CD2-CG1 4.07Å; F30-V101 HydrophobicContact CG-CG1 4.08Å; F30-F102 CarbonylContact C-O 3.6Å; F30-F102 WeakPolarHBondContact CA-O 3.26Å; F30-F102 VanDerWaalsContact CB-O 3.28Å; F30-F102 WeakPolarHBondContact CB-O 3.21Å; F30-L103 HydrophobicContact CB-CD2 4.23Å; F30-G179 VanDerWaalsContact CZ-C 3.45Å; F30-G179 VanDerWaalsContact CZ-CA 3.45Å; F30-G179 PolarHBondContact N-O 2.77Å; F30-G179 PolarHBondContact O-N 3.02Å
31	L	92.7	Very high	91.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	125.9	168.1	167.2	67.3	0	0	0	108.9	V33 I67 V101 F102 L104 W114 L147 L176 L178	L31-V33 HydrophobicContact CD2-CG2 4.21Å; L31-V33 HydrophobicContact CG-CG2 4.06Å; L31-I67 HydrophobicContact CD2-CD1 3.68Å; L31-I67 HydrophobicContact CD2-CG2 3.77Å; L31-V101 CarbonylContact O-C 3.59Å; L31-V101 WeakPolarHBondContact O-CA 3.18Å; L31-F102 PolarHBondContact N-O 2.99Å; L31-F102 PolarHBondContact O-N 3.26Å; L31-L104 HydrophobicContact CB-CD2 3.53Å; L31-W114 HydrophobicContact CD2-CH2 4.3Å; L31-W114 HydrophobicContact CD2-CZ2 4.27Å; L31-L147 HydrophobicContact CD1-CD1 4.02Å; L31-L176 HydrophobicContact CD1-CB 4.37Å; L31-L178 HydrophobicContact CB-CD2 4.08Å; L31-L178 HydrophobicContact CD1-CD2 3.72Å; L31-L178 HydrophobicContact CG-CD2 4.45Å
32	K	93.7	Very high	91	Very high	91 Å²	91	44.3 Å²	44.3	40%	0.396	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	132.5	169.7	-63.6	179.1	171.2	173.8	0	108.9	F30 V101 L176 S177	F30-K32 HydrophobicContact CD2-CG 3.88Å; F30-K32 HydrophobicContact CE2-CD 3.98Å; F30-K32 VanDerWaalsContact CE2-CE 3.47Å; F30-K32 HydrophobicContact CE2-CG 3.84Å; K32-V101 HydrophobicContact CG-CG2 4.13Å; K32-L176 WeakPolarHBondContact O-CA 3.48Å; K32-S177 PolarHBondContact N-O 2.88Å; K32-S177 PolarHBondContact O-N 2.83Å
33	V	94.2	Very high	90.9	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	126.7	172.3	176.8	0	0	0	0	108.8	L31 I35 Y65 I67 R99 N100 F102 F119 L176	L31-V33 HydrophobicContact CD2-CG2 4.21Å; L31-V33 HydrophobicContact CG-CG2 4.06Å; V33-I35 HydrophobicContact CG1-CG1 4.27Å; V33-Y65 HydrophobicContact CG1-CE2 4.19Å; V33-I67 HydrophobicContact CG2-CD1 3.34Å; V33-R99 WeakPolarHBondContact O-CA 3.4Å; V33-N100 PolarHBondContact N-O 3.37Å; V33-N100 PolarHBondContact O-N 2.92Å; V33-F102 HydrophobicContact CB-CE2 4.34Å; V33-F102 HydrophobicContact CG2-CD2 4.12Å; V33-F102 HydrophobicContact CG2-CE2 3.85Å; V33-F119 HydrophobicContact CG1-CZ 3.95Å; V33-L176 HydrophobicContact CB-CD2 3.94Å; V33-L176 HydrophobicContact CG1-CD2 3.79Å; V33-L176 HydrophobicContact CG2-CD2 3.41Å; V33-L176 VanDerWaalsContact CG2-CD2 3.41Å
34	Y	93.7	Very high	90.5	Very high	59 Å²	59	37.9 Å²	37.9	23%	0.231	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125.3	177	-174.8	-128.9	0	0	0	109.3	E36 H98 R99 V174 G175	Y34-E36 HydrophobicContact CD1-CB 4.34Å; Y34-E36 HydrophobicContact CE1-CB 3.67Å; Y34-E36 HydrophobicContact CE1-CG 4.05Å; Y34-H98 CarbonylContact C-O 3.51Å; Y34-H98 WeakPolarHBondContact CA-O 3.2Å; Y34-H98 WeakPolarHBondContact CD2-O 3.36Å; Y34-R99 HydrophobicContact CD2-CG 3.38Å; Y34-R99 HydrophobicContact CE2-CG 3.78Å; Y34-R99 VanDerWaalsContact CE2-NE 3.28Å; Y34-R99 HydrophobicContact CG-CG 4.48Å; Y34-V174 CarbonylContact O-C 3.46Å; Y34-V174 WeakPolarHBondContact O-CA 3.04Å; Y34-G175 PolarHBondContact N-O 2.86Å; Y34-G175 PolarHBondContact O-N 2.97Å
35	I	94.4	Very high	90	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	105.8	171.8	-54	170.7	0	0	0	106.5	V33 L63 Y65 F96 N97 H98 I121 I172	V33-I35 HydrophobicContact CG1-CG1 4.27Å; I35-L63 HydrophobicContact CB-CD2 4.4Å; I35-L63 HydrophobicContact CD1-CD1 3.79Å; I35-L63 HydrophobicContact CD1-CD2 3.88Å; I35-L63 HydrophobicContact CG2-CD2 3.69Å; I35-Y65 HydrophobicContact CD1-CD1 3.57Å; I35-Y65 HydrophobicContact CD1-CE1 3.68Å; I35-Y65 HydrophobicContact CD1-CG 4.4Å; I35-F96 HydrophobicContact CG2-CB 4.3Å; I35-F96 HydrophobicContact CG2-CD2 4.4Å; I35-F96 HydrophobicContact CG2-CG 4.49Å; I35-N97 CarbonylContact O-C 3.52Å; I35-N97 PolarHBondContact O-N 3.04Å; I35-H98 HydrophobicContact CB-CB 4.29Å; I35-H98 PolarHBondContact N-O 3.21Å; I35-H98 PolarHBondContact O-N 3.21Å; I35-I121 HydrophobicContact CD1-CD1 3.98Å; I35-I121 HydrophobicContact CG1-CD1 4.25Å; I35-I172 HydrophobicContact CG2-CD1 3.73Å; I35-I172 HydrophobicContact CG2-CG1 4.12Å
36	E	90	Very high	89.3	Confident	68 Å²	68	47.1 Å²	47.1	32%	0.318	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	-68.3	-171	-174.1	179.5	-168	0	0	110.1	Y34 F96 N97 K173	Y34-E36 HydrophobicContact CD1-CB 4.34Å; Y34-E36 HydrophobicContact CE1-CB 3.67Å; Y34-E36 HydrophobicContact CE1-CG 4.05Å; E36-F96 PolarHBondContact O-N 2.92Å; E36-N97 PolarHBondContact O-N 3.43Å; E36-K173 HydrophobicContact CB-CB 4.1Å; E36-K173 PolarHBondContact N-O 3.06Å; E36-K173 WeakPolarHBondContact OE2-CD 3.44Å
37	C	91.6	Very high	88.6	Confident	1 Å²	1	44.5 Å²	44.5	1%	0.007	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	155.3	-172.2	55.6	0	0	0	0	111.9	Y39 I93 V94 N95 I172 K173	C37-Y39 HydrophobicContact CB-CE2 4.41Å; C37-Y39 WeakPolarHBondContact SG-CE2 3.1Å; C37-Y39 PolarHBondContact SG-OH 2.73Å; C37-Y39 VanDerWaalsContact SG-OH 3.35Å; C37-I93 HydrophobicContact CB-CG2 4.2Å; C37-V94 CarbonylContact C-O 3.53Å; C37-V94 VanDerWaalsContact CA-O 3.29Å; C37-V94 WeakPolarHBondContact CA-O 3.09Å; C37-N95 VanDerWaalsContact CB-OD1 3.22Å; C37-N95 WeakPolarHBondContact CB-OD1 3.16Å; C37-I172 WeakPolarHBondContact O-CA 3.33Å; C37-I172 WeakPolarHBondContact O-CG1 3.47Å; C37-K173 PolarHBondContact O-N 3.36Å
38	L	92.3	Very high	87.9	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	121.3	175.3	160.1	65.6	0	0	0	107.9	W40 L61 I93 V94 F96 I123 L160 I172	L38-W40 HydrophobicContact CD1-CD2 4.44Å; L38-W40 HydrophobicContact CD1-CH2 4.4Å; L38-W40 HydrophobicContact CD1-CZ2 4.11Å; L38-W40 HydrophobicContact CD2-CZ2 3.66Å; L38-W40 HydrophobicContact CG-CZ2 4.2Å; L38-L61 HydrophobicContact CD2-CD1 4.25Å; L38-L61 HydrophobicContact CD2-CD2 4.02Å; L38-I93 CarbonylContact O-C 3.57Å; L38-I93 WeakPolarHBondContact O-CA 3.27Å; L38-V94 HydrophobicContact CB-CB 4.12Å; L38-V94 HydrophobicContact CD2-CB 4.18Å; L38-V94 HydrophobicContact CG-CB 4.33Å; L38-V94 PolarHBondContact N-O 3.31Å; L38-V94 PolarHBondContact O-N 2.48Å; L38-F96 HydrophobicContact CB-CD2 4.29Å; L38-F96 HydrophobicContact CB-CE2 3.72Å; L38-F96 HydrophobicContact CD2-CE2 4.1Å; L38-I123 HydrophobicContact CD1-CD1 3.75Å; L38-I123 HydrophobicContact CD2-CD1 3.97Å; L38-I123 HydrophobicContact CD2-CG2 4.23Å; L38-I123 HydrophobicContact CG-CD1 4.47Å; L38-L160 HydrophobicContact CD1-CD1 3.33Å; L38-L160 HydrophobicContact CD1-CD2 4.49Å; L38-L160 HydrophobicContact CD1-CG 4.42Å; L38-I172 HydrophobicContact CB-CG1 4.5Å
39	Y	90.4	Very high	87.2	Confident	65 Å²	65	45.7 Å²	45.7	26%	0.255	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.6	175.3	-66.8	-85.3	0	0	0	109.9	C37 T92 I93 G170 S171 K173	C37-Y39 HydrophobicContact CB-CE2 4.41Å; C37-Y39 WeakPolarHBondContact SG-CE2 3.1Å; C37-Y39 PolarHBondContact SG-OH 2.73Å; C37-Y39 VanDerWaalsContact SG-OH 3.35Å; Y39-T92 CarbonylContact C-O 3.56Å; Y39-T92 WeakPolarHBondContact CA-O 3.47Å; Y39-I93 HydrophobicContact CD1-CB 4.47Å; Y39-I93 HydrophobicContact CD1-CD1 3.98Å; Y39-I93 HydrophobicContact CD1-CG1 3.65Å; Y39-I93 HydrophobicContact CD1-CG2 4.26Å; Y39-I93 HydrophobicContact CE1-CD1 3.59Å; Y39-I93 HydrophobicContact CE1-CG1 3.75Å; Y39-I93 HydrophobicContact CE1-CG2 4Å; Y39-G170 CarbonylContact O-C 3.39Å; Y39-G170 WeakPolarHBondContact O-CA 3.18Å; Y39-S171 PolarHBondContact N-O 3.42Å; Y39-S171 PolarHBondContact O-N 2.92Å; Y39-K173 HydrophobicContact CD2-CG 4.46Å; Y39-K173 HydrophobicContact CE2-CD 3.72Å; Y39-K173 HydrophobicContact CE2-CG 3.94Å; Y39-K173 PolarHBondContact OH-NZ 2.94Å
40	W	88.4	Confident	86.4	Confident	9 Å²	9	45 Å²	45	3%	0.034	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	111.3	166.9	-63.7	115.4	0	0	0	108.6	L38 A43 P44 L61 T92 I137 A138 L160 I162	L38-W40 HydrophobicContact CD1-CD2 4.44Å; L38-W40 HydrophobicContact CD1-CH2 4.4Å; L38-W40 HydrophobicContact CD1-CZ2 4.11Å; L38-W40 HydrophobicContact CD2-CZ2 3.66Å; L38-W40 HydrophobicContact CG-CZ2 4.2Å; W40-A43 HydrophobicContact CB-CB 3.74Å; W40-A43 HydrophobicContact CG-CB 3.95Å; W40-P44 HydrophobicContact CH2-CG 4.44Å; W40-P44 HydrophobicContact CZ3-CG 4.46Å; W40-L61 HydrophobicContact CZ2-CD1 4.46Å; W40-T92 PolarHBondContact N-O 2.97Å; W40-I137 HydrophobicContact CH2-CD1 4.08Å; W40-I137 HydrophobicContact CZ2-CD1 3.9Å; W40-A138 HydrophobicContact CH2-CB 4.1Å; W40-L160 HydrophobicContact CE3-CD1 4.25Å; W40-L160 HydrophobicContact CH2-CD1 3.97Å; W40-L160 HydrophobicContact CZ3-CD1 3.68Å; W40-I162 HydrophobicContact CH2-CD1 4.41Å; W40-I162 HydrophobicContact CZ3-CD1 3.77Å
41	R	85.5	Confident	85.5	Confident	204 Å²	204	44.6 Å²	44.6	77%	0.77	20%	0.199	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-71.6	-42.8	166.8	-173.1	-179	-66.8	148.1	-8	109.7	D169	R41-D169 HydrophobicContact CB-CB 4.3Å; R41-D169 WeakPolarHBondContact CD-OD2 3.48Å; R41-D169 IonicContact CZ-OD2 3.53Å; R41-D169 PolarHBondContact N-O 2.97Å; R41-D169 IonicContact NE-OD2 3.73Å; R41-D169 IonicContact NH1-OD2 2.72Å; R41-D169 PolarHBondContact NH1-OD2 3.42Å
42	I	86.4	Confident	84.5	Confident	77 Å²	77	54 Å²	54	40%	0.395	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	105.4	170.9	-54.6	175.2	0	0	0	106.8	I167 S168 D169	I42-I167 HydrophobicContact CD1-CG2 3.81Å; I42-I167 HydrophobicContact CG2-CG2 4.5Å; I42-I167 WeakPolarHBondContact CG2-O 3.04Å; I42-S168 CarbonylContact O-C 3.52Å; I42-S168 WeakPolarHBondContact O-CA 3.26Å; I42-S168 VanDerWaalsContact O-CB 3.26Å; I42-S168 WeakPolarHBondContact O-CB 3.35Å; I42-D169 HydrophobicContact CB-CB 4.42Å; I42-D169 PolarHBondContact N-O 3.36Å; I42-D169 PolarHBondContact O-N 3.29Å
43	A	83.6	Confident	83.5	Confident	17 Å²	17	56.9 Å²	56.9	14%	0.14	24%	0.243	C	C	.	.			trans	-75.9	148	-179.1	0	0	0	0	0	111.4	W40 Q45 Y47 V48 P91	W40-A43 HydrophobicContact CB-CB 3.74Å; W40-A43 HydrophobicContact CG-CB 3.95Å; A43-Q45 PolarHBondContact O-N 2.87Å; A43-Y47 HydrophobicContact CB-CD1 4.07Å; A43-V48 HydrophobicContact CB-CG2 3.65Å; A43-P91 VanDerWaalsContact CB-O 3.29Å; A43-P91 WeakPolarHBondContact CB-O 3.38Å
44	P	83	Confident	82	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	27%	0.27	C	S	.	.			trans	-54.8	134.8	175.9	-25.4	33.4	0	0	0	112.7	W40 Y46 Y47 V48 T164 S168	W40-P44 HydrophobicContact CH2-CG 4.44Å; W40-P44 HydrophobicContact CZ3-CG 4.46Å; P44-Y46 VanDerWaalsContact C-N 3.31Å; P44-Y46 HydrophobicContact CB-CD1 3.89Å; P44-Y46 HydrophobicContact CB-CE1 3.26Å; P44-Y46 HydrophobicContact CB-CE2 4.33Å; P44-Y46 VanDerWaalsContact CB-CZ 3.48Å; P44-Y46 HydrophobicContact CG-CE1 4.25Å; P44-Y46 PolarHBondContact O-N 2.92Å; P44-Y47 WeakPolarHBondContact O-CA 3.47Å; P44-Y47 VanDerWaalsContact O-CB 3.27Å; P44-Y47 WeakPolarHBondContact O-CB 3.28Å; P44-Y47 PolarHBondContact O-N 2.8Å; P44-V48 PolarHBondContact O-N 2.79Å; P44-T164 HydrophobicContact CB-CG2 4.35Å; P44-T164 HydrophobicContact CG-CG2 4.24Å; P44-S168 VanDerWaalsContact CA-OG 3.24Å; P44-S168 WeakPolarHBondContact CA-OG 3.31Å
45	Q	81.2	Confident	80.5	Confident	136 Å²	136	62.9 Å²	62.9	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-57.9	-42.4	-171.6	-177.5	175.8	-12.2	0	0	112.7	A43 Y47 V48 E49	A43-Q45 PolarHBondContact O-N 2.87Å; Q45-Y47 PolarHBondContact O-N 2.95Å; Q45-V48 PolarHBondContact O-N 3.24Å; Q45-E49 HydrophobicContact CG-CG 4.36Å; Q45-E49 PolarHBondContact NE2-OE1 3.11Å; Q45-E49 WeakPolarHBondContact O-CB 3.3Å; Q45-E49 WeakPolarHBondContact O-CG 3.44Å; Q45-E49 PolarHBondContact O-N 2.93Å
46	Y	77.9	Confident	78.9	Confident	65 Å²	65	67.5 Å²	67.5	26%	0.255	30%	0.302	S	S	.	.	H	α-helix	trans	-60.6	-35.4	177.3	65.1	-94.5	0	0	0	111.9	P44 E50 Y125 I137 T164	P44-Y46 VanDerWaalsContact C-N 3.31Å; P44-Y46 HydrophobicContact CB-CD1 3.89Å; P44-Y46 HydrophobicContact CB-CE1 3.26Å; P44-Y46 HydrophobicContact CB-CE2 4.33Å; P44-Y46 VanDerWaalsContact CB-CZ 3.48Å; P44-Y46 HydrophobicContact CG-CE1 4.25Å; P44-Y46 PolarHBondContact O-N 2.92Å; Y46-E50 WeakPolarHBondContact O-CG 3.48Å; Y46-E50 PolarHBondContact O-N 3.09Å; Y46-Y125 HydrophobicContact CD2-CE1 4.46Å; Y46-Y125 HydrophobicContact CD2-CE2 4.36Å; Y46-Y125 HydrophobicContact CE2-CD1 4.09Å; Y46-Y125 AromaticContact CE2-CD2 3.92Å; Y46-Y125 HydrophobicContact CE2-CD2 3.92Å; Y46-Y125 HydrophobicContact CE2-CE1 4.36Å; Y46-Y125 HydrophobicContact CE2-CE2 4.14Å; Y46-Y125 AromaticContact CE2-CG 3.9Å; Y46-Y125 HydrophobicContact CE2-CG 3.9Å; Y46-I137 WeakPolarHBondContact OH-CB 3.41Å; Y46-I137 WeakPolarHBondContact OH-CG2 3.35Å; Y46-T164 HydrophobicContact CE1-CG2 3.62Å; Y46-T164 WeakPolarHBondContact OH-CG2 3.11Å
47	Y	76.2	Confident	77.5	Confident	3 Å²	3	75.1 Å²	75.1	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-68.7	-45.9	177.7	176.1	-98.8	0	0	0	110.4	A43 P44 Q45 E49 E50 V51 L61 L89 L90 V94	A43-Y47 HydrophobicContact CB-CD1 4.07Å; P44-Y47 WeakPolarHBondContact O-CA 3.47Å; P44-Y47 VanDerWaalsContact O-CB 3.27Å; P44-Y47 WeakPolarHBondContact O-CB 3.28Å; P44-Y47 PolarHBondContact O-N 2.8Å; Q45-Y47 PolarHBondContact O-N 2.95Å; Y47-E49 VanDerWaalsContact C-N 3.34Å; Y47-E49 PolarHBondContact O-N 2.79Å; Y47-E50 PolarHBondContact O-N 3.47Å; Y47-V51 HydrophobicContact CE1-CG2 4.44Å; Y47-V51 WeakPolarHBondContact O-CG2 3.36Å; Y47-V51 PolarHBondContact O-N 3.21Å; Y47-V51 VanDerWaalsContact O-N 3.1Å; Y47-L61 HydrophobicContact CE2-CD1 4.08Å; Y47-L89 HydrophobicContact CE2-CB 4.3Å; Y47-L89 HydrophobicContact CE2-CD1 4.1Å; Y47-L89 HydrophobicContact CE2-CD2 4.34Å; Y47-L89 HydrophobicContact CE2-CG 4.48Å; Y47-L89 WeakPolarHBondContact OH-CB 3.09Å; Y47-L90 WeakPolarHBondContact CE1-O 3.24Å; Y47-L90 PolarHBondContact OH-O 2.74Å; Y47-V94 VanDerWaalsContact OH-CG2 3.25Å; Y47-V94 WeakPolarHBondContact OH-CG2 3.4Å
48	V	76.8	Confident	76.6	Confident	23 Å²	23	75.2 Å²	75.2	14%	0.139	33%	0.329	C	S	.	.	H	α-helix	trans	-61.5	-42.7	175.8	-177.4	0	0	0	0	111.4	A43 P44 Q45 E50 V51 R52	A43-V48 HydrophobicContact CB-CG2 3.65Å; P44-V48 PolarHBondContact O-N 2.79Å; Q45-V48 PolarHBondContact O-N 3.24Å; V48-E50 PolarHBondContact O-N 2.69Å; V48-V51 PolarHBondContact O-N 3.39Å; V48-R52 HydrophobicContact CG1-CG 4.35Å; V48-R52 VanDerWaalsContact CG1-NH1 3.29Å; V48-R52 WeakPolarHBondContact O-CB 3.14Å; V48-R52 WeakPolarHBondContact O-CG 3.32Å; V48-R52 PolarHBondContact O-N 2.81Å
49	E	77.5	Confident	75.9	Confident	63 Å²	63	75.5 Å²	75.5	29%	0.294	33%	0.331	S	S	.	.	H	α-helix	trans	-62.6	-40.1	178	-77.1	-177.1	-163.6	0	0	112.6	Q45 Y47 R52 R53	Q45-E49 HydrophobicContact CG-CG 4.36Å; Q45-E49 PolarHBondContact NE2-OE1 3.11Å; Q45-E49 WeakPolarHBondContact O-CB 3.3Å; Q45-E49 WeakPolarHBondContact O-CG 3.44Å; Q45-E49 PolarHBondContact O-N 2.93Å; Y47-E49 VanDerWaalsContact C-N 3.34Å; Y47-E49 PolarHBondContact O-N 2.79Å; E49-R52 PolarHBondContact O-N 3.3Å; E49-R53 VanDerWaalsContact O-CB 3.3Å; E49-R53 WeakPolarHBondContact O-CB 3.43Å; E49-R53 WeakPolarHBondContact O-CG 3.34Å; E49-R53 PolarHBondContact O-N 2.92Å; E49-R53 IonicContact OE2-CZ 3.35Å; E49-R53 IonicContact OE2-NH2 3.11Å
50	E	73.8	Confident	75.6	Confident	29 Å²	29	74.5 Å²	74.5	14%	0.136	33%	0.329	C	S	.	.	H	α-helix	trans	-68.4	-40.1	177.6	-77.5	-165.8	147.6	0	0	113.4	Y46 Y47 V48 R53 R55 A59 Y125 N127	Y46-E50 WeakPolarHBondContact O-CG 3.48Å; Y46-E50 PolarHBondContact O-N 3.09Å; Y47-E50 PolarHBondContact O-N 3.47Å; V48-E50 PolarHBondContact O-N 2.69Å; E50-R53 PolarHBondContact O-N 2.96Å; E50-R55 PolarHBondContact O-N 2.62Å; E50-A59 WeakPolarHBondContact OE2-CB 3.43Å; E50-Y125 PolarHBondContact OE1-OH 2.81Å; E50-Y125 VanDerWaalsContact OE2-CE2 3.31Å; E50-Y125 WeakPolarHBondContact OE2-CE2 2.99Å; E50-Y125 VanDerWaalsContact OE2-CZ 3.25Å; E50-Y125 PolarHBondContact OE2-OH 3.39Å; E50-N127 PolarHBondContact OE1-ND2 2.78Å
51	V	71.2	Confident	75.6	Confident	24 Å²	24	74.1 Å²	74.1	15%	0.145	33%	0.327	C	S	.	.	H	α-helix	trans	-64	-44.6	174.1	178.2	0	0	0	0	110.1	Y47 V48 G54 P91	Y47-V51 HydrophobicContact CE1-CG2 4.44Å; Y47-V51 WeakPolarHBondContact O-CG2 3.36Å; Y47-V51 PolarHBondContact O-N 3.21Å; Y47-V51 VanDerWaalsContact O-N 3.1Å; V48-V51 PolarHBondContact O-N 3.39Å; V51-G54 PolarHBondContact O-N 3.2Å; V51-P91 HydrophobicContact CB-CG 4.5Å; V51-P91 HydrophobicContact CG1-CG 3.86Å
52	R	73.1	Confident	75.8	Confident	196 Å²	196	64.4 Å²	64.4	74%	0.74	29%	0.291	S	S	*	.	H	α-helix	trans	-64.1	-39.6	177.6	-77.8	-177.9	-176.1	138.5	1.7	113.3	V48 E49 G54	V48-R52 HydrophobicContact CG1-CG 4.35Å; V48-R52 VanDerWaalsContact CG1-NH1 3.29Å; V48-R52 WeakPolarHBondContact O-CB 3.14Å; V48-R52 WeakPolarHBondContact O-CG 3.32Å; V48-R52 PolarHBondContact O-N 2.81Å; E49-R52 PolarHBondContact O-N 3.3Å; R52-G54 PolarHBondContact O-N 3.46Å
53	R	72	Confident	76.2	Confident	153 Å²	153	60.7 Å²	60.7	58%	0.577	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	1.5	179.3	-76.3	175.1	176.3	163.5	4.9	113.4	E49 E50 R55	E49-R53 VanDerWaalsContact O-CB 3.3Å; E49-R53 WeakPolarHBondContact O-CB 3.43Å; E49-R53 WeakPolarHBondContact O-CG 3.34Å; E49-R53 PolarHBondContact O-N 2.92Å; E49-R53 IonicContact OE2-CZ 3.35Å; E49-R53 IonicContact OE2-NH2 3.11Å; E50-R53 PolarHBondContact O-N 2.96Å; R53-R55 HydrophobicContact CB-CB 4.46Å; R53-R55 HydrophobicContact CB-CG 3.99Å; R53-R55 PolarHBondContact O-N 2.99Å
54	G	63.8	Low	76.7	Confident	57 Å²	57	62.5 Å²	62.5	59%	0.588	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	64	12.2	-175.7	0	0	0	0	0	112.7	V51 R52 K56	V51-G54 PolarHBondContact O-N 3.2Å; R52-G54 PolarHBondContact O-N 3.46Å; G54-K56 PolarHBondContact O-N 2.93Å
55	R	61.1	Low	77.2	Confident	131 Å²	131	62.6 Å²	62.6	49%	0.494	28%	0.276	S	S	.	.			trans	-83.6	37	179.7	-66.6	-176.6	-179.6	-169.9	1.7	110.8	E50 R53 R57 S58	E50-R55 PolarHBondContact O-N 2.62Å; R53-R55 HydrophobicContact CB-CB 4.46Å; R53-R55 HydrophobicContact CB-CG 3.99Å; R53-R55 PolarHBondContact O-N 2.99Å; R55-R57 PolarHBondContact O-N 3.43Å; R55-S58 PolarHBondContact O-N 2.54Å; R55-S58 PolarHBondContact O-OG 3.03Å; R55-S58 VanDerWaalsContact O-OG 3.05Å
56	K	60.1	Low	77.6	Confident	96 Å²	96	59.3 Å²	59.3	42%	0.417	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	19.3	175.6	-61.4	-171.9	177.6	-172	0	113.9	G54 A86	G54-K56 PolarHBondContact O-N 2.93Å; K56-A86 VanDerWaalsContact C-CB 3.45Å; K56-A86 CarbonylContact O-C 3.46Å; K56-A86 WeakPolarHBondContact O-CB 3.5Å
57	R	62.4	Low	78	Confident	229 Å²	229	56.2 Å²	56.2	86%	0.864	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-123.9	-3.6	173.5	-64.1	-172.5	-177.5	172.5	1	112.5	R55	R55-R57 PolarHBondContact O-N 3.43Å
58	S	71.1	Confident	78.3	Confident	3 Å²	3	56.4 Å²	56.4	2%	0.021	25%	0.247	C	C	.	.	S	Bend	trans	-105.4	5.5	-175.3	60.6	0	0	0	0	114.8	R55 N127 L128	R55-S58 PolarHBondContact O-N 2.54Å; R55-S58 PolarHBondContact O-OG 3.03Å; R55-S58 VanDerWaalsContact O-OG 3.05Å; S58-N127 CarbonylContact O-C 3.4Å; S58-N127 WeakPolarHBondContact O-CA 3.49Å; S58-N127 PolarHBondContact O-OD1 3.19Å; S58-L128 PolarHBondContact O-N 2.95Å
59	A	77.4	Confident	78.5	Confident	5 Å²	5	56 Å²	56	4%	0.041	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	145	-175	0	0	0	0	0	112.4	E50 A86 Y125 K126	E50-A59 WeakPolarHBondContact OE2-CB 3.43Å; A59-A86 VanDerWaalsContact O-CA 3.32Å; A59-A86 WeakPolarHBondContact O-CA 3.24Å; A59-A86 WeakPolarHBondContact O-CB 3.39Å; A59-Y125 HydrophobicContact CB-CE2 3.55Å; A59-Y125 WeakPolarHBondContact CB-OH 3.42Å; A59-K126 CarbonylContact C-O 3.56Å; A59-K126 WeakPolarHBondContact CA-O 3.38Å
60	Q	84.3	Confident	77.9	Confident	45 Å²	45	55.4 Å²	55.4	21%	0.21	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	133.5	176.6	-170	177.2	23.1	0	0	108.3	S83 I84 K126	Q60-S83 PolarHBondContact NE2-OG 2.8Å; Q60-I84 WeakPolarHBondContact CG-O 3.33Å; Q60-K126 PolarHBondContact N-O 2.98Å; Q60-K126 PolarHBondContact O-N 3.42Å
61	L	88.5	Confident	77.2	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.2	168.4	-164.1	147.9	0	0	0	107.3	L38 W40 Y47 I84 L89 V94 F96 I123 Y124 I137	L38-L61 HydrophobicContact CD2-CD1 4.25Å; L38-L61 HydrophobicContact CD2-CD2 4.02Å; W40-L61 HydrophobicContact CZ2-CD1 4.46Å; Y47-L61 HydrophobicContact CE2-CD1 4.08Å; L61-I84 PolarHBondContact O-N 3.11Å; L61-L89 HydrophobicContact CB-CD1 4.42Å; L61-L89 HydrophobicContact CB-CD2 3.6Å; L61-V94 HydrophobicContact CD2-CG1 4.26Å; L61-F96 HydrophobicContact CD2-CE1 4.16Å; L61-F96 HydrophobicContact CD2-CE2 4.29Å; L61-F96 HydrophobicContact CD2-CZ 3.41Å; L61-F96 VanDerWaalsContact CD2-CZ 3.41Å; L61-I123 HydrophobicContact CD1-CG2 4.32Å; L61-I123 HydrophobicContact CD2-CG2 3.7Å; L61-I123 HydrophobicContact CG-CG2 4.04Å; L61-Y124 WeakPolarHBondContact CA-O 3.28Å; L61-I137 HydrophobicContact CD1-CD1 4.14Å
62	F	90.9	Very high	76.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	149.7	175	66.1	-86.6	0	0	0	109.8	R64 R81 V82 Y124 K126 E134	F62-R64 HydrophobicContact CD2-CG 4.16Å; F62-R64 HydrophobicContact CE2-CG 4.06Å; F62-R81 HydrophobicContact CD2-CG 3.93Å; F62-R81 VanDerWaalsContact CD2-NE 3.32Å; F62-R81 VanDerWaalsContact CE2-NH2 3.32Å; F62-V82 CarbonylContact C-O 3.54Å; F62-V82 WeakPolarHBondContact CA-O 3.47Å; F62-V82 VanDerWaalsContact CB-O 3.28Å; F62-V82 WeakPolarHBondContact CB-O 3.33Å; F62-Y124 HydrophobicContact CD2-CD2 4.11Å; F62-Y124 HydrophobicContact CD2-CG 4.28Å; F62-Y124 HydrophobicContact CE1-CG 4.31Å; F62-Y124 HydrophobicContact CE2-CD1 4.36Å; F62-Y124 AromaticContact CE2-CD2 3.56Å; F62-Y124 HydrophobicContact CE2-CD2 3.56Å; F62-Y124 HydrophobicContact CE2-CE2 4.47Å; F62-Y124 AromaticContact CE2-CG 3.5Å; F62-Y124 HydrophobicContact CE2-CG 3.5Å; F62-Y124 HydrophobicContact CZ-CD1 4.13Å; F62-Y124 HydrophobicContact CZ-CD2 4.1Å; F62-Y124 AromaticContact CZ-CG 3.53Å; F62-Y124 HydrophobicContact CZ-CG 3.53Å; F62-Y124 PolarHBondContact N-O 3.03Å; F62-Y124 PolarHBondContact O-N 2.85Å; F62-K126 HydrophobicContact CD1-CB 4.5Å; F62-K126 HydrophobicContact CE1-CB 3.99Å; F62-E134 HydrophobicContact CE1-CB 4.24Å; F62-E134 HydrophobicContact CE1-CG 3.79Å; F62-E134 HydrophobicContact CZ-CB 3.8Å; F62-E134 VanDerWaalsContact CZ-CD 3.43Å; F62-E134 HydrophobicContact CZ-CG 3.58Å; F62-E134 WeakPolarHBondContact CZ-OE2 3.47Å
63	L	93.9	Very high	75.2	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	152.4	171.4	64.1	78	0	0	0	109.9	I35 Y65 R81 V82 F96 I121 S122 I172	I35-L63 HydrophobicContact CB-CD2 4.4Å; I35-L63 HydrophobicContact CD1-CD1 3.79Å; I35-L63 HydrophobicContact CD1-CD2 3.88Å; I35-L63 HydrophobicContact CG2-CD2 3.69Å; L63-Y65 HydrophobicContact CD1-CD1 3.66Å; L63-Y65 HydrophobicContact CD1-CE1 4.15Å; L63-R81 WeakPolarHBondContact O-CA 3.43Å; L63-V82 HydrophobicContact CD1-CB 3.65Å; L63-V82 HydrophobicContact CD1-CG2 3.62Å; L63-V82 HydrophobicContact CG-CB 3.86Å; L63-V82 HydrophobicContact CG-CG2 4.37Å; L63-V82 PolarHBondContact N-O 3.35Å; L63-V82 PolarHBondContact O-N 3.06Å; L63-F96 HydrophobicContact CB-CE1 4.04Å; L63-F96 HydrophobicContact CB-CZ 4.1Å; L63-F96 HydrophobicContact CD2-CB 4.34Å; L63-F96 HydrophobicContact CD2-CD1 3.37Å; L63-F96 HydrophobicContact CD2-CD2 3.79Å; L63-F96 HydrophobicContact CD2-CE1 3.42Å; L63-F96 VanDerWaalsContact CD2-CE1 3.42Å; L63-F96 HydrophobicContact CD2-CE2 3.81Å; L63-F96 HydrophobicContact CD2-CG 3.56Å; L63-F96 HydrophobicContact CD2-CZ 3.62Å; L63-F96 HydrophobicContact CG-CD1 3.84Å; L63-F96 HydrophobicContact CG-CE1 3.58Å; L63-F96 HydrophobicContact CG-CG 4.5Å; L63-F96 HydrophobicContact CG-CZ 4.03Å; L63-I121 HydrophobicContact CB-CG2 3.96Å; L63-I121 HydrophobicContact CD1-CG2 4.48Å; L63-I121 HydrophobicContact CD2-CG2 4.45Å; L63-S122 CarbonylContact C-O 3.36Å; L63-S122 VanDerWaalsContact CA-O 3.3Å; L63-S122 WeakPolarHBondContact CA-O 3.32Å; L63-I172 HydrophobicContact CD2-CD1 4.49Å
64	R	94.7	Very high	74.3	Confident	54 Å²	54	57.4 Å²	57.4	20%	0.204	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	136.9	168.4	-69.9	175.3	163	156.6	11.8	108.1	F62 E79 K80 R81 I121 S122 Y124 E134	F62-R64 HydrophobicContact CD2-CG 4.16Å; F62-R64 HydrophobicContact CE2-CG 4.06Å; R64-E79 WeakPolarHBondContact CD-OE1 3.32Å; R64-E79 IonicContact NE-OE1 3.08Å; R64-E79 PolarHBondContact NE-OE1 2.93Å; R64-K80 VanDerWaalsContact CA-O 3.31Å; R64-K80 WeakPolarHBondContact CA-O 3.39Å; R64-R81 HydrophobicContact CG-CB 4.43Å; R64-R81 HydrophobicContact CG-CG 4.21Å; R64-R81 VanDerWaalsContact NH2-NH1 3.17Å; R64-I121 CarbonylContact O-C 3.49Å; R64-I121 WeakPolarHBondContact O-CA 3.32Å; R64-S122 PolarHBondContact N-O 3.24Å; R64-S122 PolarHBondContact O-N 3.31Å; R64-Y124 HydrophobicContact CB-CD2 4.41Å; R64-Y124 HydrophobicContact CB-CE2 3.94Å; R64-Y124 HydrophobicContact CG-CD2 4.14Å; R64-Y124 HydrophobicContact CG-CE2 3.94Å; R64-E134 IonicContact CZ-OE2 3.13Å; R64-E134 IonicContact NH1-OE2 3.1Å; R64-E134 IonicContact NH2-OE2 2.69Å; R64-E134 PolarHBondContact NH2-OE2 2.86Å
65	Y	94.4	Very high	73.8	Confident	3 Å²	3	57.3 Å²	57.3	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	152.7	170.7	67.6	-95	0	0	0	109.9	V33 I35 L63 I67 E79 K80 V82 H98 N100 F102 F119 R120	V33-Y65 HydrophobicContact CG1-CE2 4.19Å; I35-Y65 HydrophobicContact CD1-CD1 3.57Å; I35-Y65 HydrophobicContact CD1-CE1 3.68Å; I35-Y65 HydrophobicContact CD1-CG 4.4Å; L63-Y65 HydrophobicContact CD1-CD1 3.66Å; L63-Y65 HydrophobicContact CD1-CE1 4.15Å; Y65-I67 HydrophobicContact CD2-CD1 4.42Å; Y65-I67 HydrophobicContact CD2-CG1 4.1Å; Y65-I67 HydrophobicContact CE2-CD1 4.06Å; Y65-I67 HydrophobicContact CE2-CG1 4.19Å; Y65-E79 WeakPolarHBondContact O-CA 3.42Å; Y65-K80 HydrophobicContact CD1-CB 4.13Å; Y65-K80 HydrophobicContact CD2-CB 4.36Å; Y65-K80 HydrophobicContact CE1-CB 3.55Å; Y65-K80 HydrophobicContact CE1-CG 4.37Å; Y65-K80 HydrophobicContact CE2-CB 3.84Å; Y65-K80 HydrophobicContact CE2-CG 3.92Å; Y65-K80 VanDerWaalsContact CZ-CB 3.4Å; Y65-K80 PolarHBondContact N-O 3.22Å; Y65-K80 PolarHBondContact O-N 2.83Å; Y65-V82 HydrophobicContact CE1-CG2 4.31Å; Y65-H98 AromaticContact CE1-CD2 3.69Å; Y65-H98 AromaticContact CE1-NE2 3.52Å; Y65-H98 AromaticContact CZ-NE2 3.61Å; Y65-H98 PolarHBondContact OH-NE2 3Å; Y65-N100 WeakPolarHBondContact OH-CB 3.38Å; Y65-F102 HydrophobicContact CE2-CE2 4.02Å; Y65-F102 AromaticContact CE2-CZ 3.81Å; Y65-F102 HydrophobicContact CE2-CZ 3.81Å; Y65-F119 AromaticContact CD2-CE2 3.49Å; Y65-F119 HydrophobicContact CD2-CE2 3.49Å; Y65-F119 VanDerWaalsContact CD2-CE2 3.49Å; Y65-F119 AromaticContact CD2-CZ 3.77Å; Y65-F119 HydrophobicContact CD2-CZ 3.77Å; Y65-F119 HydrophobicContact CE2-CE2 4.21Å; Y65-F119 HydrophobicContact CE2-CZ 4.4Å; Y65-F119 AromaticContact CG-CE2 3.99Å; Y65-F119 HydrophobicContact CG-CE2 3.99Å; Y65-F119 AromaticContact CG-CZ 3.92Å; Y65-F119 HydrophobicContact CG-CZ 3.92Å; Y65-R120 WeakPolarHBondContact CA-O 3.27Å; Y65-R120 WeakPolarHBondContact CB-O 3.34Å
66	Y	88.9	Confident	73.5	Confident	66 Å²	66	60.6 Å²	60.6	26%	0.259	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	146.6	174.3	70.3	-96.7	0	0	0	109.3	N118 F119 R120	Y66-N118 PolarHBondContact OH-O 2.97Å; Y66-N118 VanDerWaalsContact OH-O 3.13Å; Y66-F119 WeakPolarHBondContact O-CD2 3.47Å; Y66-R120 HydrophobicContact CD1-CB 4.29Å; Y66-R120 HydrophobicContact CE1-CB 3.53Å; Y66-R120 HydrophobicContact CE1-CG 3.83Å; Y66-R120 WeakPolarHBondContact OH-CD 3.45Å; Y66-R120 VanDerWaalsContact OH-CG 3.27Å; Y66-R120 WeakPolarHBondContact OH-CG 3.11Å; Y66-R120 PolarHBondContact OH-NE 3.25Å
67	I	86.2	Confident	73.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	124	168.9	-55.5	-176	0	0	0	107.4	L31 V33 Y65 L69 F102 F119	L31-I67 HydrophobicContact CD2-CD1 3.68Å; L31-I67 HydrophobicContact CD2-CG2 3.77Å; V33-I67 HydrophobicContact CG2-CD1 3.34Å; Y65-I67 HydrophobicContact CD2-CD1 4.42Å; Y65-I67 HydrophobicContact CD2-CG1 4.1Å; Y65-I67 HydrophobicContact CE2-CD1 4.06Å; Y65-I67 HydrophobicContact CE2-CG1 4.19Å; I67-L69 HydrophobicContact CB-CG 4.33Å; I67-L69 HydrophobicContact CG2-CD2 3.83Å; I67-L69 HydrophobicContact CG2-CG 3.98Å; I67-L69 PolarHBondContact O-N 3.36Å; I67-F102 HydrophobicContact CD1-CD2 3.68Å; I67-F102 HydrophobicContact CD1-CE2 3.25Å; I67-F102 HydrophobicContact CD1-CG 4.5Å; I67-F102 HydrophobicContact CD1-CZ 3.76Å; I67-F102 HydrophobicContact CG1-CE2 4.32Å; I67-F102 HydrophobicContact CG1-CZ 4.38Å; I67-F119 HydrophobicContact CD1-CD2 4.44Å; I67-F119 HydrophobicContact CD1-CE2 3.98Å; I67-F119 HydrophobicContact CG1-CD2 3.85Å; I67-F119 HydrophobicContact CG1-CE2 3.61Å
68	P	82.7	Confident	74	Confident	7 Å²	7	51.7 Å²	51.7	5%	0.045	28%	0.276	C	S	.	.			trans	-68.5	99	173.9	28.2	-31.7	0	0	0	108.5	L110 W114 E117 L144	P68-L110 WeakPolarHBondContact O-CD1 3.17Å; P68-W114 PolarHBondContact O-NE1 3.48Å; P68-E117 VanDerWaalsContact CB-OE2 3.26Å; P68-E117 WeakPolarHBondContact CB-OE2 3.46Å; P68-E117 HydrophobicContact CG-CB 4.26Å; P68-E117 WeakPolarHBondContact CG-OE2 3.48Å; P68-L144 HydrophobicContact CG-CD1 3.39Å
69	L	80.7	Confident	74.6	Confident	15 Å²	15	57.3 Å²	57.3	8%	0.079	30%	0.302	C	S	.	.			trans	-107.8	133	171.9	-61.4	176.1	0	0	0	108.1	I67 D71 F102 L104 W114	I67-L69 HydrophobicContact CB-CG 4.33Å; I67-L69 HydrophobicContact CG2-CD2 3.83Å; I67-L69 HydrophobicContact CG2-CG 3.98Å; I67-L69 PolarHBondContact O-N 3.36Å; L69-D71 VanDerWaalsContact C-N 3.31Å; L69-D71 PolarHBondContact O-N 3.37Å; L69-F102 HydrophobicContact CD1-CB 3.86Å; L69-F102 HydrophobicContact CD1-CD1 3.54Å; L69-F102 HydrophobicContact CD1-CE1 4.29Å; L69-F102 HydrophobicContact CD1-CG 3.93Å; L69-L104 HydrophobicContact CD2-CB 4.33Å; L69-L104 HydrophobicContact CD2-CD2 3.89Å; L69-W114 HydrophobicContact CD2-CZ2 4.31Å
70	L	65	Low	75.3	Confident	51 Å²	51	60 Å²	60	27%	0.267	31%	0.312	S	S	.	.			trans	-86.1	77.7	169.6	-85.3	150.7	0	0	0	108.1	K72 N109 L110	L70-K72 PolarHBondContact O-N 2.86Å; L70-N109 VanDerWaalsContact CD1-C 3.49Å; L70-N109 HydrophobicContact CD1-CB 3.7Å; L70-L110 HydrophobicContact CB-CD1 4.4Å; L70-L110 VanDerWaalsContact CD1-CA 3.45Å; L70-L110 HydrophobicContact CD1-CB 3.81Å; L70-L110 HydrophobicContact CD1-CD1 4.12Å; L70-L110 VanDerWaalsContact CD1-N 3.27Å; L70-L110 HydrophobicContact CG-CD1 4.49Å
71	D	59.2	Low	75.6	Confident	73 Å²	73	63.1 Å²	63.1	39%	0.39	32%	0.322	S	S	.	.			trans	-68.7	124.3	163.2	177	22.5	0	0	0	108.8	L69 A73 T74 G75	L69-D71 VanDerWaalsContact C-N 3.31Å; L69-D71 PolarHBondContact O-N 3.37Å; D71-A73 PolarHBondContact O-N 3.15Å; D71-A73 PolarHBondContact OD1-N 2.73Å; D71-A73 VanDerWaalsContact OD1-N 3.11Å; D71-T74 PolarHBondContact OD2-N 2.87Å; D71-T74 PolarHBondContact OD2-OG1 3.18Å; D71-G75 PolarHBondContact O-N 2.79Å; D71-G75 VanDerWaalsContact O-N 3.11Å
72	K	53.8	Low	75.6	Confident	195 Å²	195	64 Å²	64	85%	0.848	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-24.4	179.1	-66.7	-176	179.8	-178.9	0	112.1	L70	L70-K72 PolarHBondContact O-N 2.86Å
73	A	48.9	Very low	75.5	Confident	88 Å²	88	67 Å²	67	73%	0.727	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-36.6	-174.8	0	0	0	0	0	113.8	D71	D71-A73 PolarHBondContact O-N 3.15Å; D71-A73 PolarHBondContact OD1-N 2.73Å; D71-A73 VanDerWaalsContact OD1-N 3.11Å
74	T	52.7	Low	74.9	Confident	88 Å²	88	67.4 Å²	67.4	54%	0.54	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-21	-170.2	62	0	0	0	0	114.8	D71 R76	D71-T74 PolarHBondContact OD2-N 2.87Å; D71-T74 PolarHBondContact OD2-OG1 3.18Å; T74-R76 PolarHBondContact O-N 2.82Å
75	G	53.1	Low	73.8	Confident	54 Å²	54	67.2 Å²	67.2	56%	0.557	36%	0.357	S	S	*	.			trans	57	11.5	-174.5	0	0	0	0	0	114.3	D71	D71-G75 PolarHBondContact O-N 2.79Å; D71-G75 VanDerWaalsContact O-N 3.11Å
76	R	54	Low	72.5	Confident	200 Å²	200	67.7 Å²	67.7	76%	0.755	36%	0.361	S	S	*	.			trans	-95.6	130.7	-177.4	-70.9	-169.4	-174	-163.4	2.5	109.7	T74	T74-R76 PolarHBondContact O-N 2.82Å
77	A	63.3	Low	71.4	Confident	53 Å²	53	72.8 Å²	72.8	44%	0.438	38%	0.38	S	S	.	.			trans	-60.6	136.3	165.9	0	0	0	0	0	109.5	E79	A77-E79 PolarHBondContact O-N 2.94Å
78	E	70.8	Confident	70.7	Confident	86 Å²	86	76.9 Å²	76.9	40%	0.402	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	109.8	172.6	-75.7	-160.4	-163.7	0	0	109.5	K80 F102	E78-K80 WeakPolarHBondContact OE2-CE 3.36Å; E78-K80 IonicContact OE2-NZ 2.77Å; E78-K80 PolarHBondContact OE2-NZ 2.83Å; E78-F102 HydrophobicContact CB-CD1 4.41Å; E78-F102 HydrophobicContact CB-CE1 3.8Å; E78-F102 HydrophobicContact CG-CE1 4.43Å; E78-F102 WeakPolarHBondContact OE2-CD1 3.14Å; E78-F102 VanDerWaalsContact OE2-CE1 3.24Å; E78-F102 WeakPolarHBondContact OE2-CE1 3.19Å
79	E	84.5	Confident	70.1	Confident	120 Å²	120	76.8 Å²	76.8	56%	0.561	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	129	166.7	-171.7	-175.1	171.7	0	0	109.4	R64 Y65 A77	R64-E79 WeakPolarHBondContact CD-OE1 3.32Å; R64-E79 IonicContact NE-OE1 3.08Å; R64-E79 PolarHBondContact NE-OE1 2.93Å; Y65-E79 WeakPolarHBondContact O-CA 3.42Å; A77-E79 PolarHBondContact O-N 2.94Å
80	K	90.1	Very high	69.8	Low	61 Å²	61	79.3 Å²	79.3	27%	0.265	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	137.2	171.5	-64	-64	177.8	-171.6	0	109.8	R64 Y65 E78 N100 F102	R64-K80 VanDerWaalsContact CA-O 3.31Å; R64-K80 WeakPolarHBondContact CA-O 3.39Å; Y65-K80 HydrophobicContact CD1-CB 4.13Å; Y65-K80 HydrophobicContact CD2-CB 4.36Å; Y65-K80 HydrophobicContact CE1-CB 3.55Å; Y65-K80 HydrophobicContact CE1-CG 4.37Å; Y65-K80 HydrophobicContact CE2-CB 3.84Å; Y65-K80 HydrophobicContact CE2-CG 3.92Å; Y65-K80 VanDerWaalsContact CZ-CB 3.4Å; Y65-K80 PolarHBondContact N-O 3.22Å; Y65-K80 PolarHBondContact O-N 2.83Å; E78-K80 WeakPolarHBondContact OE2-CE 3.36Å; E78-K80 IonicContact OE2-NZ 2.77Å; E78-K80 PolarHBondContact OE2-NZ 2.83Å; K80-N100 WeakPolarHBondContact CE-ND2 3.47Å; K80-F102 HydrophobicContact CD-CZ 4.49Å; K80-F102 VanDerWaalsContact CE-CE1 3.47Å; K80-F102 HydrophobicContact CG-CE1 4.2Å; K80-F102 HydrophobicContact CG-CZ 3.76Å
81	R	91.8	Very high	70.2	Confident	111 Å²	111	79.3 Å²	79.3	42%	0.419	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126	176.4	-173.5	179.4	-178.7	164.6	4.4	109.2	F62 L63 R64 E134	F62-R81 HydrophobicContact CD2-CG 3.93Å; F62-R81 VanDerWaalsContact CD2-NE 3.32Å; F62-R81 VanDerWaalsContact CE2-NH2 3.32Å; L63-R81 WeakPolarHBondContact O-CA 3.43Å; R64-R81 HydrophobicContact CG-CB 4.43Å; R64-R81 HydrophobicContact CG-CG 4.21Å; R64-R81 VanDerWaalsContact NH2-NH1 3.17Å; R81-E134 IonicContact CZ-OE1 3.8Å; R81-E134 IonicContact CZ-OE2 3.24Å; R81-E134 IonicContact NH1-OE1 3.9Å; R81-E134 PolarHBondContact NH1-OE1 2.85Å; R81-E134 VanDerWaalsContact NH1-OE1 3.11Å; R81-E134 IonicContact NH1-OE2 2.84Å; R81-E134 VanDerWaalsContact NH2-CD 3.27Å; R81-E134 IonicContact NH2-OE1 2.91Å; R81-E134 PolarHBondContact NH2-OE1 3.07Å; R81-E134 IonicContact NH2-OE2 3.89Å
82	V	89.3	Confident	71.3	Confident	19 Å²	19	79.8 Å²	79.8	12%	0.115	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.9	179.1	-174	0	0	0	0	108.1	F62 L63 Y65 F96 H98	F62-V82 CarbonylContact C-O 3.54Å; F62-V82 WeakPolarHBondContact CA-O 3.47Å; F62-V82 VanDerWaalsContact CB-O 3.28Å; F62-V82 WeakPolarHBondContact CB-O 3.33Å; L63-V82 HydrophobicContact CD1-CB 3.65Å; L63-V82 HydrophobicContact CD1-CG2 3.62Å; L63-V82 HydrophobicContact CG-CB 3.86Å; L63-V82 HydrophobicContact CG-CG2 4.37Å; L63-V82 PolarHBondContact N-O 3.35Å; L63-V82 PolarHBondContact O-N 3.06Å; Y65-V82 HydrophobicContact CE1-CG2 4.31Å; V82-F96 HydrophobicContact CB-CD1 4.42Å; V82-F96 HydrophobicContact CG1-CD1 3.95Å; V82-H98 HydrophobicContact CG1-CB 3.98Å; V82-H98 HydrophobicContact CG2-CB 4.12Å; V82-H98 VanDerWaalsContact CG2-CG 3.43Å; V82-H98 WeakPolarHBondContact CG2-ND1 3.36Å
83	S	87	Confident	72.8	Confident	62 Å²	62	73 Å²	73	43%	0.434	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	136	-176	71.2	0	0	0	0	112	Q60	Q60-S83 PolarHBondContact NE2-OG 2.8Å
84	I	81.4	Confident	74.6	Confident	9 Å²	9	68.8 Å²	68.8	5%	0.046	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127.5	173.8	-65.9	169.5	0	0	0	108.2	Q60 L61 D88 L89 V94 N95 F96	Q60-I84 WeakPolarHBondContact CG-O 3.33Å; L61-I84 PolarHBondContact O-N 3.11Å; I84-D88 HydrophobicContact CG2-CB 3.81Å; I84-L89 HydrophobicContact CB-CD2 4.39Å; I84-L89 HydrophobicContact CG2-CD2 3.98Å; I84-V94 HydrophobicContact CD1-CG1 3.21Å; I84-V94 HydrophobicContact CG1-CG1 4.49Å; I84-N95 VanDerWaalsContact CD1-O 3.27Å; I84-N95 WeakPolarHBondContact CD1-O 3.01Å; I84-F96 HydrophobicContact CD1-CB 4.27Å; I84-F96 HydrophobicContact CD1-CD1 3.27Å; I84-F96 HydrophobicContact CD1-CD2 3.92Å; I84-F96 HydrophobicContact CD1-CE1 3.41Å; I84-F96 VanDerWaalsContact CD1-CE1 3.41Å; I84-F96 HydrophobicContact CD1-CE2 4.05Å; I84-F96 HydrophobicContact CD1-CG 3.56Å; I84-F96 HydrophobicContact CD1-CZ 3.82Å; I84-F96 HydrophobicContact CG1-CD1 3.69Å; I84-F96 HydrophobicContact CG1-CE1 3.85Å; I84-F96 HydrophobicContact CG1-CG 4.37Å
85	P	71.4	Confident	76.2	Confident	51 Å²	51	67.4 Å²	67.4	33%	0.331	35%	0.35	S	S	.	.			trans	-69.5	150.2	178.4	31.8	-35.5	0	0	0	110.4	R87 D88	P85-R87 HydrophobicContact CB-CG 4.26Å; P85-R87 HydrophobicContact CG-CG 4.1Å; P85-R87 PolarHBondContact O-N 3.45Å; P85-D88 WeakPolarHBondContact CG-OD2 3.35Å; P85-D88 PolarHBondContact O-N 2.89Å
86	A	68.1	Low	77.9	Confident	13 Å²	13	65.7 Å²	65.7	11%	0.107	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-46	-32.4	-177.6	0	0	0	0	0	116.1	K56 A59 D88 L89	K56-A86 VanDerWaalsContact C-CB 3.45Å; K56-A86 CarbonylContact O-C 3.46Å; K56-A86 WeakPolarHBondContact O-CB 3.5Å; A59-A86 VanDerWaalsContact O-CA 3.32Å; A59-A86 WeakPolarHBondContact O-CA 3.24Å; A59-A86 WeakPolarHBondContact O-CB 3.39Å; A86-D88 VanDerWaalsContact C-N 3.32Å; A86-D88 PolarHBondContact O-N 3.44Å; A86-L89 WeakPolarHBondContact O-CB 3.12Å; A86-L89 PolarHBondContact O-N 2.89Å
87	R	66.7	Low	79.4	Confident	172 Å²	172	59 Å²	59	65%	0.649	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-68.8	-28.7	-178.5	59.8	177.9	-179.5	-155.6	-2.4	113.7	P85	P85-R87 HydrophobicContact CB-CG 4.26Å; P85-R87 HydrophobicContact CG-CG 4.1Å; P85-R87 PolarHBondContact O-N 3.45Å
88	D	70.7	Confident	80.7	Confident	87 Å²	87	58.2 Å²	58.2	47%	0.465	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-97.5	2.7	-175.1	-58.3	-35.3	0	0	0	111.4	I84 P85 A86 L90	I84-D88 HydrophobicContact CG2-CB 3.81Å; P85-D88 WeakPolarHBondContact CG-OD2 3.35Å; P85-D88 PolarHBondContact O-N 2.89Å; A86-D88 VanDerWaalsContact C-N 3.32Å; A86-D88 PolarHBondContact O-N 3.44Å; D88-L90 PolarHBondContact O-N 2.95Å
89	L	70.5	Confident	81.7	Confident	5 Å²	5	61 Å²	61	3%	0.026	30%	0.3	C	S	.	.			trans	-77.3	112.3	175.8	-64.8	178.4	0	0	0	110.1	Y47 L61 I84 A86 V94	Y47-L89 HydrophobicContact CE2-CB 4.3Å; Y47-L89 HydrophobicContact CE2-CD1 4.1Å; Y47-L89 HydrophobicContact CE2-CD2 4.34Å; Y47-L89 HydrophobicContact CE2-CG 4.48Å; Y47-L89 WeakPolarHBondContact OH-CB 3.09Å; L61-L89 HydrophobicContact CB-CD1 4.42Å; L61-L89 HydrophobicContact CB-CD2 3.6Å; I84-L89 HydrophobicContact CB-CD2 4.39Å; I84-L89 HydrophobicContact CG2-CD2 3.98Å; A86-L89 WeakPolarHBondContact O-CB 3.12Å; A86-L89 PolarHBondContact O-N 2.89Å; L89-V94 HydrophobicContact CD2-CG1 4.11Å; L89-V94 HydrophobicContact CD2-CG2 4.34Å
90	L	72.8	Confident	82.1	Confident	68 Å²	68	57.2 Å²	57.2	36%	0.356	28%	0.284	S	S	.	.			trans	-98.9	152.8	167.8	-50.8	171.5	0	0	0	110.1	Y47 D88 T92 I93	Y47-L90 WeakPolarHBondContact CE1-O 3.24Å; Y47-L90 PolarHBondContact OH-O 2.74Å; D88-L90 PolarHBondContact O-N 2.95Å; L90-T92 PolarHBondContact O-N 3.11Å; L90-I93 VanDerWaalsContact CB-O 3.28Å; L90-I93 WeakPolarHBondContact CB-O 3.28Å
91	P	73.4	Confident	82	Confident	51 Å²	51	57.7 Å²	57.7	33%	0.331	29%	0.292	S	S	.	.	S	Bend	trans	-58.6	-35.2	177.9	-24.7	34.4	0	0	0	113.5	A43 V51	A43-P91 VanDerWaalsContact CB-O 3.29Å; A43-P91 WeakPolarHBondContact CB-O 3.38Å; V51-P91 HydrophobicContact CB-CG 4.5Å; V51-P91 HydrophobicContact CG1-CG 3.86Å
92	T	82.7	Confident	81.9	Confident	83 Å²	83	52.7 Å²	52.7	51%	0.509	27%	0.273	S	S	.	.	S	Bend	trans	-106.3	-35.6	-169.4	49.9	0	0	0	0	113.8	Y39 W40 L90	Y39-T92 CarbonylContact C-O 3.56Å; Y39-T92 WeakPolarHBondContact CA-O 3.47Å; W40-T92 PolarHBondContact N-O 2.97Å; L90-T92 PolarHBondContact O-N 3.11Å
93	I	85.6	Confident	81.8	Confident	51 Å²	51	56.5 Å²	56.5	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	126.3	-173.6	-52.6	176.5	0	0	0	109.7	C37 L38 Y39 L90 N95	C37-I93 HydrophobicContact CB-CG2 4.2Å; L38-I93 CarbonylContact O-C 3.57Å; L38-I93 WeakPolarHBondContact O-CA 3.27Å; Y39-I93 HydrophobicContact CD1-CB 4.47Å; Y39-I93 HydrophobicContact CD1-CD1 3.98Å; Y39-I93 HydrophobicContact CD1-CG1 3.65Å; Y39-I93 HydrophobicContact CD1-CG2 4.26Å; Y39-I93 HydrophobicContact CE1-CD1 3.59Å; Y39-I93 HydrophobicContact CE1-CG1 3.75Å; Y39-I93 HydrophobicContact CE1-CG2 4Å; L90-I93 VanDerWaalsContact CB-O 3.28Å; L90-I93 WeakPolarHBondContact CB-O 3.28Å; I93-N95 WeakPolarHBondContact CG2-OD1 3.41Å
94	V	86.3	Confident	81.9	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	107	177.9	176.6	0	0	0	0	108.1	C37 L38 Y47 L61 I84 L89 F96	C37-V94 CarbonylContact C-O 3.53Å; C37-V94 VanDerWaalsContact CA-O 3.29Å; C37-V94 WeakPolarHBondContact CA-O 3.09Å; L38-V94 HydrophobicContact CB-CB 4.12Å; L38-V94 HydrophobicContact CD2-CB 4.18Å; L38-V94 HydrophobicContact CG-CB 4.33Å; L38-V94 PolarHBondContact N-O 3.31Å; L38-V94 PolarHBondContact O-N 2.48Å; Y47-V94 VanDerWaalsContact OH-CG2 3.25Å; Y47-V94 WeakPolarHBondContact OH-CG2 3.4Å; L61-V94 HydrophobicContact CD2-CG1 4.26Å; I84-V94 HydrophobicContact CD1-CG1 3.21Å; I84-V94 HydrophobicContact CG1-CG1 4.49Å; L89-V94 HydrophobicContact CD2-CG1 4.11Å; L89-V94 HydrophobicContact CD2-CG2 4.34Å; V94-F96 HydrophobicContact CG1-CE2 4.05Å; V94-F96 HydrophobicContact CG1-CZ 4.25Å
95	N	87.2	Confident	82.2	Confident	59 Å²	59	58.1 Å²	58.1	32%	0.316	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	112.3	-175.7	-65.9	-38.8	0	0	0	110.7	C37 I84 I93	C37-N95 VanDerWaalsContact CB-OD1 3.22Å; C37-N95 WeakPolarHBondContact CB-OD1 3.16Å; I84-N95 VanDerWaalsContact CD1-O 3.27Å; I84-N95 WeakPolarHBondContact CD1-O 3.01Å; I93-N95 WeakPolarHBondContact CG2-OD1 3.41Å
96	F	87.5	Confident	82.9	Confident	18 Å²	18	56.3 Å²	56.3	8%	0.079	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-41.7	174.2	-71.6	-84.8	0	0	0	111.5	I35 E36 L38 L61 L63 V82 I84 V94 H98	I35-F96 HydrophobicContact CG2-CB 4.3Å; I35-F96 HydrophobicContact CG2-CD2 4.4Å; I35-F96 HydrophobicContact CG2-CG 4.49Å; E36-F96 PolarHBondContact O-N 2.92Å; L38-F96 HydrophobicContact CB-CD2 4.29Å; L38-F96 HydrophobicContact CB-CE2 3.72Å; L38-F96 HydrophobicContact CD2-CE2 4.1Å; L61-F96 HydrophobicContact CD2-CE1 4.16Å; L61-F96 HydrophobicContact CD2-CE2 4.29Å; L61-F96 HydrophobicContact CD2-CZ 3.41Å; L61-F96 VanDerWaalsContact CD2-CZ 3.41Å; L63-F96 HydrophobicContact CB-CE1 4.04Å; L63-F96 HydrophobicContact CB-CZ 4.1Å; L63-F96 HydrophobicContact CD2-CB 4.34Å; L63-F96 HydrophobicContact CD2-CD1 3.37Å; L63-F96 HydrophobicContact CD2-CD2 3.79Å; L63-F96 HydrophobicContact CD2-CE1 3.42Å; L63-F96 VanDerWaalsContact CD2-CE1 3.42Å; L63-F96 HydrophobicContact CD2-CE2 3.81Å; L63-F96 HydrophobicContact CD2-CG 3.56Å; L63-F96 HydrophobicContact CD2-CZ 3.62Å; L63-F96 HydrophobicContact CG-CD1 3.84Å; L63-F96 HydrophobicContact CG-CE1 3.58Å; L63-F96 HydrophobicContact CG-CG 4.5Å; L63-F96 HydrophobicContact CG-CZ 4.03Å; V82-F96 HydrophobicContact CB-CD1 4.42Å; V82-F96 HydrophobicContact CG1-CD1 3.95Å; I84-F96 HydrophobicContact CD1-CB 4.27Å; I84-F96 HydrophobicContact CD1-CD1 3.27Å; I84-F96 HydrophobicContact CD1-CD2 3.92Å; I84-F96 HydrophobicContact CD1-CE1 3.41Å; I84-F96 VanDerWaalsContact CD1-CE1 3.41Å; I84-F96 HydrophobicContact CD1-CE2 4.05Å; I84-F96 HydrophobicContact CD1-CG 3.56Å; I84-F96 HydrophobicContact CD1-CZ 3.82Å; I84-F96 HydrophobicContact CG1-CD1 3.69Å; I84-F96 HydrophobicContact CG1-CE1 3.85Å; I84-F96 HydrophobicContact CG1-CG 4.37Å; V94-F96 HydrophobicContact CG1-CE2 4.05Å; V94-F96 HydrophobicContact CG1-CZ 4.25Å; F96-H98 HydrophobicContact CB-CB 4.34Å; F96-H98 PolarHBondContact O-N 3.23Å
97	N	87	Confident	83.9	Confident	61 Å²	61	58 Å²	58	33%	0.326	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	46.4	35.5	-174.6	-66	-48.1	0	0	0	112.8	I35 E36	I35-N97 CarbonylContact O-C 3.52Å; I35-N97 PolarHBondContact O-N 3.04Å; E36-N97 PolarHBondContact O-N 3.43Å
98	H	90.9	Very high	84.9	Confident	35 Å²	35	50.6 Å²	50.6	16%	0.162	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	129.1	-173.8	175.5	65.1	0	0	0	109.9	Y34 I35 Y65 V82 F96	Y34-H98 CarbonylContact C-O 3.51Å; Y34-H98 WeakPolarHBondContact CA-O 3.2Å; Y34-H98 WeakPolarHBondContact CD2-O 3.36Å; I35-H98 HydrophobicContact CB-CB 4.29Å; I35-H98 PolarHBondContact N-O 3.21Å; I35-H98 PolarHBondContact O-N 3.21Å; Y65-H98 AromaticContact CE1-CD2 3.69Å; Y65-H98 AromaticContact CE1-NE2 3.52Å; Y65-H98 AromaticContact CZ-NE2 3.61Å; Y65-H98 PolarHBondContact OH-NE2 3Å; V82-H98 HydrophobicContact CG1-CB 3.98Å; V82-H98 HydrophobicContact CG2-CB 4.12Å; V82-H98 VanDerWaalsContact CG2-CG 3.43Å; V82-H98 WeakPolarHBondContact CG2-ND1 3.36Å; F96-H98 HydrophobicContact CB-CB 4.34Å; F96-H98 PolarHBondContact O-N 3.23Å
99	R	91.8	Very high	85.7	Confident	146 Å²	146	51 Å²	51	55%	0.551	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	128	176	-72.3	176	-176.6	-169.6	4.2	108.1	V33 Y34	V33-R99 WeakPolarHBondContact O-CA 3.4Å; Y34-R99 HydrophobicContact CD2-CG 3.38Å; Y34-R99 HydrophobicContact CE2-CG 3.78Å; Y34-R99 VanDerWaalsContact CE2-NE 3.28Å; Y34-R99 HydrophobicContact CG-CG 4.48Å
100	N	91.3	Very high	86.5	Confident	39 Å²	39	50.9 Å²	50.9	21%	0.209	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	147.5	170.6	-163.4	46.7	0	0	0	110.9	V33 Y65 K80 F102	V33-N100 PolarHBondContact N-O 3.37Å; V33-N100 PolarHBondContact O-N 2.92Å; Y65-N100 WeakPolarHBondContact OH-CB 3.38Å; K80-N100 WeakPolarHBondContact CE-ND2 3.47Å; N100-F102 HydrophobicContact CB-CE2 4.17Å; N100-F102 WeakPolarHBondContact ND2-CE1 3.34Å; N100-F102 WeakPolarHBondContact ND2-CE2 3.44Å; N100-F102 WeakPolarHBondContact ND2-CZ 3.27Å
101	V	89.3	Confident	87.4	Confident	72 Å²	72	48 Å²	48	44%	0.436	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.5	175.4	-174.3	0	0	0	0	108	F30 L31 K32	F30-V101 HydrophobicContact CB-CG1 3.81Å; F30-V101 HydrophobicContact CD2-CG1 4.07Å; F30-V101 HydrophobicContact CG-CG1 4.08Å; L31-V101 CarbonylContact O-C 3.59Å; L31-V101 WeakPolarHBondContact O-CA 3.18Å; K32-V101 HydrophobicContact CG-CG2 4.13Å
102	F	89.1	Confident	88	Confident	5 Å²	5	48.4 Å²	48.4	2%	0.022	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.1	174.7	-62.5	-90.2	0	0	0	108.5	F30 L31 V33 Y65 I67 L69 E78 K80 N100	F30-F102 CarbonylContact C-O 3.6Å; F30-F102 WeakPolarHBondContact CA-O 3.26Å; F30-F102 VanDerWaalsContact CB-O 3.28Å; F30-F102 WeakPolarHBondContact CB-O 3.21Å; L31-F102 PolarHBondContact N-O 2.99Å; L31-F102 PolarHBondContact O-N 3.26Å; V33-F102 HydrophobicContact CB-CE2 4.34Å; V33-F102 HydrophobicContact CG2-CD2 4.12Å; V33-F102 HydrophobicContact CG2-CE2 3.85Å; Y65-F102 HydrophobicContact CE2-CE2 4.02Å; Y65-F102 AromaticContact CE2-CZ 3.81Å; Y65-F102 HydrophobicContact CE2-CZ 3.81Å; I67-F102 HydrophobicContact CD1-CD2 3.68Å; I67-F102 HydrophobicContact CD1-CE2 3.25Å; I67-F102 HydrophobicContact CD1-CG 4.5Å; I67-F102 HydrophobicContact CD1-CZ 3.76Å; I67-F102 HydrophobicContact CG1-CE2 4.32Å; I67-F102 HydrophobicContact CG1-CZ 4.38Å; L69-F102 HydrophobicContact CD1-CB 3.86Å; L69-F102 HydrophobicContact CD1-CD1 3.54Å; L69-F102 HydrophobicContact CD1-CE1 4.29Å; L69-F102 HydrophobicContact CD1-CG 3.93Å; E78-F102 HydrophobicContact CB-CD1 4.41Å; E78-F102 HydrophobicContact CB-CE1 3.8Å; E78-F102 HydrophobicContact CG-CE1 4.43Å; E78-F102 WeakPolarHBondContact OE2-CD1 3.14Å; E78-F102 VanDerWaalsContact OE2-CE1 3.24Å; E78-F102 WeakPolarHBondContact OE2-CE1 3.19Å; K80-F102 HydrophobicContact CD-CZ 4.49Å; K80-F102 VanDerWaalsContact CE-CE1 3.47Å; K80-F102 HydrophobicContact CG-CE1 4.2Å; K80-F102 HydrophobicContact CG-CZ 3.76Å; N100-F102 HydrophobicContact CB-CE2 4.17Å; N100-F102 WeakPolarHBondContact ND2-CE1 3.34Å; N100-F102 WeakPolarHBondContact ND2-CE2 3.44Å; N100-F102 WeakPolarHBondContact ND2-CZ 3.27Å
103	L	87.7	Confident	88.3	Confident	100 Å²	100	49.2 Å²	49.2	52%	0.524	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	132.9	169.6	-60.6	179.5	0	0	0	108.3	F30	F30-L103 HydrophobicContact CB-CD2 4.23Å
104	L	88.7	Confident	88.7	Confident	24 Å²	24	46.8 Å²	46.8	13%	0.126	24%	0.236	C	C	.	.			trans	-150.2	161	-180	64.7	83	0	0	0	111.2	V28 T29 L31 L69 V106 L110 W114	V28-L104 HydrophobicContact CG1-CD1 3.84Å; T29-L104 CarbonylContact C-O 3.58Å; T29-L104 VanDerWaalsContact CA-O 3.28Å; T29-L104 WeakPolarHBondContact CA-O 3.26Å; T29-L104 PolarHBondContact O-N 3.04Å; L31-L104 HydrophobicContact CB-CD2 3.53Å; L69-L104 HydrophobicContact CD2-CB 4.33Å; L69-L104 HydrophobicContact CD2-CD2 3.89Å; L104-V106 HydrophobicContact CD1-CG2 3.36Å; L104-L110 HydrophobicContact CD1-CD2 4.34Å; L104-W114 HydrophobicContact CD2-CH2 3.76Å; L104-W114 HydrophobicContact CD2-CZ2 4Å
105	S	86.6	Confident	88.9	Confident	80 Å²	80	48 Å²	48	56%	0.559	25%	0.246	S	C	*	.			trans	-122.6	115.8	168.7	173.2	0	0	0	0	107.2	N107	S105-N107 PolarHBondContact O-N 3.16Å
106	V	87.7	Confident	89	Confident	13 Å²	13	51.2 Å²	51.2	8%	0.079	26%	0.26	C	S	.	.			trans	-72.5	127.6	179.8	-177.5	0	0	0	0	109.1	L25 V28 L104 M111	L25-V106 HydrophobicContact CB-CG1 4.4Å; L25-V106 WeakPolarHBondContact O-CB 3.3Å; V28-V106 HydrophobicContact CB-CG2 3.7Å; V28-V106 HydrophobicContact CG1-CG2 3.83Å; L104-V106 HydrophobicContact CD1-CG2 3.36Å; V106-M111 HydrophobicContact CG1-CE 4.2Å; V106-M111 HydrophobicContact CG1-CG 3.41Å; V106-M111 VanDerWaalsContact CG1-CG 3.41Å; V106-M111 HydrophobicContact CG1-SD 3.68Å
107	N	87.8	Confident	89.2	Confident	48 Å²	48	53.5 Å²	53.5	26%	0.257	27%	0.27	S	S	.	.			trans	-136.4	168.5	174.5	59.4	56.8	0	0	0	109.3	S105 N109 L110 M111	S105-N107 PolarHBondContact O-N 3.16Å; N107-N109 VanDerWaalsContact C-N 3.26Å; N107-N109 PolarHBondContact O-N 2.91Å; N107-N109 WeakPolarHBondContact OD1-CB 3.32Å; N107-N109 PolarHBondContact OD1-N 3.47Å; N107-L110 PolarHBondContact O-N 3.39Å; N107-L110 PolarHBondContact OD1-N 2.85Å; N107-M111 PolarHBondContact O-N 3.35Å
108	T	87.7	Confident	89.4	Confident	17 Å²	17	52.8 Å²	52.8	10%	0.104	27%	0.267	C	S	.	.	H	α-helix	trans	-52.3	-43.5	-177.6	-48.4	0	0	0	0	112.4	W22 L110 M111 Q112	W22-T108 HydrophobicContact CH2-CG2 4.21Å; T108-L110 PolarHBondContact O-N 3.45Å; T108-M111 PolarHBondContact O-N 3.22Å; T108-Q112 WeakPolarHBondContact O-CB 3.4Å; T108-Q112 PolarHBondContact O-N 3.39Å
109	N	87.1	Confident	89.5	Confident	96 Å²	96	51.2 Å²	51.2	51%	0.513	26%	0.259	S	S	.	.	H	α-helix	trans	-64.1	-39.3	179.3	-64.1	-39.3	0	0	0	112.5	L70 N107 R113	L70-N109 VanDerWaalsContact CD1-C 3.49Å; L70-N109 HydrophobicContact CD1-CB 3.7Å; N107-N109 VanDerWaalsContact C-N 3.26Å; N107-N109 PolarHBondContact O-N 2.91Å; N107-N109 WeakPolarHBondContact OD1-CB 3.32Å; N107-N109 PolarHBondContact OD1-N 3.47Å; N109-R113 WeakPolarHBondContact O-CG 3.43Å; N109-R113 PolarHBondContact O-N 2.74Å
110	L	89	Confident	89.7	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-67.8	-42.4	177.1	-173.4	63.2	0	0	0	111.2	P68 L70 L104 N107 T108 R113 W114	P68-L110 WeakPolarHBondContact O-CD1 3.17Å; L70-L110 HydrophobicContact CB-CD1 4.4Å; L70-L110 VanDerWaalsContact CD1-CA 3.45Å; L70-L110 HydrophobicContact CD1-CB 3.81Å; L70-L110 HydrophobicContact CD1-CD1 4.12Å; L70-L110 VanDerWaalsContact CD1-N 3.27Å; L70-L110 HydrophobicContact CG-CD1 4.49Å; L104-L110 HydrophobicContact CD1-CD2 4.34Å; N107-L110 PolarHBondContact O-N 3.39Å; N107-L110 PolarHBondContact OD1-N 2.85Å; T108-L110 PolarHBondContact O-N 3.45Å; L110-R113 PolarHBondContact O-N 2.79Å; L110-W114 HydrophobicContact CD1-CZ2 4.39Å; L110-W114 HydrophobicContact CD2-CZ2 4.14Å; L110-W114 HydrophobicContact CG-CD2 4.37Å; L110-W114 HydrophobicContact CG-CZ2 4.35Å; L110-W114 WeakPolarHBondContact O-CB 3.22Å; L110-W114 PolarHBondContact O-N 2.9Å
111	M	89.7	Confident	89.9	Confident	6 Å²	6	47.5 Å²	47.5	3%	0.03	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-42.3	177.7	-67.4	-174.2	-76.5	0	0	111.4	W22 L25 V106 N107 T108 R113 W114 A115 L148 L300	W22-M111 HydrophobicContact CD2-CE 4.26Å; W22-M111 HydrophobicContact CE3-CE 3.91Å; W22-M111 HydrophobicContact CE3-SD 4.23Å; W22-M111 HydrophobicContact CH2-CE 3.13Å; W22-M111 HydrophobicContact CH2-SD 4.34Å; W22-M111 HydrophobicContact CZ2-CE 3.48Å; W22-M111 VanDerWaalsContact CZ2-CE 3.48Å; W22-M111 HydrophobicContact CZ3-CE 3.36Å; W22-M111 HydrophobicContact CZ3-SD 3.98Å; L25-M111 HydrophobicContact CB-SD 4.23Å; L25-M111 HydrophobicContact CD1-SD 3.83Å; V106-M111 HydrophobicContact CG1-CE 4.2Å; V106-M111 HydrophobicContact CG1-CG 3.41Å; V106-M111 VanDerWaalsContact CG1-CG 3.41Å; V106-M111 HydrophobicContact CG1-SD 3.68Å; N107-M111 PolarHBondContact O-N 3.35Å; T108-M111 PolarHBondContact O-N 3.22Å; M111-R113 PolarHBondContact O-N 2.85Å; M111-W114 PolarHBondContact O-N 3.02Å; M111-A115 WeakPolarHBondContact O-CB 3.42Å; M111-A115 PolarHBondContact O-N 2.87Å; M111-L148 HydrophobicContact CB-CD1 4.45Å; M111-L148 HydrophobicContact CB-CD2 4.34Å; M111-L148 HydrophobicContact CG-CD2 4.01Å; M111-L148 WeakPolarHBondContact O-CD1 3.36Å; M111-L300 HydrophobicContact CB-CD1 4.45Å; M111-L300 HydrophobicContact CB-CD2 3.55Å; M111-L300 HydrophobicContact SD-CD2 4.43Å
112	Q	88	Confident	90.2	Very high	60 Å²	60	45 Å²	45	28%	0.28	23%	0.228	S	C	.	.	H	α-helix	trans	-60.2	-45.7	174.5	-174.1	179.1	-1	0	0	111.4	T108 W114 A115 E116	T108-Q112 WeakPolarHBondContact O-CB 3.4Å; T108-Q112 PolarHBondContact O-N 3.39Å; Q112-W114 VanDerWaalsContact C-N 3.33Å; Q112-W114 PolarHBondContact O-N 2.92Å; Q112-A115 WeakPolarHBondContact O-CB 3.42Å; Q112-A115 PolarHBondContact O-N 3.32Å; Q112-E116 PolarHBondContact NE2-OE1 3.48Å; Q112-E116 PolarHBondContact O-N 3.27Å
113	R	88.8	Confident	90.4	Very high	100 Å²	100	44.7 Å²	44.7	38%	0.377	23%	0.227	S	C	.	.	H	α-helix	trans	-60.3	-43.7	174.8	-74.6	-172.8	-175.1	-176.2	-0.3	112.1	N109 L110 M111 A115 E116 E117	N109-R113 WeakPolarHBondContact O-CG 3.43Å; N109-R113 PolarHBondContact O-N 2.74Å; L110-R113 PolarHBondContact O-N 2.79Å; M111-R113 PolarHBondContact O-N 2.85Å; R113-A115 VanDerWaalsContact C-N 3.27Å; R113-A115 PolarHBondContact O-N 2.84Å; R113-E116 PolarHBondContact O-N 3.31Å; R113-E117 WeakPolarHBondContact O-CB 3.5Å; R113-E117 WeakPolarHBondContact O-CG 3.46Å; R113-E117 PolarHBondContact O-N 2.83Å
114	W	92.6	Very high	90.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-68.5	-26.7	178.2	-75.3	11.8	0	0	0	112.9	L31 P68 L69 L104 L110 M111 Q112 E116 L144 C145 L148 L178	L31-W114 HydrophobicContact CD2-CH2 4.3Å; L31-W114 HydrophobicContact CD2-CZ2 4.27Å; P68-W114 PolarHBondContact O-NE1 3.48Å; L69-W114 HydrophobicContact CD2-CZ2 4.31Å; L104-W114 HydrophobicContact CD2-CH2 3.76Å; L104-W114 HydrophobicContact CD2-CZ2 4Å; L110-W114 HydrophobicContact CD1-CZ2 4.39Å; L110-W114 HydrophobicContact CD2-CZ2 4.14Å; L110-W114 HydrophobicContact CG-CD2 4.37Å; L110-W114 HydrophobicContact CG-CZ2 4.35Å; L110-W114 WeakPolarHBondContact O-CB 3.22Å; L110-W114 PolarHBondContact O-N 2.9Å; M111-W114 PolarHBondContact O-N 3.02Å; Q112-W114 VanDerWaalsContact C-N 3.33Å; Q112-W114 PolarHBondContact O-N 2.92Å; W114-E116 VanDerWaalsContact C-N 3.28Å; W114-E116 PolarHBondContact O-N 3.32Å; W114-L144 HydrophobicContact CB-CB 3.89Å; W114-L144 HydrophobicContact CG-CB 4.04Å; W114-L144 HydrophobicContact CG-CD1 4.26Å; W114-L144 CarbonylContact O-C 3.52Å; W114-L144 VanDerWaalsContact O-C 3.26Å; W114-L144 WeakPolarHBondContact O-CB 3.41Å; W114-C145 WeakPolarHBondContact O-CA 3.37Å; W114-C145 PolarHBondContact O-N 3.37Å; W114-L148 HydrophobicContact CB-CD1 4.22Å; W114-L148 HydrophobicContact CB-CD2 4.34Å; W114-L148 HydrophobicContact CB-CG 4.45Å; W114-L148 HydrophobicContact CE3-CD2 3.85Å; W114-L178 HydrophobicContact CH2-CD2 3.69Å; W114-L178 HydrophobicContact CZ3-CD1 4.01Å; W114-L178 HydrophobicContact CZ3-CD2 3.63Å; W114-L178 HydrophobicContact CZ3-CG 4.42Å
115	A	90.5	Very high	90.6	Very high	25 Å²	25	41.2 Å²	41.2	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-34.3	172.3	0	0	0	0	0	111.9	M111 Q112 R113 L148 L300	M111-A115 WeakPolarHBondContact O-CB 3.42Å; M111-A115 PolarHBondContact O-N 2.87Å; Q112-A115 WeakPolarHBondContact O-CB 3.42Å; Q112-A115 PolarHBondContact O-N 3.32Å; R113-A115 VanDerWaalsContact C-N 3.27Å; R113-A115 PolarHBondContact O-N 2.84Å; A115-L148 HydrophobicContact CB-CD1 4.32Å; A115-L300 HydrophobicContact CB-CD1 4.04Å
116	E	90	Very high	90.6	Very high	128 Å²	128	39.6 Å²	39.6	60%	0.598	19%	0.188	S	C	*	.	H	α-helix	trans	-98.9	-25.4	-173.8	-63.4	172.3	-165.4	0	0	113.7	Q112 R113 W114	Q112-E116 PolarHBondContact NE2-OE1 3.48Å; Q112-E116 PolarHBondContact O-N 3.27Å; R113-E116 PolarHBondContact O-N 3.31Å; W114-E116 VanDerWaalsContact C-N 3.28Å; W114-E116 PolarHBondContact O-N 3.32Å
117	E	91.4	Very high	90.3	Very high	65 Å²	65	40.4 Å²	40.4	30%	0.304	19%	0.192	S	C	.	.			trans	-99.1	157.9	-172.1	-68.6	-167.7	-141.5	0	0	114.3	P68 R113 L144	P68-E117 VanDerWaalsContact CB-OE2 3.26Å; P68-E117 WeakPolarHBondContact CB-OE2 3.46Å; P68-E117 HydrophobicContact CG-CB 4.26Å; P68-E117 WeakPolarHBondContact CG-OE2 3.48Å; R113-E117 WeakPolarHBondContact O-CB 3.5Å; R113-E117 WeakPolarHBondContact O-CG 3.46Å; R113-E117 PolarHBondContact O-N 2.83Å; E117-L144 HydrophobicContact CB-CD1 4.32Å; E117-L144 WeakPolarHBondContact O-CB 3.41Å; E117-L144 PolarHBondContact O-N 3.46Å; E117-L144 VanDerWaalsContact O-N 3.07Å
118	N	92.1	Very high	89.8	Confident	47 Å²	47	42.7 Å²	42.7	25%	0.251	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.1	173.9	-64.6	-36.6	0	0	0	110.4	Y66 R120 L142 P143	Y66-N118 PolarHBondContact OH-O 2.97Å; Y66-N118 VanDerWaalsContact OH-O 3.13Å; N118-R120 HydrophobicContact CB-CG 4.23Å; N118-R120 PolarHBondContact O-N 3.38Å; N118-L142 CarbonylContact C-O 3.56Å; N118-L142 WeakPolarHBondContact CA-O 3.48Å; N118-P143 VanDerWaalsContact OD1-CA 3.23Å; N118-P143 WeakPolarHBondContact OD1-CA 3.39Å
119	F	93.5	Very high	89.2	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	116.7	160.2	179.6	-117.1	0	0	0	108.2	V33 Y65 Y66 I67 I121 S141 L142 L144 V174 L176	V33-F119 HydrophobicContact CG1-CZ 3.95Å; Y65-F119 AromaticContact CD2-CE2 3.49Å; Y65-F119 HydrophobicContact CD2-CE2 3.49Å; Y65-F119 VanDerWaalsContact CD2-CE2 3.49Å; Y65-F119 AromaticContact CD2-CZ 3.77Å; Y65-F119 HydrophobicContact CD2-CZ 3.77Å; Y65-F119 HydrophobicContact CE2-CE2 4.21Å; Y65-F119 HydrophobicContact CE2-CZ 4.4Å; Y65-F119 AromaticContact CG-CE2 3.99Å; Y65-F119 HydrophobicContact CG-CE2 3.99Å; Y65-F119 AromaticContact CG-CZ 3.92Å; Y65-F119 HydrophobicContact CG-CZ 3.92Å; Y66-F119 WeakPolarHBondContact O-CD2 3.47Å; I67-F119 HydrophobicContact CD1-CD2 4.44Å; I67-F119 HydrophobicContact CD1-CE2 3.98Å; I67-F119 HydrophobicContact CG1-CD2 3.85Å; I67-F119 HydrophobicContact CG1-CE2 3.61Å; F119-I121 HydrophobicContact CD1-CG1 4.26Å; F119-I121 HydrophobicContact CE1-CD1 3.7Å; F119-I121 HydrophobicContact CE1-CG1 3.61Å; F119-I121 HydrophobicContact CZ-CD1 4.26Å; F119-I121 HydrophobicContact CZ-CG1 3.98Å; F119-S141 CarbonylContact O-C 3.45Å; F119-S141 VanDerWaalsContact O-CA 3.26Å; F119-S141 WeakPolarHBondContact O-CA 3.39Å; F119-L142 HydrophobicContact CB-CB 4.38Å; F119-L142 PolarHBondContact N-O 2.83Å; F119-L142 PolarHBondContact O-N 2.82Å; F119-L144 HydrophobicContact CB-CD2 3.8Å; F119-L144 HydrophobicContact CB-CG 4.08Å; F119-V174 HydrophobicContact CD1-CG1 4.43Å; F119-V174 HydrophobicContact CE1-CG1 3.82Å; F119-L176 HydrophobicContact CB-CD1 4.18Å; F119-L176 HydrophobicContact CD1-CD1 3.92Å; F119-L176 HydrophobicContact CD1-CD2 4.36Å; F119-L176 HydrophobicContact CE1-CD1 4.46Å; F119-L176 HydrophobicContact CE1-CD2 4.1Å; F119-L176 HydrophobicContact CG-CD1 4.01Å; F119-L176 HydrophobicContact CZ-CD2 4.22Å
120	R	94.1	Very high	88.4	Confident	108 Å²	108	53.9 Å²	53.9	41%	0.408	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.9	179.7	-55.9	-177	-174	157.7	-0	110.8	Y65 Y66 N118 C140	Y65-R120 WeakPolarHBondContact CA-O 3.27Å; Y65-R120 WeakPolarHBondContact CB-O 3.34Å; Y66-R120 HydrophobicContact CD1-CB 4.29Å; Y66-R120 HydrophobicContact CE1-CB 3.53Å; Y66-R120 HydrophobicContact CE1-CG 3.83Å; Y66-R120 WeakPolarHBondContact OH-CD 3.45Å; Y66-R120 VanDerWaalsContact OH-CG 3.27Å; Y66-R120 WeakPolarHBondContact OH-CG 3.11Å; Y66-R120 PolarHBondContact OH-NE 3.25Å; N118-R120 HydrophobicContact CB-CG 4.23Å; N118-R120 PolarHBondContact O-N 3.38Å; R120-C140 WeakPolarHBondContact CA-O 3.47Å
121	I	95.6	Very high	87.2	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	125.2	170.8	-50	178	0	0	0	107.3	I35 L63 R64 F119 R139 C140 I172 V174	I35-I121 HydrophobicContact CD1-CD1 3.98Å; I35-I121 HydrophobicContact CG1-CD1 4.25Å; L63-I121 HydrophobicContact CB-CG2 3.96Å; L63-I121 HydrophobicContact CD1-CG2 4.48Å; L63-I121 HydrophobicContact CD2-CG2 4.45Å; R64-I121 CarbonylContact O-C 3.49Å; R64-I121 WeakPolarHBondContact O-CA 3.32Å; F119-I121 HydrophobicContact CD1-CG1 4.26Å; F119-I121 HydrophobicContact CE1-CD1 3.7Å; F119-I121 HydrophobicContact CE1-CG1 3.61Å; F119-I121 HydrophobicContact CZ-CD1 4.26Å; F119-I121 HydrophobicContact CZ-CG1 3.98Å; I121-R139 CarbonylContact O-C 3.46Å; I121-R139 WeakPolarHBondContact O-CA 3.26Å; I121-R139 WeakPolarHBondContact O-CG 3.31Å; I121-C140 PolarHBondContact N-O 2.95Å; I121-C140 PolarHBondContact O-N 3.43Å; I121-I172 HydrophobicContact CD1-CD1 4.19Å; I121-I172 HydrophobicContact CG2-CD1 4.37Å; I121-V174 HydrophobicContact CD1-CG1 4.35Å; I121-V174 HydrophobicContact CD1-CG2 3.49Å; I121-V174 VanDerWaalsContact CD1-CG2 3.49Å
122	S	95.7	Very high	85.9	Confident	18 Å²	18	60.8 Å²	60.8	13%	0.126	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	129.9	172.2	-74.1	0	0	0	0	109.3	L63 R64 E136	L63-S122 CarbonylContact C-O 3.36Å; L63-S122 VanDerWaalsContact CA-O 3.3Å; L63-S122 WeakPolarHBondContact CA-O 3.32Å; R64-S122 PolarHBondContact N-O 3.24Å; R64-S122 PolarHBondContact O-N 3.31Å; S122-E136 VanDerWaalsContact CB-OE1 3.22Å; S122-E136 WeakPolarHBondContact CB-OE1 3.29Å; S122-E136 PolarHBondContact OG-OE1 3.23Å
123	I	94.1	Very high	85.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	127.8	179.3	-57.4	166.8	0	0	0	107.7	L38 L61 I137 A138 L160	L38-I123 HydrophobicContact CD1-CD1 3.75Å; L38-I123 HydrophobicContact CD2-CD1 3.97Å; L38-I123 HydrophobicContact CD2-CG2 4.23Å; L38-I123 HydrophobicContact CG-CD1 4.47Å; L61-I123 HydrophobicContact CD1-CG2 4.32Å; L61-I123 HydrophobicContact CD2-CG2 3.7Å; L61-I123 HydrophobicContact CG-CG2 4.04Å; I123-I137 HydrophobicContact CB-CG1 4.21Å; I123-I137 HydrophobicContact CG2-CD1 3.88Å; I123-I137 HydrophobicContact CG2-CG1 3.79Å; I123-I137 VanDerWaalsContact O-CG1 3.32Å; I123-I137 WeakPolarHBondContact O-CG1 3.46Å; I123-I137 PolarHBondContact O-N 2.86Å; I123-A138 HydrophobicContact CB-CB 4.18Å; I123-A138 HydrophobicContact CD1-CB 4.03Å; I123-A138 PolarHBondContact N-O 2.8Å; I123-A138 PolarHBondContact O-N 2.93Å; I123-L160 HydrophobicContact CD1-CD1 4.07Å; I123-L160 HydrophobicContact CD1-CD2 3.59Å; I123-L160 HydrophobicContact CD1-CG 4.48Å
124	Y	92.1	Very high	85.5	Confident	36 Å²	36	62.7 Å²	62.7	14%	0.141	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	147.4	-178.4	-65.8	-95.4	0	0	0	111	L61 F62 R64 E134 I135 E136	L61-Y124 WeakPolarHBondContact CA-O 3.28Å; F62-Y124 HydrophobicContact CD2-CD2 4.11Å; F62-Y124 HydrophobicContact CD2-CG 4.28Å; F62-Y124 HydrophobicContact CE1-CG 4.31Å; F62-Y124 HydrophobicContact CE2-CD1 4.36Å; F62-Y124 AromaticContact CE2-CD2 3.56Å; F62-Y124 HydrophobicContact CE2-CD2 3.56Å; F62-Y124 HydrophobicContact CE2-CE2 4.47Å; F62-Y124 AromaticContact CE2-CG 3.5Å; F62-Y124 HydrophobicContact CE2-CG 3.5Å; F62-Y124 HydrophobicContact CZ-CD1 4.13Å; F62-Y124 HydrophobicContact CZ-CD2 4.1Å; F62-Y124 AromaticContact CZ-CG 3.53Å; F62-Y124 HydrophobicContact CZ-CG 3.53Å; F62-Y124 PolarHBondContact N-O 3.03Å; F62-Y124 PolarHBondContact O-N 2.85Å; R64-Y124 HydrophobicContact CB-CD2 4.41Å; R64-Y124 HydrophobicContact CB-CE2 3.94Å; R64-Y124 HydrophobicContact CG-CD2 4.14Å; R64-Y124 HydrophobicContact CG-CE2 3.94Å; Y124-E134 HydrophobicContact CD1-CB 4.4Å; Y124-I135 CarbonylContact C-O 3.43Å; Y124-I135 VanDerWaalsContact CA-O 3.23Å; Y124-I135 WeakPolarHBondContact CA-O 3.34Å; Y124-E136 HydrophobicContact CD1-CB 3.89Å; Y124-E136 HydrophobicContact CD1-CG 4.41Å; Y124-E136 HydrophobicContact CE1-CB 3.55Å; Y124-E136 HydrophobicContact CE1-CG 3.99Å
125	Y	87.9	Confident	85.3	Confident	14 Å²	14	67.1 Å²	67.1	6%	0.055	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	134.7	170.2	170.6	-86.8	0	0	0	108.8	Y46 E50 A59 N127 I135	Y46-Y125 HydrophobicContact CD2-CE1 4.46Å; Y46-Y125 HydrophobicContact CD2-CE2 4.36Å; Y46-Y125 HydrophobicContact CE2-CD1 4.09Å; Y46-Y125 AromaticContact CE2-CD2 3.92Å; Y46-Y125 HydrophobicContact CE2-CD2 3.92Å; Y46-Y125 HydrophobicContact CE2-CE1 4.36Å; Y46-Y125 HydrophobicContact CE2-CE2 4.14Å; Y46-Y125 AromaticContact CE2-CG 3.9Å; Y46-Y125 HydrophobicContact CE2-CG 3.9Å; E50-Y125 PolarHBondContact OE1-OH 2.81Å; E50-Y125 VanDerWaalsContact OE2-CE2 3.31Å; E50-Y125 WeakPolarHBondContact OE2-CE2 2.99Å; E50-Y125 VanDerWaalsContact OE2-CZ 3.25Å; E50-Y125 PolarHBondContact OE2-OH 3.39Å; A59-Y125 HydrophobicContact CB-CE2 3.55Å; A59-Y125 WeakPolarHBondContact CB-OH 3.42Å; Y125-N127 HydrophobicContact CE1-CB 4.07Å; Y125-N127 PolarHBondContact OH-ND2 3.33Å; Y125-I135 PolarHBondContact N-O 2.84Å; Y125-I135 PolarHBondContact O-N 2.79Å
126	K	87	Confident	85.4	Confident	46 Å²	46	67.9 Å²	67.9	20%	0.2	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.1	176.3	-177.4	176.4	-165.8	161.3	0	109.7	A59 Q60 F62 E134	A59-K126 CarbonylContact C-O 3.56Å; A59-K126 WeakPolarHBondContact CA-O 3.38Å; Q60-K126 PolarHBondContact N-O 2.98Å; Q60-K126 PolarHBondContact O-N 3.42Å; F62-K126 HydrophobicContact CD1-CB 4.5Å; F62-K126 HydrophobicContact CE1-CB 3.99Å; K126-E134 HydrophobicContact CB-CG 4.29Å; K126-E134 HydrophobicContact CD-CG 3.9Å; K126-E134 HydrophobicContact CG-CG 4.2Å; K126-E134 IonicContact NZ-OE1 3.64Å; K126-E134 PolarHBondContact NZ-OE1 3Å; K126-E134 VanDerWaalsContact NZ-OE1 3.08Å
127	N	81.3	Confident	85.5	Confident	30 Å²	30	61.9 Å²	61.9	16%	0.16	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	123.7	167.8	-161.2	-62.5	0	0	0	108.8	E50 S58 Y125 K129 R130	E50-N127 PolarHBondContact OE1-ND2 2.78Å; S58-N127 CarbonylContact O-C 3.4Å; S58-N127 WeakPolarHBondContact O-CA 3.49Å; S58-N127 PolarHBondContact O-OD1 3.19Å; Y125-N127 HydrophobicContact CE1-CB 4.07Å; Y125-N127 PolarHBondContact OH-ND2 3.33Å; N127-K129 VanDerWaalsContact C-N 3.32Å; N127-K129 WeakPolarHBondContact OD1-CB 3.39Å; N127-K129 PolarHBondContact OD1-N 2.9Å; N127-R130 HydrophobicContact CB-CB 4.45Å; N127-R130 PolarHBondContact OD1-N 2.78Å
128	L	78.3	Confident	85.6	Confident	96 Å²	96	58.8 Å²	58.8	50%	0.503	29%	0.291	S	S	.	.	S	Bend	trans	-78.9	-15.3	-179.8	-63.5	173.1	0	0	0	112.8	S58	S58-L128 PolarHBondContact O-N 2.95Å
129	K	75.4	Confident	85.8	Confident	147 Å²	147	60.1 Å²	60.1	64%	0.639	29%	0.292	S	S	*	.	S	Bend	trans	-94	-30.9	-179.2	-71	-177.1	171.6	-177.2	0	113.7	N127	N127-K129 VanDerWaalsContact C-N 3.32Å; N127-K129 WeakPolarHBondContact OD1-CB 3.39Å; N127-K129 PolarHBondContact OD1-N 2.9Å
130	R	68.7	Low	85.9	Confident	202 Å²	202	60.4 Å²	60.4	76%	0.762	29%	0.294	S	S	*	.	S	Bend	trans	-94.4	143.9	173.7	-68.2	-175.2	175	176.2	-2.1	108.3	N127 G132	N127-R130 HydrophobicContact CB-CB 4.45Å; N127-R130 PolarHBondContact OD1-N 2.78Å; R130-G132 PolarHBondContact O-N 3.05Å
131	S	63.6	Low	85.9	Confident	104 Å²	104	58.3 Å²	58.3	73%	0.727	30%	0.296	S	S	*	.	S	Bend	trans	-46.6	93.8	-172.8	57.7	0	0	0	0	113.2	Q133	S131-Q133 PolarHBondContact O-N 3.32Å
132	G	63.2	Low	85.8	Confident	49 Å²	49	58.5 Å²	58.5	51%	0.505	30%	0.297	S	S	.	.	S	Bend	trans	52.5	-4.1	154.5	0	0	0	0	0	120.6	R130 E134	R130-G132 PolarHBondContact O-N 3.05Å; G132-E134 PolarHBondContact O-N 2.94Å
133	Q	80.3	Confident	85.7	Confident	143 Å²	143	59.9 Å²	59.9	67%	0.668	31%	0.305	S	S	*	.			trans	-72.3	121.8	-169.9	-78	-174.9	-2.6	0	0	110.2	S131	S131-Q133 PolarHBondContact O-N 3.32Å
134	E	88.6	Confident	85.7	Confident	57 Å²	57	60 Å²	60	27%	0.266	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	113.8	174.8	-69.9	175.8	179.7	0	0	106.8	F62 R64 R81 Y124 K126 G132	F62-E134 HydrophobicContact CE1-CB 4.24Å; F62-E134 HydrophobicContact CE1-CG 3.79Å; F62-E134 HydrophobicContact CZ-CB 3.8Å; F62-E134 VanDerWaalsContact CZ-CD 3.43Å; F62-E134 HydrophobicContact CZ-CG 3.58Å; F62-E134 WeakPolarHBondContact CZ-OE2 3.47Å; R64-E134 IonicContact CZ-OE2 3.13Å; R64-E134 IonicContact NH1-OE2 3.1Å; R64-E134 IonicContact NH2-OE2 2.69Å; R64-E134 PolarHBondContact NH2-OE2 2.86Å; R81-E134 IonicContact CZ-OE1 3.8Å; R81-E134 IonicContact CZ-OE2 3.24Å; R81-E134 IonicContact NH1-OE1 3.9Å; R81-E134 PolarHBondContact NH1-OE1 2.85Å; R81-E134 VanDerWaalsContact NH1-OE1 3.11Å; R81-E134 IonicContact NH1-OE2 2.84Å; R81-E134 VanDerWaalsContact NH2-CD 3.27Å; R81-E134 IonicContact NH2-OE1 2.91Å; R81-E134 PolarHBondContact NH2-OE1 3.07Å; R81-E134 IonicContact NH2-OE2 3.89Å; Y124-E134 HydrophobicContact CD1-CB 4.4Å; K126-E134 HydrophobicContact CB-CG 4.29Å; K126-E134 HydrophobicContact CD-CG 3.9Å; K126-E134 HydrophobicContact CG-CG 4.2Å; K126-E134 IonicContact NZ-OE1 3.64Å; K126-E134 PolarHBondContact NZ-OE1 3Å; K126-E134 VanDerWaalsContact NZ-OE1 3.08Å; G132-E134 PolarHBondContact O-N 2.94Å
135	I	88.5	Confident	85.7	Confident	94 Å²	94	60.5 Å²	60.5	48%	0.482	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.7	-178	-57.9	172.8	0	0	0	106.9	Y124 Y125 I137	Y124-I135 CarbonylContact C-O 3.43Å; Y124-I135 VanDerWaalsContact CA-O 3.23Å; Y124-I135 WeakPolarHBondContact CA-O 3.34Å; Y125-I135 PolarHBondContact N-O 2.84Å; Y125-I135 PolarHBondContact O-N 2.79Å; I135-I137 HydrophobicContact CG2-CG2 4.39Å; I135-I137 PolarHBondContact O-N 2.98Å
136	E	92.2	Very high	85.9	Confident	41 Å²	41	64.6 Å²	64.6	19%	0.192	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	123.7	170.1	-165.2	174.5	177.8	0	0	108.4	S122 Y124 R139 F163	S122-E136 VanDerWaalsContact CB-OE1 3.22Å; S122-E136 WeakPolarHBondContact CB-OE1 3.29Å; S122-E136 PolarHBondContact OG-OE1 3.23Å; Y124-E136 HydrophobicContact CD1-CB 3.89Å; Y124-E136 HydrophobicContact CD1-CG 4.41Å; Y124-E136 HydrophobicContact CE1-CB 3.55Å; Y124-E136 HydrophobicContact CE1-CG 3.99Å; E136-R139 IonicContact OE1-CZ 3.35Å; E136-R139 VanDerWaalsContact OE1-CZ 3.24Å; E136-R139 IonicContact OE1-NE 3.52Å; E136-R139 PolarHBondContact OE1-NE 3.04Å; E136-R139 IonicContact OE1-NH2 3.36Å; E136-R139 PolarHBondContact OE1-NH2 3.17Å; E136-R139 IonicContact OE2-CZ 3.55Å; E136-R139 IonicContact OE2-NH2 2.83Å; E136-R139 PolarHBondContact OE2-NH2 3.34Å; E136-F163 HydrophobicContact CG-CD2 4.02Å; E136-F163 HydrophobicContact CG-CE2 4.31Å
137	I	92	Very high	86.2	Confident	2 Å²	2	62.5 Å²	62.5	1%	0.01	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	-26.6	-174.5	60.2	161.2	0	0	0	112	W40 Y46 L61 I123 I135 F163 T164	W40-I137 HydrophobicContact CH2-CD1 4.08Å; W40-I137 HydrophobicContact CZ2-CD1 3.9Å; Y46-I137 WeakPolarHBondContact OH-CB 3.41Å; Y46-I137 WeakPolarHBondContact OH-CG2 3.35Å; L61-I137 HydrophobicContact CD1-CD1 4.14Å; I123-I137 HydrophobicContact CB-CG1 4.21Å; I123-I137 HydrophobicContact CG2-CD1 3.88Å; I123-I137 HydrophobicContact CG2-CG1 3.79Å; I123-I137 VanDerWaalsContact O-CG1 3.32Å; I123-I137 WeakPolarHBondContact O-CG1 3.46Å; I123-I137 PolarHBondContact O-N 2.86Å; I135-I137 HydrophobicContact CG2-CG2 4.39Å; I135-I137 PolarHBondContact O-N 2.98Å; I137-F163 PolarHBondContact O-N 2.96Å; I137-T164 HydrophobicContact CB-CG2 3.51Å; I137-T164 HydrophobicContact CG2-CG2 3.71Å
138	A	94.1	Very high	86.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	160.1	179.4	0	0	0	0	0	111	W40 I123 L160 E161 I162	W40-A138 HydrophobicContact CH2-CB 4.1Å; I123-A138 HydrophobicContact CB-CB 4.18Å; I123-A138 HydrophobicContact CD1-CB 4.03Å; I123-A138 PolarHBondContact N-O 2.8Å; I123-A138 PolarHBondContact O-N 2.93Å; A138-L160 HydrophobicContact CB-CB 4.16Å; A138-L160 HydrophobicContact CB-CD1 4.22Å; A138-L160 HydrophobicContact CB-CD2 4.43Å; A138-L160 HydrophobicContact CB-CG 4.5Å; A138-E161 CarbonylContact C-O 3.26Å; A138-E161 WeakPolarHBondContact CA-O 3.12Å; A138-I162 HydrophobicContact CB-CD1 3.71Å
139	R	95.6	Very high	87.1	Confident	75 Å²	75	58.4 Å²	58.4	28%	0.283	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	153.3	173.7	-179.5	-171.6	-56.4	164	1	110.6	I121 E136 E161 F163	I121-R139 CarbonylContact O-C 3.46Å; I121-R139 WeakPolarHBondContact O-CA 3.26Å; I121-R139 WeakPolarHBondContact O-CG 3.31Å; E136-R139 IonicContact OE1-CZ 3.35Å; E136-R139 VanDerWaalsContact OE1-CZ 3.24Å; E136-R139 IonicContact OE1-NE 3.52Å; E136-R139 PolarHBondContact OE1-NE 3.04Å; E136-R139 IonicContact OE1-NH2 3.36Å; E136-R139 PolarHBondContact OE1-NH2 3.17Å; E136-R139 IonicContact OE2-CZ 3.55Å; E136-R139 IonicContact OE2-NH2 2.83Å; E136-R139 PolarHBondContact OE2-NH2 3.34Å; R139-E161 PolarHBondContact N-O 2.89Å; R139-E161 WeakPolarHBondContact O-CB 3.27Å; R139-E161 PolarHBondContact O-N 2.67Å; R139-F163 HydrophobicContact CB-CE2 3.52Å; R139-F163 HydrophobicContact CB-CZ 4.09Å
140	C	95.5	Very high	87.8	Confident	7 Å²	7	52.9 Å²	52.9	5%	0.047	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	163.2	165.2	68.3	0	0	0	0	110.4	R120 I121 L158 P159 L160 I172	R120-C140 WeakPolarHBondContact CA-O 3.47Å; I121-C140 PolarHBondContact N-O 2.95Å; I121-C140 PolarHBondContact O-N 3.43Å; C140-L158 HydrophobicContact CB-CB 4.02Å; C140-P159 WeakPolarHBondContact CB-O 3.39Å; C140-L160 HydrophobicContact CB-CD2 4.17Å; C140-I172 HydrophobicContact CB-CG2 4.23Å; C140-I172 WeakPolarHBondContact SG-CG2 3.39Å
141	S	94.5	Very high	88.9	Confident	63 Å²	63	44.9 Å²	44.9	44%	0.441	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	141.9	177.8	62.8	0	0	0	0	111.3	F119	F119-S141 CarbonylContact O-C 3.45Å; F119-S141 VanDerWaalsContact O-CA 3.26Å; F119-S141 WeakPolarHBondContact O-CA 3.39Å
142	L	93.5	Very high	90.3	Very high	5 Å²	5	39.9 Å²	39.9	3%	0.026	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	125.7	176.2	173.1	68.6	0	0	0	109.1	N118 F119 L144 K146 V154 L158 L176	N118-L142 CarbonylContact C-O 3.56Å; N118-L142 WeakPolarHBondContact CA-O 3.48Å; F119-L142 HydrophobicContact CB-CB 4.38Å; F119-L142 PolarHBondContact N-O 2.83Å; F119-L142 PolarHBondContact O-N 2.82Å; L142-L144 PolarHBondContact O-N 2.93Å; L142-K146 HydrophobicContact CD1-CD 4.26Å; L142-V154 HydrophobicContact CD1-CG1 3.81Å; L142-V154 HydrophobicContact CD2-CB 4.28Å; L142-V154 HydrophobicContact CD2-CG1 3.68Å; L142-V154 HydrophobicContact CG-CG1 4.28Å; L142-L158 HydrophobicContact CB-CD1 3.86Å; L142-L158 HydrophobicContact CB-CD2 4.29Å; L142-L158 HydrophobicContact CD1-CD2 4.09Å; L142-L176 HydrophobicContact CD2-CD1 3.66Å; L142-L176 HydrophobicContact CD2-CG 4.27Å
143	P	93.3	Very high	91.8	Very high	47 Å²	47	40 Å²	40	31%	0.305	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	126.5	175.9	-24.1	34.6	0	0	0	112	N118 C145	N118-P143 VanDerWaalsContact OD1-CA 3.23Å; N118-P143 WeakPolarHBondContact OD1-CA 3.39Å; P143-C145 VanDerWaalsContact CB-SG 3.6Å; P143-C145 PolarHBondContact O-N 3.42Å
144	L	93.7	Very high	92.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-72.6	-20.5	179.4	-75.1	167.8	0	0	0	112.2	P68 W114 E117 F119 L142 K146 L147 L176	P68-L144 HydrophobicContact CG-CD1 3.39Å; W114-L144 HydrophobicContact CB-CB 3.89Å; W114-L144 HydrophobicContact CG-CB 4.04Å; W114-L144 HydrophobicContact CG-CD1 4.26Å; W114-L144 CarbonylContact O-C 3.52Å; W114-L144 VanDerWaalsContact O-C 3.26Å; W114-L144 WeakPolarHBondContact O-CB 3.41Å; E117-L144 HydrophobicContact CB-CD1 4.32Å; E117-L144 WeakPolarHBondContact O-CB 3.41Å; E117-L144 PolarHBondContact O-N 3.46Å; E117-L144 VanDerWaalsContact O-N 3.07Å; F119-L144 HydrophobicContact CB-CD2 3.8Å; F119-L144 HydrophobicContact CB-CG 4.08Å; L142-L144 PolarHBondContact O-N 2.93Å; L144-K146 PolarHBondContact O-N 3.35Å; L144-K146 VanDerWaalsContact O-N 3.1Å; L144-L147 HydrophobicContact CD2-CD1 3.89Å; L144-L147 WeakPolarHBondContact O-CB 3.39Å; L144-L147 PolarHBondContact O-N 2.83Å; L144-L176 HydrophobicContact CD2-CD1 4.32Å
145	C	92.2	Very high	92.5	Very high	48 Å²	48	38.8 Å²	38.8	32%	0.324	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-56.7	-28.4	177.4	64	0	0	0	0	112.4	W114 P143 L147 L148	W114-C145 WeakPolarHBondContact O-CA 3.37Å; W114-C145 PolarHBondContact O-N 3.37Å; P143-C145 VanDerWaalsContact CB-SG 3.6Å; P143-C145 PolarHBondContact O-N 3.42Å; C145-L147 PolarHBondContact O-N 3.23Å; C145-L148 VanDerWaalsContact O-CB 3.31Å; C145-L148 WeakPolarHBondContact O-CB 3.48Å; C145-L148 PolarHBondContact O-N 2.87Å
146	K	91.5	Very high	92.7	Very high	100 Å²	100	35.5 Å²	35.5	44%	0.435	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-62.6	-24.5	175.1	-66	-171.9	174.6	-170.3	0	113.6	L142 L144 L148 V154	L142-K146 HydrophobicContact CD1-CD 4.26Å; L144-K146 PolarHBondContact O-N 3.35Å; L144-K146 VanDerWaalsContact O-N 3.1Å; K146-L148 VanDerWaalsContact C-N 3.28Å; K146-V154 HydrophobicContact CB-CG2 3.61Å
147	L	93.3	Very high	92.7	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-78.3	-11.7	173.8	-71.8	170.7	0	0	0	113.4	L31 L144 C145 V149 F152 V154 L176 L178	L31-L147 HydrophobicContact CD1-CD1 4.02Å; L144-L147 HydrophobicContact CD2-CD1 3.89Å; L144-L147 WeakPolarHBondContact O-CB 3.39Å; L144-L147 PolarHBondContact O-N 2.83Å; C145-L147 PolarHBondContact O-N 3.23Å; L147-V149 VanDerWaalsContact C-N 3.29Å; L147-F152 VanDerWaalsContact O-CD1 3.29Å; L147-F152 WeakPolarHBondContact O-CD1 3.27Å; L147-V154 HydrophobicContact CD2-CB 4.44Å; L147-V154 HydrophobicContact CD2-CG2 3.87Å; L147-V154 HydrophobicContact CG-CG2 4.1Å; L147-L176 HydrophobicContact CD1-CB 4Å; L147-L176 HydrophobicContact CD1-CD1 3.9Å; L147-L176 HydrophobicContact CD2-CB 3.79Å; L147-L176 HydrophobicContact CG-CB 4.32Å; L147-L178 HydrophobicContact CB-CD1 4.42Å; L147-L178 HydrophobicContact CB-CG 4.47Å; L147-L178 HydrophobicContact CD2-CG 4.47Å; L147-L178 WeakPolarHBondContact O-CD1 3.41Å
148	L	92.5	Very high	92.8	Very high	3 Å²	3	38.4 Å²	38.4	2%	0.016	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-86.7	-3.6	178.5	-55.3	178.8	0	0	0	112.5	T21 L25 M111 W114 A115 C145 K146 L300	T21-L148 WeakPolarHBondContact CG2-O 3.26Å; L25-L148 HydrophobicContact CD1-CD2 4.42Å; L25-L148 HydrophobicContact CD2-CD2 4.45Å; M111-L148 HydrophobicContact CB-CD1 4.45Å; M111-L148 HydrophobicContact CB-CD2 4.34Å; M111-L148 HydrophobicContact CG-CD2 4.01Å; M111-L148 WeakPolarHBondContact O-CD1 3.36Å; W114-L148 HydrophobicContact CB-CD1 4.22Å; W114-L148 HydrophobicContact CB-CD2 4.34Å; W114-L148 HydrophobicContact CB-CG 4.45Å; W114-L148 HydrophobicContact CE3-CD2 3.85Å; A115-L148 HydrophobicContact CB-CD1 4.32Å; C145-L148 VanDerWaalsContact O-CB 3.31Å; C145-L148 WeakPolarHBondContact O-CB 3.48Å; C145-L148 PolarHBondContact O-N 2.87Å; K146-L148 VanDerWaalsContact C-N 3.28Å; L148-L300 HydrophobicContact CD1-CD1 3.99Å
149	V	88	Confident	92.7	Very high	38 Å²	38	43.1 Å²	43.1	23%	0.23	24%	0.238	C	C	.	.	S	Bend	trans	-107.9	139.6	179.3	-171.2	0	0	0	0	109.2	L147 F152 E293 I296	L147-V149 VanDerWaalsContact C-N 3.29Å; V149-F152 WeakPolarHBondContact O-CA 3.36Å; V149-F152 WeakPolarHBondContact O-CD1 3.01Å; V149-F152 PolarHBondContact O-N 3.06Å; V149-E293 HydrophobicContact CG2-CG 4.28Å; V149-I296 HydrophobicContact CG2-CD1 4.07Å
150	L	88.8	Confident	92.7	Very high	30 Å²	30	40.3 Å²	40.3	16%	0.157	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	138.9	173.4	-78.7	165.5	0	0	0	110.7	L17 L24 F152 V189 M192	L17-L150 HydrophobicContact CD1-CD1 4.14Å; L24-L150 HydrophobicContact CD1-CD1 4.42Å; L24-L150 HydrophobicContact CD1-CD2 3.86Å; L150-F152 HydrophobicContact CD2-CD2 3.82Å; L150-F152 HydrophobicContact CD2-CE1 4.18Å; L150-F152 HydrophobicContact CD2-CE2 3.23Å; L150-F152 HydrophobicContact CD2-CZ 3.45Å; L150-F152 VanDerWaalsContact CD2-CZ 3.45Å; L150-F152 HydrophobicContact CG-CE1 4.13Å; L150-F152 HydrophobicContact CG-CE2 4.04Å; L150-F152 HydrophobicContact CG-CZ 3.71Å; L150-V189 HydrophobicContact CD2-CG2 4.19Å; L150-M192 HydrophobicContact CB-CE 3.93Å; L150-M192 HydrophobicContact CD1-CE 4.29Å; L150-M192 HydrophobicContact CD2-CE 4.42Å; L150-M192 HydrophobicContact CD2-SD 4.14Å; L150-M192 HydrophobicContact CG-CE 4.46Å
151	P	92.3	Very high	92.6	Very high	34 Å²	34	45.4 Å²	45.4	22%	0.221	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	cis	-94.9	32	9	27.9	-16.4	0	0	0	114.1	I153 V189 M192 R193	P151-I153 HydrophobicContact CB-CG2 4.33Å; P151-I153 HydrophobicContact CG-CG2 3.77Å; P151-I153 PolarHBondContact O-N 3.48Å; P151-V189 HydrophobicContact CB-CG1 4.33Å; P151-V189 WeakPolarHBondContact O-CG1 3.37Å; P151-M192 HydrophobicContact CB-CB 3.82Å; P151-M192 HydrophobicContact CG-CB 4.47Å; P151-R193 HydrophobicContact CB-CG 3.86Å; P151-R193 HydrophobicContact CG-CG 4.32Å; P151-R193 VanDerWaalsContact O-CZ 3.3Å; P151-R193 PolarHBondContact O-NE 2.85Å; P151-R193 PolarHBondContact O-NH2 2.81Å
152	F	93.7	Very high	92.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.241	C	C	.	.			trans	56.3	36.5	177	-43.2	-57.6	0	0	0	113.9	T21 L24 L25 L147 V149 L150 S177 L178 F185 V189 R193	T21-F152 HydrophobicContact CG2-CE1 3.84Å; T21-F152 HydrophobicContact CG2-CZ 4.01Å; L24-F152 HydrophobicContact CB-CE2 3.75Å; L24-F152 HydrophobicContact CB-CZ 3.97Å; L24-F152 HydrophobicContact CD1-CE2 4.31Å; L25-F152 HydrophobicContact CD1-CE1 4.22Å; L25-F152 HydrophobicContact CD2-CD1 3.79Å; L25-F152 HydrophobicContact CD2-CE1 3.55Å; L25-F152 HydrophobicContact CD2-CG 4.45Å; L25-F152 HydrophobicContact CD2-CZ 4.05Å; L25-F152 HydrophobicContact CG-CD1 4.4Å; L25-F152 HydrophobicContact CG-CE1 3.65Å; L25-F152 HydrophobicContact CG-CZ 3.87Å; L147-F152 VanDerWaalsContact O-CD1 3.29Å; L147-F152 WeakPolarHBondContact O-CD1 3.27Å; V149-F152 WeakPolarHBondContact O-CA 3.36Å; V149-F152 WeakPolarHBondContact O-CD1 3.01Å; V149-F152 PolarHBondContact O-N 3.06Å; L150-F152 HydrophobicContact CD2-CD2 3.82Å; L150-F152 HydrophobicContact CD2-CE1 4.18Å; L150-F152 HydrophobicContact CD2-CE2 3.23Å; L150-F152 HydrophobicContact CD2-CZ 3.45Å; L150-F152 VanDerWaalsContact CD2-CZ 3.45Å; L150-F152 HydrophobicContact CG-CE1 4.13Å; L150-F152 HydrophobicContact CG-CE2 4.04Å; L150-F152 HydrophobicContact CG-CZ 3.71Å; F152-S177 WeakPolarHBondContact O-CA 3.31Å; F152-L178 HydrophobicContact CB-CB 3.81Å; F152-L178 HydrophobicContact CB-CD1 4Å; F152-L178 HydrophobicContact CB-CG 4.05Å; F152-L178 HydrophobicContact CG-CD1 4.39Å; F152-L178 PolarHBondContact O-N 3.01Å; F152-F185 AromaticContact CD2-CE2 3.77Å; F152-F185 HydrophobicContact CD2-CE2 3.77Å; F152-F185 AromaticContact CD2-CZ 3.8Å; F152-F185 HydrophobicContact CD2-CZ 3.8Å; F152-F185 AromaticContact CE2-CE2 3.86Å; F152-F185 HydrophobicContact CE2-CE2 3.86Å; F152-F185 HydrophobicContact CE2-CZ 4.35Å; F152-V189 HydrophobicContact CD2-CG1 4.32Å; F152-V189 HydrophobicContact CD2-CG2 4.07Å; F152-V189 HydrophobicContact CE2-CG2 4.05Å; F152-R193 PolarHBondContact O-NH2 2.79Å; F152-R193 VanDerWaalsContact O-NH2 3.15Å
153	I	93	Very high	92.2	Very high	51 Å²	51	48.2 Å²	48.2	26%	0.262	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	138.5	178.4	-177.7	164.8	0	0	0	108.5	P151 E155 L176 R193	P151-I153 HydrophobicContact CB-CG2 4.33Å; P151-I153 HydrophobicContact CG-CG2 3.77Å; P151-I153 PolarHBondContact O-N 3.48Å; I153-E155 HydrophobicContact CD1-CG 4.26Å; I153-E155 HydrophobicContact CG1-CG 4.17Å; I153-L176 CarbonylContact C-O 3.57Å; I153-L176 WeakPolarHBondContact CA-O 3.32Å; I153-R193 HydrophobicContact CG2-CG 4.09Å
154	V	92.8	Very high	91.7	Very high	15 Å²	15	47 Å²	47	9%	0.091	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	113	174.7	-175.8	0	0	0	0	107.7	L142 K146 L147 A156 G175 L176	L142-V154 HydrophobicContact CD1-CG1 3.81Å; L142-V154 HydrophobicContact CD2-CB 4.28Å; L142-V154 HydrophobicContact CD2-CG1 3.68Å; L142-V154 HydrophobicContact CG-CG1 4.28Å; K146-V154 HydrophobicContact CB-CG2 3.61Å; L147-V154 HydrophobicContact CD2-CB 4.44Å; L147-V154 HydrophobicContact CD2-CG2 3.87Å; L147-V154 HydrophobicContact CG-CG2 4.1Å; V154-A156 HydrophobicContact CG1-CB 4.45Å; V154-G175 CarbonylContact O-C 3.51Å; V154-G175 WeakPolarHBondContact O-CA 3.2Å; V154-L176 PolarHBondContact N-O 3.15Å; V154-L176 PolarHBondContact O-N 2.68Å
155	E	92.3	Very high	90.8	Very high	160 Å²	160	53.1 Å²	53.1	75%	0.748	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.6	169.2	-64	-175.1	163.6	0	0	107.4	I153	I153-E155 HydrophobicContact CD1-CG 4.26Å; I153-E155 HydrophobicContact CG1-CG 4.17Å
156	A	92	Very high	90.1	Very high	25 Å²	25	54 Å²	54	21%	0.207	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	140.4	-173	0	0	0	0	0	111.5	V154 L158 V174	V154-A156 HydrophobicContact CG1-CB 4.45Å; A156-L158 HydrophobicContact CB-CD2 3.7Å; A156-L158 HydrophobicContact CB-CG 3.96Å; A156-V174 PolarHBondContact N-O 2.81Å; A156-V174 PolarHBondContact O-N 2.9Å
157	D	92.1	Very high	89.5	Confident	87 Å²	87	56 Å²	56	47%	0.465	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	100.8	162.5	-164.4	-7.2	0	0	0	107.7	S171 K173	D157-S171 WeakPolarHBondContact OD1-CB 3.34Å; D157-S171 PolarHBondContact OD1-OG 2.69Å; D157-K173 HydrophobicContact CB-CG 4.32Å
158	L	93.5	Very high	89.1	Confident	17 Å²	17	56.8 Å²	56.8	9%	0.089	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	124.8	-169.6	-62.4	172.6	0	0	0	110.3	C140 L142 A156 S171 I172 V174	C140-L158 HydrophobicContact CB-CB 4.02Å; L142-L158 HydrophobicContact CB-CD1 3.86Å; L142-L158 HydrophobicContact CB-CD2 4.29Å; L142-L158 HydrophobicContact CD1-CD2 4.09Å; A156-L158 HydrophobicContact CB-CD2 3.7Å; A156-L158 HydrophobicContact CB-CG 3.96Å; L158-S171 CarbonylContact O-C 3.59Å; L158-S171 WeakPolarHBondContact O-CA 3.25Å; L158-S171 WeakPolarHBondContact O-CB 3.37Å; L158-I172 HydrophobicContact CB-CG2 4.06Å; L158-I172 PolarHBondContact N-O 2.97Å; L158-I172 PolarHBondContact O-N 2.86Å; L158-V174 HydrophobicContact CD1-CB 4.28Å; L158-V174 HydrophobicContact CD1-CG2 4.11Å
159	P	93.4	Very high	88.9	Confident	99 Å²	99	59 Å²	59	64%	0.643	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.2	150.5	174.1	29.4	-34.9	0	0	0	110.8	C140	C140-P159 WeakPolarHBondContact CB-O 3.39Å
160	L	94.3	Very high	89.1	Confident	16 Å²	16	57.4 Å²	57.4	8%	0.084	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-95.4	130.2	179.9	-60.7	173.4	0	0	0	111.4	L38 W40 I123 A138 C140 I162 G170 I172	L38-L160 HydrophobicContact CD1-CD1 3.33Å; L38-L160 HydrophobicContact CD1-CD2 4.49Å; L38-L160 HydrophobicContact CD1-CG 4.42Å; W40-L160 HydrophobicContact CE3-CD1 4.25Å; W40-L160 HydrophobicContact CH2-CD1 3.97Å; W40-L160 HydrophobicContact CZ3-CD1 3.68Å; I123-L160 HydrophobicContact CD1-CD1 4.07Å; I123-L160 HydrophobicContact CD1-CD2 3.59Å; I123-L160 HydrophobicContact CD1-CG 4.48Å; A138-L160 HydrophobicContact CB-CB 4.16Å; A138-L160 HydrophobicContact CB-CD1 4.22Å; A138-L160 HydrophobicContact CB-CD2 4.43Å; A138-L160 HydrophobicContact CB-CG 4.5Å; C140-L160 HydrophobicContact CB-CD2 4.17Å; L160-I162 HydrophobicContact CB-CD1 3.64Å; L160-I162 HydrophobicContact CD1-CD1 4.32Å; L160-G170 WeakPolarHBondContact CG-O 3.16Å; L160-G170 PolarHBondContact N-O 3.31Å; L160-I172 HydrophobicContact CD2-CB 4.27Å; L160-I172 HydrophobicContact CD2-CG2 3.92Å
161	E	93.1	Very high	89.3	Confident	113 Å²	113	57.2 Å²	57.2	53%	0.528	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117.9	158.3	-173.9	-175.7	-174.5	0	0	108.1	A138 R139 F163	A138-E161 CarbonylContact C-O 3.26Å; A138-E161 WeakPolarHBondContact CA-O 3.12Å; R139-E161 PolarHBondContact N-O 2.89Å; R139-E161 WeakPolarHBondContact O-CB 3.27Å; R139-E161 PolarHBondContact O-N 2.67Å; E161-F163 HydrophobicContact CB-CZ 4.43Å; E161-F163 VanDerWaalsContact CD-CZ 3.5Å; E161-F163 HydrophobicContact CG-CE1 3.94Å; E161-F163 HydrophobicContact CG-CZ 3.86Å; E161-F163 WeakPolarHBondContact OE1-CE1 3.27Å
162	I	91.7	Very high	89.4	Confident	42 Å²	42	55.6 Å²	55.6	22%	0.215	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	131.8	-173.9	-58.4	-54.7	0	0	0	110.7	W40 A138 L160 T164 S168	W40-I162 HydrophobicContact CH2-CD1 4.41Å; W40-I162 HydrophobicContact CZ3-CD1 3.77Å; A138-I162 HydrophobicContact CB-CD1 3.71Å; L160-I162 HydrophobicContact CB-CD1 3.64Å; L160-I162 HydrophobicContact CD1-CD1 4.32Å; I162-T164 WeakPolarHBondContact CG2-OG1 3.28Å; I162-S168 WeakPolarHBondContact CG1-O 3.29Å
163	F	88.3	Confident	89.5	Confident	85 Å²	85	58.8 Å²	58.8	37%	0.373	33%	0.331	S	S	.	.			trans	-108.1	2.2	177.8	-57.7	-63.7	0	0	0	113.9	E136 I137 R139 E161	E136-F163 HydrophobicContact CG-CD2 4.02Å; E136-F163 HydrophobicContact CG-CE2 4.31Å; I137-F163 PolarHBondContact O-N 2.96Å; R139-F163 HydrophobicContact CB-CE2 3.52Å; R139-F163 HydrophobicContact CB-CZ 4.09Å; E161-F163 HydrophobicContact CB-CZ 4.43Å; E161-F163 VanDerWaalsContact CD-CZ 3.5Å; E161-F163 HydrophobicContact CG-CE1 3.94Å; E161-F163 HydrophobicContact CG-CZ 3.86Å; E161-F163 WeakPolarHBondContact OE1-CE1 3.27Å
164	T	83.3	Confident	89.6	Confident	21 Å²	21	56.7 Å²	56.7	13%	0.129	32%	0.32	C	S	.	.	S	Bend	trans	-84.7	151.1	179.3	59.7	0	0	0	0	111.9	P44 Y46 I137 I162	P44-T164 HydrophobicContact CB-CG2 4.35Å; P44-T164 HydrophobicContact CG-CG2 4.24Å; Y46-T164 HydrophobicContact CE1-CG2 3.62Å; Y46-T164 WeakPolarHBondContact OH-CG2 3.11Å; I137-T164 HydrophobicContact CB-CG2 3.51Å; I137-T164 HydrophobicContact CG2-CG2 3.71Å; I162-T164 WeakPolarHBondContact CG2-OG1 3.28Å
165	T	75.4	Confident	89.7	Confident	131 Å²	131	56.4 Å²	56.4	80%	0.804	32%	0.321	S	S	*	.	S	Bend	trans	-67.2	132.8	169.2	55	0	0	0	0	111.1
166	G	77.4	Confident	89.8	Confident	65 Å²	65	48.9 Å²	48.9	67%	0.67	29%	0.286	S	S	*	.	S	Bend	trans	111.3	-178.9	176.5	0	0	0	0	0	112.8	S168	G166-S168 PolarHBondContact O-N 2.83Å
167	I	78.9	Confident	89.9	Confident	142 Å²	142	48.8 Å²	48.8	73%	0.728	28%	0.283	S	S	*	.			trans	-83.6	114.2	175	-55.3	172.2	0	0	0	106.5	I42	I42-I167 HydrophobicContact CD1-CG2 3.81Å; I42-I167 HydrophobicContact CG2-CG2 4.5Å; I42-I167 WeakPolarHBondContact CG2-O 3.04Å
168	S	83.6	Confident	90.1	Very high	18 Å²	18	44.6 Å²	44.6	13%	0.126	26%	0.261	C	S	.	.			trans	-141.2	148.7	169.9	-53.8	0	0	0	0	108.9	I42 P44 I162 G166	I42-S168 CarbonylContact O-C 3.52Å; I42-S168 WeakPolarHBondContact O-CA 3.26Å; I42-S168 VanDerWaalsContact O-CB 3.26Å; I42-S168 WeakPolarHBondContact O-CB 3.35Å; P44-S168 VanDerWaalsContact CA-OG 3.24Å; P44-S168 WeakPolarHBondContact CA-OG 3.31Å; I162-S168 WeakPolarHBondContact CG1-O 3.29Å; G166-S168 PolarHBondContact O-N 2.83Å
169	D	89	Confident	90	Very high	49 Å²	49	44 Å²	44	26%	0.262	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153	145.2	-176	-177.1	24.7	0	0	0	108.8	R41 I42	R41-D169 HydrophobicContact CB-CB 4.3Å; R41-D169 WeakPolarHBondContact CD-OD2 3.48Å; R41-D169 IonicContact CZ-OD2 3.53Å; R41-D169 PolarHBondContact N-O 2.97Å; R41-D169 IonicContact NE-OD2 3.73Å; R41-D169 IonicContact NH1-OD2 2.72Å; R41-D169 PolarHBondContact NH1-OD2 3.42Å; I42-D169 HydrophobicContact CB-CB 4.42Å; I42-D169 PolarHBondContact N-O 3.36Å; I42-D169 PolarHBondContact O-N 3.29Å
170	G	91.3	Very high	89.9	Confident	6 Å²	6	39.7 Å²	39.7	6%	0.062	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.9	173	-176.9	0	0	0	0	0	112.8	Y39 L160	Y39-G170 CarbonylContact O-C 3.39Å; Y39-G170 WeakPolarHBondContact O-CA 3.18Å; L160-G170 WeakPolarHBondContact CG-O 3.16Å; L160-G170 PolarHBondContact N-O 3.31Å
171	S	93.8	Very high	89.6	Confident	25 Å²	25	46.3 Å²	46.3	18%	0.175	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	162.5	178.3	73.2	0	0	0	0	110.6	Y39 D157 L158	Y39-S171 PolarHBondContact N-O 3.42Å; Y39-S171 PolarHBondContact O-N 2.92Å; D157-S171 WeakPolarHBondContact OD1-CB 3.34Å; D157-S171 PolarHBondContact OD1-OG 2.69Å; L158-S171 CarbonylContact O-C 3.59Å; L158-S171 WeakPolarHBondContact O-CA 3.25Å; L158-S171 WeakPolarHBondContact O-CB 3.37Å
172	I	94.8	Very high	89.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	129.6	178.8	-170.9	172.7	0	0	0	110.1	I35 C37 L38 L63 I121 C140 L158 L160 V174	I35-I172 HydrophobicContact CG2-CD1 3.73Å; I35-I172 HydrophobicContact CG2-CG1 4.12Å; C37-I172 WeakPolarHBondContact O-CA 3.33Å; C37-I172 WeakPolarHBondContact O-CG1 3.47Å; L38-I172 HydrophobicContact CB-CG1 4.5Å; L63-I172 HydrophobicContact CD2-CD1 4.49Å; I121-I172 HydrophobicContact CD1-CD1 4.19Å; I121-I172 HydrophobicContact CG2-CD1 4.37Å; C140-I172 HydrophobicContact CB-CG2 4.23Å; C140-I172 WeakPolarHBondContact SG-CG2 3.39Å; L158-I172 HydrophobicContact CB-CG2 4.06Å; L158-I172 PolarHBondContact N-O 2.97Å; L158-I172 PolarHBondContact O-N 2.86Å; L160-I172 HydrophobicContact CD2-CB 4.27Å; L160-I172 HydrophobicContact CD2-CG2 3.92Å; I172-V174 HydrophobicContact CG1-CG2 4.15Å; I172-V174 HydrophobicContact CG2-CG2 4.11Å
173	K	94.9	Very high	88.9	Confident	68 Å²	68	46.7 Å²	46.7	30%	0.296	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	120.7	176.6	-73.2	-173.1	-177	169.9	0	110.9	E36 C37 Y39 D157	E36-K173 HydrophobicContact CB-CB 4.1Å; E36-K173 PolarHBondContact N-O 3.06Å; E36-K173 WeakPolarHBondContact OE2-CD 3.44Å; C37-K173 PolarHBondContact O-N 3.36Å; Y39-K173 HydrophobicContact CD2-CG 4.46Å; Y39-K173 HydrophobicContact CE2-CD 3.72Å; Y39-K173 HydrophobicContact CE2-CG 3.94Å; Y39-K173 PolarHBondContact OH-NZ 2.94Å; D157-K173 HydrophobicContact CB-CG 4.32Å
174	V	94.9	Very high	88.8	Confident	6 Å²	6	46.1 Å²	46.1	4%	0.036	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.2	-174.6	-178.4	0	0	0	0	109.5	Y34 F119 I121 A156 L158 I172 L176	Y34-V174 CarbonylContact O-C 3.46Å; Y34-V174 WeakPolarHBondContact O-CA 3.04Å; F119-V174 HydrophobicContact CD1-CG1 4.43Å; F119-V174 HydrophobicContact CE1-CG1 3.82Å; I121-V174 HydrophobicContact CD1-CG1 4.35Å; I121-V174 HydrophobicContact CD1-CG2 3.49Å; I121-V174 VanDerWaalsContact CD1-CG2 3.49Å; A156-V174 PolarHBondContact N-O 2.81Å; A156-V174 PolarHBondContact O-N 2.9Å; L158-V174 HydrophobicContact CD1-CB 4.28Å; L158-V174 HydrophobicContact CD1-CG2 4.11Å; I172-V174 HydrophobicContact CG1-CG2 4.15Å; I172-V174 HydrophobicContact CG2-CG2 4.11Å; V174-L176 HydrophobicContact CG1-CD2 4.48Å; V174-L176 HydrophobicContact CG1-CG 4.44Å
175	G	94.8	Very high	89.1	Confident	9 Å²	9	45.3 Å²	45.3	9%	0.093	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	129.6	170.8	0	0	0	0	0	110.7	Y34 V154	Y34-G175 PolarHBondContact N-O 2.86Å; Y34-G175 PolarHBondContact O-N 2.97Å; V154-G175 CarbonylContact O-C 3.51Å; V154-G175 WeakPolarHBondContact O-CA 3.2Å
176	L	95.3	Very high	89.6	Confident	3 Å²	3	42 Å²	42	2%	0.016	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	132.7	169.4	-59.8	-179.2	0	0	0	108.2	L31 K32 V33 F119 L142 L144 L147 I153 V154 V174	L31-L176 HydrophobicContact CD1-CB 4.37Å; K32-L176 WeakPolarHBondContact O-CA 3.48Å; V33-L176 HydrophobicContact CB-CD2 3.94Å; V33-L176 HydrophobicContact CG1-CD2 3.79Å; V33-L176 HydrophobicContact CG2-CD2 3.41Å; V33-L176 VanDerWaalsContact CG2-CD2 3.41Å; F119-L176 HydrophobicContact CB-CD1 4.18Å; F119-L176 HydrophobicContact CD1-CD1 3.92Å; F119-L176 HydrophobicContact CD1-CD2 4.36Å; F119-L176 HydrophobicContact CE1-CD1 4.46Å; F119-L176 HydrophobicContact CE1-CD2 4.1Å; F119-L176 HydrophobicContact CG-CD1 4.01Å; F119-L176 HydrophobicContact CZ-CD2 4.22Å; L142-L176 HydrophobicContact CD2-CD1 3.66Å; L142-L176 HydrophobicContact CD2-CG 4.27Å; L144-L176 HydrophobicContact CD2-CD1 4.32Å; L147-L176 HydrophobicContact CD1-CB 4Å; L147-L176 HydrophobicContact CD1-CD1 3.9Å; L147-L176 HydrophobicContact CD2-CB 3.79Å; L147-L176 HydrophobicContact CG-CB 4.32Å; I153-L176 CarbonylContact C-O 3.57Å; I153-L176 WeakPolarHBondContact CA-O 3.32Å; V154-L176 PolarHBondContact N-O 3.15Å; V154-L176 PolarHBondContact O-N 2.68Å; V174-L176 HydrophobicContact CG1-CD2 4.48Å; V174-L176 HydrophobicContact CG1-CG 4.44Å
177	S	94.8	Very high	89.8	Confident	22 Å²	22	44.4 Å²	44.4	15%	0.154	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	134.4	173.5	55.9	0	0	0	0	112.4	K32 F152	K32-S177 PolarHBondContact N-O 2.88Å; K32-S177 PolarHBondContact O-N 2.83Å; F152-S177 WeakPolarHBondContact O-CA 3.31Å
178	L	94.8	Very high	90.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	143.9	169.7	-57.3	-174.7	0	0	0	109.8	L25 V28 L31 W114 L147 F152 R193	L25-L178 HydrophobicContact CD2-CD1 3.79Å; V28-L178 HydrophobicContact CG1-CB 3.9Å; V28-L178 HydrophobicContact CG1-CD1 4.36Å; V28-L178 HydrophobicContact CG1-CD2 4.24Å; V28-L178 HydrophobicContact CG1-CG 4.4Å; V28-L178 HydrophobicContact CG2-CB 4.02Å; V28-L178 HydrophobicContact CG2-CD1 4.19Å; L31-L178 HydrophobicContact CB-CD2 4.08Å; L31-L178 HydrophobicContact CD1-CD2 3.72Å; L31-L178 HydrophobicContact CG-CD2 4.45Å; W114-L178 HydrophobicContact CH2-CD2 3.69Å; W114-L178 HydrophobicContact CZ3-CD1 4.01Å; W114-L178 HydrophobicContact CZ3-CD2 3.63Å; W114-L178 HydrophobicContact CZ3-CG 4.42Å; L147-L178 HydrophobicContact CB-CD1 4.42Å; L147-L178 HydrophobicContact CB-CG 4.47Å; L147-L178 HydrophobicContact CD2-CG 4.47Å; L147-L178 WeakPolarHBondContact O-CD1 3.41Å; F152-L178 HydrophobicContact CB-CB 3.81Å; F152-L178 HydrophobicContact CB-CD1 4Å; F152-L178 HydrophobicContact CB-CG 4.05Å; F152-L178 HydrophobicContact CG-CD1 4.39Å; F152-L178 PolarHBondContact O-N 3.01Å; L178-R193 VanDerWaalsContact O-CZ 3.26Å; L178-R193 PolarHBondContact O-NH1 3.17Å; L178-R193 PolarHBondContact O-NH2 3.14Å
179	G	92.6	Very high	90.3	Very high	4 Å²	4	42.4 Å²	42.4	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	166.9	172.3	0	0	0	0	0	112.3	T29 F30	T29-G179 PolarHBondContact N-O 2.74Å; F30-G179 VanDerWaalsContact CZ-C 3.45Å; F30-G179 VanDerWaalsContact CZ-CA 3.45Å; F30-G179 PolarHBondContact N-O 2.77Å; F30-G179 PolarHBondContact O-N 3.02Å
180	S	91.3	Very high	90	Very high	9 Å²	9	44.1 Å²	44.1	6%	0.063	22%	0.216	C	C	.	.			trans	-130.3	153.9	-178.5	-170.3	0	0	0	0	110.6	Q27 T29 S182 F185	Q27-S180 VanDerWaalsContact O-CB 3.24Å; Q27-S180 WeakPolarHBondContact O-CB 3.34Å; Q27-S180 PolarHBondContact O-OG 3.25Å; T29-S180 WeakPolarHBondContact OG1-CA 3.16Å; S180-S182 WeakPolarHBondContact OG-CB 3.37Å; S180-S182 PolarHBondContact OG-N 3.02Å; S180-F185 VanDerWaalsContact CB-CD1 3.45Å; S180-F185 VanDerWaalsContact CB-CG 3.43Å
181	R	87.2	Confident	89.4	Confident	155 Å²	155	46 Å²	46	59%	0.585	23%	0.227	S	C	*	.	S	Bend	trans	-80	-11.6	160.9	-64.3	176.4	178.8	-179.5	-2.8	111.9	T29	T29-R181 PolarHBondContact OG1-N 3.25Å
182	S	87	Confident	88.9	Confident	28 Å²	28	49.5 Å²	49.5	20%	0.196	24%	0.242	C	C	.	.			trans	-72.8	122.8	176.1	-176.7	0	0	0	0	110.5	S180 I184 F185 T186	S180-S182 WeakPolarHBondContact OG-CB 3.37Å; S180-S182 PolarHBondContact OG-N 3.02Å; S182-I184 VanDerWaalsContact C-N 3.26Å; S182-I184 PolarHBondContact O-N 3.48Å; S182-F185 PolarHBondContact O-N 2.75Å; S182-T186 PolarHBondContact O-N 3.11Å; S182-T186 PolarHBondContact O-OG1 2.94Å
183	M	84.5	Confident	88.3	Confident	135 Å²	135	52.1 Å²	52.1	67%	0.665	25%	0.252	S	S	*	.	H	α-helix	trans	-57.8	-40.4	175.8	-175	167.9	178.3	0	0	111.5	F185 T186 E187	M183-F185 VanDerWaalsContact C-N 3.29Å; M183-F185 PolarHBondContact O-N 2.99Å; M183-T186 PolarHBondContact O-N 2.84Å; M183-T186 VanDerWaalsContact O-N 3.15Å; M183-E187 WeakPolarHBondContact CE-OE1 3.44Å; M183-E187 HydrophobicContact CG-CG 4.11Å; M183-E187 WeakPolarHBondContact O-CB 3.35Å; M183-E187 WeakPolarHBondContact O-CG 3.2Å; M183-E187 PolarHBondContact O-N 2.9Å
184	I	84.8	Confident	87.3	Confident	73 Å²	73	51.5 Å²	51.5	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-58.5	-41.7	179.9	-60.7	172	0	0	0	111.3	Y23 S182 R188	Y23-I184 HydrophobicContact CE1-CG2 4.36Å; S182-I184 VanDerWaalsContact C-N 3.26Å; S182-I184 PolarHBondContact O-N 3.48Å; I184-R188 WeakPolarHBondContact O-CG 3.35Å; I184-R188 PolarHBondContact O-N 3.39Å
185	F	90.2	Very high	85.6	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.013	27%	0.272	C	S	.	.	H	α-helix	trans	-65.7	-49.1	177.4	175.5	-82.6	0	0	0	110.7	L24 Q27 V28 F152 S180 S182 M183 E187 R188 V189	L24-F185 HydrophobicContact CB-CD2 4.25Å; L24-F185 HydrophobicContact CB-CE2 4.42Å; L24-F185 HydrophobicContact CD2-CD2 4.17Å; L24-F185 WeakPolarHBondContact O-CD2 3.29Å; Q27-F185 HydrophobicContact CB-CB 4.2Å; Q27-F185 HydrophobicContact CB-CD2 4.31Å; V28-F185 HydrophobicContact CG2-CD2 4.26Å; V28-F185 HydrophobicContact CG2-CE2 3.52Å; V28-F185 HydrophobicContact CG2-CZ 3.96Å; F152-F185 AromaticContact CD2-CE2 3.77Å; F152-F185 HydrophobicContact CD2-CE2 3.77Å; F152-F185 AromaticContact CD2-CZ 3.8Å; F152-F185 HydrophobicContact CD2-CZ 3.8Å; F152-F185 AromaticContact CE2-CE2 3.86Å; F152-F185 HydrophobicContact CE2-CE2 3.86Å; F152-F185 HydrophobicContact CE2-CZ 4.35Å; S180-F185 VanDerWaalsContact CB-CD1 3.45Å; S180-F185 VanDerWaalsContact CB-CG 3.43Å; S182-F185 PolarHBondContact O-N 2.75Å; M183-F185 VanDerWaalsContact C-N 3.29Å; M183-F185 PolarHBondContact O-N 2.99Å; F185-E187 PolarHBondContact O-N 3.07Å; F185-R188 PolarHBondContact O-N 3.15Å; F185-V189 HydrophobicContact CD1-CB 4.44Å; F185-V189 HydrophobicContact CD1-CG2 4.3Å; F185-V189 HydrophobicContact CD2-CG2 4.14Å; F185-V189 HydrophobicContact CE1-CB 4.08Å; F185-V189 HydrophobicContact CE1-CG1 4.26Å; F185-V189 HydrophobicContact CE1-CG2 4.04Å; F185-V189 HydrophobicContact CE2-CG2 3.89Å; F185-V189 HydrophobicContact CG-CG2 4.34Å; F185-V189 HydrophobicContact CZ-CB 4.28Å; F185-V189 HydrophobicContact CZ-CG1 4.26Å; F185-V189 HydrophobicContact CZ-CG2 3.84Å; F185-V189 WeakPolarHBondContact O-CB 3.39Å; F185-V189 WeakPolarHBondContact O-CG2 3.47Å; F185-V189 PolarHBondContact O-N 3.23Å
186	T	85.6	Confident	83.7	Confident	63 Å²	63	57.2 Å²	57.2	39%	0.387	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-44.1	-177.3	-56.3	0	0	0	0	111.5	S182 M183 R188 V189 E190	S182-T186 PolarHBondContact O-N 3.11Å; S182-T186 PolarHBondContact O-OG1 2.94Å; M183-T186 PolarHBondContact O-N 2.84Å; M183-T186 VanDerWaalsContact O-N 3.15Å; T186-R188 VanDerWaalsContact C-N 3.27Å; T186-R188 PolarHBondContact O-N 3.23Å; T186-V189 PolarHBondContact O-N 3.29Å; T186-E190 HydrophobicContact CG2-CB 4.33Å; T186-E190 WeakPolarHBondContact O-CB 3.12Å; T186-E190 PolarHBondContact O-N 3.46Å
187	E	82.3	Confident	81.6	Confident	115 Å²	115	58.8 Å²	58.8	54%	0.537	30%	0.299	S	S	.	.	H	α-helix	trans	-61.8	-31.8	178.2	-75	-178.8	158.2	0	0	113.3	M183 F185 P191	M183-E187 WeakPolarHBondContact CE-OE1 3.44Å; M183-E187 HydrophobicContact CG-CG 4.11Å; M183-E187 WeakPolarHBondContact O-CB 3.35Å; M183-E187 WeakPolarHBondContact O-CG 3.2Å; M183-E187 PolarHBondContact O-N 2.9Å; F185-E187 PolarHBondContact O-N 3.07Å; E187-P191 VanDerWaalsContact O-CD 3.26Å; E187-P191 WeakPolarHBondContact O-CD 3.11Å; E187-P191 WeakPolarHBondContact O-CG 3.27Å
188	R	86	Confident	79.4	Confident	118 Å²	118	60.9 Å²	60.9	45%	0.445	31%	0.308	S	S	.	.	H	α-helix	trans	-85.6	-42	177.9	-70.2	-163.2	-177.5	-176.9	4.5	113	E20 L24 I184 F185 T186	E20-R188 IonicContact OE1-CZ 2.85Å; E20-R188 IonicContact OE1-NE 3.6Å; E20-R188 IonicContact OE1-NH1 2.72Å; E20-R188 PolarHBondContact OE1-NH1 3.33Å; L24-R188 HydrophobicContact CD2-CB 4.25Å; I184-R188 WeakPolarHBondContact O-CG 3.35Å; I184-R188 PolarHBondContact O-N 3.39Å; F185-R188 PolarHBondContact O-N 3.15Å; T186-R188 VanDerWaalsContact C-N 3.27Å; T186-R188 PolarHBondContact O-N 3.23Å
189	V	87	Confident	77.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-86.6	-37.7	-170.1	177.5	0	0	0	0	112.7	L24 L150 P151 F152 F185 T186 M192 R193	L24-V189 HydrophobicContact CD1-CG2 4.23Å; L24-V189 HydrophobicContact CD2-CG2 4.49Å; L150-V189 HydrophobicContact CD2-CG2 4.19Å; P151-V189 HydrophobicContact CB-CG1 4.33Å; P151-V189 WeakPolarHBondContact O-CG1 3.37Å; F152-V189 HydrophobicContact CD2-CG1 4.32Å; F152-V189 HydrophobicContact CD2-CG2 4.07Å; F152-V189 HydrophobicContact CE2-CG2 4.05Å; F185-V189 HydrophobicContact CD1-CB 4.44Å; F185-V189 HydrophobicContact CD1-CG2 4.3Å; F185-V189 HydrophobicContact CD2-CG2 4.14Å; F185-V189 HydrophobicContact CE1-CB 4.08Å; F185-V189 HydrophobicContact CE1-CG1 4.26Å; F185-V189 HydrophobicContact CE1-CG2 4.04Å; F185-V189 HydrophobicContact CE2-CG2 3.89Å; F185-V189 HydrophobicContact CG-CG2 4.34Å; F185-V189 HydrophobicContact CZ-CB 4.28Å; F185-V189 HydrophobicContact CZ-CG1 4.26Å; F185-V189 HydrophobicContact CZ-CG2 3.84Å; F185-V189 WeakPolarHBondContact O-CB 3.39Å; F185-V189 WeakPolarHBondContact O-CG2 3.47Å; F185-V189 PolarHBondContact O-N 3.23Å; T186-V189 PolarHBondContact O-N 3.29Å; V189-M192 WeakPolarHBondContact O-CB 3.42Å; V189-M192 PolarHBondContact O-N 3.2Å; V189-R193 HydrophobicContact CG1-CG 4.24Å; V189-R193 PolarHBondContact O-N 3.42Å
190	E	81.2	Confident	74.8	Confident	84 Å²	84	67.7 Å²	67.7	39%	0.393	34%	0.343	S	S	.	.	H	α-helix	trans	-62.4	-43.1	-175.9	-165.1	63.1	-158.7	0	0	113.2	T186 M192 R193 N194	T186-E190 HydrophobicContact CG2-CB 4.33Å; T186-E190 WeakPolarHBondContact O-CB 3.12Å; T186-E190 PolarHBondContact O-N 3.46Å; E190-M192 PolarHBondContact O-N 3.37Å; E190-M192 VanDerWaalsContact O-N 3.15Å; E190-R193 PolarHBondContact O-N 3.2Å; E190-R193 VanDerWaalsContact O-N 3.07Å; E190-N194 PolarHBondContact O-N 2.98Å
191	P	80.4	Confident	72.5	Confident	47 Å²	47	69.2 Å²	69.2	31%	0.305	36%	0.356	S	S	.	.	H	α-helix	trans	-46	-39.2	166.7	-40.1	45.7	0	0	0	115.7	E187 N194 P195 I198	E187-P191 VanDerWaalsContact O-CD 3.26Å; E187-P191 WeakPolarHBondContact O-CD 3.11Å; E187-P191 WeakPolarHBondContact O-CG 3.27Å; P191-N194 CarbonylContact O-C 3.54Å; P191-P195 WeakPolarHBondContact O-CA 3.31Å; P191-I198 HydrophobicContact CB-CD1 3.36Å; P191-I198 HydrophobicContact CB-CG1 4.06Å; P191-I198 HydrophobicContact CG-CD1 4.06Å; P191-I198 HydrophobicContact CG-CG1 4.35Å
192	M	82.3	Confident	70.3	Confident	97 Å²	97	69.1 Å²	69.1	48%	0.478	36%	0.36	S	S	.	.	H	α-helix	trans	-79.1	-29.5	-177	-57.5	176.6	69.7	0	0	112.1	L150 P151 V189 E190	L150-M192 HydrophobicContact CB-CE 3.93Å; L150-M192 HydrophobicContact CD1-CE 4.29Å; L150-M192 HydrophobicContact CD2-CE 4.42Å; L150-M192 HydrophobicContact CD2-SD 4.14Å; L150-M192 HydrophobicContact CG-CE 4.46Å; P151-M192 HydrophobicContact CB-CB 3.82Å; P151-M192 HydrophobicContact CG-CB 4.47Å; V189-M192 WeakPolarHBondContact O-CB 3.42Å; V189-M192 PolarHBondContact O-N 3.2Å; E190-M192 PolarHBondContact O-N 3.37Å; E190-M192 VanDerWaalsContact O-N 3.15Å
193	R	83.4	Confident	68.3	Low	55 Å²	55	72.5 Å²	72.5	21%	0.208	38%	0.38	C	S	.	.	H	α-helix	trans	-76.7	-40	177.7	-67.4	-179.6	174	166.5	-0.9	112.2	P151 F152 I153 L178 V189 E190	P151-R193 HydrophobicContact CB-CG 3.86Å; P151-R193 HydrophobicContact CG-CG 4.32Å; P151-R193 VanDerWaalsContact O-CZ 3.3Å; P151-R193 PolarHBondContact O-NE 2.85Å; P151-R193 PolarHBondContact O-NH2 2.81Å; F152-R193 PolarHBondContact O-NH2 2.79Å; F152-R193 VanDerWaalsContact O-NH2 3.15Å; I153-R193 HydrophobicContact CG2-CG 4.09Å; L178-R193 VanDerWaalsContact O-CZ 3.26Å; L178-R193 PolarHBondContact O-NH1 3.17Å; L178-R193 PolarHBondContact O-NH2 3.14Å; V189-R193 HydrophobicContact CG1-CG 4.24Å; V189-R193 PolarHBondContact O-N 3.42Å; E190-R193 PolarHBondContact O-N 3.2Å; E190-R193 VanDerWaalsContact O-N 3.07Å
194	N	73.8	Confident	66.4	Low	56 Å²	56	70.5 Å²	70.5	30%	0.299	37%	0.37	S	S	.	.			trans	-131.5	77.9	-178.6	-165.6	-19.4	0	0	0	109.9	E190 P191 T196 A197	E190-N194 PolarHBondContact O-N 2.98Å; P191-N194 CarbonylContact O-C 3.54Å; N194-T196 PolarHBondContact O-N 2.81Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 2.74Å; N194-A197 HydrophobicContact CB-CB 3.95Å; N194-A197 WeakPolarHBondContact O-CB 3.25Å; N194-A197 PolarHBondContact O-N 3.27Å; N194-A197 PolarHBondContact OD1-N 2.74Å
195	P	57.4	Low	64.2	Low	70 Å²	70	71.6 Å²	71.6	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-59.3	-26.9	179.5	22.7	-32.7	0	0	0	112	P191 I198	P191-P195 WeakPolarHBondContact O-CA 3.31Å; P195-I198 PolarHBondContact O-N 2.88Å
196	T	55.5	Low	61.8	Low	64 Å²	64	75.5 Å²	75.5	39%	0.393	40%	0.397	S	S	.	.	H	α-helix	trans	-71.8	-27.8	177.6	-44	0	0	0	0	112.9	N194 I198 I199 N200	N194-T196 PolarHBondContact O-N 2.81Å; N194-T196 VanDerWaalsContact O-N 3.11Å; N194-T196 PolarHBondContact OD1-N 2.74Å; T196-I198 VanDerWaalsContact C-N 3.27Å; T196-I198 PolarHBondContact O-N 2.86Å; T196-I199 PolarHBondContact O-N 2.89Å; T196-N200 PolarHBondContact O-N 2.64Å; T196-N200 VanDerWaalsContact O-N 3.13Å
197	A	51	Low	59.6	Low	36 Å²	36	77.3 Å²	77.3	30%	0.298	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-33.8	176.4	0	0	0	0	0	112.2	N194 A201	N194-A197 HydrophobicContact CB-CB 3.95Å; N194-A197 WeakPolarHBondContact O-CB 3.25Å; N194-A197 PolarHBondContact O-N 3.27Å; N194-A197 PolarHBondContact OD1-N 2.74Å; A197-A201 WeakPolarHBondContact O-CB 3.36Å; A197-A201 PolarHBondContact O-N 2.83Å
198	I	48.8	Very low	57.8	Low	67 Å²	67	75.8 Å²	75.8	34%	0.344	41%	0.412	S	S	.	.	H	α-helix	trans	-69.9	-46.8	176.1	-47.9	170.8	0	0	0	110	P191 P195 T196 N200 A201 F202	P191-I198 HydrophobicContact CB-CD1 3.36Å; P191-I198 HydrophobicContact CB-CG1 4.06Å; P191-I198 HydrophobicContact CG-CD1 4.06Å; P191-I198 HydrophobicContact CG-CG1 4.35Å; P195-I198 PolarHBondContact O-N 2.88Å; T196-I198 VanDerWaalsContact C-N 3.27Å; T196-I198 PolarHBondContact O-N 2.86Å; I198-N200 VanDerWaalsContact C-N 3.29Å; I198-N200 PolarHBondContact O-N 3.37Å; I198-A201 PolarHBondContact O-N 3.15Å; I198-F202 HydrophobicContact CG2-CD2 3.83Å; I198-F202 HydrophobicContact CG2-CE2 3.79Å; I198-F202 VanDerWaalsContact O-CD2 3.27Å; I198-F202 WeakPolarHBondContact O-CD2 3.33Å; I198-F202 PolarHBondContact O-N 3.38Å
199	I	47.3	Very low	55.8	Low	94 Å²	94	74.3 Å²	74.3	48%	0.482	42%	0.42	S	S	.	.	H	α-helix	trans	-59.7	-44.6	-175.5	-63.3	169.5	0	0	0	109.6	T196 F202 T203	T196-I199 PolarHBondContact O-N 2.89Å; I199-F202 PolarHBondContact O-N 2.86Å; I199-T203 HydrophobicContact CG2-CG2 4.43Å; I199-T203 PolarHBondContact O-N 3.3Å; I199-T203 PolarHBondContact O-OG1 2.93Å
200	N	44.8	Very low	53.8	Low	52 Å²	52	80.1 Å²	80.1	28%	0.278	45%	0.45	S	S	.	.	H	α-helix	trans	-71.9	-30.7	-179.9	-70.8	-7	0	0	0	114	T196 I198 F202 T203 M204	T196-N200 PolarHBondContact O-N 2.64Å; T196-N200 VanDerWaalsContact O-N 3.13Å; I198-N200 VanDerWaalsContact C-N 3.29Å; I198-N200 PolarHBondContact O-N 3.37Å; N200-F202 VanDerWaalsContact C-N 3.27Å; N200-F202 PolarHBondContact O-N 3.43Å; N200-T203 WeakPolarHBondContact CA-OG1 3.38Å; N200-M204 WeakPolarHBondContact O-CB 3.32Å; N200-M204 WeakPolarHBondContact O-CG 3.42Å; N200-M204 PolarHBondContact O-N 3.24Å
201	A	41.1	Very low	51.7	Low	42 Å²	42	84.8 Å²	84.8	35%	0.347	47%	0.472	S	S	.	.	H	α-helix	trans	-66.8	-30.3	176.5	0	0	0	0	0	112.4	A197 I198	A197-A201 WeakPolarHBondContact O-CB 3.36Å; A197-A201 PolarHBondContact O-N 2.83Å; I198-A201 PolarHBondContact O-N 3.15Å
202	F	41.1	Very low	49.7	Very low	153 Å²	153	85.3 Å²	85.3	67%	0.671	49%	0.485	S	S	*	.	H	α-helix	trans	-94.9	-28	179.4	-70.8	-75.1	0	0	0	114.1	I198 I199 N200	I198-F202 HydrophobicContact CG2-CD2 3.83Å; I198-F202 HydrophobicContact CG2-CE2 3.79Å; I198-F202 VanDerWaalsContact O-CD2 3.27Å; I198-F202 WeakPolarHBondContact O-CD2 3.33Å; I198-F202 PolarHBondContact O-N 3.38Å; I199-F202 PolarHBondContact O-N 2.86Å; N200-F202 VanDerWaalsContact C-N 3.27Å; N200-F202 PolarHBondContact O-N 3.43Å
203	T	45.3	Very low	47.3	Very low	99 Å²	99	85 Å²	85	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-82.5	-18.6	175.9	48.2	0	0	0	0	114.2	I199 N200 L205	I199-T203 HydrophobicContact CG2-CG2 4.43Å; I199-T203 PolarHBondContact O-N 3.3Å; I199-T203 PolarHBondContact O-OG1 2.93Å; N200-T203 WeakPolarHBondContact CA-OG1 3.38Å; T203-L205 VanDerWaalsContact C-N 3.34Å
204	M	45.9	Very low	45.3	Very low	92 Å²	92	89.7 Å²	89.7	45%	0.453	53%	0.532	S	S	.	.	S	Bend	trans	-83.4	-7.2	177.3	-70.1	-85	-71.6	0	0	114	N200 D206 V434	N200-M204 WeakPolarHBondContact O-CB 3.32Å; N200-M204 WeakPolarHBondContact O-CG 3.42Å; N200-M204 PolarHBondContact O-N 3.24Å; M204-D206 VanDerWaalsContact C-N 3.31Å; M204-D206 PolarHBondContact O-N 2.77Å; M204-D206 VanDerWaalsContact O-N 3.14Å; M204-V434 HydrophobicContact CE-CG1 4.46Å
205	L	38.6	Very low	43.5	Very low	96 Å²	96	96.3 Å²	96.3	50%	0.503	56%	0.558	S	S	.	*	S	Bend	trans	-81.6	85.3	166.4	-70.9	169.3	0	0	0	107.4	T203 P207	T203-L205 VanDerWaalsContact C-N 3.34Å; L205-P207 WeakPolarHBondContact O-CD 3.4Å
206	D	38.6	Very low	42.6	Very low	85 Å²	85	99.2 Å²	99.2	46%	0.455	58%	0.576	S	S	.	*			trans	-51.4	113.7	166.9	-179.2	6.2	0	0	0	108	M204 S208 S209	M204-D206 VanDerWaalsContact C-N 3.31Å; M204-D206 PolarHBondContact O-N 2.77Å; M204-D206 VanDerWaalsContact O-N 3.14Å; D206-S208 PolarHBondContact O-N 2.82Å; D206-S208 WeakPolarHBondContact OD1-CB 3.35Å; D206-S208 PolarHBondContact OD1-N 3.18Å; D206-S208 PolarHBondContact OD1-OG 2.93Å; D206-S208 WeakPolarHBondContact OD2-CB 3.33Å; D206-S209 PolarHBondContact O-N 3.19Å; D206-S209 PolarHBondContact O-OG 3.26Å
207	P	40.8	Very low	41.8	Very low	101 Å²	101	102.4 Å²	102.4	66%	0.656	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-56.2	-22.6	179.4	-21.5	31.9	0	0	0	112	L205 S209 L210	L205-P207 WeakPolarHBondContact O-CD 3.4Å; P207-S209 VanDerWaalsContact C-N 3.28Å; P207-S209 PolarHBondContact O-N 3.5Å; P207-L210 PolarHBondContact O-N 3.42Å
208	S	43.6	Very low	40.9	Very low	84 Å²	84	104.8 Å²	104.8	59%	0.587	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-72.1	-19	-179.8	-35.4	0	0	0	0	113.3	D206	D206-S208 PolarHBondContact O-N 2.82Å; D206-S208 WeakPolarHBondContact OD1-CB 3.35Å; D206-S208 PolarHBondContact OD1-N 3.18Å; D206-S208 PolarHBondContact OD1-OG 2.93Å; D206-S208 WeakPolarHBondContact OD2-CB 3.33Å
209	S	44.8	Very low	40.1	Very low	87 Å²	87	108.6 Å²	108.6	61%	0.608	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-86.7	-4.6	177.8	68.1	0	0	0	0	114	D206 P207	D206-S209 PolarHBondContact O-N 3.19Å; D206-S209 PolarHBondContact O-OG 3.26Å; P207-S209 VanDerWaalsContact C-N 3.28Å; P207-S209 PolarHBondContact O-N 3.5Å
210	L	43.9	Very low	39.4	Very low	121 Å²	121	112.2 Å²	112.2	63%	0.634	66%	0.656	S	S	*	*	G	3₁₀ helix	trans	-101.6	18.2	-179.7	-76.7	163	0	0	0	113.6	P207 G212	P207-L210 PolarHBondContact O-N 3.42Å; L210-G212 VanDerWaalsContact C-N 3.25Å; L210-G212 PolarHBondContact O-N 2.9Å
211	H	38.3	Very low	38.9	Very low	182 Å²	182	118.7 Å²	118.7	84%	0.843	68%	0.681	S	S	*	*			trans	-88.9	59.8	167.7	-73.9	-6.7	0	0	0	111.6
212	G	36.6	Very low	38.6	Very low	58 Å²	58	123.1 Å²	123.1	60%	0.598	70%	0.699	S	S	*	*	S	Bend	trans	-142.3	100.6	168.3	0	0	0	0	0	107.9	L210 Q214	L210-G212 VanDerWaalsContact C-N 3.25Å; L210-G212 PolarHBondContact O-N 2.9Å; G212-Q214 PolarHBondContact O-N 3.44Å
213	G	33	Very low	38.2	Very low	91 Å²	91	123 Å²	123	94%	0.938	71%	0.706	S	S	*	*			trans	-58.4	101.4	-171.3	0	0	0	0	0	113.2
214	Q	41.4	Very low	37.5	Very low	153 Å²	153	125.7 Å²	125.7	72%	0.715	72%	0.715	S	S	*	*			trans	-130.3	116.6	160.8	-72.9	-167	10.8	0	0	109.9	G212	G212-Q214 PolarHBondContact O-N 3.44Å
215	K	36.7	Very low	37.1	Very low	196 Å²	196	127 Å²	127	85%	0.852	73%	0.728	S	S	*	*			trans	-60.8	130.1	168.4	-86	175.6	170.8	175.5	0	109.2	V217	K215-V217 PolarHBondContact O-N 3.32Å
216	P	36.9	Very low	36.7	Very low	130 Å²	130	128.7 Å²	128.7	84%	0.844	74%	0.737	S	S	*	*			trans	-73	112.7	170.6	27.9	-29	0	0	0	109.3	A218	P216-A218 PolarHBondContact O-N 3.13Å
217	V	38.9	Very low	36.5	Very low	131 Å²	131	132 Å²	132	79%	0.794	76%	0.755	S	S	*	*			trans	-79.5	111.5	168.3	176.8	0	0	0	0	107.9	K215 N219	K215-V217 PolarHBondContact O-N 3.32Å; V217-N219 PolarHBondContact O-N 3.38Å
218	A	32.1	Very low	35.9	Very low	86 Å²	86	133.2 Å²	133.2	71%	0.711	76%	0.756	S	S	*	*			trans	-66.3	114.1	166.2	0	0	0	0	0	109.3	P216	P216-A218 PolarHBondContact O-N 3.13Å
219	N	31.8	Very low	35.1	Very low	148 Å²	148	136.5 Å²	136.5	79%	0.791	77%	0.767	S	S	*	*			trans	178.6	102.1	151.6	-94.1	-31	0	0	0	110.7	V217	V217-N219 PolarHBondContact O-N 3.38Å
220	L	34	Very low	34.4	Very low	169 Å²	169	139.9 Å²	139.9	89%	0.885	78%	0.777	S	S	*	*			trans	-157.1	74.4	150.9	-105.6	134.5	0	0	0	108.9
221	K	33.7	Very low	33.6	Very low	188 Å²	188	139.6 Å²	139.6	82%	0.817	78%	0.781	S	S	*	*			trans	-78.5	139.2	151.3	-92.7	179.2	173.8	177.5	0	107.6
222	N	34.4	Very low	33.1	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	77%	0.772	S	S	*	*			trans	79.9	101.7	162.4	-52.9	-11.6	0	0	0	116.5
223	N	32.1	Very low	32.7	Very low	151 Å²	151	138.4 Å²	138.4	81%	0.807	78%	0.776	S	S	*	*			trans	-162.2	81.5	132.8	-87.4	-34.4	0	0	0	108.6
224	I	31.5	Very low	32.6	Very low	155 Å²	155	140 Å²	140	80%	0.795	77%	0.767	S	S	*	*			trans	-86.6	108.6	162.8	-65	170.9	0	0	0	105.4
225	V	37.1	Very low	31.9	Very low	120 Å²	120	139.3 Å²	139.3	73%	0.727	76%	0.764	S	S	*	*			trans	-119.5	108	163.7	175.6	0	0	0	0	106.3	N227	V225-N227 PolarHBondContact O-N 3.19Å
226	D	31.7	Very low	31.7	Very low	131 Å²	131	135.7 Å²	135.7	70%	0.701	76%	0.762	S	S	*	*			trans	-63.8	115	172.4	-69.6	-51.5	0	0	0	109.8
227	N	32.8	Very low	31.3	Very low	155 Å²	155	136.6 Å²	136.6	83%	0.829	76%	0.755	S	S	*	*			trans	-132.1	84.1	161	-107.9	-7.2	0	0	0	109	V225 N229	V225-N227 PolarHBondContact O-N 3.19Å; N227-N229 PolarHBondContact O-N 3.07Å
228	N	28.1	Very low	30.9	Very low	126 Å²	126	135.7 Å²	135.7	67%	0.674	75%	0.75	S	S	*	*			trans	-64.4	115.7	160.5	-77.9	-37.7	0	0	0	108.4
229	N	27.9	Very low	30.8	Very low	153 Å²	153	136.9 Å²	136.9	82%	0.818	75%	0.753	S	S	*	*			trans	164.6	72.9	146.9	-82.1	-22.3	0	0	0	111	N227	N227-N229 PolarHBondContact O-N 3.07Å
230	L	29.2	Very low	30.7	Very low	158 Å²	158	135.4 Å²	135.4	83%	0.827	75%	0.75	S	S	*	*			trans	-142.2	99.8	161.9	-71	175.4	0	0	0	109.8
231	T	26.9	Very low	30.8	Very low	115 Å²	115	136.5 Å²	136.5	71%	0.706	75%	0.747	S	S	*	*			trans	-72.7	123.3	159.3	34.1	0	0	0	0	108.8	V233	T231-V233 PolarHBondContact O-N 3.33Å
232	P	29.5	Very low	30.6	Very low	101 Å²	101	136.2 Å²	136.2	66%	0.656	75%	0.749	S	S	*	*			trans	-75.2	114	174.9	28.7	-30.1	0	0	0	109.8
233	V	26.7	Very low	30.6	Very low	114 Å²	114	137.5 Å²	137.5	69%	0.691	75%	0.754	S	S	*	*			trans	-81.8	120.9	168.5	178.8	0	0	0	0	108.1	T231 E235	T231-V233 PolarHBondContact O-N 3.33Å; V233-E235 HydrophobicContact CG1-CG 3.95Å
234	V	31	Very low	30.5	Very low	124 Å²	124	135.5 Å²	135.5	75%	0.752	75%	0.751	S	S	*	*			trans	-92.9	99.8	170.6	178.9	0	0	0	0	107.9
235	E	27.6	Very low	30.7	Very low	140 Å²	140	137.3 Å²	137.3	65%	0.654	76%	0.756	S	S	*	*			trans	-85	118.8	170	-69.2	-171.6	156.8	0	0	110.6	V233 H237	V233-E235 HydrophobicContact CG1-CG 3.95Å; E235-H237 IonicContact OE2-CD2 3.15Å; E235-H237 IonicContact OE2-CE1 2.64Å; E235-H237 IonicContact OE2-NE2 3.4Å; E235-H237 PolarHBondContact OE2-NE2 2.85Å
236	C	31.2	Very low	30.4	Very low	119 Å²	119	136.9 Å²	136.9	80%	0.804	76%	0.758	S	S	*	*			trans	-92	106.3	162.7	-87.5	0	0	0	0	109.2
237	H	29.6	Very low	30.7	Very low	149 Å²	149	136 Å²	136	69%	0.69	76%	0.759	S	S	*	*			trans	-98.5	110.9	170	-70.7	-62.5	0	0	0	110.6	E235 S239	E235-H237 IonicContact OE2-CD2 3.15Å; E235-H237 IonicContact OE2-CE1 2.64Å; E235-H237 IonicContact OE2-NE2 3.4Å; E235-H237 PolarHBondContact OE2-NE2 2.85Å; H237-S239 PolarHBondContact O-N 3.43Å
238	T	30.4	Very low	30.7	Very low	112 Å²	112	134.6 Å²	134.6	69%	0.687	76%	0.756	S	S	*	*			trans	-80.5	100.2	158.7	49	0	0	0	0	108.2	T240	T238-T240 PolarHBondContact O-N 3.1Å
239	S	29.5	Very low	31.2	Very low	112 Å²	112	135.4 Å²	135.4	78%	0.783	77%	0.766	S	S	*	*			trans	-71	106.5	169.1	174.2	0	0	0	0	109.2	H237	H237-S239 PolarHBondContact O-N 3.43Å
240	T	30.3	Very low	31.8	Very low	117 Å²	117	136 Å²	136	72%	0.718	76%	0.764	S	S	*	*			trans	-112.1	108.6	162.5	-46.5	0	0	0	0	106.3	T238 E242	T238-T240 PolarHBondContact O-N 3.1Å; T240-E242 PolarHBondContact O-N 2.91Å
241	K	35.9	Very low	32.4	Very low	192 Å²	192	134 Å²	134	84%	0.835	76%	0.762	S	S	*	*			trans	-76.3	106.7	168.9	-88.1	-177.9	172.4	179.2	0	108.2
242	E	29.6	Very low	33	Very low	181 Å²	181	132.7 Å²	132.7	85%	0.846	76%	0.764	S	S	*	*			trans	-78.3	134.4	160.4	-72.6	-175.1	153.3	0	0	109.5	T240	T240-E242 PolarHBondContact O-N 2.91Å
243	I	34.5	Very low	33.5	Very low	163 Å²	163	136.9 Å²	136.9	84%	0.836	77%	0.772	S	S	*	*			trans	-124	129.9	157.4	-67.4	178.5	0	0	0	107
244	C	30.1	Very low	34.1	Very low	109 Å²	109	140.8 Å²	140.8	74%	0.736	78%	0.782	S	S	*	*			trans	-46.3	151.1	-172.3	-54.7	0	0	0	0	117.4
245	Q	34.7	Very low	34.5	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	78%	0.782	S	S	*	*				171.1	115	104.5	-87.5	172.6	18.2	0	0	111.4
246	S	31.6	Very low	35.1	Very low	111 Å²	111	136.1 Å²	136.1	78%	0.776	78%	0.782	S	S	*	*			trans	-72.5	167.7	158.7	45.5	0	0	0	0	110.4
247	P	37	Very low	35.9	Very low	112 Å²	112	137 Å²	137	73%	0.727	78%	0.777	S	S	*	*			cis	-150.8	161.3	39.9	32.7	-6.5	0	0	0	120.4
248	T	32.7	Very low	36.5	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	78%	0.784	S	S	*	*			trans	44.5	124.7	133.8	-37.8	0	0	0	0	121.6
249	V	40.4	Very low	37.1	Very low	144 Å²	144	140.5 Å²	140.5	87%	0.873	79%	0.786	S	S	*	*				-164.2	145.1	121.4	170.2	0	0	0	0	110
250	E	40.4	Very low	37.6	Very low	166 Å²	166	140.7 Å²	140.7	78%	0.776	78%	0.784	S	S	*	*			trans	-76.5	175.6	-164.8	-59.2	168.7	124.1	0	0	118.2
251	S	41.1	Very low	38	Very low	114 Å²	114	142.5 Å²	142.5	80%	0.797	79%	0.785	S	S	*	*			trans	99.3	121.8	149.7	-56.2	0	0	0	0	115.4
252	A	38.6	Very low	38.3	Very low	89 Å²	89	140.6 Å²	140.6	74%	0.736	78%	0.783	S	S	*	*			cis	128.9	144	17.5	0	0	0	0	0	108.1
253	K	40.7	Very low	38.8	Very low	189 Å²	189	136.6 Å²	136.6	82%	0.822	78%	0.775	S	S	*	*			trans	91.8	105.8	170.8	-60.4	-179.8	175.3	-180	0	116.2
254	Q	40.2	Very low	39.1	Very low	196 Å²	196	135 Å²	135	92%	0.916	77%	0.773	S	S	*	*				80.9	131.5	63.3	-87.2	178.7	-29.6	0	0	114.6
255	G	37.9	Very low	39.5	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	77%	0.774	S	S	*	*			trans	120	123.9	160.5	0	0	0	0	0	113.2
256	S	40.7	Very low	39.5	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	76%	0.76	S	S	*	*			cis	164.1	149.2	-17.9	51.6	0	0	0	0	105.5
257	I	49.1	Very low	40	Very low	136 Å²	136	133.2 Å²	133.2	70%	0.697	76%	0.759	S	S	*	*			trans	74.8	133.8	143.4	-67.5	161.7	0	0	0	114.7
258	E	42.2	Very low	40.1	Very low	178 Å²	178	135.9 Å²	135.9	83%	0.832	76%	0.762	S	S	*	*			cis	-162.1	145.7	21.6	-128.5	149.7	-154.2	0	0	109.7
259	E	42.2	Very low	40.4	Very low	157 Å²	157	135 Å²	135	73%	0.734	76%	0.761	S	S	*	*			trans	-81.5	160.5	156.9	-142.8	-173.2	138.1	0	0	108
260	P	40.6	Very low	40.4	Very low	116 Å²	116	133 Å²	133	75%	0.753	75%	0.751	S	S	*	*				-159.8	145.7	86.9	35.9	-13.5	0	0	0	118.6
261	Q	37.9	Very low	40.1	Very low	155 Å²	155	134.1 Å²	134.1	72%	0.724	75%	0.753	S	S	*	*				43.5	157.6	128.4	-50.7	-160.5	0.4	0	0	126.2
262	L	41.7	Very low	40.1	Very low	153 Å²	153	138.1 Å²	138.1	80%	0.801	76%	0.756	S	S	*	*			trans	96.5	135	158.7	-87.3	92.3	0	0	0	115.9
263	S	41.5	Very low	40.1	Very low	97 Å²	97	139.1 Å²	139.1	68%	0.678	76%	0.758	S	S	*	*			cis	-175.4	144.2	-4.3	33.7	0	0	0	0	108.3
264	T	39.5	Very low	39.8	Very low	130 Å²	130	135.9 Å²	135.9	80%	0.798	76%	0.759	S	S	*	*			trans	-60.2	165	165.5	-3.9	0	0	0	0	111.5
265	P	39.9	Very low	39.7	Very low	114 Å²	114	132.1 Å²	132.1	74%	0.74	75%	0.751	S	S	*	*				-158	165.3	70.2	41	-18.3	0	0	0	119.5
266	S	34.3	Very low	39.4	Very low	87 Å²	87	138.7 Å²	138.7	61%	0.608	76%	0.76	S	S	*	*			trans	26.2	140.2	143.9	66.5	0	0	0	0	122.1
267	F	41.2	Very low	39	Very low	173 Å²	173	140.9 Å²	140.9	76%	0.759	77%	0.769	S	S	*	*				-175.6	104.6	124.9	-100.6	-76.5	0	0	0	108
268	E	38.9	Very low	38.2	Very low	169 Å²	169	145.4 Å²	145.4	79%	0.79	78%	0.777	S	S	*	*				91.2	115.6	110.1	-88.4	-177.5	-177.4	0	0	115.7
269	S	40	Very low	37.6	Very low	107 Å²	107	147 Å²	147	75%	0.748	78%	0.782	S	S	*	*			trans	-93.6	156.6	154.1	56.4	0	0	0	0	107.4
270	P	39.9	Very low	37.1	Very low	102 Å²	102	145 Å²	145	66%	0.662	79%	0.785	S	S	*	*				-163.8	161.3	88.7	39.6	-17.7	0	0	0	119
271	K	34.9	Very low	36.6	Very low	188 Å²	188	143.7 Å²	143.7	82%	0.817	78%	0.784	S	S	*	*			trans	72.2	145.4	134.7	-75.6	168.3	-173.5	177.1	0	122.7
272	K	40.3	Very low	36.2	Very low	199 Å²	199	143.6 Å²	143.6	87%	0.865	79%	0.788	S	S	*	*			trans	91.7	133.8	159.4	-66.8	168	179	179.4	0	114.8
273	S	37.7	Very low	36	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	79%	0.791	S	S	*	*			cis	-173	140.1	6.5	39.6	0	0	0	0	108.3
274	S	34.8	Very low	35.5	Very low	121 Å²	121	144.7 Å²	144.7	85%	0.846	80%	0.801	S	S	*	*			trans	-79	156.7	169	-36	0	0	0	0	111.4
275	P	39.4	Very low	35.5	Very low	117 Å²	117	143.4 Å²	143.4	76%	0.76	80%	0.798	S	S	*	*			trans	-127.6	117.7	143.6	31.5	-16.7	0	0	0	112.9
276	K	31.6	Very low	35.4	Very low	208 Å²	208	145.6 Å²	145.6	90%	0.904	80%	0.803	S	S	*	*			trans	-2.3	117.7	134.9	-114.5	165.3	175.8	171.7	0	115.1
277	V	32	Very low	35.9	Very low	141 Å²	141	147.4 Å²	147.4	86%	0.855	81%	0.806	S	S	*	*			trans	-124.1	132.1	151.5	-179.5	0	0	0	0	108.2
278	R	32.4	Very low	36.3	Very low	231 Å²	231	145.4 Å²	145.4	87%	0.872	80%	0.803	S	S	*	*			trans	-70.4	139.8	-166.6	-74.3	171.3	168.1	151.6	-5.5	112.3
279	F	28.2	Very low	36.9	Very low	213 Å²	213	144 Å²	144	93%	0.934	80%	0.801	S	S	*	*			trans	-70	123.7	153.2	-76.9	-91.8	0	0	0	108.7
280	S	32.7	Very low	37.7	Very low	113 Å²	113	143.5 Å²	143.5	79%	0.79	79%	0.787	S	S	*	*			trans	-117	113.1	153.5	-72.5	0	0	0	0	106.5
281	A	30.4	Very low	38.7	Very low	89 Å²	89	141.4 Å²	141.4	74%	0.736	77%	0.774	S	S	*	*			trans	-67.2	127.8	158.7	0	0	0	0	0	107.3
282	D	29.8	Very low	39.8	Very low	154 Å²	154	135.9 Å²	135.9	82%	0.824	76%	0.756	S	S	*	*			trans	177.7	150.5	144.8	-87.4	-26.6	0	0	0	108
283	L	36.4	Very low	40.7	Very low	165 Å²	165	132 Å²	132	86%	0.864	74%	0.741	S	S	*	*			trans	101.7	91.5	170.5	-52.2	172.3	0	0	0	115.7
284	A	30.9	Very low	42	Very low	107 Å²	107	129.6 Å²	129.6	88%	0.884	72%	0.724	S	S	*	*			trans	-48.8	129.3	149.2	0	0	0	0	0	111.6
285	S	39.8	Very low	43.5	Very low	103 Å²	103	128.4 Å²	128.4	72%	0.72	70%	0.7	S	S	*	*			trans	-159.2	127.2	155.4	54.7	0	0	0	0	109.6	D287	S285-D287 PolarHBondContact O-N 2.96Å
286	N	37.5	Very low	44.5	Very low	161 Å²	161	123.8 Å²	123.8	86%	0.861	67%	0.669	S	S	*	*			trans	-41.9	123.6	170	-73.5	-27.2	0	0	0	111.9
287	D	44.6	Very low	46	Very low	124 Å²	124	116 Å²	116	66%	0.663	64%	0.638	S	S	*	*			trans	-139.5	94	167.6	-136	-13.2	0	0	0	109.2	S285 N289	S285-D287 PolarHBondContact O-N 2.96Å; D287-N289 PolarHBondContact O-N 3.23Å
288	D	50.9	Low	47.8	Very low	131 Å²	131	115.4 Å²	115.4	70%	0.701	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	25.7	178.4	-71.2	-44.3	0	0	0	113
289	N	51.7	Low	49.3	Very low	141 Å²	141	106.7 Å²	106.7	75%	0.754	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.3	17.6	-175.8	-81.2	-36.1	0	0	0	113.9	D287 C291	D287-N289 PolarHBondContact O-N 3.23Å; N289-C291 PolarHBondContact O-N 3.4Å
290	E	56.3	Low	50.9	Low	96 Å²	96	96.9 Å²	96.9	45%	0.449	55%	0.548	S	S	.	.			trans	-68.9	117.5	176.8	-164.1	173.7	-154.2	0	0	110.4	C294 R295	E290-C294 HydrophobicContact CG-CB 3.42Å; E290-C294 VanDerWaalsContact CG-CB 3.42Å; E290-R295 HydrophobicContact CG-CB 4.45Å
291	C	61.2	Low	52.6	Low	58 Å²	58	98.6 Å²	98.6	39%	0.392	54%	0.537	S	S	.	.			trans	-66.3	155.1	177.1	72.2	0	0	0	0	110.8	N289 E293 C294 R295	N289-C291 PolarHBondContact O-N 3.4Å; C291-E293 PolarHBondContact O-N 2.76Å; C291-C294 WeakPolarHBondContact O-CB 3.28Å; C291-C294 PolarHBondContact O-N 2.82Å; C291-R295 PolarHBondContact O-N 3.43Å
292	V	57	Low	54.6	Low	72 Å²	72	100.5 Å²	100.5	44%	0.436	53%	0.525	S	S	.	.	H	α-helix	trans	-51.5	-36.9	-177.9	177.3	0	0	0	0	112	R295 I296	V292-R295 PolarHBondContact O-N 2.64Å; V292-I296 HydrophobicContact CG1-CD1 3.78Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 WeakPolarHBondContact O-CB 3.15Å; V292-I296 VanDerWaalsContact O-CG1 3.29Å; V292-I296 WeakPolarHBondContact O-CG1 3.35Å; V292-I296 PolarHBondContact O-N 2.8Å
293	E	58.6	Low	56.1	Low	116 Å²	116	96.9 Å²	96.9	54%	0.542	50%	0.5	S	S	.	.	H	α-helix	trans	-64.4	-46.5	178.5	-61.7	158.3	150.9	0	0	111.8	V149 C291 R295 I296 D297	V149-E293 HydrophobicContact CG2-CG 4.28Å; C291-E293 PolarHBondContact O-N 2.76Å; E293-R295 VanDerWaalsContact C-N 3.34Å; E293-I296 PolarHBondContact O-N 2.8Å; E293-D297 WeakPolarHBondContact O-CB 3.37Å; E293-D297 PolarHBondContact O-N 2.81Å
294	C	66.8	Low	57	Low	61 Å²	61	90.2 Å²	90.2	41%	0.412	47%	0.468	S	S	.	.	H	α-helix	trans	-63.8	-40	175.3	-71.5	0	0	0	0	111.4	E290 C291 D297 Y298	E290-C294 HydrophobicContact CG-CB 3.42Å; E290-C294 VanDerWaalsContact CG-CB 3.42Å; C291-C294 WeakPolarHBondContact O-CB 3.28Å; C291-C294 PolarHBondContact O-N 2.82Å; C294-D297 PolarHBondContact O-N 3.11Å; C294-Y298 WeakPolarHBondContact O-CB 3.34Å; C294-Y298 PolarHBondContact O-N 3.48Å
295	R	65.1	Low	58.6	Low	95 Å²	95	88.5 Å²	88.5	36%	0.358	45%	0.447	S	S	.	.	H	α-helix	trans	-68.3	-38.7	178.8	-170.1	151.2	176	147.8	-11.9	112.6	E290 C291 V292 E293 M299	E290-R295 HydrophobicContact CG-CB 4.45Å; C291-R295 PolarHBondContact O-N 3.43Å; V292-R295 PolarHBondContact O-N 2.64Å; E293-R295 VanDerWaalsContact C-N 3.34Å; R295-M299 WeakPolarHBondContact O-CB 3.45Å; R295-M299 WeakPolarHBondContact O-CG 3.27Å; R295-M299 PolarHBondContact O-N 2.76Å
296	I	60.8	Low	59.7	Low	20 Å²	20	89.1 Å²	89.1	10%	0.103	44%	0.439	C	S	.	.	H	α-helix	trans	-64.3	-44.8	171.6	-70.5	168.9	0	0	0	110.1	V149 V292 E293 M299 L300	V149-I296 HydrophobicContact CG2-CD1 4.07Å; V292-I296 HydrophobicContact CG1-CD1 3.78Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 WeakPolarHBondContact O-CB 3.15Å; V292-I296 VanDerWaalsContact O-CG1 3.29Å; V292-I296 WeakPolarHBondContact O-CG1 3.35Å; V292-I296 PolarHBondContact O-N 2.8Å; E293-I296 PolarHBondContact O-N 2.8Å; I296-M299 PolarHBondContact O-N 2.66Å; I296-L300 HydrophobicContact CG2-CD1 3.84Å; I296-L300 HydrophobicContact CG2-CG 4.32Å; I296-L300 WeakPolarHBondContact O-CB 3.18Å; I296-L300 VanDerWaalsContact O-CG 3.27Å; I296-L300 WeakPolarHBondContact O-CG 3.42Å; I296-L300 PolarHBondContact O-N 2.7Å
297	D	63.5	Low	60.3	Low	45 Å²	45	87.5 Å²	87.5	24%	0.241	43%	0.426	C	S	.	.	H	α-helix	trans	-60.3	-45.9	175.6	-176.5	38.5	0	0	0	111.7	E293 C294 M299 L300 R301	E293-D297 WeakPolarHBondContact O-CB 3.37Å; E293-D297 PolarHBondContact O-N 2.81Å; C294-D297 PolarHBondContact O-N 3.11Å; D297-M299 PolarHBondContact O-N 3.08Å; D297-L300 PolarHBondContact O-N 2.83Å; D297-R301 VanDerWaalsContact O-CG 3.31Å; D297-R301 WeakPolarHBondContact O-CG 3.49Å; D297-R301 PolarHBondContact O-N 2.78Å; D297-R301 IonicContact OD1-CZ 2.7Å; D297-R301 IonicContact OD1-NE 3.87Å; D297-R301 PolarHBondContact OD1-NE 2.79Å; D297-R301 VanDerWaalsContact OD1-NE 3.15Å; D297-R301 IonicContact OD1-NH2 2.71Å; D297-R301 IonicContact OD2-CZ 2.74Å; D297-R301 IonicContact OD2-NE 2.79Å; D297-R301 PolarHBondContact OD2-NE 2.81Å; D297-R301 VanDerWaalsContact OD2-NE 3.1Å; D297-R301 IonicContact OD2-NH2 3.93Å; D297-R301 PolarHBondContact OD2-NH2 2.88Å
298	Y	68.2	Low	60.1	Low	128 Å²	128	87.7 Å²	87.7	50%	0.502	42%	0.423	S	S	.	.	H	α-helix	trans	-57.6	-47.2	174.4	175.1	-95.1	0	0	0	111.9	C294 R301 R302	C294-Y298 WeakPolarHBondContact O-CB 3.34Å; C294-Y298 PolarHBondContact O-N 3.48Å; Y298-R301 PolarHBondContact O-N 2.96Å; Y298-R302 VanDerWaalsContact O-CB 3.32Å; Y298-R302 WeakPolarHBondContact O-CB 3.35Å; Y298-R302 PolarHBondContact O-N 3.15Å
299	M	65.4	Low	59.4	Low	49 Å²	49	87.5 Å²	87.5	24%	0.241	43%	0.429	C	S	.	.	H	α-helix	trans	-62	-42.6	176.8	-75.5	-103	-51.8	0	0	112.3	V18 R295 I296 D297 R302 R303	V18-M299 HydrophobicContact CB-CE 4.49Å; V18-M299 HydrophobicContact CG1-CE 3.24Å; V18-M299 HydrophobicContact CG1-CG 4.22Å; V18-M299 HydrophobicContact CG1-SD 4.04Å; R295-M299 WeakPolarHBondContact O-CB 3.45Å; R295-M299 WeakPolarHBondContact O-CG 3.27Å; R295-M299 PolarHBondContact O-N 2.76Å; I296-M299 PolarHBondContact O-N 2.66Å; D297-M299 PolarHBondContact O-N 3.08Å; M299-R302 PolarHBondContact O-N 3.43Å; M299-R303 PolarHBondContact O-N 2.9Å
300	L	61.9	Low	58.9	Low	7 Å²	7	89.5 Å²	89.5	4%	0.037	43%	0.427	C	S	.	.	H	α-helix	trans	-61.8	-46.7	177.1	-77	168.8	0	0	0	110.9	W22 M111 A115 L148 I296 D297 R303 A304	W22-L300 HydrophobicContact CH2-CD2 4.26Å; W22-L300 HydrophobicContact CZ3-CD2 3.65Å; M111-L300 HydrophobicContact CB-CD1 4.45Å; M111-L300 HydrophobicContact CB-CD2 3.55Å; M111-L300 HydrophobicContact SD-CD2 4.43Å; A115-L300 HydrophobicContact CB-CD1 4.04Å; L148-L300 HydrophobicContact CD1-CD1 3.99Å; I296-L300 HydrophobicContact CG2-CD1 3.84Å; I296-L300 HydrophobicContact CG2-CG 4.32Å; I296-L300 WeakPolarHBondContact O-CB 3.18Å; I296-L300 VanDerWaalsContact O-CG 3.27Å; I296-L300 WeakPolarHBondContact O-CG 3.42Å; I296-L300 PolarHBondContact O-N 2.7Å; D297-L300 PolarHBondContact O-N 2.83Å; L300-R303 PolarHBondContact O-N 3.07Å; L300-A304 WeakPolarHBondContact O-CB 2.85Å; L300-A304 PolarHBondContact O-N 3.2Å
301	R	68.2	Low	57.7	Low	148 Å²	148	88 Å²	88	56%	0.558	44%	0.438	S	S	*	.	H	α-helix	trans	-62.2	-44.1	175.9	-69.6	177	-168.1	-162.4	6.3	111.7	D297 Y298 A304 T305	D297-R301 VanDerWaalsContact O-CG 3.31Å; D297-R301 WeakPolarHBondContact O-CG 3.49Å; D297-R301 PolarHBondContact O-N 2.78Å; D297-R301 IonicContact OD1-CZ 2.7Å; D297-R301 IonicContact OD1-NE 3.87Å; D297-R301 PolarHBondContact OD1-NE 2.79Å; D297-R301 VanDerWaalsContact OD1-NE 3.15Å; D297-R301 IonicContact OD1-NH2 2.71Å; D297-R301 IonicContact OD2-CZ 2.74Å; D297-R301 IonicContact OD2-NE 2.79Å; D297-R301 PolarHBondContact OD2-NE 2.81Å; D297-R301 VanDerWaalsContact OD2-NE 3.1Å; D297-R301 IonicContact OD2-NH2 3.93Å; D297-R301 PolarHBondContact OD2-NH2 2.88Å; Y298-R301 PolarHBondContact O-N 2.96Å; R301-A304 PolarHBondContact O-N 2.87Å; R301-T305 PolarHBondContact O-N 3.06Å; R301-T305 PolarHBondContact O-OG1 2.99Å
302	R	71	Confident	56.5	Low	130 Å²	130	93.3 Å²	93.3	49%	0.491	46%	0.461	S	S	.	.	H	α-helix	trans	-61.9	-45.9	179	-175.9	179	165.4	173	-2.6	111.7	Y298 M299 T305 E306	Y298-R302 VanDerWaalsContact O-CB 3.32Å; Y298-R302 WeakPolarHBondContact O-CB 3.35Å; Y298-R302 PolarHBondContact O-N 3.15Å; M299-R302 PolarHBondContact O-N 3.43Å; R302-T305 WeakPolarHBondContact CA-OG1 2.98Å; R302-T305 PolarHBondContact O-N 3.4Å; R302-T305 PolarHBondContact O-OG1 3.11Å; R302-E306 IonicContact CZ-OE1 3.61Å; R302-E306 IonicContact NE-OE1 3.67Å; R302-E306 PolarHBondContact NE-OE1 2.97Å; R302-E306 IonicContact NH2-OE1 3.92Å; R302-E306 PolarHBondContact NH2-OE1 2.94Å; R302-E306 WeakPolarHBondContact O-CG 3.38Å; R302-E306 PolarHBondContact O-N 3.31Å
303	R	62.1	Low	55.3	Low	78 Å²	78	97.9 Å²	97.9	29%	0.294	48%	0.478	S	S	.	.	H	α-helix	trans	-67.5	-37.8	176.5	-75.1	-166.3	-179.2	-169.7	3.6	112.8	W22 M299 L300 T305 E306 E307	W22-R303 VanDerWaalsContact CZ2-NH1 3.29Å; W22-R303 VanDerWaalsContact NE1-NH1 3.14Å; M299-R303 PolarHBondContact O-N 2.9Å; L300-R303 PolarHBondContact O-N 3.07Å; R303-T305 PolarHBondContact O-N 2.85Å; R303-E306 PolarHBondContact O-N 2.88Å; R303-E306 VanDerWaalsContact O-N 3.11Å; R303-E307 PolarHBondContact O-N 3.38Å
304	A	56.4	Low	54.2	Low	24 Å²	24	102.8 Å²	102.8	20%	0.198	50%	0.498	C	S	.	.	H	α-helix	trans	-59.5	-34.6	173.5	0	0	0	0	0	112	L300 R301	L300-A304 WeakPolarHBondContact O-CB 2.85Å; L300-A304 PolarHBondContact O-N 3.2Å; R301-A304 PolarHBondContact O-N 2.87Å
305	T	63.3	Low	52.4	Low	72 Å²	72	110.4 Å²	110.4	44%	0.442	52%	0.518	S	S	.	.	H	α-helix	trans	-76.5	-31.8	172.6	46.7	0	0	0	0	114.2	R301 R302 R303	R301-T305 PolarHBondContact O-N 3.06Å; R301-T305 PolarHBondContact O-OG1 2.99Å; R302-T305 WeakPolarHBondContact CA-OG1 2.98Å; R302-T305 PolarHBondContact O-N 3.4Å; R302-T305 PolarHBondContact O-OG1 3.11Å; R303-T305 PolarHBondContact O-N 2.85Å
306	E	63	Low	50.9	Low	116 Å²	116	112.4 Å²	112.4	54%	0.542	54%	0.541	S	S	.	.	H	α-helix	trans	-74.5	-29.5	178.3	-73.6	172.6	-177.5	0	0	112.5	R302 R303	R302-E306 IonicContact CZ-OE1 3.61Å; R302-E306 IonicContact NE-OE1 3.67Å; R302-E306 PolarHBondContact NE-OE1 2.97Å; R302-E306 IonicContact NH2-OE1 3.92Å; R302-E306 PolarHBondContact NH2-OE1 2.94Å; R302-E306 WeakPolarHBondContact O-CG 3.38Å; R302-E306 PolarHBondContact O-N 3.31Å; R303-E306 PolarHBondContact O-N 2.88Å; R303-E306 VanDerWaalsContact O-N 3.11Å
307	E	50.9	Low	49.6	Very low	127 Å²	127	117.6 Å²	117.6	59%	0.593	57%	0.574	S	S	*	*	S	Bend	trans	-83.7	-3.8	177	-70.5	-174.4	174.8	0	0	114.1	R303	R303-E307 PolarHBondContact O-N 3.38Å
308	Q	39.1	Very low	48	Very low	127 Å²	127	118.5 Å²	118.5	59%	0.593	59%	0.594	S	S	*	*	S	Bend	trans	-76	128	170.3	-84.1	-161.5	-11.5	0	0	111.1	Y310	Q308-Y310 PolarHBondContact O-N 3.13Å
309	P	37.8	Very low	46.3	Very low	128 Å²	128	119.8 Å²	119.8	83%	0.831	62%	0.615	S	S	*	*			trans	-70	96.6	176.4	27.6	-31.4	0	0	0	109.9	G311	P309-G311 VanDerWaalsContact C-N 3.33Å; P309-G311 PolarHBondContact O-N 2.78Å
310	Y	39.9	Very low	44.7	Very low	182 Å²	182	125 Å²	125	71%	0.714	64%	0.638	S	S	*	*			trans	-69.6	88.5	171.2	-86.9	-88.5	0	0	0	110.7	Q308 L312	Q308-Y310 PolarHBondContact O-N 3.13Å; Y310-L312 PolarHBondContact O-N 2.62Å
311	G	32.1	Very low	43.4	Very low	66 Å²	66	131.1 Å²	131.1	68%	0.68	68%	0.677	S	S	*	*			trans	-82.3	91.4	154.1	0	0	0	0	0	109.8	P309	P309-G311 VanDerWaalsContact C-N 3.33Å; P309-G311 PolarHBondContact O-N 2.78Å
312	L	35.1	Very low	41.6	Very low	168 Å²	168	130.7 Å²	130.7	88%	0.88	68%	0.68	S	S	*	*			trans	167	115.4	141.9	-93.7	149.9	0	0	0	110.2	Y310	Y310-L312 PolarHBondContact O-N 2.62Å
313	Q	32.5	Very low	39.9	Very low	169 Å²	169	135.9 Å²	135.9	79%	0.79	70%	0.702	S	S	*	*			trans	-67.8	144.5	-178	-61.6	175.8	-11.3	0	0	112.4
314	F	34.4	Very low	38.5	Very low	218 Å²	218	136.6 Å²	136.6	96%	0.956	72%	0.715	S	S	*	*			trans	-146.7	123.3	130	-87.7	-73.1	0	0	0	110.4
315	R	29.4	Very low	37.8	Very low	221 Å²	221	142.6 Å²	142.6	83%	0.834	74%	0.738	S	S	*	*			trans	-82.4	141.9	178	-83.7	176.7	162.7	178.8	-4.4	111.2
316	T	34.5	Very low	36.6	Very low	137 Å²	137	147 Å²	147	84%	0.84	75%	0.754	S	S	*	*			trans	-159.7	94.5	132.9	-29.4	0	0	0	0	108.7
317	V	32.9	Very low	35	Very low	130 Å²	130	147 Å²	147	79%	0.788	77%	0.767	S	S	*	*				48.4	111	104.2	-167.8	0	0	0	0	114.6
318	G	29.1	Very low	34.2	Very low	64 Å²	64	146 Å²	146	66%	0.66	77%	0.774	S	S	*	*			trans	-102.8	-170.4	172.4	0	0	0	0	0	113.9
319	T	34	Very low	33.9	Very low	154 Å²	154	145.8 Å²	145.8	95%	0.945	78%	0.781	S	S	*	*			trans	-153.1	134.9	162.8	32.4	0	0	0	0	112.4
320	Q	30.6	Very low	33.6	Very low	158 Å²	158	146.6 Å²	146.6	74%	0.738	78%	0.783	S	S	*	*			trans	-71.2	166.5	175.6	-84.8	171.2	-24.7	0	0	115.2
321	T	34.9	Very low	33.1	Very low	137 Å²	137	141.9 Å²	141.9	84%	0.84	78%	0.782	S	S	*	*				-177.5	108.4	121.8	43.7	0	0	0	0	109.1
322	H	31	Very low	33.2	Very low	138 Å²	138	145.5 Å²	145.5	64%	0.639	79%	0.791	S	S	*	*				52.4	119.5	84	-87.1	-71.6	0	0	0	117.6
323	Y	34.4	Very low	33	Very low	240 Å²	240	146.2 Å²	146.2	94%	0.941	79%	0.79	S	S	*	*			trans	-155.8	148.5	137.5	-104.3	-78	0	0	0	111.5
324	T	33.9	Very low	33.1	Very low	93 Å²	93	144.7 Å²	144.7	57%	0.571	79%	0.793	S	S	*	*			trans	-124.9	169.1	-157.1	37.8	0	0	0	0	113.5
325	H	40.9	Very low	33	Very low	149 Å²	149	140 Å²	140	69%	0.69	78%	0.784	S	S	*	*			trans	84.7	143.1	156.3	-72.7	-68.8	0	0	0	118
326	H	38.2	Very low	33.3	Very low	165 Å²	165	135.1 Å²	135.1	76%	0.764	78%	0.779	S	S	*	*			cis	-161.8	156.6	12.1	-111.7	-54.5	0	0	0	111
327	S	30.2	Very low	33.5	Very low	116 Å²	116	133.8 Å²	133.8	81%	0.811	77%	0.773	S	S	*	*			trans	-82.6	152.9	-178.3	-39.7	0	0	0	0	115.9
328	S	34	Very low	33.6	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	78%	0.778	S	S	*	*				168.9	116.3	116.2	-173.2	0	0	0	0	114.2
329	T	31.1	Very low	33.9	Very low	123 Å²	123	143.2 Å²	143.2	76%	0.755	79%	0.785	S	S	*	*			trans	16.4	132.5	136.2	-8.1	0	0	0	0	121.2
330	V	32.7	Very low	34.3	Very low	144 Å²	144	142.4 Å²	142.4	87%	0.873	77%	0.765	S	S	*	*				-160.4	141.5	102.3	171.9	0	0	0	0	109.8
331	A	29.5	Very low	34.9	Very low	84 Å²	84	138.5 Å²	138.5	69%	0.694	76%	0.755	S	S	*	*			trans	-75.1	150.1	-168.8	0	0	0	0	0	116.2
332	T	33.5	Very low	35.3	Very low	141 Å²	141	137.1 Å²	137.1	87%	0.865	75%	0.746	S	S	*	*			trans	-139.9	123.4	151.4	-25.5	0	0	0	0	109.2
333	Q	31.2	Very low	35.7	Very low	183 Å²	183	133.8 Å²	133.8	86%	0.855	74%	0.743	S	S	*	*			trans	-69.5	134.8	-175.8	-61.9	169.8	8.4	0	0	111.3
334	T	34.6	Very low	36.3	Very low	138 Å²	138	124.2 Å²	124.2	85%	0.847	71%	0.711	S	S	*	*			trans	-158.5	154.5	157.8	19.2	0	0	0	0	109.2
335	P	32.4	Very low	36.7	Very low	118 Å²	118	127.2 Å²	127.2	77%	0.766	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-82.9	148.1	-134.2	31.7	-36.1	0	0	0	115.3
336	T	36.6	Very low	37	Very low	120 Å²	120	124.4 Å²	124.4	74%	0.736	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-53.1	135.1	174.2	39.4	0	0	0	0	113.3	F338	T336-F338 PolarHBondContact O-N 3.15Å
337	P	37	Very low	37.5	Very low	109 Å²	109	119.5 Å²	119.5	71%	0.708	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-72	124.6	166	30.1	-29.8	0	0	0	109.1	F339	P337-F339 PolarHBondContact O-N 3.46Å; P337-F339 VanDerWaalsContact O-N 3.11Å
338	F	35.7	Very low	38.4	Very low	203 Å²	203	118.1 Å²	118.1	89%	0.89	67%	0.67	S	S	*	*			trans	-61.9	108.7	173	-89.8	-97.8	0	0	0	110.2	T336 R340	T336-F338 PolarHBondContact O-N 3.15Å; F338-R340 PolarHBondContact O-N 3.32Å; F338-R340 VanDerWaalsContact O-N 3.14Å
339	F	36	Very low	39.1	Very low	188 Å²	188	119.4 Å²	119.4	83%	0.825	67%	0.665	S	S	*	*			trans	-71.1	101.6	162	-84.8	-91.4	0	0	0	108.7	P337 S341	P337-F339 PolarHBondContact O-N 3.46Å; P337-F339 VanDerWaalsContact O-N 3.11Å; F339-S341 PolarHBondContact O-N 3.47Å
340	R	41	Very low	39.8	Very low	138 Å²	138	116.9 Å²	116.9	52%	0.521	66%	0.656	S	S	.	*			trans	-65.8	127.6	167.5	-87.5	-176.2	175.4	-172.9	-5.6	109.4	F338 E348	F338-R340 PolarHBondContact O-N 3.32Å; F338-R340 VanDerWaalsContact O-N 3.14Å; R340-E348 IonicContact CZ-OE1 2.69Å; R340-E348 IonicContact NH1-OE1 3.69Å; R340-E348 PolarHBondContact NH1-OE1 2.81Å; R340-E348 IonicContact NH1-OE2 3.56Å; R340-E348 PolarHBondContact NH1-OE2 3.03Å; R340-E348 IonicContact NH2-OE1 3.97Å
341	S	44.5	Very low	40.5	Very low	75 Å²	75	114 Å²	114	52%	0.524	65%	0.647	S	S	.	*			trans	-62	153.5	176.4	85.5	0	0	0	0	111.2	F339 A343 S344 R345	F339-S341 PolarHBondContact O-N 3.47Å; S341-A343 PolarHBondContact O-N 3.42Å; S341-A343 VanDerWaalsContact O-N 3.15Å; S341-A343 PolarHBondContact OG-N 2.74Å; S341-S344 WeakPolarHBondContact O-CB 3.26Å; S341-S344 PolarHBondContact O-N 2.74Å; S341-R345 PolarHBondContact O-N 3.37Å
342	V	42.7	Very low	41.2	Very low	108 Å²	108	116.3 Å²	116.3	66%	0.655	65%	0.648	S	S	*	*	H	α-helix	trans	-53.3	-33.4	175.8	177.6	0	0	0	0	111.5	S344 R345 L346	V342-S344 VanDerWaalsContact C-N 3.31Å; V342-S344 PolarHBondContact O-N 2.82Å; V342-R345 PolarHBondContact O-N 2.86Å; V342-L346 HydrophobicContact CG1-CD1 4.1Å; V342-L346 PolarHBondContact O-N 2.82Å; V342-L346 VanDerWaalsContact O-N 3.09Å
343	A	39.5	Very low	41.3	Very low	68 Å²	68	115.7 Å²	115.7	56%	0.562	64%	0.639	S	S	*	*	H	α-helix	trans	-61.8	-36.3	174.8	0	0	0	0	0	112.9	S341 A347	S341-A343 PolarHBondContact O-N 3.42Å; S341-A343 VanDerWaalsContact O-N 3.15Å; S341-A343 PolarHBondContact OG-N 2.74Å; A343-A347 WeakPolarHBondContact O-CB 2.85Å; A343-A347 PolarHBondContact O-N 2.66Å
344	S	46.3	Very low	41.4	Very low	40 Å²	40	112.3 Å²	112.3	28%	0.28	63%	0.633	S	S	.	*	H	α-helix	trans	-69.7	-32.2	176.9	-172.1	0	0	0	0	112.5	S341 V342 E348	S341-S344 WeakPolarHBondContact O-CB 3.26Å; S341-S344 PolarHBondContact O-N 2.74Å; V342-S344 VanDerWaalsContact C-N 3.31Å; V342-S344 PolarHBondContact O-N 2.82Å; S344-E348 PolarHBondContact O-N 3.42Å
345	R	43.9	Very low	41.6	Very low	155 Å²	155	112.7 Å²	112.7	59%	0.585	63%	0.628	S	S	*	*	H	α-helix	trans	-74.2	-38.5	177.1	-61.6	-173.9	-159	-175	4.4	111.8	S341 V342 E348 Q349	S341-R345 PolarHBondContact O-N 3.37Å; V342-R345 PolarHBondContact O-N 2.86Å; R345-E348 PolarHBondContact O-N 2.75Å; R345-Q349 PolarHBondContact O-N 3.05Å
346	L	45.4	Very low	41.9	Very low	90 Å²	90	114.6 Å²	114.6	47%	0.471	63%	0.629	S	S	.	*	H	α-helix	trans	-69.2	-35.6	175.8	-74.7	167.1	0	0	0	112.1	V342 Q349 A350	V342-L346 HydrophobicContact CG1-CD1 4.1Å; V342-L346 PolarHBondContact O-N 2.82Å; V342-L346 VanDerWaalsContact O-N 3.09Å; L346-Q349 PolarHBondContact O-N 3.28Å; L346-A350 WeakPolarHBondContact O-CB 3.13Å; L346-A350 PolarHBondContact O-N 2.71Å
347	A	49.1	Very low	41.8	Very low	62 Å²	62	117.4 Å²	117.4	51%	0.512	63%	0.633	S	S	.	*	H	α-helix	trans	-64.7	-40.8	173.3	0	0	0	0	0	112.5	A343 A350 A351	A343-A347 WeakPolarHBondContact O-CB 2.85Å; A343-A347 PolarHBondContact O-N 2.66Å; A347-A350 PolarHBondContact O-N 2.55Å; A347-A351 WeakPolarHBondContact O-CB 3.41Å; A347-A351 PolarHBondContact O-N 2.69Å
348	E	50.7	Low	42.1	Very low	88 Å²	88	119.4 Å²	119.4	41%	0.411	63%	0.633	S	S	.	*	H	α-helix	trans	-69.1	-31.8	173.6	-83.7	177.3	159.6	0	0	112.8	R340 S344 R345 N352	R340-E348 IonicContact CZ-OE1 2.69Å; R340-E348 IonicContact NH1-OE1 3.69Å; R340-E348 PolarHBondContact NH1-OE1 2.81Å; R340-E348 IonicContact NH1-OE2 3.56Å; R340-E348 PolarHBondContact NH1-OE2 3.03Å; R340-E348 IonicContact NH2-OE1 3.97Å; S344-E348 PolarHBondContact O-N 3.42Å; R345-E348 PolarHBondContact O-N 2.75Å; E348-N352 PolarHBondContact O-ND2 3.48Å
349	Q	47.6	Very low	42.1	Very low	133 Å²	133	118.9 Å²	118.9	62%	0.621	63%	0.634	S	S	*	*	H	α-helix	trans	-72.8	-34.9	173.4	-77.9	-175.7	-37.7	0	0	112.8	R345 L346 N352	R345-Q349 PolarHBondContact O-N 3.05Å; L346-Q349 PolarHBondContact O-N 3.28Å; Q349-N352 PolarHBondContact O-N 3.1Å
350	A	46	Very low	42.4	Very low	70 Å²	70	116.1 Å²	116.1	58%	0.579	63%	0.627	S	S	*	*	H	α-helix	trans	-69.6	-32.3	174.4	0	0	0	0	0	112.6	L346 A347 N352	L346-A350 WeakPolarHBondContact O-CB 3.13Å; L346-A350 PolarHBondContact O-N 2.71Å; A347-A350 PolarHBondContact O-N 2.55Å; A350-N352 VanDerWaalsContact C-N 3.29Å; A350-N352 PolarHBondContact O-N 3.28Å
351	A	47.9	Very low	42.5	Very low	82 Å²	82	114.6 Å²	114.6	68%	0.678	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-14.7	177.6	0	0	0	0	0	114.3	A347	A347-A351 WeakPolarHBondContact O-CB 3.41Å; A347-A351 PolarHBondContact O-N 2.69Å
352	N	42.9	Very low	42.6	Very low	133 Å²	133	114.5 Å²	114.5	71%	0.711	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	11.1	-176.6	-75.7	-49.7	0	0	0	114	E348 Q349 A350	E348-N352 PolarHBondContact O-ND2 3.48Å; Q349-N352 PolarHBondContact O-N 3.1Å; A350-N352 VanDerWaalsContact C-N 3.29Å; A350-N352 PolarHBondContact O-N 3.28Å
353	L	36.8	Very low	43.5	Very low	129 Å²	129	114 Å²	114	68%	0.675	63%	0.633	S	S	*	*	S	Bend	trans	-78.1	128.1	172.6	-78.2	167.7	0	0	0	110.1	I355	L353-I355 PolarHBondContact O-N 3.26Å
354	P	34	Very low	45	Very low	112 Å²	112	113.8 Å²	113.8	73%	0.727	63%	0.625	S	S	*	*			trans	-63.3	120.2	-179.7	24.4	-31.3	0	0	0	110	M356	P354-M356 PolarHBondContact O-N 2.98Å
355	I	37.7	Very low	46.5	Very low	146 Å²	146	113.6 Å²	113.6	75%	0.749	62%	0.623	S	S	*	*			trans	-69.5	97.4	171.9	-58.5	170.1	0	0	0	106.8	L353 E357	L353-I355 PolarHBondContact O-N 3.26Å; I355-E357 HydrophobicContact CG2-CG 3.91Å; I355-E357 PolarHBondContact O-N 3.01Å
356	M	38.7	Very low	48.4	Very low	158 Å²	158	107.7 Å²	107.7	78%	0.778	61%	0.605	S	S	*	*			trans	-82.1	90.3	163	-77.7	-168.5	66.5	0	0	107.8	P354 E358	P354-M356 PolarHBondContact O-N 2.98Å; M356-E358 PolarHBondContact O-N 3.37Å; M356-E358 VanDerWaalsContact O-N 3.14Å
357	E	35.2	Very low	50.4	Low	178 Å²	178	103.4 Å²	103.4	83%	0.832	58%	0.582	S	S	*	*			trans	-66.3	98.3	161.1	-82	171	-178	0	0	107.9	I355	I355-E357 HydrophobicContact CG2-CG 3.91Å; I355-E357 PolarHBondContact O-N 3.01Å
358	E	42.6	Very low	52.4	Low	151 Å²	151	104.5 Å²	104.5	71%	0.706	58%	0.575	S	S	*	*			trans	-112.6	101.1	165.3	-142.9	175.8	-159.1	0	0	107.8	M356 N360	M356-E358 PolarHBondContact O-N 3.37Å; M356-E358 VanDerWaalsContact O-N 3.14Å; E358-N360 VanDerWaalsContact C-N 3.33Å; E358-N360 PolarHBondContact O-N 3.07Å
359	E	36.6	Very low	54.4	Low	193 Å²	193	100.4 Å²	100.4	90%	0.902	56%	0.556	S	S	*	*			trans	-52.9	91.7	168.9	-74.9	178.8	130.6	0	0	109.8
360	N	40.9	Very low	56.5	Low	130 Å²	130	94 Å²	94	70%	0.695	53%	0.527	S	S	*	.			trans	-135.1	114	164.9	-97.9	-32.6	0	0	0	108.3	E358 C362	E358-N360 VanDerWaalsContact C-N 3.33Å; E358-N360 PolarHBondContact O-N 3.07Å; N360-C362 PolarHBondContact O-N 2.84Å; N360-C362 VanDerWaalsContact O-N 3.11Å
361	S	43.5	Very low	58.9	Low	105 Å²	105	90.7 Å²	90.7	73%	0.734	50%	0.499	S	S	*	.			trans	-24.8	109.2	177.8	55.5	0	0	0	0	113	V363	S361-V363 PolarHBondContact O-N 2.91Å
362	C	46.5	Very low	61	Low	73 Å²	73	88.4 Å²	88.4	49%	0.493	47%	0.474	S	S	.	.			trans	-63.1	91.9	-176.6	-170.6	0	0	0	0	110.1	N360 T364 P428	N360-C362 PolarHBondContact O-N 2.84Å; N360-C362 VanDerWaalsContact O-N 3.11Å; C362-T364 PolarHBondContact O-N 2.76Å; C362-P428 WeakPolarHBondContact SG-CD 3.09Å; C362-P428 WeakPolarHBondContact SG-CG 3.49Å
363	V	62.2	Low	63.4	Low	97 Å²	97	87.4 Å²	87.4	59%	0.588	46%	0.461	S	S	*	.			trans	-72.9	98.1	175.8	-175.5	0	0	0	0	107.3	S361 S365	S361-V363 PolarHBondContact O-N 2.91Å; V363-S365 PolarHBondContact O-N 2.64Å
364	T	70.1	Confident	66	Low	64 Å²	64	81.3 Å²	81.3	39%	0.393	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-65.2	128.1	170.5	50.7	0	0	0	0	108.7	C362	C362-T364 PolarHBondContact O-N 2.76Å
365	S	78.4	Confident	68.6	Low	36 Å²	36	79.3 Å²	79.3	25%	0.252	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	133.6	176.4	-56.4	0	0	0	0	109.6	V363 C367 I426	V363-S365 PolarHBondContact O-N 2.64Å; S365-C367 PolarHBondContact O-N 3.27Å; S365-I426 PolarHBondContact N-O 2.99Å; S365-I426 PolarHBondContact O-N 2.82Å
366	V	83.4	Confident	70.8	Confident	31 Å²	31	78.2 Å²	78.2	19%	0.188	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	119.9	173.3	-170.6	0	0	0	0	109.3	V424 K490	V366-V424 WeakPolarHBondContact CA-O 3.44Å; V366-K490 HydrophobicContact CB-CB 4.45Å; V366-K490 HydrophobicContact CB-CD 4.29Å; V366-K490 HydrophobicContact CG1-CD 3.97Å; V366-K490 PolarHBondContact O-N 3.05Å
367	C	87.6	Confident	72.8	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.9	178.4	178	0	0	0	0	110.4	S365 D423 V424 I426 V487 H488 F489	S365-C367 PolarHBondContact O-N 3.27Å; C367-D423 WeakPolarHBondContact O-CA 3.12Å; C367-V424 HydrophobicContact CB-CG2 4.28Å; C367-V424 PolarHBondContact N-O 2.85Å; C367-V424 VanDerWaalsContact O-CG2 3.26Å; C367-V424 WeakPolarHBondContact O-CG2 3.33Å; C367-V424 PolarHBondContact O-N 3.43Å; C367-I426 HydrophobicContact CB-CD1 3.39Å; C367-I426 HydrophobicContact CB-CG1 3.89Å; C367-V487 WeakPolarHBondContact SG-CG1 3.16Å; C367-H488 CarbonylContact C-O 3.57Å; C367-H488 VanDerWaalsContact CA-O 3.32Å; C367-H488 WeakPolarHBondContact CA-O 3.2Å; C367-H488 PolarHBondContact SG-O 2.93Å; C367-F489 HydrophobicContact CB-CD1 4.14Å; C367-F489 HydrophobicContact CB-CE1 4.17Å
368	K	90.7	Very high	74.4	Confident	85 Å²	85	66.1 Å²	66.1	37%	0.37	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	111.2	170.1	-173.7	172.4	-171	180	0	109.6	L422 D423 H488	K368-L422 CarbonylContact C-O 3.54Å; K368-L422 WeakPolarHBondContact CA-O 3.22Å; K368-D423 WeakPolarHBondContact CB-OD1 3.27Å; K368-D423 WeakPolarHBondContact CG-OD1 3.42Å; K368-H488 HydrophobicContact CB-CB 4.21Å; K368-H488 PolarHBondContact N-O 3.35Å; K368-H488 PolarHBondContact O-N 2.72Å
369	I	92.4	Very high	75.7	Confident	2 Å²	2	60.7 Å²	60.7	1%	0.01	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	141.2	176	-60.3	172.5	0	0	0	108.7	Y398 I400 L421 L422 V424 L433 F435 S486	I369-Y398 HydrophobicContact CD1-CD2 4.47Å; I369-Y398 HydrophobicContact CD1-CE2 3.83Å; I369-Y398 HydrophobicContact CG2-CE1 4.27Å; I369-I400 HydrophobicContact CD1-CD1 3.84Å; I369-L421 CarbonylContact O-C 3.56Å; I369-L421 WeakPolarHBondContact O-CA 3.1Å; I369-L422 PolarHBondContact N-O 2.83Å; I369-L422 PolarHBondContact O-N 2.76Å; I369-V424 HydrophobicContact CD1-CG2 3.39Å; I369-V424 HydrophobicContact CG1-CG2 3.84Å; I369-L433 HydrophobicContact CD1-CD1 3.45Å; I369-L433 VanDerWaalsContact CD1-CD1 3.45Å; I369-L433 HydrophobicContact CG1-CD1 4.16Å; I369-F435 HydrophobicContact CG2-CE1 3.98Å; I369-F435 HydrophobicContact CG2-CZ 3.86Å; I369-S486 CarbonylContact C-O 3.48Å; I369-S486 VanDerWaalsContact CA-O 3.28Å; I369-S486 WeakPolarHBondContact CA-O 3.37Å
370	G	93	Very high	76.8	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.9	173.1	0	0	0	0	0	111.8	W420 I485 S486	G370-W420 CarbonylContact C-O 3.46Å; G370-W420 WeakPolarHBondContact CA-O 3.41Å; G370-I485 CarbonylContact O-C 3.5Å; G370-I485 VanDerWaalsContact O-CA 3.26Å; G370-I485 WeakPolarHBondContact O-CA 3.21Å; G370-S486 VanDerWaalsContact CA-OG 3.25Å; G370-S486 WeakPolarHBondContact CA-OG 3.15Å; G370-S486 PolarHBondContact N-O 3.47Å; G370-S486 PolarHBondContact N-OG 2.9Å; G370-S486 PolarHBondContact O-N 2.99Å
371	V	94.9	Very high	77.5	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	108	170.3	-177.8	0	0	0	0	106.9	V396 W418 D419 W420 F435 L483	V371-V396 HydrophobicContact CG1-CB 4.05Å; V371-V396 HydrophobicContact CG1-CG1 4.19Å; V371-V396 HydrophobicContact CG1-CG2 3.89Å; V371-V396 HydrophobicContact CG2-CG1 4.34Å; V371-W418 HydrophobicContact CG1-CD2 4.48Å; V371-W418 HydrophobicContact CG1-CE3 3.91Å; V371-W418 HydrophobicContact CG1-CZ3 4.36Å; V371-D419 PolarHBondContact O-N 3.49Å; V371-W420 HydrophobicContact CB-CE3 4.06Å; V371-W420 HydrophobicContact CG2-CE3 3.93Å; V371-W420 HydrophobicContact CG2-CZ3 4.2Å; V371-W420 PolarHBondContact N-O 3.09Å; V371-W420 PolarHBondContact O-N 3.31Å; V371-F435 HydrophobicContact CG2-CD1 4Å; V371-F435 HydrophobicContact CG2-CE1 3.78Å; V371-L483 HydrophobicContact CG1-CD1 4.17Å
372	H	93.3	Very high	77.8	Confident	33 Å²	33	59.4 Å²	59.4	15%	0.153	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	-63.2	-168.7	-62.3	-86.8	0	0	0	111	W418 D419 Q484 S486	H372-W418 PolarHBondContact O-N 3.36Å; H372-D419 IonicContact ND1-OD1 3.54Å; H372-D419 PolarHBondContact O-N 3.12Å; H372-Q484 HydrophobicContact CB-CB 4.16Å; H372-Q484 HydrophobicContact CB-CG 4.09Å; H372-Q484 PolarHBondContact N-O 3.11Å; H372-S486 VanDerWaalsContact NE2-CB 3.27Å; H372-S486 WeakPolarHBondContact NE2-CB 3.33Å; H372-S486 PolarHBondContact NE2-OG 2.88Å
373	R	94	Very high	77.5	Confident	113 Å²	113	64.7 Å²	64.7	43%	0.426	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	164.1	-174.3	54.9	176	178.5	174.8	0.2	112.2	P416 T417 W469 Q484	R373-P416 CarbonylContact C-O 3.57Å; R373-P416 WeakPolarHBondContact CA-O 3.38Å; R373-P416 WeakPolarHBondContact CB-O 3.41Å; R373-T417 HydrophobicContact CB-CG2 4.35Å; R373-W469 HydrophobicContact CG-CH2 3.73Å; R373-W469 HydrophobicContact CG-CZ2 4.37Å; R373-W469 HydrophobicContact CG-CZ3 4.43Å; R373-Q484 HydrophobicContact CG-CB 4.09Å; R373-Q484 VanDerWaalsContact CG-OE1 3.29Å; R373-Q484 WeakPolarHBondContact O-CB 3.4Å; R373-Q484 PolarHBondContact O-N 2.87Å
374	A	91.1	Very high	76.7	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	161.3	167.4	0	0	0	0	0	111.1	L377 E415 P416 W418 Q482 L483	A374-L377 HydrophobicContact CB-CD1 3.99Å; A374-L377 HydrophobicContact CB-CD2 4.22Å; A374-L377 HydrophobicContact CB-CG 4.21Å; A374-E415 VanDerWaalsContact O-CA 3.27Å; A374-E415 WeakPolarHBondContact O-CA 3.3Å; A374-P416 HydrophobicContact CB-CG 3.74Å; A374-P416 PolarHBondContact N-O 2.85Å; A374-W418 HydrophobicContact CB-CH2 4.09Å; A374-W418 HydrophobicContact CB-CZ3 3.99Å; A374-Q482 CarbonylContact C-O 3.46Å; A374-Q482 WeakPolarHBondContact CA-O 3.38Å; A374-Q482 VanDerWaalsContact CB-O 3.32Å; A374-Q482 WeakPolarHBondContact CB-O 3.47Å; A374-L483 HydrophobicContact CB-CD1 3.96Å
375	R	87.9	Confident	75.6	Confident	70 Å²	70	68.5 Å²	68.5	26%	0.264	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	165.1	174.3	65.8	179.7	-179.2	176	0.1	111.3	L377 E415 W469 G481 Q482	R375-L377 PolarHBondContact O-N 2.86Å; R375-E415 HydrophobicContact CB-CG 4.4Å; R375-W469 HydrophobicContact CB-CH2 4.28Å; R375-W469 HydrophobicContact CB-CZ3 4.25Å; R375-W469 HydrophobicContact CG-CE3 4.17Å; R375-W469 HydrophobicContact CG-CH2 3.83Å; R375-W469 HydrophobicContact CG-CZ3 3.54Å; R375-G481 CarbonylContact O-C 3.56Å; R375-G481 WeakPolarHBondContact O-CA 2.94Å; R375-Q482 HydrophobicContact CG-CB 4Å; R375-Q482 PolarHBondContact N-O 3.14Å; R375-Q482 PolarHBondContact O-N 3.48Å
376	Y	82.9	Confident	74.2	Confident	123 Å²	123	70.4 Å²	70.4	48%	0.482	36%	0.36	S	S	.	.			trans	58.2	28.6	179.2	-47.6	-50.1	0	0	0	114.1	S378 Q482	Y376-S378 PolarHBondContact O-N 2.91Å; Y376-Q482 HydrophobicContact CD2-CG 4.37Å
377	L	81.4	Confident	72.6	Confident	12 Å²	12	78.9 Å²	78.9	6%	0.063	39%	0.394	C	S	.	.			trans	-71.7	115.2	174.3	-58.1	-175.1	0	0	0	109	A374 R375 L379 L394 L413 P416 L437 L472	A374-L377 HydrophobicContact CB-CD1 3.99Å; A374-L377 HydrophobicContact CB-CD2 4.22Å; A374-L377 HydrophobicContact CB-CG 4.21Å; R375-L377 PolarHBondContact O-N 2.86Å; L377-L379 VanDerWaalsContact C-N 3.3Å; L377-L379 PolarHBondContact O-N 2.89Å; L377-L394 HydrophobicContact CD1-CD1 3.75Å; L377-L413 WeakPolarHBondContact CB-O 3.43Å; L377-P416 HydrophobicContact CD1-CG 3.77Å; L377-L437 HydrophobicContact CD1-CD2 3.94Å; L377-L437 HydrophobicContact CD2-CD2 3.68Å; L377-L472 HydrophobicContact CD2-CD1 3.52Å
378	S	68.7	Low	70.8	Confident	70 Å²	70	82.5 Å²	82.5	49%	0.49	42%	0.42	S	S	.	.			trans	-92.7	61.5	-177.9	-64.8	0	0	0	0	110.9	Y376 T380	Y376-S378 PolarHBondContact O-N 2.91Å; S378-T380 PolarHBondContact O-N 3.03Å
379	L	70.5	Confident	69	Low	36 Å²	36	82.5 Å²	82.5	19%	0.188	44%	0.444	C	S	.	.			trans	-78	105.1	172.4	-67.1	169.9	0	0	0	108.6	L377 D381 L394 L413 Y439 L450	L377-L379 VanDerWaalsContact C-N 3.3Å; L377-L379 PolarHBondContact O-N 2.89Å; L379-D381 VanDerWaalsContact C-N 3.31Å; L379-D381 PolarHBondContact O-N 2.93Å; L379-L394 HydrophobicContact CD1-CD1 4.18Å; L379-L394 HydrophobicContact CD1-CD2 4.16Å; L379-L413 HydrophobicContact CD1-CB 4.1Å; L379-L413 HydrophobicContact CD1-CD2 3.95Å; L379-Y439 HydrophobicContact CD1-CD2 3.94Å; L379-Y439 HydrophobicContact CD1-CE2 4.09Å; L379-Y439 HydrophobicContact CD2-CD2 4.35Å; L379-Y439 HydrophobicContact CD2-CG 4.33Å; L379-L450 HydrophobicContact CD1-CD1 4.11Å; L379-L450 HydrophobicContact CD2-CD1 3.78Å; L379-L450 HydrophobicContact CD2-CD2 3.53Å; L379-L450 HydrophobicContact CD2-CG 4.3Å; L379-L450 HydrophobicContact CG-CD1 4.26Å
380	T	58.9	Low	67.5	Low	130 Å²	130	87 Å²	87	80%	0.798	46%	0.463	S	S	*	.			trans	-72.4	87.3	172.6	45.4	0	0	0	0	109.8	S378 K382	S378-T380 PolarHBondContact O-N 3.03Å; T380-K382 VanDerWaalsContact C-N 3.27Å; T380-K382 PolarHBondContact O-N 3.09Å
381	D	55.9	Low	66	Low	92 Å²	92	88 Å²	88	49%	0.492	47%	0.473	S	S	.	.			trans	-72.7	84.1	165.5	-75.2	-29.4	0	0	0	109.2	L379 E383 L413	L379-D381 VanDerWaalsContact C-N 3.31Å; L379-D381 PolarHBondContact O-N 2.93Å; D381-E383 PolarHBondContact O-N 3.2Å; D381-L413 WeakPolarHBondContact OD2-CD1 3.32Å
382	K	49.2	Very low	64.8	Low	180 Å²	180	89.5 Å²	89.5	78%	0.783	48%	0.484	S	S	*	.			trans	-80.1	105.9	158.3	-72	-165.4	177.2	-174.6	0	108	T380	T380-K382 VanDerWaalsContact C-N 3.27Å; T380-K382 PolarHBondContact O-N 3.09Å
383	E	41.5	Very low	64.4	Low	183 Å²	183	89.1 Å²	89.1	86%	0.855	48%	0.482	S	S	*	.	S	Bend	trans	64.5	126	157.3	-67.3	176.5	154.7	0	0	118.7	D381	D381-E383 PolarHBondContact O-N 3.2Å
384	G	45.4	Very low	64.2	Low	58 Å²	58	83.7 Å²	83.7	60%	0.598	46%	0.461	S	S	*	.			trans	123.8	82.2	162	0	0	0	0	0	112.5	S386	G384-S386 PolarHBondContact O-N 3.44Å; G384-S386 PolarHBondContact O-OG 3.02Å
385	E	45.7	Very low	64.3	Low	183 Å²	183	85.7 Å²	85.7	86%	0.855	47%	0.468	S	S	*	.			trans	-49.4	92.7	154	-78	-177.4	154.3	0	0	108.2	K387	E385-K387 PolarHBondContact O-N 3.39Å
386	S	49.2	Very low	64.6	Low	77 Å²	77	82.3 Å²	82.3	54%	0.538	46%	0.456	S	S	.	.			trans	-75.8	101.2	176.7	-61.9	0	0	0	0	105.6	G384 S388	G384-S386 PolarHBondContact O-N 3.44Å; G384-S386 PolarHBondContact O-OG 3.02Å; S386-S388 PolarHBondContact O-N 3.24Å
387	K	50.3	Low	65.2	Low	209 Å²	209	77 Å²	77	91%	0.909	44%	0.436	S	S	*	.			trans	-61.3	15.5	175.8	-68.7	-178.1	176.1	178.5	0	114.4	E385	E385-K387 PolarHBondContact O-N 3.39Å
388	S	50.3	Low	65.7	Low	76 Å²	76	76.4 Å²	76.4	53%	0.531	43%	0.433	S	S	.	.	S	Bend	trans	-85.1	123.5	171.2	175.2	0	0	0	0	108.2	S386 K390	S386-S388 PolarHBondContact O-N 3.24Å; S388-K390 CarbonylContact O-C 3.56Å; S388-K390 PolarHBondContact O-N 2.9Å
389	G	52.5	Low	66.7	Low	85 Å²	85	76 Å²	76	88%	0.876	42%	0.423	S	S	*	.	S	Bend	trans	-61.8	8.2	-177.5	0	0	0	0	0	116.2
390	K	61.6	Low	67.5	Low	95 Å²	95	75 Å²	75	41%	0.413	42%	0.418	S	S	.	.	S	Bend	trans	-123	84.9	169.7	-64.9	176.6	-179	176.7	0	107.7	S388 E443	S388-K390 CarbonylContact O-C 3.56Å; S388-K390 PolarHBondContact O-N 2.9Å; K390-E443 WeakPolarHBondContact CD-OE2 3.36Å; K390-E443 IonicContact NZ-OE1 3.7Å; K390-E443 PolarHBondContact NZ-OE1 2.65Å; K390-E443 IonicContact NZ-OE2 3.86Å; K390-E443 PolarHBondContact NZ-OE2 2.77Å
391	G	60	Low	68.6	Low	21 Å²	21	71.3 Å²	71.3	22%	0.216	41%	0.406	C	S	.	.			trans	-66.6	-173.4	178.8	0	0	0	0	0	113	H393	G391-H393 PolarHBondContact O-CE1 2.93Å; G391-H393 PolarHBondContact O-ND1 3.31Å; G391-H393 VanDerWaalsContact O-ND1 3.08Å; G391-H393 PolarHBondContact O-NE2 2.75Å
392	P	69.7	Low	69.8	Low	33 Å²	33	74.9 Å²	74.9	21%	0.214	43%	0.425	C	S	.	.			trans	-62.8	144.4	179.6	27.3	-34.6	0	0	0	111.6	L413 Y439 K440	P392-L413 HydrophobicContact CB-CD1 4.44Å; P392-L413 HydrophobicContact CB-CD2 3.87Å; P392-L413 HydrophobicContact CG-CD1 3.63Å; P392-L413 HydrophobicContact CG-CD2 3.77Å; P392-L413 HydrophobicContact CG-CG 4.03Å; P392-Y439 HydrophobicContact CB-CE2 3.73Å; P392-K440 CarbonylContact C-O 3.51Å; P392-K440 VanDerWaalsContact CA-O 3.26Å; P392-K440 WeakPolarHBondContact CA-O 3.2Å
393	H	85	Confident	71.6	Confident	24 Å²	24	71.8 Å²	71.8	11%	0.111	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	136.4	-176.6	-53.9	-38.8	0	0	0	111.1	G391 W395 P409 S410 Y411 Y439 K440	G391-H393 PolarHBondContact O-CE1 2.93Å; G391-H393 PolarHBondContact O-ND1 3.31Å; G391-H393 VanDerWaalsContact O-ND1 3.08Å; G391-H393 PolarHBondContact O-NE2 2.75Å; H393-W395 HydrophobicContact CB-CE3 4.3Å; H393-W395 HydrophobicContact CB-CZ3 4.37Å; H393-P409 HydrophobicContact CB-CB 3.86Å; H393-S410 CarbonylContact C-O 3.45Å; H393-S410 WeakPolarHBondContact CA-O 3.44Å; H393-Y411 AromaticContact CE1-CD1 3.51Å; H393-Y411 AromaticContact CE1-CE1 2.95Å; H393-Y411 WeakPolarHBondContact CE1-CE1 3.22Å; H393-Y411 AromaticContact CE1-CZ 3.57Å; H393-Y411 AromaticContact ND1-CD1 3.34Å; H393-Y411 VanDerWaalsContact ND1-CD1 3.34Å; H393-Y411 WeakPolarHBondContact ND1-CD1 3.23Å; H393-Y411 AromaticContact ND1-CE1 3.16Å; H393-Y411 WeakPolarHBondContact ND1-CE1 3.39Å; H393-Y411 AromaticContact ND1-CZ 3.62Å; H393-Y439 WeakPolarHBondContact O-CA 3.43Å; H393-K440 PolarHBondContact N-O 3.29Å; H393-K440 PolarHBondContact O-N 2.83Å
394	L	90.3	Very high	73.9	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.3	169.8	-70.6	171.3	0	0	0	110.1	L377 L379 P409 S410 S412 L413 P416 W418 W438 Y439 L450	L377-L394 HydrophobicContact CD1-CD1 3.75Å; L379-L394 HydrophobicContact CD1-CD1 4.18Å; L379-L394 HydrophobicContact CD1-CD2 4.16Å; L394-P409 CarbonylContact O-C 3.49Å; L394-P409 WeakPolarHBondContact O-CA 3.26Å; L394-S410 PolarHBondContact N-O 3.04Å; L394-S410 PolarHBondContact O-N 3.46Å; L394-S412 WeakPolarHBondContact CD1-O 3.41Å; L394-L413 HydrophobicContact CD1-CD2 4.19Å; L394-L413 HydrophobicContact CG-CD2 4.29Å; L394-P416 HydrophobicContact CB-CB 4.45Å; L394-P416 HydrophobicContact CD1-CB 4.16Å; L394-P416 HydrophobicContact CD1-CG 3.86Å; L394-W418 HydrophobicContact CB-CZ2 4.12Å; L394-W418 PolarHBondContact O-NE1 2.83Å; L394-W438 VanDerWaalsContact CA-O 3.3Å; L394-W438 WeakPolarHBondContact CA-O 2.85Å; L394-W438 WeakPolarHBondContact CD2-O 3.32Å; L394-Y439 HydrophobicContact CD2-CD2 3.77Å; L394-Y439 HydrophobicContact CD2-CG 4.23Å; L394-Y439 HydrophobicContact CG-CD2 4.35Å; L394-L450 HydrophobicContact CD2-CD1 3.48Å; L394-L450 VanDerWaalsContact CD2-CD1 3.48Å
395	W	93.6	Very high	76.2	Confident	42 Å²	42	66.2 Å²	66.2	16%	0.159	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	159.2	173.3	68.5	92.7	0	0	0	110.4	H393 T406 S407 W438 K440 K447	H393-W395 HydrophobicContact CB-CE3 4.3Å; H393-W395 HydrophobicContact CB-CZ3 4.37Å; W395-T406 HydrophobicContact CG-CG2 4.49Å; W395-S407 WeakPolarHBondContact CA-OG 3.48Å; W395-W438 AromaticContact CD1-CD1 3.98Å; W395-W438 HydrophobicContact CD2-CB 3.77Å; W395-W438 AromaticContact CE2-CG 3.85Å; W395-W438 HydrophobicContact CE3-CB 4.25Å; W395-W438 HydrophobicContact CG-CB 4.28Å; W395-W438 HydrophobicContact CH2-CB 3.98Å; W395-W438 HydrophobicContact CZ2-CB 3.46Å; W395-W438 VanDerWaalsContact CZ2-CB 3.46Å; W395-W438 HydrophobicContact CZ2-CG 4Å; W395-W438 HydrophobicContact CZ3-CB 4.34Å; W395-W438 PolarHBondContact N-O 3.38Å; W395-W438 VanDerWaalsContact N-O 3.09Å; W395-W438 AromaticContact NE1-CD1 3.55Å; W395-W438 AromaticContact NE1-CG 3.65Å; W395-W438 PolarHBondContact O-N 2.83Å; W395-K440 HydrophobicContact CH2-CB 3.7Å; W395-K440 HydrophobicContact CH2-CD 4.31Å; W395-K440 HydrophobicContact CZ3-CB 3.52Å; W395-K447 HydrophobicContact CH2-CB 4.1Å; W395-K447 HydrophobicContact CZ2-CB 4.24Å
396	V	93.9	Very high	78.6	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	135.9	179.3	179.2	0	0	0	0	108.7	V371 S407 W418 F435 Q436 L437 L483	V371-V396 HydrophobicContact CG1-CB 4.05Å; V371-V396 HydrophobicContact CG1-CG1 4.19Å; V371-V396 HydrophobicContact CG1-CG2 3.89Å; V371-V396 HydrophobicContact CG2-CG1 4.34Å; V396-S407 PolarHBondContact N-OG 3.43Å; V396-S407 PolarHBondContact O-N 3.38Å; V396-W418 HydrophobicContact CG2-CE3 4.44Å; V396-W418 HydrophobicContact CG2-CH2 3.74Å; V396-W418 HydrophobicContact CG2-CZ2 3.92Å; V396-W418 HydrophobicContact CG2-CZ3 4.02Å; V396-F435 HydrophobicContact CG1-CB 4.06Å; V396-F435 HydrophobicContact CG1-CD1 3.93Å; V396-Q436 CarbonylContact C-O 3.6Å; V396-Q436 VanDerWaalsContact CA-O 3.3Å; V396-Q436 WeakPolarHBondContact CA-O 2.92Å; V396-L437 HydrophobicContact CG2-CD1 3.69Å; V396-L483 HydrophobicContact CG1-CD2 4.31Å; V396-L483 HydrophobicContact CG2-CD1 4.17Å; V396-L483 HydrophobicContact CG2-CD2 4.35Å
397	T	94.9	Very high	80.7	Confident	10 Å²	10	57.8 Å²	57.8	6%	0.061	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	149.2	167.8	63.6	0	0	0	0	110.5	Y405 T406 F435 Q436 W438	T397-Y405 CarbonylContact C-O 3.48Å; T397-Y405 WeakPolarHBondContact CA-O 3.44Å; T397-T406 HydrophobicContact CG2-CG2 4.04Å; T397-F435 CarbonylContact O-C 3.6Å; T397-F435 VanDerWaalsContact O-CA 3.32Å; T397-F435 WeakPolarHBondContact O-CA 3.48Å; T397-Q436 PolarHBondContact N-O 3.38Å; T397-Q436 PolarHBondContact O-N 2.95Å; T397-Q436 PolarHBondContact OG1-OE1 2.94Å; T397-W438 PolarHBondContact OG1-NE1 3.24Å
398	Y	93.1	Very high	82.7	Confident	1 Å²	1	51.2 Å²	51.2	0%	0.004	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	156.5	167	65.9	-94	0	0	0	110.5	I369 I400 Y405 W420 V434 F435	I369-Y398 HydrophobicContact CD1-CD2 4.47Å; I369-Y398 HydrophobicContact CD1-CE2 3.83Å; I369-Y398 HydrophobicContact CG2-CE1 4.27Å; Y398-I400 HydrophobicContact CD2-CD1 4.2Å; Y398-I400 HydrophobicContact CD2-CG1 4.05Å; Y398-I400 HydrophobicContact CE2-CD1 3.72Å; Y398-I400 HydrophobicContact CE2-CG1 4.04Å; Y398-Y405 HydrophobicContact CD2-CD2 4.05Å; Y398-Y405 HydrophobicContact CD2-CG 4.35Å; Y398-Y405 HydrophobicContact CE1-CG 4.49Å; Y398-Y405 AromaticContact CE2-CD2 3.49Å; Y398-Y405 HydrophobicContact CE2-CD2 3.49Å; Y398-Y405 VanDerWaalsContact CE2-CD2 3.49Å; Y398-Y405 HydrophobicContact CE2-CE2 4.35Å; Y398-Y405 AromaticContact CE2-CG 3.62Å; Y398-Y405 HydrophobicContact CE2-CG 3.62Å; Y398-Y405 AromaticContact CZ-CG 3.7Å; Y398-Y405 PolarHBondContact N-O 3.49Å; Y398-Y405 PolarHBondContact O-N 2.72Å; Y398-W420 HydrophobicContact CD1-CH2 4.16Å; Y398-W420 AromaticContact CD1-CZ3 3.95Å; Y398-W420 HydrophobicContact CD1-CZ3 3.95Å; Y398-W420 HydrophobicContact CE1-CE3 4.42Å; Y398-W420 AromaticContact CE1-CH2 3.46Å; Y398-W420 HydrophobicContact CE1-CH2 3.46Å; Y398-W420 VanDerWaalsContact CE1-CH2 3.46Å; Y398-W420 HydrophobicContact CE1-CZ2 4.44Å; Y398-W420 AromaticContact CE1-CZ3 3.45Å; Y398-W420 HydrophobicContact CE1-CZ3 3.45Å; Y398-W420 VanDerWaalsContact CE1-CZ3 3.45Å; Y398-V434 VanDerWaalsContact CA-O 3.31Å; Y398-V434 WeakPolarHBondContact CA-O 3.12Å; Y398-V434 WeakPolarHBondContact CB-O 3.46Å; Y398-F435 AromaticContact CD1-CD1 3.81Å; Y398-F435 HydrophobicContact CD1-CD1 3.81Å; Y398-F435 AromaticContact CD1-CE1 3.53Å; Y398-F435 HydrophobicContact CD1-CE1 3.53Å; Y398-F435 HydrophobicContact CD1-CZ 4.47Å; Y398-F435 HydrophobicContact CE1-CE1 4.19Å; Y398-F435 HydrophobicContact CG-CD1 4.04Å; Y398-F435 AromaticContact CG-CE1 3.8Å; Y398-F435 HydrophobicContact CG-CE1 3.8Å; Y398-F435 HydrophobicContact CG-CZ 4.41Å
399	H	89	Confident	84.6	Confident	61 Å²	61	50.7 Å²	50.7	28%	0.282	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	140	-174.7	-66.5	-106.4	0	0	0	111.1	E403 V404	H399-E403 WeakPolarHBondContact CA-O 3.49Å; H399-V404 WeakPolarHBondContact CE1-CG2 3.37Å; H399-V404 WeakPolarHBondContact ND1-CG2 3.21Å
400	I	87.8	Confident	86.3	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.072	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	111.2	170.1	-56.9	-179.2	0	0	0	107.3	I369 Y398 D402 E403 Y405 V424 H425 I426 L433	I369-I400 HydrophobicContact CD1-CD1 3.84Å; Y398-I400 HydrophobicContact CD2-CD1 4.2Å; Y398-I400 HydrophobicContact CD2-CG1 4.05Å; Y398-I400 HydrophobicContact CE2-CD1 3.72Å; Y398-I400 HydrophobicContact CE2-CG1 4.04Å; I400-D402 PolarHBondContact O-N 3.35Å; I400-E403 PolarHBondContact N-O 3.01Å; I400-E403 PolarHBondContact O-N 3.05Å; I400-Y405 HydrophobicContact CB-CE2 4.08Å; I400-Y405 HydrophobicContact CD1-CD2 4.39Å; I400-Y405 HydrophobicContact CD1-CE2 4.08Å; I400-Y405 HydrophobicContact CG1-CD2 4.34Å; I400-Y405 HydrophobicContact CG1-CE2 4.17Å; I400-V424 HydrophobicContact CD1-CB 3.65Å; I400-V424 HydrophobicContact CD1-CG1 3.9Å; I400-V424 HydrophobicContact CD1-CG2 3.5Å; I400-H425 WeakPolarHBondContact CG2-O 3.45Å; I400-I426 HydrophobicContact CD1-CG1 4.49Å; I400-L433 HydrophobicContact CD1-CD2 4.12Å; I400-L433 HydrophobicContact CG1-CD2 3.73Å
401	G	81.8	Confident	87.4	Confident	53 Å²	53	49.4 Å²	49.4	55%	0.546	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	-126.3	-166.4	0	0	0	0	0	110.3
402	D	81.1	Confident	88.4	Confident	167 Å²	167	50.9 Å²	50.9	89%	0.893	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.1	178.5	-61.8	-32	0	0	0	113.6	I400	I400-D402 PolarHBondContact O-N 3.35Å
403	E	86.6	Confident	88.9	Confident	116 Å²	116	50.5 Å²	50.5	54%	0.542	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	134.9	-176.6	-64.3	-170.9	158	0	0	112	H399 I400 Y405	H399-E403 WeakPolarHBondContact CA-O 3.49Å; I400-E403 PolarHBondContact N-O 3.01Å; I400-E403 PolarHBondContact O-N 3.05Å; E403-Y405 HydrophobicContact CB-CD2 4.44Å; E403-Y405 HydrophobicContact CB-CE2 3.75Å; E403-Y405 VanDerWaalsContact OE2-CZ 3.28Å; E403-Y405 PolarHBondContact OE2-OH 3.49Å
404	V	91.1	Very high	88.6	Confident	80 Å²	80	57 Å²	57	49%	0.485	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	117.1	176.7	-167.8	0	0	0	0	109.8	H399	H399-V404 WeakPolarHBondContact CE1-CG2 3.37Å; H399-V404 WeakPolarHBondContact ND1-CG2 3.21Å
405	Y	93.7	Very high	88.3	Confident	44 Å²	44	62.5 Å²	62.5	17%	0.173	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	130.5	177.3	-65.8	-86.3	0	0	0	109.2	T397 Y398 I400 E403 L422 V424	T397-Y405 CarbonylContact C-O 3.48Å; T397-Y405 WeakPolarHBondContact CA-O 3.44Å; Y398-Y405 HydrophobicContact CD2-CD2 4.05Å; Y398-Y405 HydrophobicContact CD2-CG 4.35Å; Y398-Y405 HydrophobicContact CE1-CG 4.49Å; Y398-Y405 AromaticContact CE2-CD2 3.49Å; Y398-Y405 HydrophobicContact CE2-CD2 3.49Å; Y398-Y405 VanDerWaalsContact CE2-CD2 3.49Å; Y398-Y405 HydrophobicContact CE2-CE2 4.35Å; Y398-Y405 AromaticContact CE2-CG 3.62Å; Y398-Y405 HydrophobicContact CE2-CG 3.62Å; Y398-Y405 AromaticContact CZ-CG 3.7Å; Y398-Y405 PolarHBondContact N-O 3.49Å; Y398-Y405 PolarHBondContact O-N 2.72Å; I400-Y405 HydrophobicContact CB-CE2 4.08Å; I400-Y405 HydrophobicContact CD1-CD2 4.39Å; I400-Y405 HydrophobicContact CD1-CE2 4.08Å; I400-Y405 HydrophobicContact CG1-CD2 4.34Å; I400-Y405 HydrophobicContact CG1-CE2 4.17Å; E403-Y405 HydrophobicContact CB-CD2 4.44Å; E403-Y405 HydrophobicContact CB-CE2 3.75Å; E403-Y405 VanDerWaalsContact OE2-CZ 3.28Å; E403-Y405 PolarHBondContact OE2-OH 3.49Å; Y405-L422 HydrophobicContact CD1-CD2 3.09Å; Y405-L422 HydrophobicContact CE1-CD2 3.26Å; Y405-L422 HydrophobicContact CG-CD2 4.12Å; Y405-V424 HydrophobicContact CD1-CG1 4.45Å; Y405-V424 HydrophobicContact CE1-CG1 3.9Å; Y405-V424 HydrophobicContact CE2-CG1 4.21Å
406	T	94.4	Very high	88.1	Confident	77 Å²	77	60.5 Å²	60.5	47%	0.472	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	127	-176.1	-59	0	0	0	0	111	W395 T397 W420	W395-T406 HydrophobicContact CG-CG2 4.49Å; T397-T406 HydrophobicContact CG2-CG2 4.04Å; T406-W420 WeakPolarHBondContact O-CZ2 3.35Å
407	S	94.2	Very high	88	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.042	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-71	158.1	176.1	82.1	0	0	0	0	111.4	W395 V396 W418	W395-S407 WeakPolarHBondContact CA-OG 3.48Å; V396-S407 PolarHBondContact N-OG 3.43Å; V396-S407 PolarHBondContact O-N 3.38Å; S407-W418 PolarHBondContact OG-NE1 3.23Å
408	P	92.2	Very high	88	Confident	71 Å²	71	64.7 Å²	64.7	46%	0.461	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-54.9	149.6	164	-23.1	34	0	0	0	111.3	W418	P408-W418 PolarHBondContact O-NE1 2.95Å; P408-W418 VanDerWaalsContact O-NE1 3.11Å
409	P	89.9	Confident	87.9	Confident	64 Å²	64	69.4 Å²	69.4	42%	0.416	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-69.8	139.1	173	28.1	-32.6	0	0	0	110.9	H393 L394	H393-P409 HydrophobicContact CB-CB 3.86Å; L394-P409 CarbonylContact O-C 3.49Å; L394-P409 WeakPolarHBondContact O-CA 3.26Å
410	S	88.6	Confident	88.1	Confident	15 Å²	15	68.6 Å²	68.6	11%	0.105	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-110.4	139.7	171.4	-166.8	0	0	0	0	109.8	H393 L394 P416 T417	H393-S410 CarbonylContact C-O 3.45Å; H393-S410 WeakPolarHBondContact CA-O 3.44Å; L394-S410 PolarHBondContact N-O 3.04Å; L394-S410 PolarHBondContact O-N 3.46Å; S410-P416 WeakPolarHBondContact OG-CB 3.21Å; S410-T417 PolarHBondContact OG-O 3Å
411	Y	84.1	Confident	88.4	Confident	138 Å²	138	71.6 Å²	71.6	54%	0.541	38%	0.383	S	S	.	.			trans	-98.6	-3.7	-176.3	-58.5	-105.9	0	0	0	112.2	H393	H393-Y411 AromaticContact CE1-CD1 3.51Å; H393-Y411 AromaticContact CE1-CE1 2.95Å; H393-Y411 WeakPolarHBondContact CE1-CE1 3.22Å; H393-Y411 AromaticContact CE1-CZ 3.57Å; H393-Y411 AromaticContact ND1-CD1 3.34Å; H393-Y411 VanDerWaalsContact ND1-CD1 3.34Å; H393-Y411 WeakPolarHBondContact ND1-CD1 3.23Å; H393-Y411 AromaticContact ND1-CE1 3.16Å; H393-Y411 WeakPolarHBondContact ND1-CE1 3.39Å; H393-Y411 AromaticContact ND1-CZ 3.62Å
412	S	82.1	Confident	88.9	Confident	53 Å²	53	71.7 Å²	71.7	37%	0.371	37%	0.371	S	S	.	.			trans	-87.5	117.3	176	173	0	0	0	0	109.6	L394 E415 P416	L394-S412 WeakPolarHBondContact CD1-O 3.41Å; S412-E415 VanDerWaalsContact OG-C 3.29Å; S412-E415 PolarHBondContact OG-O 2.63Å; S412-P416 WeakPolarHBondContact O-CA 3.26Å; S412-P416 WeakPolarHBondContact O-CB 3.35Å; S412-P416 WeakPolarHBondContact O-CD 3.23Å
413	L	79.1	Confident	89.4	Confident	25 Å²	25	67.5 Å²	67.5	13%	0.131	35%	0.349	C	S	.	.	S	Bend	trans	-83	-32.2	-171.3	-65.5	177.6	0	0	0	115	L377 L379 D381 P392 L394 Y439	L377-L413 WeakPolarHBondContact CB-O 3.43Å; L379-L413 HydrophobicContact CD1-CB 4.1Å; L379-L413 HydrophobicContact CD1-CD2 3.95Å; D381-L413 WeakPolarHBondContact OD2-CD1 3.32Å; P392-L413 HydrophobicContact CB-CD1 4.44Å; P392-L413 HydrophobicContact CB-CD2 3.87Å; P392-L413 HydrophobicContact CG-CD1 3.63Å; P392-L413 HydrophobicContact CG-CD2 3.77Å; P392-L413 HydrophobicContact CG-CG 4.03Å; L394-L413 HydrophobicContact CD1-CD2 4.19Å; L394-L413 HydrophobicContact CG-CD2 4.29Å; L413-Y439 HydrophobicContact CD2-CD2 4.21Å; L413-Y439 HydrophobicContact CD2-CE2 3.76Å
414	K	79.1	Confident	89.6	Confident	161 Å²	161	62 Å²	62	70%	0.7	32%	0.324	S	S	*	.	S	Bend	trans	-88.5	-39.9	-176.6	-67	-175.9	178	-178.9	0	112.1
415	E	85.2	Confident	89.5	Confident	114 Å²	114	63.7 Å²	63.7	53%	0.533	33%	0.326	S	S	.	.	S	Bend	trans	-141	69.7	-174.8	-61.3	-171.9	161.4	0	0	110	A374 R375 S412	A374-E415 VanDerWaalsContact O-CA 3.27Å; A374-E415 WeakPolarHBondContact O-CA 3.3Å; R375-E415 HydrophobicContact CB-CG 4.4Å; S412-E415 VanDerWaalsContact OG-C 3.29Å; S412-E415 PolarHBondContact OG-O 2.63Å
416	P	89.1	Confident	89.1	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.318	C	S	.	.			trans	-64.2	137.6	174.9	28.3	-35.7	0	0	0	110.1	R373 A374 L377 L394 S410 S412 W418	R373-P416 CarbonylContact C-O 3.57Å; R373-P416 WeakPolarHBondContact CA-O 3.38Å; R373-P416 WeakPolarHBondContact CB-O 3.41Å; A374-P416 HydrophobicContact CB-CG 3.74Å; A374-P416 PolarHBondContact N-O 2.85Å; L377-P416 HydrophobicContact CD1-CG 3.77Å; L394-P416 HydrophobicContact CB-CB 4.45Å; L394-P416 HydrophobicContact CD1-CB 4.16Å; L394-P416 HydrophobicContact CD1-CG 3.86Å; S410-P416 WeakPolarHBondContact OG-CB 3.21Å; S412-P416 WeakPolarHBondContact O-CA 3.26Å; S412-P416 WeakPolarHBondContact O-CB 3.35Å; S412-P416 WeakPolarHBondContact O-CD 3.23Å; P416-W418 HydrophobicContact CB-CH2 3.66Å; P416-W418 HydrophobicContact CB-CZ2 3.62Å; P416-W418 HydrophobicContact CB-CZ3 4.15Å; P416-W418 HydrophobicContact CG-CH2 3.33Å; P416-W418 HydrophobicContact CG-CZ2 3.78Å; P416-W418 HydrophobicContact CG-CZ3 3.89Å
417	T	92.1	Very high	88.6	Confident	71 Å²	71	59.6 Å²	59.6	44%	0.436	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.8	170.5	-55.2	0	0	0	0	108.2	R373 S410 D419	R373-T417 HydrophobicContact CB-CG2 4.35Å; S410-T417 PolarHBondContact OG-O 3Å; T417-D419 WeakPolarHBondContact CG2-OD2 3.44Å
418	W	93.1	Very high	87.8	Confident	28 Å²	28	62.1 Å²	62.1	11%	0.106	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	-38.2	179.8	-62.2	-79.4	0	0	0	111.9	V371 H372 A374 L394 V396 S407 P408 P416 W420 L437 L483	V371-W418 HydrophobicContact CG1-CD2 4.48Å; V371-W418 HydrophobicContact CG1-CE3 3.91Å; V371-W418 HydrophobicContact CG1-CZ3 4.36Å; H372-W418 PolarHBondContact O-N 3.36Å; A374-W418 HydrophobicContact CB-CH2 4.09Å; A374-W418 HydrophobicContact CB-CZ3 3.99Å; L394-W418 HydrophobicContact CB-CZ2 4.12Å; L394-W418 PolarHBondContact O-NE1 2.83Å; V396-W418 HydrophobicContact CG2-CE3 4.44Å; V396-W418 HydrophobicContact CG2-CH2 3.74Å; V396-W418 HydrophobicContact CG2-CZ2 3.92Å; V396-W418 HydrophobicContact CG2-CZ3 4.02Å; S407-W418 PolarHBondContact OG-NE1 3.23Å; P408-W418 PolarHBondContact O-NE1 2.95Å; P408-W418 VanDerWaalsContact O-NE1 3.11Å; P416-W418 HydrophobicContact CB-CH2 3.66Å; P416-W418 HydrophobicContact CB-CZ2 3.62Å; P416-W418 HydrophobicContact CB-CZ3 4.15Å; P416-W418 HydrophobicContact CG-CH2 3.33Å; P416-W418 HydrophobicContact CG-CZ2 3.78Å; P416-W418 HydrophobicContact CG-CZ3 3.89Å; W418-W420 HydrophobicContact CB-CB 4.09Å; W418-W420 PolarHBondContact O-N 2.84Å; W418-L437 HydrophobicContact CH2-CD1 3.63Å; W418-L437 HydrophobicContact CZ2-CD1 3.9Å; W418-L483 HydrophobicContact CH2-CD1 4.29Å; W418-L483 HydrophobicContact CZ3-CD1 3.68Å
419	D	92.1	Very high	87.3	Confident	100 Å²	100	66.3 Å²	66.3	54%	0.535	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.7	38.5	-172.4	-64.3	-32.7	0	0	0	112.6	V371 H372 T417	V371-D419 PolarHBondContact O-N 3.49Å; H372-D419 IonicContact ND1-OD1 3.54Å; H372-D419 PolarHBondContact O-N 3.12Å; T417-D419 WeakPolarHBondContact CG2-OD2 3.44Å
420	W	93.6	Very high	87	Confident	43 Å²	43	66 Å²	66	16%	0.163	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	118.6	-172.4	174.4	50.9	0	0	0	109.5	G370 V371 Y398 T406 W418 L422	G370-W420 CarbonylContact C-O 3.46Å; G370-W420 WeakPolarHBondContact CA-O 3.41Å; V371-W420 HydrophobicContact CB-CE3 4.06Å; V371-W420 HydrophobicContact CG2-CE3 3.93Å; V371-W420 HydrophobicContact CG2-CZ3 4.2Å; V371-W420 PolarHBondContact N-O 3.09Å; V371-W420 PolarHBondContact O-N 3.31Å; Y398-W420 HydrophobicContact CD1-CH2 4.16Å; Y398-W420 AromaticContact CD1-CZ3 3.95Å; Y398-W420 HydrophobicContact CD1-CZ3 3.95Å; Y398-W420 HydrophobicContact CE1-CE3 4.42Å; Y398-W420 AromaticContact CE1-CH2 3.46Å; Y398-W420 HydrophobicContact CE1-CH2 3.46Å; Y398-W420 VanDerWaalsContact CE1-CH2 3.46Å; Y398-W420 HydrophobicContact CE1-CZ2 4.44Å; Y398-W420 AromaticContact CE1-CZ3 3.45Å; Y398-W420 HydrophobicContact CE1-CZ3 3.45Å; Y398-W420 VanDerWaalsContact CE1-CZ3 3.45Å; T406-W420 WeakPolarHBondContact O-CZ2 3.35Å; W418-W420 HydrophobicContact CB-CB 4.09Å; W418-W420 PolarHBondContact O-N 2.84Å; W420-L422 HydrophobicContact CZ2-CD2 4.38Å
421	L	93.3	Very high	86.8	Confident	77 Å²	77	72.7 Å²	72.7	40%	0.403	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	135	-175.8	-71.9	145.4	0	0	0	109.9	I369	I369-L421 CarbonylContact O-C 3.56Å; I369-L421 WeakPolarHBondContact O-CA 3.1Å
422	L	92.8	Very high	87	Confident	56 Å²	56	67.7 Å²	67.7	29%	0.293	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	137.2	-179.6	-160.1	71.7	0	0	0	111.3	K368 I369 Y405 W420 V424	K368-L422 CarbonylContact C-O 3.54Å; K368-L422 WeakPolarHBondContact CA-O 3.22Å; I369-L422 PolarHBondContact N-O 2.83Å; I369-L422 PolarHBondContact O-N 2.76Å; Y405-L422 HydrophobicContact CD1-CD2 3.09Å; Y405-L422 HydrophobicContact CE1-CD2 3.26Å; Y405-L422 HydrophobicContact CG-CD2 4.12Å; W420-L422 HydrophobicContact CZ2-CD2 4.38Å; L422-V424 HydrophobicContact CB-CG1 4.49Å; L422-V424 HydrophobicContact CD2-CG1 3.88Å; L422-V424 HydrophobicContact CG-CG1 4.18Å
423	D	91	Very high	87.4	Confident	78 Å²	78	65.2 Å²	65.2	42%	0.417	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	127	167.6	-72.8	-14.5	0	0	0	108.2	C367 K368 K490	C367-D423 WeakPolarHBondContact O-CA 3.12Å; K368-D423 WeakPolarHBondContact CB-OD1 3.27Å; K368-D423 WeakPolarHBondContact CG-OD1 3.42Å; D423-K490 IonicContact OD1-NZ 2.85Å; D423-K490 IonicContact OD2-NZ 2.76Å; D423-K490 PolarHBondContact OD2-NZ 2.99Å
424	V	90.7	Very high	87.9	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.012	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	159.7	-177.5	-64.5	0	0	0	0	110.5	V366 C367 I369 I400 Y405 L422 I426	V366-V424 WeakPolarHBondContact CA-O 3.44Å; C367-V424 HydrophobicContact CB-CG2 4.28Å; C367-V424 PolarHBondContact N-O 2.85Å; C367-V424 VanDerWaalsContact O-CG2 3.26Å; C367-V424 WeakPolarHBondContact O-CG2 3.33Å; C367-V424 PolarHBondContact O-N 3.43Å; I369-V424 HydrophobicContact CD1-CG2 3.39Å; I369-V424 HydrophobicContact CG1-CG2 3.84Å; I400-V424 HydrophobicContact CD1-CB 3.65Å; I400-V424 HydrophobicContact CD1-CG1 3.9Å; I400-V424 HydrophobicContact CD1-CG2 3.5Å; Y405-V424 HydrophobicContact CD1-CG1 4.45Å; Y405-V424 HydrophobicContact CE1-CG1 3.9Å; Y405-V424 HydrophobicContact CE2-CG1 4.21Å; L422-V424 HydrophobicContact CB-CG1 4.49Å; L422-V424 HydrophobicContact CD2-CG1 3.88Å; L422-V424 HydrophobicContact CG-CG1 4.18Å; V424-I426 HydrophobicContact CG2-CD1 4.42Å; V424-I426 HydrophobicContact CG2-CG1 4.11Å
425	H	89.2	Confident	88.6	Confident	115 Å²	115	57.5 Å²	57.5	53%	0.532	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	122.7	173.6	-67	-8.5	0	0	0	109.2	I400	I400-H425 WeakPolarHBondContact CG2-O 3.45Å
426	I	86.2	Confident	88.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	122	-178.6	-60.9	-173.9	0	0	0	108.1	S365 C367 I400 V424 Q430 L457 F489	S365-I426 PolarHBondContact N-O 2.99Å; S365-I426 PolarHBondContact O-N 2.82Å; C367-I426 HydrophobicContact CB-CD1 3.39Å; C367-I426 HydrophobicContact CB-CG1 3.89Å; I400-I426 HydrophobicContact CD1-CG1 4.49Å; V424-I426 HydrophobicContact CG2-CD1 4.42Å; V424-I426 HydrophobicContact CG2-CG1 4.11Å; I426-Q430 HydrophobicContact CG2-CB 3.77Å; I426-Q430 HydrophobicContact CG2-CG 4.2Å; I426-L457 HydrophobicContact CD1-CD1 3.9Å; I426-L457 HydrophobicContact CD1-CD2 4.39Å; I426-L457 HydrophobicContact CG2-CD1 3.76Å; I426-F489 HydrophobicContact CD1-CE1 4.23Å; I426-F489 HydrophobicContact CD1-CZ 4.41Å
427	A	84.3	Confident	89	Confident	34 Å²	34	53.4 Å²	53.4	28%	0.281	27%	0.272	S	S	.	.			trans	-62.9	144.3	171.6	0	0	0	0	0	110.3	E429 Q430	A427-E429 PolarHBondContact O-N 2.9Å; A427-E429 VanDerWaalsContact O-N 3.14Å; A427-Q430 WeakPolarHBondContact O-CB 3.29Å; A427-Q430 PolarHBondContact O-N 3.39Å
428	P	77.3	Confident	88.9	Confident	59 Å²	59	51.9 Å²	51.9	38%	0.383	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.5	-179.8	23.2	-32.8	0	0	0	112.8	C362 Q430	C362-P428 WeakPolarHBondContact SG-CD 3.09Å; C362-P428 WeakPolarHBondContact SG-CG 3.49Å; P428-Q430 VanDerWaalsContact C-N 3.33Å
429	E	81.7	Confident	88.6	Confident	160 Å²	160	51.3 Å²	51.3	75%	0.748	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-24.5	177.4	-64.5	156.9	-146.9	0	0	113.5	A427 K431	A427-E429 PolarHBondContact O-N 2.9Å; A427-E429 VanDerWaalsContact O-N 3.14Å; E429-K431 PolarHBondContact O-N 3.43Å; E429-K431 VanDerWaalsContact O-N 3.09Å
430	Q	82.9	Confident	88.4	Confident	57 Å²	57	49.2 Å²	49.2	27%	0.266	24%	0.242	S	C	.	.			trans	-71.7	107.4	-178.8	-168.5	75.1	25.3	0	0	109.7	I426 A427 P428 N432 L457	I426-Q430 HydrophobicContact CG2-CB 3.77Å; I426-Q430 HydrophobicContact CG2-CG 4.2Å; A427-Q430 WeakPolarHBondContact O-CB 3.29Å; A427-Q430 PolarHBondContact O-N 3.39Å; P428-Q430 VanDerWaalsContact C-N 3.33Å; Q430-N432 PolarHBondContact NE2-O 2.87Å; Q430-L457 HydrophobicContact CG-CD1 4.16Å
431	K	85	Confident	87.8	Confident	155 Å²	155	52.1 Å²	52.1	67%	0.674	26%	0.256	S	S	*	.			trans	-90.9	-25.4	179.2	-66	-177.6	-178.2	178.4	0	113.8	E429 L457	E429-K431 PolarHBondContact O-N 3.43Å; E429-K431 VanDerWaalsContact O-N 3.09Å; K431-L457 WeakPolarHBondContact O-CB 3.5Å; K431-L457 PolarHBondContact O-N 3.25Å
432	N	88.3	Confident	87	Confident	34 Å²	34	50.4 Å²	50.4	18%	0.182	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.5	-170.1	-66.7	-57.6	0	0	0	111.6	Q430 N454 V455 D456	Q430-N432 PolarHBondContact NE2-O 2.87Å; N432-N454 WeakPolarHBondContact CB-OD1 3.05Å; N432-V455 CarbonylContact C-O 3.56Å; N432-V455 VanDerWaalsContact CA-O 3.26Å; N432-V455 WeakPolarHBondContact CA-O 3.14Å; N432-D456 WeakPolarHBondContact OD1-CA 3.22Å
433	L	89.9	Confident	86.1	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.7	166.8	-67.8	175.4	0	0	0	109.6	I369 I400 F435 V455 L457	I369-L433 HydrophobicContact CD1-CD1 3.45Å; I369-L433 VanDerWaalsContact CD1-CD1 3.45Å; I369-L433 HydrophobicContact CG1-CD1 4.16Å; I400-L433 HydrophobicContact CD1-CD2 4.12Å; I400-L433 HydrophobicContact CG1-CD2 3.73Å; L433-F435 HydrophobicContact CB-CD2 4.39Å; L433-F435 HydrophobicContact CB-CE2 3.66Å; L433-F435 HydrophobicContact CB-CZ 4.27Å; L433-F435 HydrophobicContact CD1-CE2 4.35Å; L433-F435 HydrophobicContact CD1-CZ 4.26Å; L433-V455 HydrophobicContact CB-CB 4.41Å; L433-V455 PolarHBondContact N-O 2.93Å; L433-V455 PolarHBondContact O-N 3.19Å; L433-L457 HydrophobicContact CD1-CD1 4.5Å; L433-L457 HydrophobicContact CD1-CD2 3.63Å; L433-L457 HydrophobicContact CD1-CG 4.42Å; L433-L457 HydrophobicContact CD2-CD1 4.44Å; L433-L457 HydrophobicContact CG-CD1 4.01Å; L433-L457 HydrophobicContact CG-CD2 3.81Å; L433-L457 HydrophobicContact CG-CG 4.06Å
434	V	90.1	Very high	85.3	Confident	25 Å²	25	56.6 Å²	56.6	15%	0.152	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	116.3	179.9	-176.7	0	0	0	0	109	M204 Y398 V452 V453	M204-V434 HydrophobicContact CE-CG1 4.46Å; Y398-V434 VanDerWaalsContact CA-O 3.31Å; Y398-V434 WeakPolarHBondContact CA-O 3.12Å; Y398-V434 WeakPolarHBondContact CB-O 3.46Å; V434-V452 HydrophobicContact CG1-CG1 3.31Å; V434-V453 CarbonylContact C-O 3.6Å; V434-V453 WeakPolarHBondContact CA-O 3.45Å
435	F	92.6	Very high	84.8	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	131.3	175.7	-61.3	-100.7	0	0	0	109.3	I369 V371 V396 T397 Y398 L433 V452 V453 V455 L483 I485	I369-F435 HydrophobicContact CG2-CE1 3.98Å; I369-F435 HydrophobicContact CG2-CZ 3.86Å; V371-F435 HydrophobicContact CG2-CD1 4Å; V371-F435 HydrophobicContact CG2-CE1 3.78Å; V396-F435 HydrophobicContact CG1-CB 4.06Å; V396-F435 HydrophobicContact CG1-CD1 3.93Å; T397-F435 CarbonylContact O-C 3.6Å; T397-F435 VanDerWaalsContact O-CA 3.32Å; T397-F435 WeakPolarHBondContact O-CA 3.48Å; Y398-F435 AromaticContact CD1-CD1 3.81Å; Y398-F435 HydrophobicContact CD1-CD1 3.81Å; Y398-F435 AromaticContact CD1-CE1 3.53Å; Y398-F435 HydrophobicContact CD1-CE1 3.53Å; Y398-F435 HydrophobicContact CD1-CZ 4.47Å; Y398-F435 HydrophobicContact CE1-CE1 4.19Å; Y398-F435 HydrophobicContact CG-CD1 4.04Å; Y398-F435 AromaticContact CG-CE1 3.8Å; Y398-F435 HydrophobicContact CG-CE1 3.8Å; Y398-F435 HydrophobicContact CG-CZ 4.41Å; L433-F435 HydrophobicContact CB-CD2 4.39Å; L433-F435 HydrophobicContact CB-CE2 3.66Å; L433-F435 HydrophobicContact CB-CZ 4.27Å; L433-F435 HydrophobicContact CD1-CE2 4.35Å; L433-F435 HydrophobicContact CD1-CZ 4.26Å; F435-V452 CarbonylContact O-C 3.51Å; F435-V452 VanDerWaalsContact O-CA 3.26Å; F435-V452 WeakPolarHBondContact O-CA 3.11Å; F435-V453 HydrophobicContact CB-CB 4.25Å; F435-V453 PolarHBondContact N-O 2.69Å; F435-V453 PolarHBondContact O-N 2.85Å; F435-V455 HydrophobicContact CD2-CG2 3.89Å; F435-V455 HydrophobicContact CE2-CB 4.2Å; F435-V455 HydrophobicContact CE2-CG2 3.64Å; F435-L483 HydrophobicContact CB-CD2 4.13Å; F435-I485 HydrophobicContact CB-CD1 4.3Å; F435-I485 HydrophobicContact CD1-CD1 4.08Å; F435-I485 HydrophobicContact CD1-CG1 4.43Å; F435-I485 HydrophobicContact CD2-CD1 3.53Å; F435-I485 HydrophobicContact CE1-CD1 4.3Å; F435-I485 HydrophobicContact CE1-CG1 4.39Å; F435-I485 HydrophobicContact CE1-CG2 4.18Å; F435-I485 HydrophobicContact CE2-CD1 3.78Å; F435-I485 HydrophobicContact CE2-CG2 4.05Å; F435-I485 HydrophobicContact CG-CD1 3.7Å; F435-I485 HydrophobicContact CZ-CD1 4.16Å; F435-I485 HydrophobicContact CZ-CG1 4.44Å; F435-I485 HydrophobicContact CZ-CG2 3.67Å
436	Q	91.7	Very high	84.4	Confident	28 Å²	28	59.9 Å²	59.9	13%	0.131	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	122.8	178.8	-66.4	173.5	-19.4	0	0	108.7	V396 T397 W438 L449 V452	V396-Q436 CarbonylContact C-O 3.6Å; V396-Q436 VanDerWaalsContact CA-O 3.3Å; V396-Q436 WeakPolarHBondContact CA-O 2.92Å; T397-Q436 PolarHBondContact N-O 3.38Å; T397-Q436 PolarHBondContact O-N 2.95Å; T397-Q436 PolarHBondContact OG1-OE1 2.94Å; Q436-W438 HydrophobicContact CB-CZ2 4.4Å; Q436-W438 VanDerWaalsContact OE1-CZ2 3.32Å; Q436-L449 HydrophobicContact CB-CD1 3.74Å; Q436-L449 HydrophobicContact CG-CD1 4.21Å; Q436-V452 HydrophobicContact CG-CG2 4.36Å
437	L	91.4	Very high	84.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	117.5	175.2	179.9	65.4	0	0	0	109.5	L377 V396 W418 L450 G451 L472	L377-L437 HydrophobicContact CD1-CD2 3.94Å; L377-L437 HydrophobicContact CD2-CD2 3.68Å; V396-L437 HydrophobicContact CG2-CD1 3.69Å; W418-L437 HydrophobicContact CH2-CD1 3.63Å; W418-L437 HydrophobicContact CZ2-CD1 3.9Å; L437-L450 HydrophobicContact CD2-CB 4.22Å; L437-L450 HydrophobicContact CD2-CD1 4.04Å; L437-L450 HydrophobicContact CG-CB 4.25Å; L437-L450 HydrophobicContact CG-CD1 4.22Å; L437-L450 PolarHBondContact O-N 3.34Å; L437-G451 PolarHBondContact N-O 3.44Å; L437-L472 HydrophobicContact CB-CD2 4.06Å; L437-L472 HydrophobicContact CD2-CD1 3.63Å; L437-L472 HydrophobicContact CD2-CD2 4.35Å
438	W	90.9	Very high	84.4	Confident	39 Å²	39	69 Å²	69	15%	0.148	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	147.3	-178.4	-62	92	0	0	0	111.4	L394 W395 T397 Q436 K447 Q448 L449	L394-W438 VanDerWaalsContact CA-O 3.3Å; L394-W438 WeakPolarHBondContact CA-O 2.85Å; L394-W438 WeakPolarHBondContact CD2-O 3.32Å; W395-W438 AromaticContact CD1-CD1 3.98Å; W395-W438 HydrophobicContact CD2-CB 3.77Å; W395-W438 AromaticContact CE2-CG 3.85Å; W395-W438 HydrophobicContact CE3-CB 4.25Å; W395-W438 HydrophobicContact CG-CB 4.28Å; W395-W438 HydrophobicContact CH2-CB 3.98Å; W395-W438 HydrophobicContact CZ2-CB 3.46Å; W395-W438 VanDerWaalsContact CZ2-CB 3.46Å; W395-W438 HydrophobicContact CZ2-CG 4Å; W395-W438 HydrophobicContact CZ3-CB 4.34Å; W395-W438 PolarHBondContact N-O 3.38Å; W395-W438 VanDerWaalsContact N-O 3.09Å; W395-W438 AromaticContact NE1-CD1 3.55Å; W395-W438 AromaticContact NE1-CG 3.65Å; W395-W438 PolarHBondContact O-N 2.83Å; T397-W438 PolarHBondContact OG1-NE1 3.24Å; Q436-W438 HydrophobicContact CB-CZ2 4.4Å; Q436-W438 VanDerWaalsContact OE1-CZ2 3.32Å; W438-K447 HydrophobicContact CE3-CB 4.11Å; W438-K447 HydrophobicContact CE3-CD 3.93Å; W438-K447 HydrophobicContact CE3-CG 4.02Å; W438-K447 HydrophobicContact CH2-CD 4.44Å; W438-K447 HydrophobicContact CZ3-CD 3.85Å; W438-K447 HydrophobicContact CZ3-CG 3.96Å; W438-Q448 CarbonylContact C-O 3.59Å; W438-Q448 WeakPolarHBondContact CA-O 3.49Å; W438-L449 HydrophobicContact CD2-CD1 4.23Å; W438-L449 HydrophobicContact CE3-CB 4.17Å; W438-L449 HydrophobicContact CE3-CD1 4.41Å; W438-L449 HydrophobicContact CH2-CB 4.39Å; W438-L449 HydrophobicContact CH2-CD1 4.4Å; W438-L449 HydrophobicContact CZ2-CD1 4.23Å; W438-L449 HydrophobicContact CZ3-CB 3.95Å; W438-L449 HydrophobicContact CZ3-CD1 4.49Å
439	Y	86.7	Confident	84.9	Confident	16 Å²	16	68.5 Å²	68.5	6%	0.063	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	141.3	174.6	170.4	-105.7	0	0	0	110.3	L379 P392 H393 L394 L413 K441 Q448 L450	L379-Y439 HydrophobicContact CD1-CD2 3.94Å; L379-Y439 HydrophobicContact CD1-CE2 4.09Å; L379-Y439 HydrophobicContact CD2-CD2 4.35Å; L379-Y439 HydrophobicContact CD2-CG 4.33Å; P392-Y439 HydrophobicContact CB-CE2 3.73Å; H393-Y439 WeakPolarHBondContact O-CA 3.43Å; L394-Y439 HydrophobicContact CD2-CD2 3.77Å; L394-Y439 HydrophobicContact CD2-CG 4.23Å; L394-Y439 HydrophobicContact CG-CD2 4.35Å; L413-Y439 HydrophobicContact CD2-CD2 4.21Å; L413-Y439 HydrophobicContact CD2-CE2 3.76Å; Y439-K441 HydrophobicContact CE1-CB 3.98Å; Y439-Q448 HydrophobicContact CD1-CB 4.27Å; Y439-Q448 PolarHBondContact N-O 3.01Å; Y439-Q448 PolarHBondContact O-N 2.91Å; Y439-L450 HydrophobicContact CG-CD2 4.38Å
440	K	86.2	Confident	85	Confident	56 Å²	56	61.2 Å²	61.2	24%	0.243	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	120.1	171.1	-163.5	-175.8	-173.9	-179.1	0	109.2	P392 H393 W395 A442 E443 A445	P392-K440 CarbonylContact C-O 3.51Å; P392-K440 VanDerWaalsContact CA-O 3.26Å; P392-K440 WeakPolarHBondContact CA-O 3.2Å; H393-K440 PolarHBondContact N-O 3.29Å; H393-K440 PolarHBondContact O-N 2.83Å; W395-K440 HydrophobicContact CH2-CB 3.7Å; W395-K440 HydrophobicContact CH2-CD 4.31Å; W395-K440 HydrophobicContact CZ3-CB 3.52Å; K440-A442 WeakPolarHBondContact CD-O 3.37Å; K440-A442 WeakPolarHBondContact CE-O 3.35Å; K440-A442 VanDerWaalsContact CG-O 3.27Å; K440-A442 WeakPolarHBondContact CG-O 3.4Å; K440-E443 WeakPolarHBondContact CE-O 3.26Å; K440-E443 PolarHBondContact NZ-O 2.86Å; K440-A445 WeakPolarHBondContact CE-O 3.48Å; K440-A445 HydrophobicContact CG-CB 4.35Å
441	K	81.5	Confident	85.1	Confident	104 Å²	104	58.5 Å²	58.5	45%	0.452	29%	0.287	S	S	.	.	S	Bend	trans	-66.3	-37.4	-176.5	-172.7	170.8	-178.3	174.2	0	113	Y439 A445	Y439-K441 HydrophobicContact CE1-CB 3.98Å; K441-A445 HydrophobicContact CB-CB 4.26Å
442	A	77.5	Confident	85.2	Confident	41 Å²	41	52.3 Å²	52.3	34%	0.339	26%	0.262	S	S	.	.	S	Bend	trans	-152	162.6	-179.4	0	0	0	0	0	110.6	K440 N444 A445	K440-A442 WeakPolarHBondContact CD-O 3.37Å; K440-A442 WeakPolarHBondContact CE-O 3.35Å; K440-A442 VanDerWaalsContact CG-O 3.27Å; K440-A442 WeakPolarHBondContact CG-O 3.4Å; A442-N444 PolarHBondContact O-N 2.77Å; A442-A445 HydrophobicContact CB-CB 4.27Å; A442-A445 WeakPolarHBondContact O-CB 3.32Å; A442-A445 PolarHBondContact O-N 2.86Å
443	E	73.6	Confident	85.2	Confident	101 Å²	101	50.8 Å²	50.8	47%	0.472	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-27.6	-177	-165.9	165.7	-152.5	0	0	113.8	K390 K440	K390-E443 WeakPolarHBondContact CD-OE2 3.36Å; K390-E443 IonicContact NZ-OE1 3.7Å; K390-E443 PolarHBondContact NZ-OE1 2.65Å; K390-E443 IonicContact NZ-OE2 3.86Å; K390-E443 PolarHBondContact NZ-OE2 2.77Å; K440-E443 WeakPolarHBondContact CE-O 3.26Å; K440-E443 PolarHBondContact NZ-O 2.86Å
444	N	74.5	Confident	85.2	Confident	163 Å²	163	52.8 Å²	52.8	87%	0.872	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102	1	177.4	-63.9	-15.4	0	0	0	114.2	A442	A442-N444 PolarHBondContact O-N 2.77Å
445	A	78.6	Confident	85.1	Confident	34 Å²	34	51.7 Å²	51.7	28%	0.281	26%	0.258	S	S	.	.	S	Bend	trans	-78.2	154.2	178.6	0	0	0	0	0	111.4	K440 K441 A442	K440-A445 WeakPolarHBondContact CE-O 3.48Å; K440-A445 HydrophobicContact CG-CB 4.35Å; K441-A445 HydrophobicContact CB-CB 4.26Å; A442-A445 HydrophobicContact CB-CB 4.27Å; A442-A445 WeakPolarHBondContact O-CB 3.32Å; A442-A445 PolarHBondContact O-N 2.86Å
446	E	81.5	Confident	84.7	Confident	152 Å²	152	53.9 Å²	53.9	71%	0.71	27%	0.269	S	S	*	.	P	Polyproline II helix	trans	-63.6	145.9	169.5	-68.4	-176.9	177	0	0	110.6
447	K	86.9	Confident	84.4	Confident	135 Å²	135	52.5 Å²	52.5	59%	0.587	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-74.3	133.4	173.3	61.9	179.8	-178	174.7	0	109.3	W395 W438	W395-K447 HydrophobicContact CH2-CB 4.1Å; W395-K447 HydrophobicContact CZ2-CB 4.24Å; W438-K447 HydrophobicContact CE3-CB 4.11Å; W438-K447 HydrophobicContact CE3-CD 3.93Å; W438-K447 HydrophobicContact CE3-CG 4.02Å; W438-K447 HydrophobicContact CH2-CD 4.44Å; W438-K447 HydrophobicContact CZ3-CD 3.85Å; W438-K447 HydrophobicContact CZ3-CG 3.96Å
448	Q	84.5	Confident	83.7	Confident	89 Å²	89	55.3 Å²	55.3	42%	0.416	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	130.2	176.7	-174.7	176.6	-0.1	0	0	109.4	W438 Y439 L450	W438-Q448 CarbonylContact C-O 3.59Å; W438-Q448 WeakPolarHBondContact CA-O 3.49Å; Y439-Q448 HydrophobicContact CD1-CB 4.27Å; Y439-Q448 PolarHBondContact N-O 3.01Å; Y439-Q448 PolarHBondContact O-N 2.91Å; Q448-L450 HydrophobicContact CG-CD2 4.5Å
449	L	86.1	Confident	82.8	Confident	50 Å²	50	59.6 Å²	59.6	26%	0.262	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	121.4	170.3	-177.7	68.2	0	0	0	108.6	Q436 W438 V452	Q436-L449 HydrophobicContact CB-CD1 3.74Å; Q436-L449 HydrophobicContact CG-CD1 4.21Å; W438-L449 HydrophobicContact CD2-CD1 4.23Å; W438-L449 HydrophobicContact CE3-CB 4.17Å; W438-L449 HydrophobicContact CE3-CD1 4.41Å; W438-L449 HydrophobicContact CH2-CB 4.39Å; W438-L449 HydrophobicContact CH2-CD1 4.4Å; W438-L449 HydrophobicContact CZ2-CD1 4.23Å; W438-L449 HydrophobicContact CZ3-CB 3.95Å; W438-L449 HydrophobicContact CZ3-CD1 4.49Å; L449-V452 HydrophobicContact CD1-CG2 4.37Å; L449-V452 HydrophobicContact CD2-CG2 3.92Å; L449-V452 HydrophobicContact CG-CG2 4.48Å
450	L	84.2	Confident	82.4	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-31.1	177.4	-63.7	-172	0	0	0	113	L379 L394 L437 Y439 Q448	L379-L450 HydrophobicContact CD1-CD1 4.11Å; L379-L450 HydrophobicContact CD2-CD1 3.78Å; L379-L450 HydrophobicContact CD2-CD2 3.53Å; L379-L450 HydrophobicContact CD2-CG 4.3Å; L379-L450 HydrophobicContact CG-CD1 4.26Å; L394-L450 HydrophobicContact CD2-CD1 3.48Å; L394-L450 VanDerWaalsContact CD2-CD1 3.48Å; L437-L450 HydrophobicContact CD2-CB 4.22Å; L437-L450 HydrophobicContact CD2-CD1 4.04Å; L437-L450 HydrophobicContact CG-CB 4.25Å; L437-L450 HydrophobicContact CG-CD1 4.22Å; L437-L450 PolarHBondContact O-N 3.34Å; Y439-L450 HydrophobicContact CG-CD2 4.38Å; Q448-L450 HydrophobicContact CG-CD2 4.5Å
451	G	84.7	Confident	81.8	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.01	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175	167.7	-178.8	0	0	0	0	0	112.5	L437 L473	L437-G451 PolarHBondContact N-O 3.44Å; G451-L473 WeakPolarHBondContact CA-O 3.48Å
452	V	88.6	Confident	81.1	Confident	24 Å²	24	64.4 Å²	64.4	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.9	-177.7	-175.5	0	0	0	0	109.2	V434 F435 Q436 L449 L473	V434-V452 HydrophobicContact CG1-CG1 3.31Å; F435-V452 CarbonylContact O-C 3.51Å; F435-V452 VanDerWaalsContact O-CA 3.26Å; F435-V452 WeakPolarHBondContact O-CA 3.11Å; Q436-V452 HydrophobicContact CG-CG2 4.36Å; L449-V452 HydrophobicContact CD1-CG2 4.37Å; L449-V452 HydrophobicContact CD2-CG2 3.92Å; L449-V452 HydrophobicContact CG-CG2 4.48Å; V452-L473 PolarHBondContact N-O 3.3Å; V452-L473 WeakPolarHBondContact O-CB 3.22Å; V452-L473 PolarHBondContact O-N 2.84Å
453	V	88.2	Confident	80.4	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.012	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	128.7	168.2	172.7	0	0	0	0	108.4	V434 F435 V455 F470 L472 L483 I485	V434-V453 CarbonylContact C-O 3.6Å; V434-V453 WeakPolarHBondContact CA-O 3.45Å; F435-V453 HydrophobicContact CB-CB 4.25Å; F435-V453 PolarHBondContact N-O 2.69Å; F435-V453 PolarHBondContact O-N 2.85Å; V453-V455 HydrophobicContact CG1-CG2 3.85Å; V453-F470 HydrophobicContact CB-CB 4.28Å; V453-F470 HydrophobicContact CG1-CB 3.31Å; V453-F470 HydrophobicContact CG1-CD1 3.93Å; V453-F470 HydrophobicContact CG1-CD2 4.19Å; V453-F470 HydrophobicContact CG1-CG 3.56Å; V453-F470 HydrophobicContact CG2-CB 3.96Å; V453-L472 HydrophobicContact CG2-CD2 3.76Å; V453-L472 HydrophobicContact CG2-CG 4.27Å; V453-L483 HydrophobicContact CG2-CB 4.03Å; V453-L483 HydrophobicContact CG2-CD2 4.17Å; V453-I485 HydrophobicContact CB-CD1 4.28Å; V453-I485 HydrophobicContact CG1-CD1 3.79Å
454	N	89	Confident	79.6	Confident	43 Å²	43	68.2 Å²	68.2	23%	0.23	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.7	170.9	-173.1	29.4	0	0	0	109.5	N432	N432-N454 WeakPolarHBondContact CB-OD1 3.05Å
455	V	87.4	Confident	78.8	Confident	1 Å²	1	68 Å²	68	1%	0.006	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	117.4	179	-178.5	0	0	0	0	109.1	N432 L433 F435 V453 L457 F470 I485 V487	N432-V455 CarbonylContact C-O 3.56Å; N432-V455 VanDerWaalsContact CA-O 3.26Å; N432-V455 WeakPolarHBondContact CA-O 3.14Å; L433-V455 HydrophobicContact CB-CB 4.41Å; L433-V455 PolarHBondContact N-O 2.93Å; L433-V455 PolarHBondContact O-N 3.19Å; F435-V455 HydrophobicContact CD2-CG2 3.89Å; F435-V455 HydrophobicContact CE2-CB 4.2Å; F435-V455 HydrophobicContact CE2-CG2 3.64Å; V453-V455 HydrophobicContact CG1-CG2 3.85Å; V455-L457 PolarHBondContact O-N 2.5Å; V455-F470 HydrophobicContact CB-CE1 4.48Å; V455-F470 HydrophobicContact CB-CZ 4.4Å; V455-F470 HydrophobicContact CG1-CE1 4.3Å; V455-F470 HydrophobicContact CG1-CZ 3.92Å; V455-F470 HydrophobicContact CG2-CD1 4.26Å; V455-F470 HydrophobicContact CG2-CD2 4.36Å; V455-F470 HydrophobicContact CG2-CE1 3.9Å; V455-F470 HydrophobicContact CG2-CE2 3.99Å; V455-F470 HydrophobicContact CG2-CG 4.49Å; V455-F470 HydrophobicContact CG2-CZ 3.76Å; V455-I485 HydrophobicContact CG2-CD1 3.92Å; V455-V487 HydrophobicContact CG1-CG2 4.3Å
456	D	85.1	Confident	78.5	Confident	46 Å²	46	67 Å²	67	25%	0.246	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	116.8	173	-176.6	-9.2	0	0	0	110.3	N432 S458 Q459 C460	N432-D456 WeakPolarHBondContact OD1-CA 3.22Å; D456-S458 VanDerWaalsContact C-N 3.29Å; D456-S458 PolarHBondContact O-N 2.8Å; D456-S458 VanDerWaalsContact OD1-CB 3.26Å; D456-S458 WeakPolarHBondContact OD1-CB 3.45Å; D456-S458 PolarHBondContact OD1-N 2.8Å; D456-S458 PolarHBondContact OD1-OG 3.44Å; D456-S458 PolarHBondContact OD2-OG 2.91Å; D456-S458 VanDerWaalsContact OD2-OG 3.04Å; D456-Q459 HydrophobicContact CB-CG 4.11Å; D456-Q459 PolarHBondContact O-N 2.8Å; D456-Q459 PolarHBondContact OD2-NE2 3.41Å; D456-C460 PolarHBondContact O-SG 2.72Å
457	L	84.7	Confident	78.7	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-72.1	-24.3	-178.9	-68	-179	0	0	0	112.4	I426 Q430 K431 L433 V455 Q459 C460 R461 V487 F489	I426-L457 HydrophobicContact CD1-CD1 3.9Å; I426-L457 HydrophobicContact CD1-CD2 4.39Å; I426-L457 HydrophobicContact CG2-CD1 3.76Å; Q430-L457 HydrophobicContact CG-CD1 4.16Å; K431-L457 WeakPolarHBondContact O-CB 3.5Å; K431-L457 PolarHBondContact O-N 3.25Å; L433-L457 HydrophobicContact CD1-CD1 4.5Å; L433-L457 HydrophobicContact CD1-CD2 3.63Å; L433-L457 HydrophobicContact CD1-CG 4.42Å; L433-L457 HydrophobicContact CD2-CD1 4.44Å; L433-L457 HydrophobicContact CG-CD1 4.01Å; L433-L457 HydrophobicContact CG-CD2 3.81Å; L433-L457 HydrophobicContact CG-CG 4.06Å; V455-L457 PolarHBondContact O-N 2.5Å; L457-Q459 VanDerWaalsContact C-N 3.28Å; L457-Q459 PolarHBondContact O-N 3.1Å; L457-C460 PolarHBondContact O-N 3.31Å; L457-C460 VanDerWaalsContact O-N 3.12Å; L457-R461 WeakPolarHBondContact O-CG 3.44Å; L457-R461 PolarHBondContact O-N 3.3Å; L457-V487 HydrophobicContact CD2-CG1 3.9Å; L457-F489 HydrophobicContact CB-CZ 4.22Å; L457-F489 HydrophobicContact CD2-CZ 4.07Å
458	S	78	Confident	78.5	Confident	58 Å²	58	58.5 Å²	58.5	41%	0.406	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-38.1	177	72.3	0	0	0	0	111.4	D456 C460 H462	D456-S458 VanDerWaalsContact C-N 3.29Å; D456-S458 PolarHBondContact O-N 2.8Å; D456-S458 VanDerWaalsContact OD1-CB 3.26Å; D456-S458 WeakPolarHBondContact OD1-CB 3.45Å; D456-S458 PolarHBondContact OD1-N 2.8Å; D456-S458 PolarHBondContact OD1-OG 3.44Å; D456-S458 PolarHBondContact OD2-OG 2.91Å; D456-S458 VanDerWaalsContact OD2-OG 3.04Å; S458-C460 VanDerWaalsContact C-N 3.32Å; S458-C460 PolarHBondContact O-N 3.44Å; S458-H462 PolarHBondContact O-CD2 3.07Å; S458-H462 VanDerWaalsContact O-CD2 3.31Å
459	Q	71.8	Confident	78.6	Confident	130 Å²	130	57.4 Å²	57.4	61%	0.607	27%	0.272	S	S	*	.	H	α-helix	trans	-67.8	-34.2	174.5	-59.1	-179.8	19.6	0	0	111.6	D456 L457	D456-Q459 HydrophobicContact CB-CG 4.11Å; D456-Q459 PolarHBondContact O-N 2.8Å; D456-Q459 PolarHBondContact OD2-NE2 3.41Å; L457-Q459 VanDerWaalsContact C-N 3.28Å; L457-Q459 PolarHBondContact O-N 3.1Å
460	C	77.8	Confident	78.7	Confident	7 Å²	7	57 Å²	57	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-77.1	-31.7	-178.3	-59.9	0	0	0	0	112.9	D456 L457 S458 H462 S463 W468 V487 F489	D456-C460 PolarHBondContact O-SG 2.72Å; L457-C460 PolarHBondContact O-N 3.31Å; L457-C460 VanDerWaalsContact O-N 3.12Å; S458-C460 VanDerWaalsContact C-N 3.32Å; S458-C460 PolarHBondContact O-N 3.44Å; C460-H462 PolarHBondContact O-N 3.05Å; C460-S463 PolarHBondContact O-N 3.3Å; C460-W468 HydrophobicContact CB-CH2 4.1Å; C460-W468 HydrophobicContact CB-CZ3 4.3Å; C460-W468 VanDerWaalsContact SG-CZ3 3.53Å; C460-V487 HydrophobicContact CB-CB 4.15Å; C460-V487 HydrophobicContact CB-CG1 3.93Å; C460-F489 HydrophobicContact CB-CE2 3.93Å
461	R	73.3	Confident	78.7	Confident	107 Å²	107	61.2 Å²	61.2	40%	0.404	29%	0.291	S	S	.	.	H	α-helix	trans	-61.6	-26.9	-179.1	-77.8	178.6	-175.3	171	4.8	113.5	L457 F489	L457-R461 WeakPolarHBondContact O-CG 3.44Å; L457-R461 PolarHBondContact O-N 3.3Å; R461-F489 HydrophobicContact CB-CD2 4.39Å; R461-F489 HydrophobicContact CB-CE2 4.29Å; R461-F489 HydrophobicContact CG-CD1 4.31Å; R461-F489 HydrophobicContact CG-CD2 3.82Å; R461-F489 HydrophobicContact CG-CE1 4Å; R461-F489 HydrophobicContact CG-CE2 3.48Å; R461-F489 VanDerWaalsContact CG-CE2 3.48Å; R461-F489 HydrophobicContact CG-CG 4.23Å; R461-F489 HydrophobicContact CG-CZ 3.58Å
462	H	67.6	Low	78.6	Confident	162 Å²	162	61.9 Å²	61.9	75%	0.75	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-6.1	-176.5	-59.1	-57.9	0	0	0	114.3	S458 C460	S458-H462 PolarHBondContact O-CD2 3.07Å; S458-H462 VanDerWaalsContact O-CD2 3.31Å; C460-H462 PolarHBondContact O-N 3.05Å
463	S	63.2	Low	78.2	Confident	43 Å²	43	65.5 Å²	65.5	30%	0.301	31%	0.312	S	S	.	.			trans	-94.6	128.3	-174.7	178.3	0	0	0	0	112	C460 R465 W468	C460-S463 PolarHBondContact O-N 3.3Å; S463-R465 WeakPolarHBondContact CB-O 2.99Å; S463-R465 PolarHBondContact O-N 3.01Å; S463-R465 PolarHBondContact OG-N 3.29Å; S463-R465 VanDerWaalsContact OG-N 3.15Å; S463-R465 PolarHBondContact OG-O 3.5Å; S463-W468 WeakPolarHBondContact OG-CZ2 3.47Å
464	F	56.7	Low	77.2	Confident	180 Å²	180	67.1 Å²	67.1	79%	0.789	32%	0.321	S	S	*	.	S	Bend	trans	-70.3	-21.5	169.7	-75.7	-84.7	0	0	0	113.1
465	R	57.2	Low	75.7	Confident	159 Å²	159	71.3 Å²	71.3	60%	0.6	34%	0.342	S	S	*	.			trans	-92.2	130.6	169.9	-80.9	-173	169.4	177.7	-1.7	108.2	S463 W468	S463-R465 WeakPolarHBondContact CB-O 2.99Å; S463-R465 PolarHBondContact O-N 3.01Å; S463-R465 PolarHBondContact OG-N 3.29Å; S463-R465 VanDerWaalsContact OG-N 3.15Å; S463-R465 PolarHBondContact OG-O 3.5Å; R465-W468 WeakPolarHBondContact O-CH2 3.17Å; R465-W468 WeakPolarHBondContact O-CZ2 3.31Å
466	S	72.2	Confident	74.2	Confident	11 Å²	11	82.1 Å²	82.1	8%	0.077	38%	0.383	C	S	.	.			trans	-103.1	-20	-178.6	54.9	0	0	0	0	113.4	W468 S486 V487 H488	S466-W468 VanDerWaalsContact C-CE3 3.46Å; S466-W468 WeakPolarHBondContact O-CZ3 3.28Å; S466-S486 CarbonylContact O-C 3.49Å; S466-S486 WeakPolarHBondContact O-CA 3.3Å; S466-V487 WeakPolarHBondContact CA-O 3.27Å; S466-V487 WeakPolarHBondContact CB-O 3.45Å; S466-V487 PolarHBondContact O-N 3.14Å; S466-H488 WeakPolarHBondContact CB-CD2 3.47Å; S466-H488 WeakPolarHBondContact CB-CE1 3.41Å; S466-H488 WeakPolarHBondContact CB-ND1 3.39Å; S466-H488 WeakPolarHBondContact CB-NE2 3.46Å; S466-H488 PolarHBondContact OG-CD2 2.89Å; S466-H488 PolarHBondContact OG-CE1 3.44Å; S466-H488 PolarHBondContact OG-ND1 3.06Å; S466-H488 PolarHBondContact OG-NE2 3.07Å
467	T	85.3	Confident	72.7	Confident	54 Å²	54	82.7 Å²	82.7	33%	0.331	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	123.3	-168.8	-47.1	0	0	0	0	111.4	Q484 I485 S486	T467-Q484 HydrophobicContact CG2-CG 3.7Å; T467-I485 CarbonylContact C-O 3.58Å; T467-I485 VanDerWaalsContact CA-O 3.29Å; T467-I485 WeakPolarHBondContact CA-O 3.37Å; T467-S486 VanDerWaalsContact OG1-CB 3.27Å; T467-S486 WeakPolarHBondContact OG1-CB 3.25Å
468	W	83.3	Confident	71.1	Confident	55 Å²	55	86.1 Å²	86.1	21%	0.208	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	159.1	-179.7	-58.3	-87.7	0	0	0	112.1	C460 S463 R465 S466 F470 Q484 I485 V487	C460-W468 HydrophobicContact CB-CH2 4.1Å; C460-W468 HydrophobicContact CB-CZ3 4.3Å; C460-W468 VanDerWaalsContact SG-CZ3 3.53Å; S463-W468 WeakPolarHBondContact OG-CZ2 3.47Å; R465-W468 WeakPolarHBondContact O-CH2 3.17Å; R465-W468 WeakPolarHBondContact O-CZ2 3.31Å; S466-W468 VanDerWaalsContact C-CE3 3.46Å; S466-W468 WeakPolarHBondContact O-CZ3 3.28Å; W468-F470 HydrophobicContact CB-CD2 4.22Å; W468-F470 HydrophobicContact CB-CE2 3.56Å; W468-F470 HydrophobicContact CB-CZ 3.79Å; W468-F470 HydrophobicContact CD2-CZ 4.42Å; W468-F470 HydrophobicContact CE3-CE2 4.37Å; W468-F470 HydrophobicContact CE3-CZ 4.14Å; W468-F470 HydrophobicContact CG-CE2 4.48Å; W468-F470 HydrophobicContact CG-CZ 4.34Å; W468-Q484 CarbonylContact O-C 3.2Å; W468-Q484 VanDerWaalsContact O-CA 3.27Å; W468-Q484 WeakPolarHBondContact O-CA 3.42Å; W468-I485 PolarHBondContact N-O 3.01Å; W468-I485 PolarHBondContact O-N 2.98Å; W468-V487 HydrophobicContact CZ3-CB 4.38Å
469	W	87.2	Confident	70.1	Confident	67 Å²	67	84 Å²	84	25%	0.254	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	131.2	164.5	-71.2	98.4	0	0	0	109.1	R373 R375 Q482 Q484	R373-W469 HydrophobicContact CG-CH2 3.73Å; R373-W469 HydrophobicContact CG-CZ2 4.37Å; R373-W469 HydrophobicContact CG-CZ3 4.43Å; R375-W469 HydrophobicContact CB-CH2 4.28Å; R375-W469 HydrophobicContact CB-CZ3 4.25Å; R375-W469 HydrophobicContact CG-CE3 4.17Å; R375-W469 HydrophobicContact CG-CH2 3.83Å; R375-W469 HydrophobicContact CG-CZ3 3.54Å; W469-Q482 HydrophobicContact CE3-CB 3.85Å; W469-Q482 HydrophobicContact CZ3-CB 4.37Å; W469-Q484 HydrophobicContact CD2-CB 3.9Å; W469-Q484 HydrophobicContact CD2-CG 4.27Å; W469-Q484 HydrophobicContact CE3-CB 3.7Å; W469-Q484 HydrophobicContact CH2-CB 3.92Å; W469-Q484 HydrophobicContact CZ2-CB 4.09Å; W469-Q484 HydrophobicContact CZ2-CG 4.39Å; W469-Q484 HydrophobicContact CZ3-CB 3.7Å
470	F	86.8	Confident	70	Confident	41 Å²	41	82 Å²	82	18%	0.18	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.4	176.3	-62.9	-91.8	0	0	0	109.5	V453 V455 W468 Q482 L483 I485	V453-F470 HydrophobicContact CB-CB 4.28Å; V453-F470 HydrophobicContact CG1-CB 3.31Å; V453-F470 HydrophobicContact CG1-CD1 3.93Å; V453-F470 HydrophobicContact CG1-CD2 4.19Å; V453-F470 HydrophobicContact CG1-CG 3.56Å; V453-F470 HydrophobicContact CG2-CB 3.96Å; V455-F470 HydrophobicContact CB-CE1 4.48Å; V455-F470 HydrophobicContact CB-CZ 4.4Å; V455-F470 HydrophobicContact CG1-CE1 4.3Å; V455-F470 HydrophobicContact CG1-CZ 3.92Å; V455-F470 HydrophobicContact CG2-CD1 4.26Å; V455-F470 HydrophobicContact CG2-CD2 4.36Å; V455-F470 HydrophobicContact CG2-CE1 3.9Å; V455-F470 HydrophobicContact CG2-CE2 3.99Å; V455-F470 HydrophobicContact CG2-CG 4.49Å; V455-F470 HydrophobicContact CG2-CZ 3.76Å; W468-F470 HydrophobicContact CB-CD2 4.22Å; W468-F470 HydrophobicContact CB-CE2 3.56Å; W468-F470 HydrophobicContact CB-CZ 3.79Å; W468-F470 HydrophobicContact CD2-CZ 4.42Å; W468-F470 HydrophobicContact CE3-CE2 4.37Å; W468-F470 HydrophobicContact CE3-CZ 4.14Å; W468-F470 HydrophobicContact CG-CE2 4.48Å; W468-F470 HydrophobicContact CG-CZ 4.34Å; F470-Q482 CarbonylContact O-C 3.52Å; F470-Q482 WeakPolarHBondContact O-CA 3.41Å; F470-L483 PolarHBondContact N-O 3.19Å; F470-L483 PolarHBondContact O-N 2.94Å; F470-I485 HydrophobicContact CD2-CB 4.08Å; F470-I485 HydrophobicContact CD2-CD1 3.89Å; F470-I485 HydrophobicContact CD2-CG1 4.34Å; F470-I485 HydrophobicContact CE2-CB 3.9Å; F470-I485 HydrophobicContact CE2-CD1 4.29Å
471	D	83.8	Confident	70.2	Confident	95 Å²	95	81.7 Å²	81.7	51%	0.508	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	135	173	-61.9	-35.9	0	0	0	109.2	L473 Q482	D471-L473 PolarHBondContact O-N 2.85Å; D471-Q482 WeakPolarHBondContact OD1-CG 3.29Å; D471-Q482 PolarHBondContact OD1-NE2 2.9Å
472	L	83.8	Confident	70.9	Confident	14 Å²	14	78.3 Å²	78.3	7%	0.073	40%	0.396	C	S	.	.			trans	-73	119.2	173	-77.6	161.5	0	0	0	108.6	L377 L437 V453 D474 G481	L377-L472 HydrophobicContact CD2-CD1 3.52Å; L437-L472 HydrophobicContact CB-CD2 4.06Å; L437-L472 HydrophobicContact CD2-CD1 3.63Å; L437-L472 HydrophobicContact CD2-CD2 4.35Å; V453-L472 HydrophobicContact CG2-CD2 3.76Å; V453-L472 HydrophobicContact CG2-CG 4.27Å; L472-D474 PolarHBondContact O-N 2.94Å; L472-G481 WeakPolarHBondContact CB-O 3.4Å; L472-G481 PolarHBondContact N-O 3.43Å
473	L	79.5	Confident	72	Confident	101 Å²	101	70.6 Å²	70.6	53%	0.529	36%	0.361	S	S	.	.	B	Isolated β-bridge	trans	-75.6	103.2	168.6	-62.3	172.5	0	0	0	107.4	G451 V452 D471	G451-L473 WeakPolarHBondContact CA-O 3.48Å; V452-L473 PolarHBondContact N-O 3.3Å; V452-L473 WeakPolarHBondContact O-CB 3.22Å; V452-L473 PolarHBondContact O-N 2.84Å; D471-L473 PolarHBondContact O-N 2.85Å
474	D	68.2	Low	73.4	Confident	36 Å²	36	70.2 Å²	70.2	19%	0.193	35%	0.354	C	S	.	.			trans	-93	119.3	178.4	-171.3	-5.6	0	0	0	110.7	L472 R476 T477 G478 S479	L472-D474 PolarHBondContact O-N 2.94Å; D474-R476 PolarHBondContact OD1-N 3.07Å; D474-T477 PolarHBondContact OD1-N 3.24Å; D474-T477 WeakPolarHBondContact OD2-CA 3.15Å; D474-T477 WeakPolarHBondContact OD2-CB 3.5Å; D474-T477 PolarHBondContact OD2-N 2.86Å; D474-T477 PolarHBondContact OD2-OG1 3.22Å; D474-G478 PolarHBondContact OD2-N 3.39Å; D474-S479 WeakPolarHBondContact OD2-CB 3.24Å; D474-S479 PolarHBondContact OD2-N 2.79Å
475	L	57.1	Low	75.1	Confident	130 Å²	130	61.6 Å²	61.6	68%	0.681	32%	0.316	S	S	*	.	S	Bend	trans	-86.5	-12	177.7	-65.1	173	0	0	0	113
476	R	56.2	Low	76.8	Confident	229 Å²	229	54.1 Å²	54.1	86%	0.864	29%	0.288	S	S	*	.	S	Bend	trans	-141.2	-31.1	-169.1	-66.4	-170.8	177.9	-161.8	0.5	116.6	D474	D474-R476 PolarHBondContact OD1-N 3.07Å
477	T	52.3	Low	77.7	Confident	57 Å²	57	53.7 Å²	53.7	35%	0.35	29%	0.285	S	S	.	.	S	Bend	trans	-108.3	-4.2	-168.6	74.4	0	0	0	0	115.5	D474 S479	D474-T477 PolarHBondContact OD1-N 3.24Å; D474-T477 WeakPolarHBondContact OD2-CA 3.15Å; D474-T477 WeakPolarHBondContact OD2-CB 3.5Å; D474-T477 PolarHBondContact OD2-N 2.86Å; D474-T477 PolarHBondContact OD2-OG1 3.22Å; T477-S479 PolarHBondContact O-N 3.46Å; T477-S479 WeakPolarHBondContact OG1-CB 3.26Å; T477-S479 PolarHBondContact OG1-OG 3.45Å
478	G	51.6	Low	77.8	Confident	73 Å²	73	55.1 Å²	55.1	75%	0.753	29%	0.288	S	S	*	.			trans	61.4	15.1	-174.4	0	0	0	0	0	114.8	D474 S480	D474-G478 PolarHBondContact OD2-N 3.39Å; G478-S480 PolarHBondContact O-N 3.05Å
479	S	56.7	Low	77.9	Confident	13 Å²	13	54.8 Å²	54.8	9%	0.091	29%	0.288	C	S	.	.			trans	-71.3	119.6	-176.4	-71.7	0	0	0	0	111.4	D474 T477 G481	D474-S479 WeakPolarHBondContact OD2-CB 3.24Å; D474-S479 PolarHBondContact OD2-N 2.79Å; T477-S479 PolarHBondContact O-N 3.46Å; T477-S479 WeakPolarHBondContact OG1-CB 3.26Å; T477-S479 PolarHBondContact OG1-OG 3.45Å; S479-G481 PolarHBondContact O-N 2.87Å
480	S	69.3	Low	77.6	Confident	87 Å²	87	56.4 Å²	56.4	61%	0.608	30%	0.297	S	S	*	.			trans	-81.6	38.8	177.5	65.7	0	0	0	0	113.5	G478	G478-S480 PolarHBondContact O-N 3.05Å
481	G	82.1	Confident	76.7	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.01	33%	0.329	C	S	.	.			trans	-70.7	158.9	-174.2	0	0	0	0	0	112.7	R375 L472 S479	R375-G481 CarbonylContact O-C 3.56Å; R375-G481 WeakPolarHBondContact O-CA 2.94Å; L472-G481 WeakPolarHBondContact CB-O 3.4Å; L472-G481 PolarHBondContact N-O 3.43Å; S479-G481 PolarHBondContact O-N 2.87Å
482	Q	87.9	Confident	75.5	Confident	37 Å²	37	63.2 Å²	63.2	17%	0.173	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	144.1	171.8	-65.1	-174	-31.4	0	0	111	A374 R375 Y376 W469 F470 D471	A374-Q482 CarbonylContact C-O 3.46Å; A374-Q482 WeakPolarHBondContact CA-O 3.38Å; A374-Q482 VanDerWaalsContact CB-O 3.32Å; A374-Q482 WeakPolarHBondContact CB-O 3.47Å; R375-Q482 HydrophobicContact CG-CB 4Å; R375-Q482 PolarHBondContact N-O 3.14Å; R375-Q482 PolarHBondContact O-N 3.48Å; Y376-Q482 HydrophobicContact CD2-CG 4.37Å; W469-Q482 HydrophobicContact CE3-CB 3.85Å; W469-Q482 HydrophobicContact CZ3-CB 4.37Å; F470-Q482 CarbonylContact O-C 3.52Å; F470-Q482 WeakPolarHBondContact O-CA 3.41Å; D471-Q482 WeakPolarHBondContact OD1-CG 3.29Å; D471-Q482 PolarHBondContact OD1-NE2 2.9Å
483	L	90.7	Very high	73.8	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	132.1	178	-173.8	64.2	0	0	0	110.2	V371 A374 V396 W418 F435 V453 F470 I485	V371-L483 HydrophobicContact CG1-CD1 4.17Å; A374-L483 HydrophobicContact CB-CD1 3.96Å; V396-L483 HydrophobicContact CG1-CD2 4.31Å; V396-L483 HydrophobicContact CG2-CD1 4.17Å; V396-L483 HydrophobicContact CG2-CD2 4.35Å; W418-L483 HydrophobicContact CH2-CD1 4.29Å; W418-L483 HydrophobicContact CZ3-CD1 3.68Å; F435-L483 HydrophobicContact CB-CD2 4.13Å; V453-L483 HydrophobicContact CG2-CB 4.03Å; V453-L483 HydrophobicContact CG2-CD2 4.17Å; F470-L483 PolarHBondContact N-O 3.19Å; F470-L483 PolarHBondContact O-N 2.94Å; L483-I485 HydrophobicContact CD2-CD1 3.86Å; L483-I485 HydrophobicContact CD2-CG1 4.09Å; L483-I485 HydrophobicContact CG-CD1 4.18Å; L483-I485 HydrophobicContact CG-CG1 4.02Å
484	Q	93.6	Very high	72.2	Confident	34 Å²	34	74.3 Å²	74.3	16%	0.159	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	115.2	177.6	-170.8	177.1	10.1	0	0	110.4	H372 R373 T467 W468 W469	H372-Q484 HydrophobicContact CB-CB 4.16Å; H372-Q484 HydrophobicContact CB-CG 4.09Å; H372-Q484 PolarHBondContact N-O 3.11Å; R373-Q484 HydrophobicContact CG-CB 4.09Å; R373-Q484 VanDerWaalsContact CG-OE1 3.29Å; R373-Q484 WeakPolarHBondContact O-CB 3.4Å; R373-Q484 PolarHBondContact O-N 2.87Å; T467-Q484 HydrophobicContact CG2-CG 3.7Å; W468-Q484 CarbonylContact O-C 3.2Å; W468-Q484 VanDerWaalsContact O-CA 3.27Å; W468-Q484 WeakPolarHBondContact O-CA 3.42Å; W469-Q484 HydrophobicContact CD2-CB 3.9Å; W469-Q484 HydrophobicContact CD2-CG 4.27Å; W469-Q484 HydrophobicContact CE3-CB 3.7Å; W469-Q484 HydrophobicContact CH2-CB 3.92Å; W469-Q484 HydrophobicContact CZ2-CB 4.09Å; W469-Q484 HydrophobicContact CZ2-CG 4.39Å; W469-Q484 HydrophobicContact CZ3-CB 3.7Å
485	I	92.8	Very high	70.9	Confident	0 Å²	0	81.6 Å²	81.6	0%	0	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	141.6	-177.2	-62.9	158.5	0	0	0	109.2	G370 F435 V453 V455 T467 W468 F470 L483 V487	G370-I485 CarbonylContact O-C 3.5Å; G370-I485 VanDerWaalsContact O-CA 3.26Å; G370-I485 WeakPolarHBondContact O-CA 3.21Å; F435-I485 HydrophobicContact CB-CD1 4.3Å; F435-I485 HydrophobicContact CD1-CD1 4.08Å; F435-I485 HydrophobicContact CD1-CG1 4.43Å; F435-I485 HydrophobicContact CD2-CD1 3.53Å; F435-I485 HydrophobicContact CE1-CD1 4.3Å; F435-I485 HydrophobicContact CE1-CG1 4.39Å; F435-I485 HydrophobicContact CE1-CG2 4.18Å; F435-I485 HydrophobicContact CE2-CD1 3.78Å; F435-I485 HydrophobicContact CE2-CG2 4.05Å; F435-I485 HydrophobicContact CG-CD1 3.7Å; F435-I485 HydrophobicContact CZ-CD1 4.16Å; F435-I485 HydrophobicContact CZ-CG1 4.44Å; F435-I485 HydrophobicContact CZ-CG2 3.67Å; V453-I485 HydrophobicContact CB-CD1 4.28Å; V453-I485 HydrophobicContact CG1-CD1 3.79Å; V455-I485 HydrophobicContact CG2-CD1 3.92Å; T467-I485 CarbonylContact C-O 3.58Å; T467-I485 VanDerWaalsContact CA-O 3.29Å; T467-I485 WeakPolarHBondContact CA-O 3.37Å; W468-I485 PolarHBondContact N-O 3.01Å; W468-I485 PolarHBondContact O-N 2.98Å; F470-I485 HydrophobicContact CD2-CB 4.08Å; F470-I485 HydrophobicContact CD2-CD1 3.89Å; F470-I485 HydrophobicContact CD2-CG1 4.34Å; F470-I485 HydrophobicContact CE2-CB 3.9Å; F470-I485 HydrophobicContact CE2-CD1 4.29Å; L483-I485 HydrophobicContact CD2-CD1 3.86Å; L483-I485 HydrophobicContact CD2-CG1 4.09Å; L483-I485 HydrophobicContact CG-CD1 4.18Å; L483-I485 HydrophobicContact CG-CG1 4.02Å; I485-V487 HydrophobicContact CG2-CG2 4.08Å
486	S	91.8	Very high	70.2	Confident	1 Å²	1	79.4 Å²	79.4	1%	0.007	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	136.8	166.8	66	0	0	0	0	113.4	I369 G370 H372 S466 T467	I369-S486 CarbonylContact C-O 3.48Å; I369-S486 VanDerWaalsContact CA-O 3.28Å; I369-S486 WeakPolarHBondContact CA-O 3.37Å; G370-S486 VanDerWaalsContact CA-OG 3.25Å; G370-S486 WeakPolarHBondContact CA-OG 3.15Å; G370-S486 PolarHBondContact N-O 3.47Å; G370-S486 PolarHBondContact N-OG 2.9Å; G370-S486 PolarHBondContact O-N 2.99Å; H372-S486 VanDerWaalsContact NE2-CB 3.27Å; H372-S486 WeakPolarHBondContact NE2-CB 3.33Å; H372-S486 PolarHBondContact NE2-OG 2.88Å; S466-S486 CarbonylContact O-C 3.49Å; S466-S486 WeakPolarHBondContact O-CA 3.3Å; T467-S486 VanDerWaalsContact OG1-CB 3.27Å; T467-S486 WeakPolarHBondContact OG1-CB 3.25Å
487	V	90.6	Very high	69.7	Low	2 Å²	2	78.2 Å²	78.2	1%	0.012	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.8	174.3	-177.1	0	0	0	0	108.6	C367 V455 L457 C460 S466 W468 I485 F489	C367-V487 WeakPolarHBondContact SG-CG1 3.16Å; V455-V487 HydrophobicContact CG1-CG2 4.3Å; L457-V487 HydrophobicContact CD2-CG1 3.9Å; C460-V487 HydrophobicContact CB-CB 4.15Å; C460-V487 HydrophobicContact CB-CG1 3.93Å; S466-V487 WeakPolarHBondContact CA-O 3.27Å; S466-V487 WeakPolarHBondContact CB-O 3.45Å; S466-V487 PolarHBondContact O-N 3.14Å; W468-V487 HydrophobicContact CZ3-CB 4.38Å; I485-V487 HydrophobicContact CG2-CG2 4.08Å; V487-F489 HydrophobicContact CG1-CE2 3.93Å; V487-F489 HydrophobicContact CG1-CZ 4.44Å
488	H	88.3	Confident	69.2	Low	84 Å²	84	81.8 Å²	81.8	39%	0.389	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	116.4	178.2	-66.1	-100.6	0	0	0	110.8	C367 K368 S466	C367-H488 CarbonylContact C-O 3.57Å; C367-H488 VanDerWaalsContact CA-O 3.32Å; C367-H488 WeakPolarHBondContact CA-O 3.2Å; C367-H488 PolarHBondContact SG-O 2.93Å; K368-H488 HydrophobicContact CB-CB 4.21Å; K368-H488 PolarHBondContact N-O 3.35Å; K368-H488 PolarHBondContact O-N 2.72Å; S466-H488 WeakPolarHBondContact CB-CD2 3.47Å; S466-H488 WeakPolarHBondContact CB-CE1 3.41Å; S466-H488 WeakPolarHBondContact CB-ND1 3.39Å; S466-H488 WeakPolarHBondContact CB-NE2 3.46Å; S466-H488 PolarHBondContact OG-CD2 2.89Å; S466-H488 PolarHBondContact OG-CE1 3.44Å; S466-H488 PolarHBondContact OG-ND1 3.06Å; S466-H488 PolarHBondContact OG-NE2 3.07Å
489	F	85.7	Confident	69.1	Low	49 Å²	49	87.4 Å²	87.4	22%	0.215	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	129.2	168.8	-68	-88.8	0	0	0	109.5	C367 I426 L457 C460 R461 V487 E491	C367-F489 HydrophobicContact CB-CD1 4.14Å; C367-F489 HydrophobicContact CB-CE1 4.17Å; I426-F489 HydrophobicContact CD1-CE1 4.23Å; I426-F489 HydrophobicContact CD1-CZ 4.41Å; L457-F489 HydrophobicContact CB-CZ 4.22Å; L457-F489 HydrophobicContact CD2-CZ 4.07Å; C460-F489 HydrophobicContact CB-CE2 3.93Å; R461-F489 HydrophobicContact CB-CD2 4.39Å; R461-F489 HydrophobicContact CB-CE2 4.29Å; R461-F489 HydrophobicContact CG-CD1 4.31Å; R461-F489 HydrophobicContact CG-CD2 3.82Å; R461-F489 HydrophobicContact CG-CE1 4Å; R461-F489 HydrophobicContact CG-CE2 3.48Å; R461-F489 VanDerWaalsContact CG-CE2 3.48Å; R461-F489 HydrophobicContact CG-CG 4.23Å; R461-F489 HydrophobicContact CG-CZ 3.58Å; V487-F489 HydrophobicContact CG1-CE2 3.93Å; V487-F489 HydrophobicContact CG1-CZ 4.44Å; F489-E491 PolarHBondContact O-N 2.97Å
490	K	80.2	Confident	68.5	Low	101 Å²	101	98.1 Å²	98.1	44%	0.439	48%	0.482	S	S	.	.			trans	-73.6	119.4	166.3	-70	-176.2	-174.4	169.5	0	106.5	V366 D423 D492	V366-K490 HydrophobicContact CB-CB 4.45Å; V366-K490 HydrophobicContact CB-CD 4.29Å; V366-K490 HydrophobicContact CG1-CD 3.97Å; V366-K490 PolarHBondContact O-N 3.05Å; D423-K490 IonicContact OD1-NZ 2.85Å; D423-K490 IonicContact OD2-NZ 2.76Å; D423-K490 PolarHBondContact OD2-NZ 2.99Å; K490-D492 PolarHBondContact O-N 3.14Å
491	E	68.5	Low	67.3	Low	185 Å²	185	97.9 Å²	97.9	86%	0.864	49%	0.485	S	S	*	.			trans	-67.4	105.8	173.1	-167.5	172.5	-156	0	0	107.4	F489 R493	F489-E491 PolarHBondContact O-N 2.97Å; E491-R493 VanDerWaalsContact C-N 3.32Å; E491-R493 PolarHBondContact O-N 3.28Å
492	D	58.9	Low	65.4	Low	94 Å²	94	104 Å²	104	50%	0.503	52%	0.524	S	S	.	.			trans	-63.3	98.8	170.5	-77.5	-32.7	0	0	0	107	K490 P494	K490-D492 PolarHBondContact O-N 3.14Å; D492-P494 WeakPolarHBondContact O-CD 3.35Å; D492-P494 VanDerWaalsContact O-N 3.1Å
493	R	47.7	Very low	63.3	Low	227 Å²	227	107 Å²	107	86%	0.857	55%	0.55	S	S	*	.			trans	-58.4	117.4	164.9	-95.5	-173	-179	-178.8	1	106.1	E491 M495	E491-R493 VanDerWaalsContact C-N 3.32Å; E491-R493 PolarHBondContact O-N 3.28Å; R493-M495 PolarHBondContact O-N 2.86Å
494	P	47.1	Very low	61.2	Low	120 Å²	120	112.4 Å²	112.4	78%	0.779	59%	0.585	S	S	*	*			trans	-58.6	119	168.2	23.6	-30	0	0	0	106.5	D492 A496	D492-P494 WeakPolarHBondContact O-CD 3.35Å; D492-P494 VanDerWaalsContact O-N 3.1Å; P494-A496 PolarHBondContact O-N 2.94Å
495	M	40.6	Very low	58.9	Low	190 Å²	190	116.7 Å²	116.7	94%	0.936	62%	0.618	S	S	*	*			trans	-59.7	97.3	164	-90.6	-155.6	142	0	0	106	R493 K497	R493-M495 PolarHBondContact O-N 2.86Å; M495-K497 PolarHBondContact O-N 2.8Å
496	A	42.4	Very low	56.6	Low	83 Å²	83	123 Å²	123	69%	0.686	66%	0.657	S	S	*	*			trans	-54.6	111.9	169.9	0	0	0	0	0	106.6	P494 V498	P494-A496 PolarHBondContact O-N 2.94Å; A496-V498 PolarHBondContact O-N 2.94Å
497	K	44.9	Very low	54.3	Low	205 Å²	205	129 Å²	129	89%	0.891	70%	0.697	S	S	*	*			trans	-49.5	109.3	167.6	-97.8	177.4	171.9	176.1	0	106.7	M495 E499	M495-K497 PolarHBondContact O-N 2.8Å; K497-E499 VanDerWaalsContact C-N 3.27Å; K497-E499 PolarHBondContact O-N 2.92Å
498	V	41.4	Very low	51.8	Low	132 Å²	132	135.7 Å²	135.7	80%	0.8	74%	0.738	S	S	*	*			trans	-70.4	90.9	170.4	177	0	0	0	0	106.3	A496 R500	A496-V498 PolarHBondContact O-N 2.94Å; V498-R500 PolarHBondContact O-N 3.39Å
499	E	49.4	Very low	50.2	Low	191 Å²	191	141.4 Å²	141.4	89%	0.893	77%	0.765	S	S	*	*			trans	-74.9	114.2	166.2	-152.5	166.7	-157.2	0	0	107.5	K497	K497-E499 VanDerWaalsContact C-N 3.27Å; K497-E499 PolarHBondContact O-N 2.92Å
500	R	43.7	Very low	48.2	Very low	237 Å²	237	144.1 Å²	144.1	89%	0.894	79%	0.79	S	S	*	*			trans	-68.8	142.4	-179.3	-97.9	178.7	-174.1	146	1.9	111	V498	V498-R500 PolarHBondContact O-N 3.39Å
501	A	44.5	Very low	46.8	Very low	82 Å²	82	146.9 Å²	146.9	68%	0.678	81%	0.81	S	S	*	*			trans	-59.7	-178.1	-178.1	0	0	0	0	0	116.1
502	P	42.6	Very low	45.8	Very low	129 Å²	129	149.4 Å²	149.4	84%	0.838	81%	0.811	S	S	*	*				-136.6	137.3	102	34	-20.3	0	0	0	115.3
503	S	44.3	Very low	45.4	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	83%	0.827	S	S	*	*			trans	-64.6	-174.5	161.8	-15.5	0	0	0	0	111.3
504	P	45.4	Very low	45.4	Very low	114 Å²	114	145.2 Å²	145.2	74%	0.74	82%	0.822	S	S	*	*			cis	-139.2	175	-12	34.3	-13.6	0	0	0	113.4
505	S	46.6	Very low	45.6	Very low	123 Å²	123	150.3 Å²	150.3	86%	0.86	83%	0.826	S	S	*	*				-176.9	130.4	125.5	44	0	0	0	0	111.2
506	V	43.9	Very low	45.9	Very low	134 Å²	134	147.8 Å²	147.8	81%	0.812	82%	0.816	S	S	*	*			trans	-91.7	143.5	-173.6	169.9	0	0	0	0	108.6
507	C	42.9	Very low	46.2	Very low	125 Å²	125	151.4 Å²	151.4	85%	0.845	82%	0.823	S	S	*	*			trans	178.6	104.8	133.2	-95.2	0	0	0	0	110.4
508	T	38.8	Very low	46.9	Very low	144 Å²	144	149.8 Å²	149.8	88%	0.883	82%	0.821	S	S	*	*			trans	-138	109.2	157.1	17.2	0	0	0	0	106.8
509	E	53.6	Low	47.3	Very low	203 Å²	203	148.4 Å²	148.4	95%	0.949	81%	0.814	S	S	*	*			trans	-121.3	117.2	162.7	-94.7	-173.1	161.5	0	0	108.5
510	S	44.8	Very low	47.2	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	81%	0.808	S	S	*	*			trans	-92.3	131.5	158.6	55.3	0	0	0	0	107.9
511	D	50.6	Low	47.4	Very low	160 Å²	160	137.7 Å²	137.7	86%	0.856	80%	0.796	S	S	*	*				-164.9	149.4	123.3	-121.7	-27	0	0	0	114.7
512	R	46.6	Very low	47.6	Very low	237 Å²	237	140 Å²	140	89%	0.894	80%	0.802	S	S	*	*			trans	-83.3	145.4	-170.7	-71.5	169.8	166	174	-4.2	113.2
513	S	51.3	Low	47.8	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	79%	0.793	S	S	*	*			trans	-161.5	136.9	139.4	-171.9	0	0	0	0	110.9
514	P	46.9	Very low	47.9	Very low	116 Å²	116	141.1 Å²	141.1	75%	0.753	80%	0.796	S	S	*	*			trans	-107.7	139	-167.8	37	-27	0	0	0	113.8
515	R	53.2	Low	48	Very low	227 Å²	227	139.4 Å²	139.4	86%	0.857	79%	0.791	S	S	*	*			trans	-153.9	123.8	148.2	-79.2	-158.1	-179.9	163.6	-0.8	111.8
516	D	46.8	Very low	48.1	Very low	137 Å²	137	139.7 Å²	139.7	73%	0.733	78%	0.783	S	S	*	*			trans	75	126.6	134.3	-62.1	-29.2	0	0	0	122.2
517	L	48.2	Very low	48.1	Very low	159 Å²	159	141.6 Å²	141.6	83%	0.832	78%	0.781	S	S	*	*			trans	96.5	90.1	152.7	-55.7	165.3	0	0	0	119.3
518	M	58.5	Low	48.2	Very low	171 Å²	171	143 Å²	143	84%	0.842	78%	0.779	S	S	*	*				39	160.1	118.5	-67.6	-74.4	146	0	0	120.8
519	P	50.5	Low	48.7	Very low	102 Å²	102	149 Å²	149	66%	0.662	79%	0.793	S	S	*	*			cis	-139.9	-175.2	-46.6	38.3	-20.3	0	0	0	113.1
520	S	47.6	Very low	48.4	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	79%	0.785	S	S	*	*			trans	79.9	141.7	156.7	115.8	0	0	0	0	115.3
521	S	47.4	Very low	48.6	Very low	94 Å²	94	148.4 Å²	148.4	66%	0.657	79%	0.787	S	S	*	*			cis	-174.8	163.7	2.3	44.6	0	0	0	0	107.4
522	V	48.7	Very low	48.5	Very low	130 Å²	130	147.8 Å²	147.8	79%	0.788	78%	0.783	S	S	*	*			trans	79.2	127.3	154.3	-177.5	0	0	0	0	115.9
523	V	48.1	Very low	48.6	Very low	107 Å²	107	142.5 Å²	142.5	65%	0.648	78%	0.777	S	S	*	*			cis	-175	137.1	1.5	115.3	0	0	0	0	107.9
524	L	46.3	Very low	48.4	Very low	148 Å²	148	144.1 Å²	144.1	78%	0.775	77%	0.774	S	S	*	*			trans	56.4	115.7	139.6	-67.6	164	0	0	0	119.7
525	A	46.7	Very low	48.5	Very low	78 Å²	78	145.9 Å²	145.9	65%	0.645	78%	0.775	S	S	*	*				87.4	148.3	80.6	0	0	0	0	0	111.2
526	D	47.7	Very low	48.2	Very low	129 Å²	129	140.1 Å²	140.1	69%	0.69	77%	0.769	S	S	*	*			cis	-159.5	165	10.8	-137.5	-26.5	0	0	0	109.6
527	K	44.3	Very low	48.3	Very low	174 Å²	174	140.4 Å²	140.4	76%	0.757	77%	0.772	S	S	*	*			trans	-27.9	159.4	166.5	-64.2	158.3	-176.5	170.1	0	117.3
528	L	45.4	Very low	48.3	Very low	153 Å²	153	138.8 Å²	138.8	80%	0.801	77%	0.767	S	S	*	*				-169.6	123.6	106.8	-96.8	158	0	0	0	112.7
529	K	48.5	Very low	47.4	Very low	271 Å²	271	135.9 Å²	135.9	100%	1.178	76%	0.76	S	S	*	*			trans	61.7	0	149.1	-80.4	177.5	176.1	179.6	0	121

Retrieved 529 of 529 residues in 206.6 ms (Link to these results)

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